USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 774 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 575 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 580 CYS SG : rot 130:sc= -0.394 USER MOD Single : A 522 MET CE :methyl 179:sc= 0 (180deg=-0.000396) USER MOD Single : A 524 LYS NZ :NH3+ -169:sc= 1.22 (180deg=1.02) USER MOD Single : A 526 GLN : amide:sc= 0.797 K(o=0.8,f=-0.017) USER MOD Single : A 528 GLN : amide:sc= 0.795 K(o=0.8,f=0) USER MOD Single : A 529 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 531 TYR OH : rot 103:sc= 0.138 USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot -31:sc= 0.0149 USER MOD Single : A 536 THR OG1 : rot 180:sc= 0 USER MOD Single : A 540 GLN : amide:sc= 0.283 K(o=0.28,f=-3.4!) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 553 GLN : amide:sc= -0.0179 K(o=-0.018,f=-1.1) USER MOD Single : A 554 ASN : amide:sc= -0.194 K(o=-0.19,f=-1.5!) USER MOD Single : A 558 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 564 MET CE :methyl 178:sc= -0.277 (180deg=-0.288) USER MOD Single : A 567 LYS NZ :NH3+ -162:sc= 1 (180deg=0.74) USER MOD Single : A 569 SER OG : rot 180:sc= 0 USER MOD Single : A 572 ASN : amide:sc= -0.305 K(o=-0.3,f=-7.1!) USER MOD Single : A 573 GLN : amide:sc= -0.0855 X(o=-0.086,f=-0.45) USER MOD Single : A 574 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 579 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 587 ASN : amide:sc= 1.18 K(o=1.2,f=-4!) USER MOD Single : A 589 THR OG1 : rot -2:sc= 1.19 USER MOD Single : B1728 SER OG : rot -33:sc= 0.166 USER MOD Single : B1729 THR OG1 : rot 180:sc= 0 USER MOD Single : B1742 ASN : amide:sc= -0.0703 X(o=-0.07,f=-0.07) USER MOD Single : B1744 THR OG1 : rot 86:sc= 0.0694 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 513 33.488 7.987 34.617 1.00 0.00 N ATOM 2 CA GLY A 513 33.408 9.173 33.756 1.00 0.00 C ATOM 3 C GLY A 513 32.186 9.109 32.862 1.00 0.00 C ATOM 4 O GLY A 513 31.697 8.021 32.548 1.00 0.00 O ATOM 0 HA2 GLY A 513 33.367 10.072 34.371 1.00 0.00 H new ATOM 0 HA3 GLY A 513 34.308 9.245 33.145 1.00 0.00 H new ATOM 10 N ARG A 514 31.691 10.284 32.456 1.00 0.00 N ATOM 11 CA ARG A 514 30.512 10.498 31.599 1.00 0.00 C ATOM 12 C ARG A 514 30.658 9.931 30.184 1.00 0.00 C ATOM 13 O ARG A 514 31.767 9.702 29.692 1.00 0.00 O ATOM 14 CB ARG A 514 30.178 12.009 31.564 1.00 0.00 C ATOM 15 CG ARG A 514 31.220 12.926 30.883 1.00 0.00 C ATOM 16 CD ARG A 514 31.053 13.063 29.359 1.00 0.00 C ATOM 17 NE ARG A 514 32.129 13.873 28.758 1.00 0.00 N ATOM 18 CZ ARG A 514 32.700 13.681 27.581 1.00 0.00 C ATOM 19 NH1 ARG A 514 32.278 12.832 26.690 1.00 0.00 N ATOM 20 NH2 ARG A 514 33.754 14.352 27.243 1.00 0.00 N ATOM 0 H ARG A 514 32.126 11.165 32.731 1.00 0.00 H new ATOM 0 HA ARG A 514 29.687 9.939 32.042 1.00 0.00 H new ATOM 0 HB2 ARG A 514 29.224 12.137 31.052 1.00 0.00 H new ATOM 0 HB3 ARG A 514 30.038 12.352 32.589 1.00 0.00 H new ATOM 0 HG2 ARG A 514 31.161 13.917 31.332 1.00 0.00 H new ATOM 0 HG3 ARG A 514 32.217 12.539 31.093 1.00 0.00 H new ATOM 0 HD2 ARG A 514 31.047 12.073 28.904 1.00 0.00 H new ATOM 0 HD3 ARG A 514 30.088 13.520 29.139 1.00 0.00 H new ATOM 0 HE ARG A 514 32.468 14.663 29.307 1.00 0.00 H new ATOM 0 HH11 ARG A 514 31.455 12.261 26.880 1.00 0.00 H new ATOM 0 HH12 ARG A 514 32.770 12.738 25.802 1.00 0.00 H new ATOM 0 HH21 ARG A 514 34.151 15.036 27.887 1.00 0.00 H new ATOM 0 HH22 ARG A 514 34.187 14.197 26.333 1.00 0.00 H new ATOM 34 N LEU A 515 29.522 9.838 29.501 1.00 0.00 N ATOM 35 CA LEU A 515 29.396 9.652 28.053 1.00 0.00 C ATOM 36 C LEU A 515 28.980 10.973 27.386 1.00 0.00 C ATOM 37 O LEU A 515 29.713 11.496 26.544 1.00 0.00 O ATOM 38 CB LEU A 515 28.378 8.531 27.756 1.00 0.00 C ATOM 39 CG LEU A 515 28.722 7.155 28.357 1.00 0.00 C ATOM 40 CD1 LEU A 515 27.597 6.167 28.056 1.00 0.00 C ATOM 41 CD2 LEU A 515 30.018 6.586 27.781 1.00 0.00 C ATOM 0 H LEU A 515 28.615 9.893 29.963 1.00 0.00 H new ATOM 0 HA LEU A 515 30.360 9.355 27.640 1.00 0.00 H new ATOM 0 HB2 LEU A 515 27.402 8.840 28.131 1.00 0.00 H new ATOM 0 HB3 LEU A 515 28.285 8.424 26.675 1.00 0.00 H new ATOM 0 HG LEU A 515 28.847 7.295 29.431 1.00 0.00 H new ATOM 0 HD11 LEU A 515 27.843 5.194 28.482 1.00 0.00 H new ATOM 0 HD12 LEU A 515 26.667 6.530 28.494 1.00 0.00 H new ATOM 0 HD13 LEU A 515 27.477 6.070 26.977 1.00 0.00 H new ATOM 0 HD21 LEU A 515 30.222 5.615 28.233 1.00 0.00 H new ATOM 0 HD22 LEU A 515 29.916 6.470 26.702 1.00 0.00 H new ATOM 0 HD23 LEU A 515 30.842 7.267 27.997 1.00 0.00 H new ATOM 53 N ASP A 516 27.861 11.559 27.817 1.00 0.00 N ATOM 54 CA ASP A 516 27.268 12.780 27.255 1.00 0.00 C ATOM 55 C ASP A 516 27.579 14.104 27.975 1.00 0.00 C ATOM 56 O ASP A 516 27.679 14.163 29.200 1.00 0.00 O ATOM 57 CB ASP A 516 25.760 12.604 26.987 1.00 0.00 C ATOM 58 CG ASP A 516 25.403 11.785 25.739 1.00 0.00 C ATOM 59 OD1 ASP A 516 24.190 11.668 25.436 1.00 0.00 O ATOM 60 OD2 ASP A 516 26.302 11.280 25.024 1.00 0.00 O ATOM 0 H ASP A 516 27.321 11.184 28.597 1.00 0.00 H new ATOM 0 HA ASP A 516 27.790 12.899 26.306 1.00 0.00 H new ATOM 0 HB2 ASP A 516 25.307 12.126 27.856 1.00 0.00 H new ATOM 0 HB3 ASP A 516 25.307 13.591 26.894 1.00 0.00 H new ATOM 65 N LEU A 517 27.678 15.194 27.209 1.00 0.00 N ATOM 66 CA LEU A 517 27.573 16.572 27.707 1.00 0.00 C ATOM 67 C LEU A 517 26.089 16.974 27.929 1.00 0.00 C ATOM 68 O LEU A 517 25.177 16.293 27.434 1.00 0.00 O ATOM 69 CB LEU A 517 28.307 17.497 26.713 1.00 0.00 C ATOM 70 CG LEU A 517 29.843 17.498 26.881 1.00 0.00 C ATOM 71 CD1 LEU A 517 30.419 18.669 26.100 1.00 0.00 C ATOM 72 CD2 LEU A 517 30.352 17.730 28.306 1.00 0.00 C ATOM 0 H LEU A 517 27.837 15.144 26.203 1.00 0.00 H new ATOM 0 HA LEU A 517 28.048 16.665 28.684 1.00 0.00 H new ATOM 0 HB2 LEU A 517 28.062 17.190 25.696 1.00 0.00 H new ATOM 0 HB3 LEU A 517 27.937 18.515 26.836 1.00 0.00 H new ATOM 0 HG LEU A 517 30.148 16.506 26.548 1.00 0.00 H new ATOM 0 HD11 LEU A 517 31.503 18.682 26.210 1.00 0.00 H new ATOM 0 HD12 LEU A 517 30.162 18.565 25.046 1.00 0.00 H new ATOM 0 HD13 LEU A 517 30.005 19.601 26.484 1.00 0.00 H new ATOM 0 HD21 LEU A 517 31.442 17.711 28.311 1.00 0.00 H new ATOM 0 HD22 LEU A 517 30.004 18.699 28.663 1.00 0.00 H new ATOM 0 HD23 LEU A 517 29.973 16.945 28.960 1.00 0.00 H new ATOM 84 N PRO A 518 25.815 18.059 28.679 1.00 0.00 N ATOM 85 CA PRO A 518 24.454 18.498 29.008 1.00 0.00 C ATOM 86 C PRO A 518 23.670 19.014 27.786 1.00 0.00 C ATOM 87 O PRO A 518 24.274 19.375 26.767 1.00 0.00 O ATOM 88 CB PRO A 518 24.616 19.568 30.095 1.00 0.00 C ATOM 89 CG PRO A 518 26.014 20.120 29.852 1.00 0.00 C ATOM 90 CD PRO A 518 26.789 18.920 29.330 1.00 0.00 C ATOM 0 HA PRO A 518 23.854 17.659 29.361 1.00 0.00 H new ATOM 0 HB2 PRO A 518 23.857 20.346 30.007 1.00 0.00 H new ATOM 0 HB3 PRO A 518 24.522 19.142 31.094 1.00 0.00 H new ATOM 0 HG2 PRO A 518 26.003 20.935 29.128 1.00 0.00 H new ATOM 0 HG3 PRO A 518 26.454 20.513 30.768 1.00 0.00 H new ATOM 0 HD2 PRO A 518 27.563 19.232 28.629 1.00 0.00 H new ATOM 0 HD3 PRO A 518 27.289 18.396 30.144 1.00 0.00 H new ATOM 98 N PRO A 519 22.326 19.057 27.861 1.00 0.00 N ATOM 99 CA PRO A 519 21.479 19.479 26.748 1.00 0.00 C ATOM 100 C PRO A 519 21.757 20.940 26.367 1.00 0.00 C ATOM 101 O PRO A 519 21.885 21.812 27.227 1.00 0.00 O ATOM 102 CB PRO A 519 20.037 19.253 27.215 1.00 0.00 C ATOM 103 CG PRO A 519 20.131 19.355 28.736 1.00 0.00 C ATOM 104 CD PRO A 519 21.514 18.780 29.039 1.00 0.00 C ATOM 0 HA PRO A 519 21.679 18.908 25.841 1.00 0.00 H new ATOM 0 HB2 PRO A 519 19.361 20.002 26.804 1.00 0.00 H new ATOM 0 HB3 PRO A 519 19.662 18.279 26.901 1.00 0.00 H new ATOM 0 HG2 PRO A 519 20.040 20.386 29.077 1.00 0.00 H new ATOM 0 HG3 PRO A 519 19.342 18.786 29.227 1.00 0.00 H new ATOM 0 HD2 PRO A 519 21.944 19.242 29.928 1.00 0.00 H new ATOM 0 HD3 PRO A 519 21.458 17.709 29.232 1.00 0.00 H new ATOM 112 N GLY A 520 21.890 21.203 25.069 1.00 0.00 N ATOM 113 CA GLY A 520 22.184 22.526 24.518 1.00 0.00 C ATOM 114 C GLY A 520 23.629 23.015 24.692 1.00 0.00 C ATOM 115 O GLY A 520 23.930 24.096 24.188 1.00 0.00 O ATOM 0 H GLY A 520 21.794 20.484 24.352 1.00 0.00 H new ATOM 0 HA2 GLY A 520 21.949 22.516 23.454 1.00 0.00 H new ATOM 0 HA3 GLY A 520 21.516 23.250 24.985 1.00 0.00 H new ATOM 119 N PHE A 521 24.524 22.259 25.356 1.00 0.00 N ATOM 120 CA PHE A 521 25.914 22.639 25.649 1.00 0.00 C ATOM 121 C PHE A 521 26.641 23.546 24.636 1.00 0.00 C ATOM 122 O PHE A 521 26.749 23.189 23.456 1.00 0.00 O ATOM 123 CB PHE A 521 26.729 21.383 25.988 1.00 0.00 C ATOM 124 CG PHE A 521 28.222 21.611 26.057 1.00 0.00 C ATOM 125 CD1 PHE A 521 28.808 21.916 27.297 1.00 0.00 C ATOM 126 CD2 PHE A 521 29.015 21.565 24.892 1.00 0.00 C ATOM 127 CE1 PHE A 521 30.187 22.173 27.371 1.00 0.00 C ATOM 128 CE2 PHE A 521 30.394 21.827 24.967 1.00 0.00 C ATOM 129 CZ PHE A 521 30.981 22.097 26.213 1.00 0.00 C ATOM 0 H PHE A 521 24.288 21.334 25.715 1.00 0.00 H new ATOM 0 HA PHE A 521 25.836 23.302 26.511 1.00 0.00 H new ATOM 0 HB2 PHE A 521 26.388 20.991 26.946 1.00 0.00 H new ATOM 0 HB3 PHE A 521 26.524 20.618 25.239 1.00 0.00 H new ATOM 0 HD1 PHE A 521 28.201 21.953 28.189 1.00 0.00 H new ATOM 0 HD2 PHE A 521 28.562 21.328 23.941 1.00 0.00 H new ATOM 0 HE1 PHE A 521 30.638 22.429 28.318 1.00 0.00 H new ATOM 0 HE2 PHE A 521 30.998 21.821 24.072 1.00 0.00 H new ATOM 0 HZ PHE A 521 32.048 22.247 26.283 1.00 0.00 H new ATOM 139 N MET A 522 27.155 24.697 25.081 1.00 0.00 N ATOM 140 CA MET A 522 27.795 25.679 24.194 1.00 0.00 C ATOM 141 C MET A 522 29.315 25.507 24.133 1.00 0.00 C ATOM 142 O MET A 522 29.890 25.441 23.044 1.00 0.00 O ATOM 143 CB MET A 522 27.446 27.115 24.617 1.00 0.00 C ATOM 144 CG MET A 522 25.939 27.357 24.679 1.00 0.00 C ATOM 145 SD MET A 522 25.423 29.096 24.579 1.00 0.00 S ATOM 146 CE MET A 522 26.124 29.749 26.118 1.00 0.00 C ATOM 0 H MET A 522 27.140 24.975 26.062 1.00 0.00 H new ATOM 0 HA MET A 522 27.401 25.496 23.194 1.00 0.00 H new ATOM 0 HB2 MET A 522 27.884 27.319 25.594 1.00 0.00 H new ATOM 0 HB3 MET A 522 27.895 27.817 23.914 1.00 0.00 H new ATOM 0 HG2 MET A 522 25.466 26.808 23.864 1.00 0.00 H new ATOM 0 HG3 MET A 522 25.559 26.936 25.610 1.00 0.00 H new ATOM 0 HE1 MET A 522 25.907 30.814 26.194 1.00 0.00 H new ATOM 0 HE2 MET A 522 25.684 29.228 26.968 1.00 0.00 H new ATOM 0 HE3 MET A 522 27.203 29.598 26.119 1.00 0.00 H new ATOM 156 N PHE A 523 29.956 25.490 25.301 1.00 0.00 N ATOM 157 CA PHE A 523 31.410 25.470 25.500 1.00 0.00 C ATOM 158 C PHE A 523 31.808 25.198 26.953 1.00 0.00 C ATOM 159 O PHE A 523 30.949 25.145 27.822 1.00 0.00 O ATOM 160 CB PHE A 523 32.061 26.756 24.966 1.00 0.00 C ATOM 161 CG PHE A 523 31.443 28.072 25.404 1.00 0.00 C ATOM 162 CD1 PHE A 523 30.432 28.678 24.636 1.00 0.00 C ATOM 163 CD2 PHE A 523 31.917 28.720 26.560 1.00 0.00 C ATOM 164 CE1 PHE A 523 29.888 29.912 25.029 1.00 0.00 C ATOM 165 CE2 PHE A 523 31.385 29.965 26.940 1.00 0.00 C ATOM 166 CZ PHE A 523 30.370 30.563 26.176 1.00 0.00 C ATOM 0 H PHE A 523 29.448 25.490 26.186 1.00 0.00 H new ATOM 0 HA PHE A 523 31.793 24.631 24.919 1.00 0.00 H new ATOM 0 HB2 PHE A 523 33.109 26.756 25.267 1.00 0.00 H new ATOM 0 HB3 PHE A 523 32.043 26.718 23.877 1.00 0.00 H new ATOM 0 HD1 PHE A 523 30.073 28.193 23.741 1.00 0.00 H new ATOM 0 HD2 PHE A 523 32.691 28.260 27.156 1.00 0.00 H new ATOM 0 HE1 PHE A 523 29.097 30.361 24.447 1.00 0.00 H new ATOM 0 HE2 PHE A 523 31.758 30.463 27.823 1.00 0.00 H new ATOM 0 HZ PHE A 523 29.962 31.519 26.469 1.00 0.00 H new ATOM 176 N LYS A 524 33.094 25.038 27.255 1.00 0.00 N ATOM 177 CA LYS A 524 33.620 25.000 28.627 1.00 0.00 C ATOM 178 C LYS A 524 34.381 26.281 29.005 1.00 0.00 C ATOM 179 O LYS A 524 34.839 27.038 28.145 1.00 0.00 O ATOM 180 CB LYS A 524 34.498 23.756 28.811 1.00 0.00 C ATOM 181 CG LYS A 524 33.709 22.456 28.909 1.00 0.00 C ATOM 182 CD LYS A 524 34.637 21.242 29.057 1.00 0.00 C ATOM 183 CE LYS A 524 34.050 20.006 28.382 1.00 0.00 C ATOM 184 NZ LYS A 524 35.002 18.875 28.441 1.00 0.00 N ATOM 0 H LYS A 524 33.817 24.929 26.544 1.00 0.00 H new ATOM 0 HA LYS A 524 32.770 24.942 29.307 1.00 0.00 H new ATOM 0 HB2 LYS A 524 35.193 23.686 27.974 1.00 0.00 H new ATOM 0 HB3 LYS A 524 35.097 23.876 29.714 1.00 0.00 H new ATOM 0 HG2 LYS A 524 33.032 22.504 29.762 1.00 0.00 H new ATOM 0 HG3 LYS A 524 33.091 22.336 28.019 1.00 0.00 H new ATOM 0 HD2 LYS A 524 35.609 21.470 28.620 1.00 0.00 H new ATOM 0 HD3 LYS A 524 34.803 21.036 30.114 1.00 0.00 H new ATOM 0 HE2 LYS A 524 33.116 19.728 28.871 1.00 0.00 H new ATOM 0 HE3 LYS A 524 33.811 20.232 27.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 34.669 18.108 27.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 35.940 19.194 28.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 35.067 18.527 29.419 1.00 0.00 H new ATOM 198 N VAL A 525 34.593 26.468 30.304 1.00 0.00 N ATOM 199 CA VAL A 525 35.535 27.429 30.914 1.00 0.00 C ATOM 200 C VAL A 525 36.354 26.738 32.014 1.00 0.00 C ATOM 201 O VAL A 525 35.905 25.714 32.525 1.00 0.00 O ATOM 202 CB VAL A 525 34.815 28.676 31.464 1.00 0.00 C ATOM 203 CG1 VAL A 525 33.915 29.348 30.423 1.00 0.00 C ATOM 204 CG2 VAL A 525 33.945 28.285 32.659 1.00 0.00 C ATOM 0 H VAL A 525 34.089 25.928 31.007 1.00 0.00 H new ATOM 0 HA VAL A 525 36.212 27.774 30.132 1.00 0.00 H new ATOM 0 HB VAL A 525 35.593 29.383 31.752 1.00 0.00 H new ATOM 0 HG11 VAL A 525 33.434 30.220 30.866 1.00 0.00 H new ATOM 0 HG12 VAL A 525 34.516 29.660 29.569 1.00 0.00 H new ATOM 0 HG13 VAL A 525 33.153 28.643 30.091 1.00 0.00 H new ATOM 0 HG21 VAL A 525 33.438 29.169 33.045 1.00 0.00 H new ATOM 0 HG22 VAL A 525 33.204 27.550 32.345 1.00 0.00 H new ATOM 0 HG23 VAL A 525 34.572 27.856 33.441 1.00 0.00 H new ATOM 214 N GLN A 526 37.503 27.285 32.428 1.00 0.00 N ATOM 215 CA GLN A 526 38.280 26.787 33.577 1.00 0.00 C ATOM 216 C GLN A 526 38.548 27.874 34.637 1.00 0.00 C ATOM 217 O GLN A 526 39.080 28.933 34.310 1.00 0.00 O ATOM 218 CB GLN A 526 39.593 26.141 33.104 1.00 0.00 C ATOM 219 CG GLN A 526 40.334 25.465 34.271 1.00 0.00 C ATOM 220 CD GLN A 526 41.228 24.313 33.819 1.00 0.00 C ATOM 221 OE1 GLN A 526 41.899 24.353 32.792 1.00 0.00 O ATOM 222 NE2 GLN A 526 41.274 23.243 34.580 1.00 0.00 N ATOM 0 H GLN A 526 37.926 28.094 31.973 1.00 0.00 H new ATOM 0 HA GLN A 526 37.669 26.027 34.065 1.00 0.00 H new ATOM 0 HB2 GLN A 526 39.380 25.404 32.330 1.00 0.00 H new ATOM 0 HB3 GLN A 526 40.233 26.900 32.654 1.00 0.00 H new ATOM 0 HG2 GLN A 526 40.941 26.208 34.788 1.00 0.00 H new ATOM 0 HG3 GLN A 526 39.605 25.092 34.990 1.00 0.00 H new ATOM 0 HE21 GLN A 526 40.720 23.201 35.435 1.00 0.00 H new ATOM 0 HE22 GLN A 526 41.864 22.454 34.316 1.00 0.00 H new ATOM 231 N ALA A 527 38.227 27.633 35.911 1.00 0.00 N ATOM 232 CA ALA A 527 38.399 28.592 37.011 1.00 0.00 C ATOM 233 C ALA A 527 39.877 28.934 37.277 1.00 0.00 C ATOM 234 O ALA A 527 40.697 28.055 37.546 1.00 0.00 O ATOM 235 CB ALA A 527 37.682 28.048 38.255 1.00 0.00 C ATOM 0 H ALA A 527 37.830 26.744 36.216 1.00 0.00 H new ATOM 0 HA ALA A 527 37.945 29.541 36.728 1.00 0.00 H new ATOM 0 HB1 ALA A 527 37.801 28.750 39.080 1.00 0.00 H new ATOM 0 HB2 ALA A 527 36.622 27.921 38.037 1.00 0.00 H new ATOM 0 HB3 ALA A 527 38.113 27.086 38.532 1.00 0.00 H new ATOM 241 N GLN A 528 40.212 30.225 37.224 1.00 0.00 N ATOM 242 CA GLN A 528 41.538 30.775 37.541 1.00 0.00 C ATOM 243 C GLN A 528 41.667 31.142 39.040 1.00 0.00 C ATOM 244 O GLN A 528 42.766 31.142 39.600 1.00 0.00 O ATOM 245 CB GLN A 528 41.775 32.029 36.674 1.00 0.00 C ATOM 246 CG GLN A 528 41.552 31.891 35.156 1.00 0.00 C ATOM 247 CD GLN A 528 42.395 30.812 34.480 1.00 0.00 C ATOM 248 OE1 GLN A 528 43.550 31.011 34.122 1.00 0.00 O ATOM 249 NE2 GLN A 528 41.883 29.611 34.348 1.00 0.00 N ATOM 0 H GLN A 528 39.544 30.946 36.949 1.00 0.00 H new ATOM 0 HA GLN A 528 42.288 30.013 37.326 1.00 0.00 H new ATOM 0 HB2 GLN A 528 41.121 32.821 37.040 1.00 0.00 H new ATOM 0 HB3 GLN A 528 42.800 32.362 36.835 1.00 0.00 H new ATOM 0 HG2 GLN A 528 40.499 31.675 34.976 1.00 0.00 H new ATOM 0 HG3 GLN A 528 41.767 32.849 34.683 1.00 0.00 H new ATOM 0 HE21 GLN A 528 40.923 29.431 34.642 1.00 0.00 H new ATOM 0 HE22 GLN A 528 42.445 28.858 33.952 1.00 0.00 H new ATOM 258 N HIS A 529 40.530 31.423 39.688 1.00 0.00 N ATOM 259 CA HIS A 529 40.368 31.796 41.100 1.00 0.00 C ATOM 260 C HIS A 529 39.141 31.083 41.699 1.00 0.00 C ATOM 261 O HIS A 529 38.310 30.555 40.958 1.00 0.00 O ATOM 262 CB HIS A 529 40.221 33.322 41.216 1.00 0.00 C ATOM 263 CG HIS A 529 41.422 34.087 40.735 1.00 0.00 C ATOM 264 ND1 HIS A 529 42.544 34.395 41.470 1.00 0.00 N ATOM 265 CD2 HIS A 529 41.603 34.604 39.483 1.00 0.00 C ATOM 266 CE1 HIS A 529 43.388 35.069 40.676 1.00 0.00 C ATOM 267 NE2 HIS A 529 42.854 35.224 39.451 1.00 0.00 N ATOM 0 H HIS A 529 39.633 31.394 39.204 1.00 0.00 H new ATOM 0 HA HIS A 529 41.250 31.485 41.660 1.00 0.00 H new ATOM 0 HB2 HIS A 529 39.348 33.638 40.644 1.00 0.00 H new ATOM 0 HB3 HIS A 529 40.031 33.581 42.258 1.00 0.00 H new ATOM 0 HD2 HIS A 529 40.902 34.544 38.663 1.00 0.00 H new ATOM 0 HE1 HIS A 529 44.358 35.435 40.977 1.00 0.00 H new ATOM 0 HE2 HIS A 529 43.279 35.700 38.656 1.00 0.00 H new ATOM 275 N ASP A 530 39.012 31.048 43.028 1.00 0.00 N ATOM 276 CA ASP A 530 37.852 30.450 43.700 1.00 0.00 C ATOM 277 C ASP A 530 36.781 31.553 43.823 1.00 0.00 C ATOM 278 O ASP A 530 37.074 32.708 44.161 1.00 0.00 O ATOM 279 CB ASP A 530 38.222 29.905 45.094 1.00 0.00 C ATOM 280 CG ASP A 530 39.594 29.234 45.168 1.00 0.00 C ATOM 281 OD1 ASP A 530 40.599 29.954 45.350 1.00 0.00 O ATOM 282 OD2 ASP A 530 39.679 27.988 45.079 1.00 0.00 O ATOM 0 H ASP A 530 39.707 31.432 43.669 1.00 0.00 H new ATOM 0 HA ASP A 530 37.482 29.604 43.121 1.00 0.00 H new ATOM 0 HB2 ASP A 530 38.194 30.726 45.810 1.00 0.00 H new ATOM 0 HB3 ASP A 530 37.463 29.186 45.403 1.00 0.00 H new ATOM 287 N TYR A 531 35.527 31.179 43.576 1.00 0.00 N ATOM 288 CA TYR A 531 34.356 32.052 43.615 1.00 0.00 C ATOM 289 C TYR A 531 33.226 31.523 44.498 1.00 0.00 C ATOM 290 O TYR A 531 32.663 30.465 44.213 1.00 0.00 O ATOM 291 CB TYR A 531 33.901 32.428 42.200 1.00 0.00 C ATOM 292 CG TYR A 531 32.549 33.121 42.152 1.00 0.00 C ATOM 293 CD1 TYR A 531 32.436 34.484 42.491 1.00 0.00 C ATOM 294 CD2 TYR A 531 31.389 32.374 41.865 1.00 0.00 C ATOM 295 CE1 TYR A 531 31.163 35.082 42.589 1.00 0.00 C ATOM 296 CE2 TYR A 531 30.119 32.972 41.948 1.00 0.00 C ATOM 297 CZ TYR A 531 30.002 34.321 42.335 1.00 0.00 C ATOM 298 OH TYR A 531 28.769 34.879 42.460 1.00 0.00 O ATOM 0 H TYR A 531 35.289 30.217 43.333 1.00 0.00 H new ATOM 0 HA TYR A 531 34.666 32.974 44.106 1.00 0.00 H new ATOM 0 HB2 TYR A 531 34.649 33.081 41.750 1.00 0.00 H new ATOM 0 HB3 TYR A 531 33.857 31.525 41.591 1.00 0.00 H new ATOM 0 HD1 TYR A 531 33.324 35.070 42.676 1.00 0.00 H new ATOM 0 HD2 TYR A 531 31.476 31.336 41.580 1.00 0.00 H new ATOM 0 HE1 TYR A 531 31.076 36.124 42.859 1.00 0.00 H new ATOM 0 HE2 TYR A 531 29.235 32.398 41.715 1.00 0.00 H new ATOM 0 HH TYR A 531 28.409 35.080 41.571 1.00 0.00 H new ATOM 308 N THR A 532 32.906 32.244 45.573 1.00 0.00 N ATOM 309 CA THR A 532 31.884 31.862 46.558 1.00 0.00 C ATOM 310 C THR A 532 30.457 32.247 46.179 1.00 0.00 C ATOM 311 O THR A 532 30.202 33.414 45.869 1.00 0.00 O ATOM 312 CB THR A 532 32.242 32.309 47.987 1.00 0.00 C ATOM 313 OG1 THR A 532 33.640 32.337 48.195 1.00 0.00 O ATOM 314 CG2 THR A 532 31.659 31.391 49.049 1.00 0.00 C ATOM 0 H THR A 532 33.359 33.131 45.792 1.00 0.00 H new ATOM 0 HA THR A 532 31.894 30.772 46.545 1.00 0.00 H new ATOM 0 HB THR A 532 31.816 33.308 48.081 1.00 0.00 H new ATOM 0 HG1 THR A 532 33.829 32.627 49.112 1.00 0.00 H new ATOM 0 HG21 THR A 532 31.942 31.752 50.038 1.00 0.00 H new ATOM 0 HG22 THR A 532 30.572 31.380 48.964 1.00 0.00 H new ATOM 0 HG23 THR A 532 32.044 30.381 48.908 1.00 0.00 H new ATOM 322 N ALA A 533 29.514 31.300 46.221 1.00 0.00 N ATOM 323 CA ALA A 533 28.119 31.557 45.864 1.00 0.00 C ATOM 324 C ALA A 533 27.418 32.403 46.940 1.00 0.00 C ATOM 325 O ALA A 533 27.125 31.937 48.044 1.00 0.00 O ATOM 326 CB ALA A 533 27.412 30.220 45.617 1.00 0.00 C ATOM 0 H ALA A 533 29.698 30.337 46.503 1.00 0.00 H new ATOM 0 HA ALA A 533 28.076 32.142 44.945 1.00 0.00 H new ATOM 0 HB1 ALA A 533 26.371 30.403 45.350 1.00 0.00 H new ATOM 0 HB2 ALA A 533 27.908 29.691 44.803 1.00 0.00 H new ATOM 0 HB3 ALA A 533 27.454 29.614 46.522 1.00 0.00 H new ATOM 332 N THR A 534 27.139 33.663 46.608 1.00 0.00 N ATOM 333 CA THR A 534 26.510 34.645 47.511 1.00 0.00 C ATOM 334 C THR A 534 24.984 34.516 47.624 1.00 0.00 C ATOM 335 O THR A 534 24.399 35.020 48.576 1.00 0.00 O ATOM 336 CB THR A 534 26.957 36.064 47.111 1.00 0.00 C ATOM 337 OG1 THR A 534 26.598 37.018 48.086 1.00 0.00 O ATOM 338 CG2 THR A 534 26.353 36.517 45.780 1.00 0.00 C ATOM 0 H THR A 534 27.346 34.045 45.685 1.00 0.00 H new ATOM 0 HA THR A 534 26.860 34.428 48.520 1.00 0.00 H new ATOM 0 HB THR A 534 28.041 36.005 47.017 1.00 0.00 H new ATOM 0 HG1 THR A 534 25.769 36.738 48.528 1.00 0.00 H new ATOM 0 HG21 THR A 534 26.701 37.523 45.546 1.00 0.00 H new ATOM 0 HG22 THR A 534 26.662 35.833 44.989 1.00 0.00 H new ATOM 0 HG23 THR A 534 25.266 36.517 45.855 1.00 0.00 H new ATOM 346 N ASP A 535 24.347 33.830 46.672 1.00 0.00 N ATOM 347 CA ASP A 535 22.894 33.725 46.473 1.00 0.00 C ATOM 348 C ASP A 535 22.415 32.385 45.872 1.00 0.00 C ATOM 349 O ASP A 535 23.225 31.562 45.436 1.00 0.00 O ATOM 350 CB ASP A 535 22.385 34.951 45.693 1.00 0.00 C ATOM 351 CG ASP A 535 22.006 36.188 46.516 1.00 0.00 C ATOM 352 OD1 ASP A 535 22.019 37.298 45.925 1.00 0.00 O ATOM 353 OD2 ASP A 535 21.600 36.081 47.700 1.00 0.00 O ATOM 0 H ASP A 535 24.864 33.297 45.972 1.00 0.00 H new ATOM 0 HA ASP A 535 22.441 33.725 47.464 1.00 0.00 H new ATOM 0 HB2 ASP A 535 23.155 35.242 44.978 1.00 0.00 H new ATOM 0 HB3 ASP A 535 21.512 34.647 45.115 1.00 0.00 H new ATOM 358 N THR A 536 21.099 32.136 45.878 1.00 0.00 N ATOM 359 CA THR A 536 20.485 30.853 45.476 1.00 0.00 C ATOM 360 C THR A 536 20.717 30.391 44.027 1.00 0.00 C ATOM 361 O THR A 536 20.875 29.194 43.768 1.00 0.00 O ATOM 362 CB THR A 536 18.995 30.854 45.863 1.00 0.00 C ATOM 363 OG1 THR A 536 18.487 29.547 45.986 1.00 0.00 O ATOM 364 CG2 THR A 536 18.108 31.559 44.843 1.00 0.00 C ATOM 0 H THR A 536 20.412 32.832 46.168 1.00 0.00 H new ATOM 0 HA THR A 536 21.024 30.090 46.038 1.00 0.00 H new ATOM 0 HB THR A 536 18.966 31.387 46.814 1.00 0.00 H new ATOM 0 HG1 THR A 536 17.540 29.586 46.234 1.00 0.00 H new ATOM 0 HG21 THR A 536 17.071 31.524 45.177 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.422 32.598 44.744 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.196 31.060 43.878 1.00 0.00 H new ATOM 372 N ASP A 537 20.782 31.326 43.074 1.00 0.00 N ATOM 373 CA ASP A 537 21.048 31.035 41.659 1.00 0.00 C ATOM 374 C ASP A 537 22.533 30.838 41.304 1.00 0.00 C ATOM 375 O ASP A 537 22.872 30.325 40.238 1.00 0.00 O ATOM 376 CB ASP A 537 20.356 32.063 40.739 1.00 0.00 C ATOM 377 CG ASP A 537 18.834 31.909 40.590 1.00 0.00 C ATOM 378 OD1 ASP A 537 18.252 32.635 39.744 1.00 0.00 O ATOM 379 OD2 ASP A 537 18.194 31.063 41.256 1.00 0.00 O ATOM 0 H ASP A 537 20.650 32.319 43.265 1.00 0.00 H new ATOM 0 HA ASP A 537 20.603 30.057 41.477 1.00 0.00 H new ATOM 0 HB2 ASP A 537 20.566 33.062 41.120 1.00 0.00 H new ATOM 0 HB3 ASP A 537 20.807 31.998 39.749 1.00 0.00 H new ATOM 384 N GLU A 538 23.443 31.241 42.188 1.00 0.00 N ATOM 385 CA GLU A 538 24.861 31.388 41.896 1.00 0.00 C ATOM 386 C GLU A 538 25.661 30.073 42.009 1.00 0.00 C ATOM 387 O GLU A 538 25.515 29.306 42.968 1.00 0.00 O ATOM 388 CB GLU A 538 25.415 32.533 42.762 1.00 0.00 C ATOM 389 CG GLU A 538 25.097 33.931 42.192 1.00 0.00 C ATOM 390 CD GLU A 538 23.618 34.374 42.123 1.00 0.00 C ATOM 391 OE1 GLU A 538 23.336 35.361 41.404 1.00 0.00 O ATOM 392 OE2 GLU A 538 22.735 33.845 42.835 1.00 0.00 O ATOM 0 H GLU A 538 23.205 31.480 43.151 1.00 0.00 H new ATOM 0 HA GLU A 538 24.982 31.650 40.845 1.00 0.00 H new ATOM 0 HB2 GLU A 538 25.000 32.454 43.767 1.00 0.00 H new ATOM 0 HB3 GLU A 538 26.495 32.422 42.853 1.00 0.00 H new ATOM 0 HG2 GLU A 538 25.636 34.665 42.791 1.00 0.00 H new ATOM 0 HG3 GLU A 538 25.506 33.980 41.183 1.00 0.00 H new ATOM 399 N LEU A 539 26.515 29.813 41.015 1.00 0.00 N ATOM 400 CA LEU A 539 27.392 28.643 40.919 1.00 0.00 C ATOM 401 C LEU A 539 28.687 28.876 41.714 1.00 0.00 C ATOM 402 O LEU A 539 29.367 29.877 41.498 1.00 0.00 O ATOM 403 CB LEU A 539 27.741 28.371 39.435 1.00 0.00 C ATOM 404 CG LEU A 539 27.717 26.900 38.978 1.00 0.00 C ATOM 405 CD1 LEU A 539 28.520 26.739 37.700 1.00 0.00 C ATOM 406 CD2 LEU A 539 28.304 25.911 39.982 1.00 0.00 C ATOM 0 H LEU A 539 26.618 30.442 40.219 1.00 0.00 H new ATOM 0 HA LEU A 539 26.870 27.782 41.337 1.00 0.00 H new ATOM 0 HB2 LEU A 539 27.044 28.932 38.813 1.00 0.00 H new ATOM 0 HB3 LEU A 539 28.736 28.772 39.240 1.00 0.00 H new ATOM 0 HG LEU A 539 26.659 26.671 38.850 1.00 0.00 H new ATOM 0 HD11 LEU A 539 28.497 25.696 37.385 1.00 0.00 H new ATOM 0 HD12 LEU A 539 28.088 27.364 36.918 1.00 0.00 H new ATOM 0 HD13 LEU A 539 29.552 27.042 37.878 1.00 0.00 H new ATOM 0 HD21 LEU A 539 28.245 24.901 39.575 1.00 0.00 H new ATOM 0 HD22 LEU A 539 29.347 26.164 40.175 1.00 0.00 H new ATOM 0 HD23 LEU A 539 27.740 25.961 40.914 1.00 0.00 H new ATOM 418 N GLN A 540 29.064 27.952 42.594 1.00 0.00 N ATOM 419 CA GLN A 540 30.303 28.044 43.375 1.00 0.00 C ATOM 420 C GLN A 540 31.488 27.383 42.652 1.00 0.00 C ATOM 421 O GLN A 540 31.369 26.243 42.199 1.00 0.00 O ATOM 422 CB GLN A 540 30.044 27.386 44.730 1.00 0.00 C ATOM 423 CG GLN A 540 31.145 27.710 45.751 1.00 0.00 C ATOM 424 CD GLN A 540 30.610 27.723 47.173 1.00 0.00 C ATOM 425 OE1 GLN A 540 30.333 28.770 47.747 1.00 0.00 O ATOM 426 NE2 GLN A 540 30.258 26.582 47.711 1.00 0.00 N ATOM 0 H GLN A 540 28.518 27.113 42.789 1.00 0.00 H new ATOM 0 HA GLN A 540 30.578 29.090 43.506 1.00 0.00 H new ATOM 0 HB2 GLN A 540 29.082 27.721 45.117 1.00 0.00 H new ATOM 0 HB3 GLN A 540 29.977 26.306 44.601 1.00 0.00 H new ATOM 0 HG2 GLN A 540 31.944 26.973 45.670 1.00 0.00 H new ATOM 0 HG3 GLN A 540 31.582 28.681 45.518 1.00 0.00 H new ATOM 0 HE21 GLN A 540 30.484 25.705 47.241 1.00 0.00 H new ATOM 0 HE22 GLN A 540 29.758 26.570 48.600 1.00 0.00 H new ATOM 435 N LEU A 541 32.641 28.056 42.573 1.00 0.00 N ATOM 436 CA LEU A 541 33.828 27.605 41.820 1.00 0.00 C ATOM 437 C LEU A 541 35.085 27.509 42.699 1.00 0.00 C ATOM 438 O LEU A 541 35.289 28.340 43.586 1.00 0.00 O ATOM 439 CB LEU A 541 34.075 28.549 40.619 1.00 0.00 C ATOM 440 CG LEU A 541 32.928 28.631 39.593 1.00 0.00 C ATOM 441 CD1 LEU A 541 33.352 29.528 38.430 1.00 0.00 C ATOM 442 CD2 LEU A 541 32.554 27.263 39.027 1.00 0.00 C ATOM 0 H LEU A 541 32.783 28.951 43.040 1.00 0.00 H new ATOM 0 HA LEU A 541 33.623 26.597 41.459 1.00 0.00 H new ATOM 0 HB2 LEU A 541 34.270 29.551 41.001 1.00 0.00 H new ATOM 0 HB3 LEU A 541 34.978 28.223 40.103 1.00 0.00 H new ATOM 0 HG LEU A 541 32.060 29.036 40.113 1.00 0.00 H new ATOM 0 HD11 LEU A 541 32.542 29.588 37.703 1.00 0.00 H new ATOM 0 HD12 LEU A 541 33.578 30.526 38.804 1.00 0.00 H new ATOM 0 HD13 LEU A 541 34.238 29.110 37.953 1.00 0.00 H new ATOM 0 HD21 LEU A 541 31.741 27.376 38.309 1.00 0.00 H new ATOM 0 HD22 LEU A 541 33.420 26.826 38.529 1.00 0.00 H new ATOM 0 HD23 LEU A 541 32.233 26.609 39.838 1.00 0.00 H new ATOM 454 N LYS A 542 35.968 26.543 42.410 1.00 0.00 N ATOM 455 CA LYS A 542 37.313 26.421 43.001 1.00 0.00 C ATOM 456 C LYS A 542 38.379 26.628 41.928 1.00 0.00 C ATOM 457 O LYS A 542 38.206 26.162 40.806 1.00 0.00 O ATOM 458 CB LYS A 542 37.392 25.050 43.706 1.00 0.00 C ATOM 459 CG LYS A 542 38.516 24.864 44.736 1.00 0.00 C ATOM 460 CD LYS A 542 39.947 24.655 44.217 1.00 0.00 C ATOM 461 CE LYS A 542 40.090 23.588 43.121 1.00 0.00 C ATOM 462 NZ LYS A 542 39.876 22.221 43.641 1.00 0.00 N ATOM 0 H LYS A 542 35.763 25.802 41.739 1.00 0.00 H new ATOM 0 HA LYS A 542 37.501 27.193 43.747 1.00 0.00 H new ATOM 0 HB2 LYS A 542 36.440 24.870 44.206 1.00 0.00 H new ATOM 0 HB3 LYS A 542 37.501 24.281 42.941 1.00 0.00 H new ATOM 0 HG2 LYS A 542 38.521 25.740 45.385 1.00 0.00 H new ATOM 0 HG3 LYS A 542 38.259 24.007 45.359 1.00 0.00 H new ATOM 0 HD2 LYS A 542 40.320 25.604 43.831 1.00 0.00 H new ATOM 0 HD3 LYS A 542 40.586 24.380 45.057 1.00 0.00 H new ATOM 0 HE2 LYS A 542 39.373 23.789 42.325 1.00 0.00 H new ATOM 0 HE3 LYS A 542 41.084 23.655 42.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 542 39.982 21.535 42.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 542 40.577 22.018 44.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 542 38.918 22.147 44.040 1.00 0.00 H new ATOM 476 N ALA A 543 39.482 27.310 42.246 1.00 0.00 N ATOM 477 CA ALA A 543 40.579 27.568 41.308 1.00 0.00 C ATOM 478 C ALA A 543 41.145 26.260 40.709 1.00 0.00 C ATOM 479 O ALA A 543 41.855 25.499 41.376 1.00 0.00 O ATOM 480 CB ALA A 543 41.656 28.390 42.027 1.00 0.00 C ATOM 0 H ALA A 543 39.641 27.704 43.173 1.00 0.00 H new ATOM 0 HA ALA A 543 40.202 28.140 40.460 1.00 0.00 H new ATOM 0 HB1 ALA A 543 42.479 28.590 41.341 1.00 0.00 H new ATOM 0 HB2 ALA A 543 41.228 29.334 42.365 1.00 0.00 H new ATOM 0 HB3 ALA A 543 42.027 27.831 42.886 1.00 0.00 H new ATOM 486 N GLY A 544 40.792 26.013 39.446 1.00 0.00 N ATOM 487 CA GLY A 544 41.084 24.799 38.678 1.00 0.00 C ATOM 488 C GLY A 544 39.849 24.124 38.072 1.00 0.00 C ATOM 489 O GLY A 544 39.996 23.265 37.200 1.00 0.00 O ATOM 0 H GLY A 544 40.264 26.694 38.900 1.00 0.00 H new ATOM 0 HA2 GLY A 544 41.778 25.049 37.875 1.00 0.00 H new ATOM 0 HA3 GLY A 544 41.592 24.086 39.327 1.00 0.00 H new ATOM 493 N ASP A 545 38.636 24.506 38.481 1.00 0.00 N ATOM 494 CA ASP A 545 37.400 23.838 38.082 1.00 0.00 C ATOM 495 C ASP A 545 36.950 24.105 36.649 1.00 0.00 C ATOM 496 O ASP A 545 36.758 25.258 36.262 1.00 0.00 O ATOM 497 CB ASP A 545 36.270 24.116 39.085 1.00 0.00 C ATOM 498 CG ASP A 545 36.373 23.331 40.396 1.00 0.00 C ATOM 499 OD1 ASP A 545 37.204 22.393 40.509 1.00 0.00 O ATOM 500 OD2 ASP A 545 35.589 23.656 41.316 1.00 0.00 O ATOM 0 H ASP A 545 38.486 25.298 39.106 1.00 0.00 H new ATOM 0 HA ASP A 545 37.641 22.775 38.099 1.00 0.00 H new ATOM 0 HB2 ASP A 545 36.260 25.181 39.315 1.00 0.00 H new ATOM 0 HB3 ASP A 545 35.316 23.883 38.611 1.00 0.00 H new ATOM 505 N VAL A 546 36.733 23.047 35.872 1.00 0.00 N ATOM 506 CA VAL A 546 36.044 23.134 34.585 1.00 0.00 C ATOM 507 C VAL A 546 34.542 23.343 34.770 1.00 0.00 C ATOM 508 O VAL A 546 33.910 22.654 35.574 1.00 0.00 O ATOM 509 CB VAL A 546 36.370 21.964 33.634 1.00 0.00 C ATOM 510 CG1 VAL A 546 36.046 22.333 32.185 1.00 0.00 C ATOM 511 CG2 VAL A 546 37.851 21.565 33.678 1.00 0.00 C ATOM 0 H VAL A 546 37.030 22.102 36.117 1.00 0.00 H new ATOM 0 HA VAL A 546 36.435 24.020 34.085 1.00 0.00 H new ATOM 0 HB VAL A 546 35.758 21.129 33.975 1.00 0.00 H new ATOM 0 HG11 VAL A 546 36.284 21.492 31.533 1.00 0.00 H new ATOM 0 HG12 VAL A 546 34.986 22.570 32.098 1.00 0.00 H new ATOM 0 HG13 VAL A 546 36.637 23.200 31.889 1.00 0.00 H new ATOM 0 HG21 VAL A 546 38.025 20.737 32.990 1.00 0.00 H new ATOM 0 HG22 VAL A 546 38.466 22.416 33.385 1.00 0.00 H new ATOM 0 HG23 VAL A 546 38.115 21.258 34.690 1.00 0.00 H new ATOM 521 N VAL A 547 33.951 24.271 34.022 1.00 0.00 N ATOM 522 CA VAL A 547 32.502 24.520 33.979 1.00 0.00 C ATOM 523 C VAL A 547 31.960 24.370 32.575 1.00 0.00 C ATOM 524 O VAL A 547 32.426 25.036 31.653 1.00 0.00 O ATOM 525 CB VAL A 547 32.036 25.828 34.670 1.00 0.00 C ATOM 526 CG1 VAL A 547 30.614 25.693 35.211 1.00 0.00 C ATOM 527 CG2 VAL A 547 32.950 26.294 35.803 1.00 0.00 C ATOM 0 H VAL A 547 34.478 24.892 33.408 1.00 0.00 H new ATOM 0 HA VAL A 547 32.058 23.738 34.596 1.00 0.00 H new ATOM 0 HB VAL A 547 32.075 26.584 33.886 1.00 0.00 H new ATOM 0 HG11 VAL A 547 30.317 26.626 35.689 1.00 0.00 H new ATOM 0 HG12 VAL A 547 29.932 25.473 34.390 1.00 0.00 H new ATOM 0 HG13 VAL A 547 30.577 24.884 35.940 1.00 0.00 H new ATOM 0 HG21 VAL A 547 32.555 27.214 36.234 1.00 0.00 H new ATOM 0 HG22 VAL A 547 32.997 25.524 36.573 1.00 0.00 H new ATOM 0 HG23 VAL A 547 33.951 26.477 35.411 1.00 0.00 H new ATOM 537 N LEU A 548 31.002 23.465 32.406 1.00 0.00 N ATOM 538 CA LEU A 548 30.310 23.249 31.150 1.00 0.00 C ATOM 539 C LEU A 548 29.281 24.379 30.972 1.00 0.00 C ATOM 540 O LEU A 548 28.219 24.352 31.598 1.00 0.00 O ATOM 541 CB LEU A 548 29.637 21.860 31.166 1.00 0.00 C ATOM 542 CG LEU A 548 30.435 20.615 31.609 1.00 0.00 C ATOM 543 CD1 LEU A 548 29.506 19.426 31.830 1.00 0.00 C ATOM 544 CD2 LEU A 548 31.474 20.165 30.596 1.00 0.00 C ATOM 0 H LEU A 548 30.682 22.852 33.155 1.00 0.00 H new ATOM 0 HA LEU A 548 31.004 23.267 30.309 1.00 0.00 H new ATOM 0 HB2 LEU A 548 28.764 21.932 31.814 1.00 0.00 H new ATOM 0 HB3 LEU A 548 29.270 21.667 30.158 1.00 0.00 H new ATOM 0 HG LEU A 548 30.937 20.921 32.527 1.00 0.00 H new ATOM 0 HD11 LEU A 548 30.091 18.560 32.142 1.00 0.00 H new ATOM 0 HD12 LEU A 548 28.779 19.671 32.605 1.00 0.00 H new ATOM 0 HD13 LEU A 548 28.983 19.196 30.902 1.00 0.00 H new ATOM 0 HD21 LEU A 548 31.995 19.286 30.975 1.00 0.00 H new ATOM 0 HD22 LEU A 548 30.982 19.918 29.655 1.00 0.00 H new ATOM 0 HD23 LEU A 548 32.192 20.968 30.430 1.00 0.00 H new ATOM 556 N VAL A 549 29.600 25.395 30.168 1.00 0.00 N ATOM 557 CA VAL A 549 28.641 26.446 29.770 1.00 0.00 C ATOM 558 C VAL A 549 27.438 25.914 28.975 1.00 0.00 C ATOM 559 O VAL A 549 27.587 25.221 27.963 1.00 0.00 O ATOM 560 CB VAL A 549 29.322 27.606 29.019 1.00 0.00 C ATOM 561 CG1 VAL A 549 28.437 28.853 28.943 1.00 0.00 C ATOM 562 CG2 VAL A 549 30.641 27.988 29.700 1.00 0.00 C ATOM 0 H VAL A 549 30.531 25.519 29.770 1.00 0.00 H new ATOM 0 HA VAL A 549 28.247 26.835 30.709 1.00 0.00 H new ATOM 0 HB VAL A 549 29.505 27.249 28.006 1.00 0.00 H new ATOM 0 HG11 VAL A 549 28.964 29.641 28.404 1.00 0.00 H new ATOM 0 HG12 VAL A 549 27.512 28.611 28.420 1.00 0.00 H new ATOM 0 HG13 VAL A 549 28.205 29.196 29.951 1.00 0.00 H new ATOM 0 HG21 VAL A 549 31.107 28.809 29.155 1.00 0.00 H new ATOM 0 HG22 VAL A 549 30.444 28.299 30.726 1.00 0.00 H new ATOM 0 HG23 VAL A 549 31.311 27.128 29.704 1.00 0.00 H new ATOM 572 N ILE A 550 26.232 26.286 29.407 1.00 0.00 N ATOM 573 CA ILE A 550 24.945 25.910 28.804 1.00 0.00 C ATOM 574 C ILE A 550 24.155 27.183 28.446 1.00 0.00 C ATOM 575 O ILE A 550 24.371 28.236 29.053 1.00 0.00 O ATOM 576 CB ILE A 550 24.140 24.974 29.742 1.00 0.00 C ATOM 577 CG1 ILE A 550 23.671 25.695 31.029 1.00 0.00 C ATOM 578 CG2 ILE A 550 24.934 23.681 30.013 1.00 0.00 C ATOM 579 CD1 ILE A 550 23.090 24.781 32.117 1.00 0.00 C ATOM 0 H ILE A 550 26.117 26.885 30.224 1.00 0.00 H new ATOM 0 HA ILE A 550 25.128 25.350 27.887 1.00 0.00 H new ATOM 0 HB ILE A 550 23.219 24.684 29.236 1.00 0.00 H new ATOM 0 HG12 ILE A 550 24.516 26.241 31.449 1.00 0.00 H new ATOM 0 HG13 ILE A 550 22.917 26.434 30.758 1.00 0.00 H new ATOM 0 HG21 ILE A 550 24.358 23.032 30.673 1.00 0.00 H new ATOM 0 HG22 ILE A 550 25.123 23.166 29.071 1.00 0.00 H new ATOM 0 HG23 ILE A 550 25.884 23.930 30.487 1.00 0.00 H new ATOM 0 HD11 ILE A 550 22.792 25.382 32.976 1.00 0.00 H new ATOM 0 HD12 ILE A 550 22.221 24.254 31.723 1.00 0.00 H new ATOM 0 HD13 ILE A 550 23.844 24.057 32.425 1.00 0.00 H new ATOM 591 N PRO A 551 23.241 27.120 27.463 1.00 0.00 N ATOM 592 CA PRO A 551 22.366 28.237 27.128 1.00 0.00 C ATOM 593 C PRO A 551 21.415 28.528 28.296 1.00 0.00 C ATOM 594 O PRO A 551 20.947 27.618 28.986 1.00 0.00 O ATOM 595 CB PRO A 551 21.652 27.811 25.843 1.00 0.00 C ATOM 596 CG PRO A 551 21.598 26.289 25.941 1.00 0.00 C ATOM 597 CD PRO A 551 22.891 25.947 26.675 1.00 0.00 C ATOM 0 HA PRO A 551 22.899 29.173 26.962 1.00 0.00 H new ATOM 0 HB2 PRO A 551 20.653 28.243 25.779 1.00 0.00 H new ATOM 0 HB3 PRO A 551 22.197 28.135 24.957 1.00 0.00 H new ATOM 0 HG2 PRO A 551 20.720 25.951 26.491 1.00 0.00 H new ATOM 0 HG3 PRO A 551 21.557 25.822 24.957 1.00 0.00 H new ATOM 0 HD2 PRO A 551 22.755 25.076 27.316 1.00 0.00 H new ATOM 0 HD3 PRO A 551 23.685 25.703 25.969 1.00 0.00 H new ATOM 605 N PHE A 552 21.141 29.812 28.540 1.00 0.00 N ATOM 606 CA PHE A 552 20.328 30.232 29.679 1.00 0.00 C ATOM 607 C PHE A 552 18.913 29.667 29.760 1.00 0.00 C ATOM 608 O PHE A 552 18.185 29.656 28.762 1.00 0.00 O ATOM 609 CB PHE A 552 20.304 31.750 29.858 1.00 0.00 C ATOM 610 CG PHE A 552 21.517 32.353 30.545 1.00 0.00 C ATOM 611 CD1 PHE A 552 21.428 32.756 31.891 1.00 0.00 C ATOM 612 CD2 PHE A 552 22.727 32.534 29.846 1.00 0.00 C ATOM 613 CE1 PHE A 552 22.536 33.331 32.535 1.00 0.00 C ATOM 614 CE2 PHE A 552 23.837 33.105 30.493 1.00 0.00 C ATOM 615 CZ PHE A 552 23.743 33.505 31.838 1.00 0.00 C ATOM 0 H PHE A 552 21.474 30.581 27.959 1.00 0.00 H new ATOM 0 HA PHE A 552 20.858 29.773 30.514 1.00 0.00 H new ATOM 0 HB2 PHE A 552 20.199 32.211 28.876 1.00 0.00 H new ATOM 0 HB3 PHE A 552 19.416 32.016 30.431 1.00 0.00 H new ATOM 0 HD1 PHE A 552 20.503 32.622 32.431 1.00 0.00 H new ATOM 0 HD2 PHE A 552 22.802 32.234 28.811 1.00 0.00 H new ATOM 0 HE1 PHE A 552 22.460 33.640 33.567 1.00 0.00 H new ATOM 0 HE2 PHE A 552 24.764 33.237 29.956 1.00 0.00 H new ATOM 0 HZ PHE A 552 24.596 33.945 32.333 1.00 0.00 H new ATOM 625 N GLN A 553 18.483 29.317 30.972 1.00 0.00 N ATOM 626 CA GLN A 553 17.137 28.799 31.215 1.00 0.00 C ATOM 627 C GLN A 553 15.999 29.772 30.848 1.00 0.00 C ATOM 628 O GLN A 553 14.912 29.320 30.486 1.00 0.00 O ATOM 629 CB GLN A 553 17.026 28.322 32.673 1.00 0.00 C ATOM 630 CG GLN A 553 17.411 29.377 33.735 1.00 0.00 C ATOM 631 CD GLN A 553 16.769 29.153 35.105 1.00 0.00 C ATOM 632 OE1 GLN A 553 15.687 28.607 35.239 1.00 0.00 O ATOM 633 NE2 GLN A 553 17.367 29.632 36.172 1.00 0.00 N ATOM 0 H GLN A 553 19.057 29.384 31.812 1.00 0.00 H new ATOM 0 HA GLN A 553 17.000 27.957 30.537 1.00 0.00 H new ATOM 0 HB2 GLN A 553 16.001 28.000 32.857 1.00 0.00 H new ATOM 0 HB3 GLN A 553 17.663 27.447 32.803 1.00 0.00 H new ATOM 0 HG2 GLN A 553 18.495 29.381 33.851 1.00 0.00 H new ATOM 0 HG3 GLN A 553 17.126 30.364 33.370 1.00 0.00 H new ATOM 0 HE21 GLN A 553 18.273 30.093 36.085 1.00 0.00 H new ATOM 0 HE22 GLN A 553 16.926 29.543 37.087 1.00 0.00 H new ATOM 642 N ASN A 554 16.250 31.085 30.901 1.00 0.00 N ATOM 643 CA ASN A 554 15.339 32.151 30.477 1.00 0.00 C ATOM 644 C ASN A 554 16.099 33.447 30.130 1.00 0.00 C ATOM 645 O ASN A 554 17.157 33.704 30.709 1.00 0.00 O ATOM 646 CB ASN A 554 14.273 32.387 31.572 1.00 0.00 C ATOM 647 CG ASN A 554 12.942 31.724 31.253 1.00 0.00 C ATOM 648 OD1 ASN A 554 12.558 31.565 30.104 1.00 0.00 O ATOM 649 ND2 ASN A 554 12.176 31.373 32.253 1.00 0.00 N ATOM 0 H ASN A 554 17.134 31.448 31.257 1.00 0.00 H new ATOM 0 HA ASN A 554 14.836 31.837 29.563 1.00 0.00 H new ATOM 0 HB2 ASN A 554 14.645 32.005 32.523 1.00 0.00 H new ATOM 0 HB3 ASN A 554 14.119 33.459 31.697 1.00 0.00 H new ATOM 0 HD21 ASN A 554 11.258 30.966 32.074 1.00 0.00 H new ATOM 0 HD22 ASN A 554 12.497 31.506 33.212 1.00 0.00 H new ATOM 656 N PRO A 555 15.557 34.306 29.245 1.00 0.00 N ATOM 657 CA PRO A 555 16.217 35.536 28.801 1.00 0.00 C ATOM 658 C PRO A 555 16.333 36.585 29.918 1.00 0.00 C ATOM 659 O PRO A 555 17.325 37.307 29.988 1.00 0.00 O ATOM 660 CB PRO A 555 15.367 36.038 27.627 1.00 0.00 C ATOM 661 CG PRO A 555 13.970 35.492 27.931 1.00 0.00 C ATOM 662 CD PRO A 555 14.259 34.155 28.606 1.00 0.00 C ATOM 0 HA PRO A 555 17.249 35.347 28.507 1.00 0.00 H new ATOM 0 HB2 PRO A 555 15.368 37.126 27.569 1.00 0.00 H new ATOM 0 HB3 PRO A 555 15.743 35.668 26.673 1.00 0.00 H new ATOM 0 HG2 PRO A 555 13.410 36.160 28.585 1.00 0.00 H new ATOM 0 HG3 PRO A 555 13.380 35.366 27.023 1.00 0.00 H new ATOM 0 HD2 PRO A 555 13.489 33.912 29.338 1.00 0.00 H new ATOM 0 HD3 PRO A 555 14.274 33.344 27.878 1.00 0.00 H new ATOM 670 N GLU A 556 15.358 36.649 30.833 1.00 0.00 N ATOM 671 CA GLU A 556 15.414 37.520 32.019 1.00 0.00 C ATOM 672 C GLU A 556 16.336 36.972 33.129 1.00 0.00 C ATOM 673 O GLU A 556 16.744 37.718 34.015 1.00 0.00 O ATOM 674 CB GLU A 556 13.992 37.782 32.545 1.00 0.00 C ATOM 675 CG GLU A 556 13.294 36.549 33.144 1.00 0.00 C ATOM 676 CD GLU A 556 11.893 36.858 33.695 1.00 0.00 C ATOM 677 OE1 GLU A 556 11.389 36.064 34.521 1.00 0.00 O ATOM 678 OE2 GLU A 556 11.257 37.874 33.306 1.00 0.00 O ATOM 0 H GLU A 556 14.503 36.096 30.773 1.00 0.00 H new ATOM 0 HA GLU A 556 15.858 38.465 31.708 1.00 0.00 H new ATOM 0 HB2 GLU A 556 14.038 38.562 33.305 1.00 0.00 H new ATOM 0 HB3 GLU A 556 13.382 38.168 31.728 1.00 0.00 H new ATOM 0 HG2 GLU A 556 13.215 35.776 32.379 1.00 0.00 H new ATOM 0 HG3 GLU A 556 13.912 36.143 33.945 1.00 0.00 H new ATOM 685 N GLU A 557 16.695 35.682 33.089 1.00 0.00 N ATOM 686 CA GLU A 557 17.634 35.076 34.048 1.00 0.00 C ATOM 687 C GLU A 557 19.112 35.391 33.727 1.00 0.00 C ATOM 688 O GLU A 557 20.001 35.246 34.573 1.00 0.00 O ATOM 689 CB GLU A 557 17.422 33.557 34.114 1.00 0.00 C ATOM 690 CG GLU A 557 16.074 33.131 34.727 1.00 0.00 C ATOM 691 CD GLU A 557 15.967 33.263 36.254 1.00 0.00 C ATOM 692 OE1 GLU A 557 14.898 32.946 36.825 1.00 0.00 O ATOM 693 OE2 GLU A 557 16.957 33.594 36.947 1.00 0.00 O ATOM 0 H GLU A 557 16.343 35.027 32.391 1.00 0.00 H new ATOM 0 HA GLU A 557 17.419 35.521 35.019 1.00 0.00 H new ATOM 0 HB2 GLU A 557 17.495 33.148 33.106 1.00 0.00 H new ATOM 0 HB3 GLU A 557 18.229 33.114 34.697 1.00 0.00 H new ATOM 0 HG2 GLU A 557 15.284 33.729 34.273 1.00 0.00 H new ATOM 0 HG3 GLU A 557 15.884 32.092 34.456 1.00 0.00 H new ATOM 700 N GLN A 558 19.381 35.820 32.496 1.00 0.00 N ATOM 701 CA GLN A 558 20.688 36.274 32.027 1.00 0.00 C ATOM 702 C GLN A 558 21.016 37.693 32.521 1.00 0.00 C ATOM 703 O GLN A 558 20.222 38.619 32.353 1.00 0.00 O ATOM 704 CB GLN A 558 20.715 36.149 30.496 1.00 0.00 C ATOM 705 CG GLN A 558 22.102 36.366 29.871 1.00 0.00 C ATOM 706 CD GLN A 558 22.179 35.846 28.433 1.00 0.00 C ATOM 707 OE1 GLN A 558 21.176 35.670 27.740 1.00 0.00 O ATOM 708 NE2 GLN A 558 23.367 35.561 27.942 1.00 0.00 N ATOM 0 H GLN A 558 18.666 35.863 31.769 1.00 0.00 H new ATOM 0 HA GLN A 558 21.474 35.646 32.446 1.00 0.00 H new ATOM 0 HB2 GLN A 558 20.354 35.159 30.217 1.00 0.00 H new ATOM 0 HB3 GLN A 558 20.020 36.873 30.071 1.00 0.00 H new ATOM 0 HG2 GLN A 558 22.342 37.429 29.884 1.00 0.00 H new ATOM 0 HG3 GLN A 558 22.854 35.862 30.478 1.00 0.00 H new ATOM 0 HE21 GLN A 558 24.202 35.704 28.511 1.00 0.00 H new ATOM 0 HE22 GLN A 558 23.453 35.197 26.993 1.00 0.00 H new ATOM 717 N ASP A 559 22.203 37.859 33.111 1.00 0.00 N ATOM 718 CA ASP A 559 22.806 39.141 33.502 1.00 0.00 C ATOM 719 C ASP A 559 24.095 39.470 32.714 1.00 0.00 C ATOM 720 O ASP A 559 24.819 38.581 32.252 1.00 0.00 O ATOM 721 CB ASP A 559 22.927 39.263 35.048 1.00 0.00 C ATOM 722 CG ASP A 559 21.880 40.189 35.671 1.00 0.00 C ATOM 723 OD1 ASP A 559 21.247 39.795 36.673 1.00 0.00 O ATOM 724 OD2 ASP A 559 21.705 41.326 35.167 1.00 0.00 O ATOM 0 H ASP A 559 22.801 37.065 33.341 1.00 0.00 H new ATOM 0 HA ASP A 559 22.121 39.935 33.204 1.00 0.00 H new ATOM 0 HB2 ASP A 559 22.833 38.272 35.491 1.00 0.00 H new ATOM 0 HB3 ASP A 559 23.922 39.632 35.299 1.00 0.00 H new ATOM 729 N GLU A 560 24.369 40.760 32.508 1.00 0.00 N ATOM 730 CA GLU A 560 25.471 41.242 31.667 1.00 0.00 C ATOM 731 C GLU A 560 26.837 40.959 32.314 1.00 0.00 C ATOM 732 O GLU A 560 27.105 41.408 33.434 1.00 0.00 O ATOM 733 CB GLU A 560 25.277 42.742 31.391 1.00 0.00 C ATOM 734 CG GLU A 560 26.349 43.334 30.463 1.00 0.00 C ATOM 735 CD GLU A 560 26.315 44.864 30.400 1.00 0.00 C ATOM 736 OE1 GLU A 560 26.810 45.420 29.390 1.00 0.00 O ATOM 737 OE2 GLU A 560 25.849 45.529 31.359 1.00 0.00 O ATOM 0 H GLU A 560 23.823 41.513 32.927 1.00 0.00 H new ATOM 0 HA GLU A 560 25.458 40.703 30.720 1.00 0.00 H new ATOM 0 HB2 GLU A 560 24.295 42.898 30.945 1.00 0.00 H new ATOM 0 HB3 GLU A 560 25.287 43.283 32.337 1.00 0.00 H new ATOM 0 HG2 GLU A 560 27.333 43.013 30.804 1.00 0.00 H new ATOM 0 HG3 GLU A 560 26.213 42.932 29.459 1.00 0.00 H new ATOM 744 N GLY A 561 27.707 40.237 31.599 1.00 0.00 N ATOM 745 CA GLY A 561 29.032 39.800 32.070 1.00 0.00 C ATOM 746 C GLY A 561 29.038 38.490 32.871 1.00 0.00 C ATOM 747 O GLY A 561 30.107 38.011 33.257 1.00 0.00 O ATOM 0 H GLY A 561 27.505 39.930 30.648 1.00 0.00 H new ATOM 0 HA2 GLY A 561 29.687 39.683 31.207 1.00 0.00 H new ATOM 0 HA3 GLY A 561 29.459 40.589 32.690 1.00 0.00 H new ATOM 751 N TRP A 562 27.861 37.904 33.102 1.00 0.00 N ATOM 752 CA TRP A 562 27.658 36.597 33.733 1.00 0.00 C ATOM 753 C TRP A 562 27.513 35.467 32.713 1.00 0.00 C ATOM 754 O TRP A 562 27.016 35.689 31.606 1.00 0.00 O ATOM 755 CB TRP A 562 26.420 36.669 34.635 1.00 0.00 C ATOM 756 CG TRP A 562 26.594 37.510 35.852 1.00 0.00 C ATOM 757 CD1 TRP A 562 26.611 38.860 35.873 1.00 0.00 C ATOM 758 CD2 TRP A 562 27.065 37.091 37.164 1.00 0.00 C ATOM 759 NE1 TRP A 562 26.980 39.296 37.129 1.00 0.00 N ATOM 760 CE2 TRP A 562 27.318 38.248 37.952 1.00 0.00 C ATOM 761 CE3 TRP A 562 27.286 35.840 37.768 1.00 0.00 C ATOM 762 CZ2 TRP A 562 27.788 38.167 39.267 1.00 0.00 C ATOM 763 CZ3 TRP A 562 27.757 35.744 39.088 1.00 0.00 C ATOM 764 CH2 TRP A 562 28.021 36.905 39.836 1.00 0.00 C ATOM 0 H TRP A 562 26.981 38.349 32.842 1.00 0.00 H new ATOM 0 HA TRP A 562 28.544 36.365 34.324 1.00 0.00 H new ATOM 0 HB2 TRP A 562 25.585 37.060 34.054 1.00 0.00 H new ATOM 0 HB3 TRP A 562 26.150 35.659 34.942 1.00 0.00 H new ATOM 0 HD1 TRP A 562 26.373 39.500 35.036 1.00 0.00 H new ATOM 0 HE1 TRP A 562 27.000 40.276 37.412 1.00 0.00 H new ATOM 0 HE3 TRP A 562 27.090 34.938 37.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 27.970 39.065 39.838 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 27.917 34.772 39.531 1.00 0.00 H new ATOM 0 HH2 TRP A 562 28.401 36.826 40.844 1.00 0.00 H new ATOM 775 N LEU A 563 27.848 34.239 33.105 1.00 0.00 N ATOM 776 CA LEU A 563 27.543 33.035 32.323 1.00 0.00 C ATOM 777 C LEU A 563 26.895 31.959 33.196 1.00 0.00 C ATOM 778 O LEU A 563 26.984 31.997 34.422 1.00 0.00 O ATOM 779 CB LEU A 563 28.804 32.523 31.600 1.00 0.00 C ATOM 780 CG LEU A 563 29.071 33.173 30.225 1.00 0.00 C ATOM 781 CD1 LEU A 563 30.309 32.508 29.621 1.00 0.00 C ATOM 782 CD2 LEU A 563 27.930 32.979 29.219 1.00 0.00 C ATOM 0 H LEU A 563 28.341 34.047 33.977 1.00 0.00 H new ATOM 0 HA LEU A 563 26.814 33.296 31.556 1.00 0.00 H new ATOM 0 HB2 LEU A 563 29.668 32.695 32.241 1.00 0.00 H new ATOM 0 HB3 LEU A 563 28.716 31.445 31.466 1.00 0.00 H new ATOM 0 HG LEU A 563 29.188 34.243 30.400 1.00 0.00 H new ATOM 0 HD11 LEU A 563 30.520 32.949 28.647 1.00 0.00 H new ATOM 0 HD12 LEU A 563 31.163 32.660 30.282 1.00 0.00 H new ATOM 0 HD13 LEU A 563 30.127 31.440 29.503 1.00 0.00 H new ATOM 0 HD21 LEU A 563 28.189 33.463 28.277 1.00 0.00 H new ATOM 0 HD22 LEU A 563 27.772 31.914 29.049 1.00 0.00 H new ATOM 0 HD23 LEU A 563 27.016 33.422 29.615 1.00 0.00 H new ATOM 794 N MET A 564 26.207 31.021 32.541 1.00 0.00 N ATOM 795 CA MET A 564 25.501 29.904 33.160 1.00 0.00 C ATOM 796 C MET A 564 26.100 28.572 32.713 1.00 0.00 C ATOM 797 O MET A 564 26.450 28.382 31.550 1.00 0.00 O ATOM 798 CB MET A 564 24.005 30.001 32.834 1.00 0.00 C ATOM 799 CG MET A 564 23.151 28.894 33.465 1.00 0.00 C ATOM 800 SD MET A 564 21.359 29.192 33.389 1.00 0.00 S ATOM 801 CE MET A 564 21.198 30.486 34.652 1.00 0.00 C ATOM 0 H MET A 564 26.125 31.022 31.524 1.00 0.00 H new ATOM 0 HA MET A 564 25.616 29.955 34.243 1.00 0.00 H new ATOM 0 HB2 MET A 564 23.633 30.968 33.172 1.00 0.00 H new ATOM 0 HB3 MET A 564 23.878 29.970 31.752 1.00 0.00 H new ATOM 0 HG2 MET A 564 23.372 27.951 32.964 1.00 0.00 H new ATOM 0 HG3 MET A 564 23.444 28.776 34.508 1.00 0.00 H new ATOM 0 HE1 MET A 564 20.159 30.811 34.709 1.00 0.00 H new ATOM 0 HE2 MET A 564 21.509 30.091 35.619 1.00 0.00 H new ATOM 0 HE3 MET A 564 21.829 31.334 34.387 1.00 0.00 H new ATOM 811 N GLY A 565 26.218 27.638 33.647 1.00 0.00 N ATOM 812 CA GLY A 565 26.785 26.323 33.411 1.00 0.00 C ATOM 813 C GLY A 565 26.583 25.381 34.591 1.00 0.00 C ATOM 814 O GLY A 565 25.955 25.726 35.597 1.00 0.00 O ATOM 0 H GLY A 565 25.914 27.780 34.610 1.00 0.00 H new ATOM 0 HA2 GLY A 565 26.329 25.889 32.521 1.00 0.00 H new ATOM 0 HA3 GLY A 565 27.851 26.422 33.207 1.00 0.00 H new ATOM 818 N VAL A 566 27.160 24.194 34.461 1.00 0.00 N ATOM 819 CA VAL A 566 27.302 23.196 35.528 1.00 0.00 C ATOM 820 C VAL A 566 28.765 22.773 35.606 1.00 0.00 C ATOM 821 O VAL A 566 29.424 22.629 34.574 1.00 0.00 O ATOM 822 CB VAL A 566 26.319 22.023 35.311 1.00 0.00 C ATOM 823 CG1 VAL A 566 26.597 21.239 34.023 1.00 0.00 C ATOM 824 CG2 VAL A 566 26.330 21.030 36.478 1.00 0.00 C ATOM 0 H VAL A 566 27.560 23.882 33.576 1.00 0.00 H new ATOM 0 HA VAL A 566 27.033 23.619 36.496 1.00 0.00 H new ATOM 0 HB VAL A 566 25.341 22.498 35.238 1.00 0.00 H new ATOM 0 HG11 VAL A 566 25.874 20.429 33.927 1.00 0.00 H new ATOM 0 HG12 VAL A 566 26.511 21.906 33.165 1.00 0.00 H new ATOM 0 HG13 VAL A 566 27.604 20.824 34.060 1.00 0.00 H new ATOM 0 HG21 VAL A 566 25.623 20.225 36.277 1.00 0.00 H new ATOM 0 HG22 VAL A 566 27.331 20.614 36.592 1.00 0.00 H new ATOM 0 HG23 VAL A 566 26.044 21.544 37.396 1.00 0.00 H new ATOM 834 N LYS A 567 29.316 22.610 36.811 1.00 0.00 N ATOM 835 CA LYS A 567 30.689 22.127 36.979 1.00 0.00 C ATOM 836 C LYS A 567 30.860 20.766 36.324 1.00 0.00 C ATOM 837 O LYS A 567 30.034 19.876 36.517 1.00 0.00 O ATOM 838 CB LYS A 567 31.065 22.108 38.469 1.00 0.00 C ATOM 839 CG LYS A 567 31.674 23.456 38.885 1.00 0.00 C ATOM 840 CD LYS A 567 32.207 23.447 40.320 1.00 0.00 C ATOM 841 CE LYS A 567 31.090 23.240 41.348 1.00 0.00 C ATOM 842 NZ LYS A 567 31.572 23.513 42.716 1.00 0.00 N ATOM 0 H LYS A 567 28.831 22.806 37.687 1.00 0.00 H new ATOM 0 HA LYS A 567 31.375 22.810 36.478 1.00 0.00 H new ATOM 0 HB2 LYS A 567 30.181 21.900 39.071 1.00 0.00 H new ATOM 0 HB3 LYS A 567 31.777 21.305 38.661 1.00 0.00 H new ATOM 0 HG2 LYS A 567 32.485 23.709 38.202 1.00 0.00 H new ATOM 0 HG3 LYS A 567 30.919 24.236 38.787 1.00 0.00 H new ATOM 0 HD2 LYS A 567 32.948 22.655 40.426 1.00 0.00 H new ATOM 0 HD3 LYS A 567 32.716 24.389 40.523 1.00 0.00 H new ATOM 0 HE2 LYS A 567 30.252 23.897 41.116 1.00 0.00 H new ATOM 0 HE3 LYS A 567 30.720 22.217 41.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 30.921 23.085 43.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 32.521 23.106 42.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 31.614 24.541 42.871 1.00 0.00 H new ATOM 856 N GLU A 568 31.944 20.584 35.573 1.00 0.00 N ATOM 857 CA GLU A 568 32.248 19.284 34.980 1.00 0.00 C ATOM 858 C GLU A 568 32.386 18.231 36.084 1.00 0.00 C ATOM 859 O GLU A 568 31.743 17.198 35.994 1.00 0.00 O ATOM 860 CB GLU A 568 33.492 19.367 34.088 1.00 0.00 C ATOM 861 CG GLU A 568 33.784 18.040 33.370 1.00 0.00 C ATOM 862 CD GLU A 568 34.891 18.201 32.323 1.00 0.00 C ATOM 863 OE1 GLU A 568 34.576 18.233 31.111 1.00 0.00 O ATOM 864 OE2 GLU A 568 36.084 18.295 32.701 1.00 0.00 O ATOM 0 H GLU A 568 32.623 21.315 35.362 1.00 0.00 H new ATOM 0 HA GLU A 568 31.425 18.979 34.333 1.00 0.00 H new ATOM 0 HB2 GLU A 568 33.354 20.155 33.348 1.00 0.00 H new ATOM 0 HB3 GLU A 568 34.353 19.647 34.695 1.00 0.00 H new ATOM 0 HG2 GLU A 568 34.079 17.287 34.101 1.00 0.00 H new ATOM 0 HG3 GLU A 568 32.876 17.678 32.888 1.00 0.00 H new ATOM 871 N SER A 569 33.062 18.539 37.195 1.00 0.00 N ATOM 872 CA SER A 569 33.153 17.656 38.371 1.00 0.00 C ATOM 873 C SER A 569 31.818 17.299 39.033 1.00 0.00 C ATOM 874 O SER A 569 31.713 16.306 39.748 1.00 0.00 O ATOM 875 CB SER A 569 34.017 18.320 39.449 1.00 0.00 C ATOM 876 OG SER A 569 33.522 19.608 39.790 1.00 0.00 O ATOM 0 H SER A 569 33.568 19.417 37.308 1.00 0.00 H new ATOM 0 HA SER A 569 33.580 16.732 37.981 1.00 0.00 H new ATOM 0 HB2 SER A 569 34.040 17.690 40.338 1.00 0.00 H new ATOM 0 HB3 SER A 569 35.044 18.406 39.093 1.00 0.00 H new ATOM 0 HG SER A 569 34.092 20.005 40.481 1.00 0.00 H new ATOM 882 N ASP A 570 30.788 18.112 38.836 1.00 0.00 N ATOM 883 CA ASP A 570 29.423 17.856 39.284 1.00 0.00 C ATOM 884 C ASP A 570 28.592 16.999 38.316 1.00 0.00 C ATOM 885 O ASP A 570 27.965 16.013 38.708 1.00 0.00 O ATOM 886 CB ASP A 570 28.773 19.203 39.622 1.00 0.00 C ATOM 887 CG ASP A 570 29.100 19.777 41.003 1.00 0.00 C ATOM 888 OD1 ASP A 570 29.894 19.190 41.779 1.00 0.00 O ATOM 889 OD2 ASP A 570 28.513 20.837 41.332 1.00 0.00 O ATOM 0 H ASP A 570 30.882 19.000 38.342 1.00 0.00 H new ATOM 0 HA ASP A 570 29.460 17.236 40.180 1.00 0.00 H new ATOM 0 HB2 ASP A 570 29.075 19.929 38.868 1.00 0.00 H new ATOM 0 HB3 ASP A 570 27.692 19.092 39.543 1.00 0.00 H new ATOM 894 N TRP A 571 28.673 17.330 37.027 1.00 0.00 N ATOM 895 CA TRP A 571 28.056 16.591 35.922 1.00 0.00 C ATOM 896 C TRP A 571 28.688 15.202 35.705 1.00 0.00 C ATOM 897 O TRP A 571 27.980 14.234 35.453 1.00 0.00 O ATOM 898 CB TRP A 571 28.134 17.488 34.678 1.00 0.00 C ATOM 899 CG TRP A 571 27.573 16.927 33.408 1.00 0.00 C ATOM 900 CD1 TRP A 571 28.271 16.237 32.476 1.00 0.00 C ATOM 901 CD2 TRP A 571 26.170 16.788 33.023 1.00 0.00 C ATOM 902 NE1 TRP A 571 27.413 15.750 31.510 1.00 0.00 N ATOM 903 CE2 TRP A 571 26.106 16.059 31.799 1.00 0.00 C ATOM 904 CE3 TRP A 571 24.942 17.213 33.574 1.00 0.00 C ATOM 905 CZ2 TRP A 571 24.897 15.768 31.155 1.00 0.00 C ATOM 906 CZ3 TRP A 571 23.721 16.935 32.928 1.00 0.00 C ATOM 907 CH2 TRP A 571 23.693 16.208 31.725 1.00 0.00 C ATOM 0 H TRP A 571 29.189 18.151 36.711 1.00 0.00 H new ATOM 0 HA TRP A 571 27.014 16.370 36.155 1.00 0.00 H new ATOM 0 HB2 TRP A 571 27.613 18.420 34.897 1.00 0.00 H new ATOM 0 HB3 TRP A 571 29.180 17.740 34.506 1.00 0.00 H new ATOM 0 HD1 TRP A 571 29.341 16.089 32.486 1.00 0.00 H new ATOM 0 HE1 TRP A 571 27.712 15.227 30.687 1.00 0.00 H new ATOM 0 HE3 TRP A 571 24.938 17.760 34.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 571 24.892 15.211 30.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 571 22.796 17.284 33.362 1.00 0.00 H new ATOM 0 HH2 TRP A 571 22.751 15.990 31.243 1.00 0.00 H new ATOM 918 N ASN A 572 30.003 15.071 35.902 1.00 0.00 N ATOM 919 CA ASN A 572 30.772 13.820 35.828 1.00 0.00 C ATOM 920 C ASN A 572 30.607 12.938 37.088 1.00 0.00 C ATOM 921 O ASN A 572 30.968 11.759 37.064 1.00 0.00 O ATOM 922 CB ASN A 572 32.256 14.194 35.612 1.00 0.00 C ATOM 923 CG ASN A 572 33.045 13.185 34.802 1.00 0.00 C ATOM 924 OD1 ASN A 572 32.537 12.179 34.335 1.00 0.00 O ATOM 925 ND2 ASN A 572 34.304 13.455 34.567 1.00 0.00 N ATOM 0 H ASN A 572 30.592 15.873 36.129 1.00 0.00 H new ATOM 0 HA ASN A 572 30.394 13.222 34.999 1.00 0.00 H new ATOM 0 HB2 ASN A 572 32.305 15.161 35.112 1.00 0.00 H new ATOM 0 HB3 ASN A 572 32.733 14.314 36.585 1.00 0.00 H new ATOM 0 HD21 ASN A 572 34.862 12.824 33.992 1.00 0.00 H new ATOM 0 HD22 ASN A 572 34.727 14.297 34.958 1.00 0.00 H new ATOM 932 N GLN A 573 30.069 13.496 38.182 1.00 0.00 N ATOM 933 CA GLN A 573 29.497 12.754 39.321 1.00 0.00 C ATOM 934 C GLN A 573 27.983 12.483 39.156 1.00 0.00 C ATOM 935 O GLN A 573 27.354 11.875 40.027 1.00 0.00 O ATOM 936 CB GLN A 573 29.815 13.483 40.640 1.00 0.00 C ATOM 937 CG GLN A 573 31.306 13.417 41.018 1.00 0.00 C ATOM 938 CD GLN A 573 31.836 12.030 41.370 1.00 0.00 C ATOM 939 OE1 GLN A 573 31.106 11.067 41.587 1.00 0.00 O ATOM 940 NE2 GLN A 573 33.136 11.869 41.421 1.00 0.00 N ATOM 0 H GLN A 573 30.017 14.507 38.305 1.00 0.00 H new ATOM 0 HA GLN A 573 29.968 11.772 39.349 1.00 0.00 H new ATOM 0 HB2 GLN A 573 29.513 14.527 40.554 1.00 0.00 H new ATOM 0 HB3 GLN A 573 29.222 13.045 41.443 1.00 0.00 H new ATOM 0 HG2 GLN A 573 31.891 13.810 40.186 1.00 0.00 H new ATOM 0 HG3 GLN A 573 31.477 14.078 41.868 1.00 0.00 H new ATOM 0 HE21 GLN A 573 33.755 12.660 41.243 1.00 0.00 H new ATOM 0 HE22 GLN A 573 33.528 10.953 41.639 1.00 0.00 H new ATOM 949 N HIS A 574 27.396 12.928 38.038 1.00 0.00 N ATOM 950 CA HIS A 574 26.003 12.728 37.608 1.00 0.00 C ATOM 951 C HIS A 574 24.961 13.283 38.587 1.00 0.00 C ATOM 952 O HIS A 574 23.877 12.720 38.784 1.00 0.00 O ATOM 953 CB HIS A 574 25.766 11.282 37.144 1.00 0.00 C ATOM 954 CG HIS A 574 26.704 10.886 36.033 1.00 0.00 C ATOM 955 ND1 HIS A 574 26.710 11.417 34.766 1.00 0.00 N ATOM 956 CD2 HIS A 574 27.697 9.944 36.083 1.00 0.00 C ATOM 957 CE1 HIS A 574 27.695 10.826 34.073 1.00 0.00 C ATOM 958 NE2 HIS A 574 28.336 9.918 34.834 1.00 0.00 N ATOM 0 H HIS A 574 27.920 13.479 37.358 1.00 0.00 H new ATOM 0 HA HIS A 574 25.844 13.349 36.726 1.00 0.00 H new ATOM 0 HB2 HIS A 574 25.896 10.604 37.988 1.00 0.00 H new ATOM 0 HB3 HIS A 574 24.736 11.174 36.805 1.00 0.00 H new ATOM 0 HD2 HIS A 574 27.945 9.329 36.935 1.00 0.00 H new ATOM 0 HE1 HIS A 574 27.941 11.048 33.045 1.00 0.00 H new ATOM 0 HE2 HIS A 574 29.124 9.332 34.559 1.00 0.00 H new ATOM 966 N LYS A 575 25.312 14.403 39.223 1.00 0.00 N ATOM 967 CA LYS A 575 24.467 15.139 40.166 1.00 0.00 C ATOM 968 C LYS A 575 23.368 15.902 39.424 1.00 0.00 C ATOM 969 O LYS A 575 23.568 16.349 38.295 1.00 0.00 O ATOM 970 CB LYS A 575 25.341 16.081 41.006 1.00 0.00 C ATOM 971 CG LYS A 575 26.446 15.335 41.777 1.00 0.00 C ATOM 972 CD LYS A 575 27.526 16.271 42.332 1.00 0.00 C ATOM 973 CE LYS A 575 27.347 16.641 43.812 1.00 0.00 C ATOM 974 NZ LYS A 575 26.187 17.528 44.081 1.00 0.00 N ATOM 0 H LYS A 575 26.225 14.838 39.091 1.00 0.00 H new ATOM 0 HA LYS A 575 23.974 14.436 40.837 1.00 0.00 H new ATOM 0 HB2 LYS A 575 25.798 16.825 40.353 1.00 0.00 H new ATOM 0 HB3 LYS A 575 24.711 16.621 41.713 1.00 0.00 H new ATOM 0 HG2 LYS A 575 25.996 14.780 42.600 1.00 0.00 H new ATOM 0 HG3 LYS A 575 26.912 14.603 41.117 1.00 0.00 H new ATOM 0 HD2 LYS A 575 28.500 15.798 42.204 1.00 0.00 H new ATOM 0 HD3 LYS A 575 27.535 17.186 41.740 1.00 0.00 H new ATOM 0 HE2 LYS A 575 27.233 15.726 44.393 1.00 0.00 H new ATOM 0 HE3 LYS A 575 28.254 17.131 44.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 26.134 17.731 45.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 26.302 18.418 43.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 25.311 17.057 43.776 1.00 0.00 H new ATOM 988 N GLU A 576 22.216 16.041 40.069 1.00 0.00 N ATOM 989 CA GLU A 576 20.985 16.644 39.542 1.00 0.00 C ATOM 990 C GLU A 576 21.172 18.049 38.927 1.00 0.00 C ATOM 991 O GLU A 576 21.279 19.053 39.637 1.00 0.00 O ATOM 992 CB GLU A 576 19.885 16.624 40.620 1.00 0.00 C ATOM 993 CG GLU A 576 20.349 17.019 42.035 1.00 0.00 C ATOM 994 CD GLU A 576 20.872 15.850 42.899 1.00 0.00 C ATOM 995 OE1 GLU A 576 20.961 16.020 44.141 1.00 0.00 O ATOM 996 OE2 GLU A 576 21.205 14.759 42.379 1.00 0.00 O ATOM 0 H GLU A 576 22.103 15.719 41.030 1.00 0.00 H new ATOM 0 HA GLU A 576 20.673 16.025 38.701 1.00 0.00 H new ATOM 0 HB2 GLU A 576 19.086 17.300 40.315 1.00 0.00 H new ATOM 0 HB3 GLU A 576 19.457 15.623 40.661 1.00 0.00 H new ATOM 0 HG2 GLU A 576 21.137 17.767 41.947 1.00 0.00 H new ATOM 0 HG3 GLU A 576 19.516 17.492 42.556 1.00 0.00 H new ATOM 1003 N LEU A 577 21.178 18.119 37.590 1.00 0.00 N ATOM 1004 CA LEU A 577 21.507 19.302 36.784 1.00 0.00 C ATOM 1005 C LEU A 577 20.723 20.555 37.198 1.00 0.00 C ATOM 1006 O LEU A 577 21.319 21.603 37.438 1.00 0.00 O ATOM 1007 CB LEU A 577 21.249 18.942 35.307 1.00 0.00 C ATOM 1008 CG LEU A 577 21.434 20.095 34.297 1.00 0.00 C ATOM 1009 CD1 LEU A 577 22.883 20.572 34.214 1.00 0.00 C ATOM 1010 CD2 LEU A 577 20.963 19.705 32.895 1.00 0.00 C ATOM 0 H LEU A 577 20.942 17.312 37.012 1.00 0.00 H new ATOM 0 HA LEU A 577 22.554 19.560 36.946 1.00 0.00 H new ATOM 0 HB2 LEU A 577 21.918 18.128 35.028 1.00 0.00 H new ATOM 0 HB3 LEU A 577 20.231 18.563 35.216 1.00 0.00 H new ATOM 0 HG LEU A 577 20.817 20.912 34.672 1.00 0.00 H new ATOM 0 HD11 LEU A 577 22.958 21.383 33.490 1.00 0.00 H new ATOM 0 HD12 LEU A 577 23.205 20.928 35.192 1.00 0.00 H new ATOM 0 HD13 LEU A 577 23.521 19.746 33.900 1.00 0.00 H new ATOM 0 HD21 LEU A 577 21.111 20.544 32.215 1.00 0.00 H new ATOM 0 HD22 LEU A 577 21.537 18.848 32.544 1.00 0.00 H new ATOM 0 HD23 LEU A 577 19.905 19.445 32.926 1.00 0.00 H new ATOM 1022 N GLU A 578 19.399 20.440 37.328 1.00 0.00 N ATOM 1023 CA GLU A 578 18.497 21.566 37.630 1.00 0.00 C ATOM 1024 C GLU A 578 18.702 22.182 39.033 1.00 0.00 C ATOM 1025 O GLU A 578 18.216 23.285 39.288 1.00 0.00 O ATOM 1026 CB GLU A 578 17.031 21.129 37.433 1.00 0.00 C ATOM 1027 CG GLU A 578 16.700 20.746 35.975 1.00 0.00 C ATOM 1028 CD GLU A 578 15.204 20.464 35.722 1.00 0.00 C ATOM 1029 OE1 GLU A 578 14.386 20.525 36.674 1.00 0.00 O ATOM 1030 OE2 GLU A 578 14.837 20.162 34.557 1.00 0.00 O ATOM 0 H GLU A 578 18.911 19.550 37.226 1.00 0.00 H new ATOM 0 HA GLU A 578 18.749 22.360 36.927 1.00 0.00 H new ATOM 0 HB2 GLU A 578 16.822 20.278 38.081 1.00 0.00 H new ATOM 0 HB3 GLU A 578 16.372 21.938 37.747 1.00 0.00 H new ATOM 0 HG2 GLU A 578 17.023 21.552 35.317 1.00 0.00 H new ATOM 0 HG3 GLU A 578 17.277 19.862 35.703 1.00 0.00 H new ATOM 1037 N LYS A 579 19.441 21.506 39.926 1.00 0.00 N ATOM 1038 CA LYS A 579 19.878 22.022 41.243 1.00 0.00 C ATOM 1039 C LYS A 579 21.371 22.366 41.285 1.00 0.00 C ATOM 1040 O LYS A 579 21.786 23.253 42.031 1.00 0.00 O ATOM 1041 CB LYS A 579 19.556 20.996 42.349 1.00 0.00 C ATOM 1042 CG LYS A 579 18.088 20.550 42.440 1.00 0.00 C ATOM 1043 CD LYS A 579 17.122 21.726 42.642 1.00 0.00 C ATOM 1044 CE LYS A 579 15.662 21.274 42.727 1.00 0.00 C ATOM 1045 NZ LYS A 579 15.357 20.536 43.970 1.00 0.00 N ATOM 0 H LYS A 579 19.764 20.554 39.751 1.00 0.00 H new ATOM 0 HA LYS A 579 19.327 22.947 41.413 1.00 0.00 H new ATOM 0 HB2 LYS A 579 20.175 20.113 42.191 1.00 0.00 H new ATOM 0 HB3 LYS A 579 19.847 21.422 43.309 1.00 0.00 H new ATOM 0 HG2 LYS A 579 17.818 20.016 41.529 1.00 0.00 H new ATOM 0 HG3 LYS A 579 17.977 19.848 43.266 1.00 0.00 H new ATOM 0 HD2 LYS A 579 17.388 22.259 43.555 1.00 0.00 H new ATOM 0 HD3 LYS A 579 17.234 22.430 41.818 1.00 0.00 H new ATOM 0 HE2 LYS A 579 15.013 22.147 42.661 1.00 0.00 H new ATOM 0 HE3 LYS A 579 15.433 20.641 41.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 14.355 20.256 43.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 15.954 19.686 44.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 15.547 21.146 44.791 1.00 0.00 H new ATOM 1059 N CYS A 580 22.179 21.655 40.498 1.00 0.00 N ATOM 1060 CA CYS A 580 23.633 21.800 40.454 1.00 0.00 C ATOM 1061 C CYS A 580 24.126 22.949 39.557 1.00 0.00 C ATOM 1062 O CYS A 580 25.232 23.452 39.766 1.00 0.00 O ATOM 1063 CB CYS A 580 24.244 20.450 40.056 1.00 0.00 C ATOM 1064 SG CYS A 580 23.960 19.267 41.401 1.00 0.00 S ATOM 0 H CYS A 580 21.830 20.943 39.856 1.00 0.00 H new ATOM 0 HA CYS A 580 23.972 22.085 41.450 1.00 0.00 H new ATOM 0 HB2 CYS A 580 23.792 20.088 39.132 1.00 0.00 H new ATOM 0 HB3 CYS A 580 25.312 20.559 39.867 1.00 0.00 H new ATOM 0 HG CYS A 580 23.449 18.174 40.917 1.00 0.00 H new ATOM 1070 N ARG A 581 23.323 23.384 38.577 1.00 0.00 N ATOM 1071 CA ARG A 581 23.588 24.560 37.729 1.00 0.00 C ATOM 1072 C ARG A 581 23.619 25.867 38.523 1.00 0.00 C ATOM 1073 O ARG A 581 23.085 25.958 39.632 1.00 0.00 O ATOM 1074 CB ARG A 581 22.543 24.633 36.593 1.00 0.00 C ATOM 1075 CG ARG A 581 21.127 24.973 37.097 1.00 0.00 C ATOM 1076 CD ARG A 581 20.098 25.004 35.964 1.00 0.00 C ATOM 1077 NE ARG A 581 18.753 25.277 36.500 1.00 0.00 N ATOM 1078 CZ ARG A 581 17.606 25.285 35.848 1.00 0.00 C ATOM 1079 NH1 ARG A 581 17.515 25.021 34.579 1.00 0.00 N ATOM 1080 NH2 ARG A 581 16.510 25.559 36.486 1.00 0.00 N ATOM 0 H ARG A 581 22.447 22.917 38.344 1.00 0.00 H new ATOM 0 HA ARG A 581 24.583 24.436 37.301 1.00 0.00 H new ATOM 0 HB2 ARG A 581 22.855 25.385 35.868 1.00 0.00 H new ATOM 0 HB3 ARG A 581 22.516 23.677 36.070 1.00 0.00 H new ATOM 0 HG2 ARG A 581 20.822 24.237 37.841 1.00 0.00 H new ATOM 0 HG3 ARG A 581 21.144 25.942 37.596 1.00 0.00 H new ATOM 0 HD2 ARG A 581 20.370 25.770 35.238 1.00 0.00 H new ATOM 0 HD3 ARG A 581 20.100 24.050 35.436 1.00 0.00 H new ATOM 0 HE ARG A 581 18.702 25.485 37.497 1.00 0.00 H new ATOM 0 HH11 ARG A 581 18.353 24.795 34.044 1.00 0.00 H new ATOM 0 HH12 ARG A 581 16.605 25.040 34.118 1.00 0.00 H new ATOM 0 HH21 ARG A 581 16.539 25.766 37.484 1.00 0.00 H new ATOM 0 HH22 ARG A 581 15.619 25.567 35.989 1.00 0.00 H new ATOM 1094 N GLY A 582 24.198 26.894 37.905 1.00 0.00 N ATOM 1095 CA GLY A 582 24.153 28.268 38.404 1.00 0.00 C ATOM 1096 C GLY A 582 24.789 29.313 37.487 1.00 0.00 C ATOM 1097 O GLY A 582 25.387 28.972 36.464 1.00 0.00 O ATOM 0 H GLY A 582 24.718 26.795 37.033 1.00 0.00 H new ATOM 0 HA2 GLY A 582 23.112 28.542 38.574 1.00 0.00 H new ATOM 0 HA3 GLY A 582 24.654 28.303 39.371 1.00 0.00 H new ATOM 1101 N VAL A 583 24.688 30.585 37.889 1.00 0.00 N ATOM 1102 CA VAL A 583 25.409 31.718 37.284 1.00 0.00 C ATOM 1103 C VAL A 583 26.726 32.015 38.001 1.00 0.00 C ATOM 1104 O VAL A 583 26.805 31.982 39.229 1.00 0.00 O ATOM 1105 CB VAL A 583 24.562 33.004 37.159 1.00 0.00 C ATOM 1106 CG1 VAL A 583 23.327 32.820 36.280 1.00 0.00 C ATOM 1107 CG2 VAL A 583 24.107 33.579 38.502 1.00 0.00 C ATOM 0 H VAL A 583 24.087 30.865 38.664 1.00 0.00 H new ATOM 0 HA VAL A 583 25.633 31.391 36.269 1.00 0.00 H new ATOM 0 HB VAL A 583 25.246 33.711 36.690 1.00 0.00 H new ATOM 0 HG11 VAL A 583 22.773 33.757 36.231 1.00 0.00 H new ATOM 0 HG12 VAL A 583 23.635 32.527 35.276 1.00 0.00 H new ATOM 0 HG13 VAL A 583 22.690 32.044 36.705 1.00 0.00 H new ATOM 0 HG21 VAL A 583 23.518 34.480 38.331 1.00 0.00 H new ATOM 0 HG22 VAL A 583 23.499 32.842 39.026 1.00 0.00 H new ATOM 0 HG23 VAL A 583 24.980 33.825 39.107 1.00 0.00 H new ATOM 1117 N PHE A 584 27.753 32.350 37.228 1.00 0.00 N ATOM 1118 CA PHE A 584 29.081 32.739 37.708 1.00 0.00 C ATOM 1119 C PHE A 584 29.688 33.899 36.890 1.00 0.00 C ATOM 1120 O PHE A 584 29.311 34.092 35.725 1.00 0.00 O ATOM 1121 CB PHE A 584 30.012 31.520 37.731 1.00 0.00 C ATOM 1122 CG PHE A 584 30.197 30.852 36.385 1.00 0.00 C ATOM 1123 CD1 PHE A 584 31.279 31.229 35.567 1.00 0.00 C ATOM 1124 CD2 PHE A 584 29.283 29.881 35.935 1.00 0.00 C ATOM 1125 CE1 PHE A 584 31.450 30.633 34.308 1.00 0.00 C ATOM 1126 CE2 PHE A 584 29.464 29.272 34.681 1.00 0.00 C ATOM 1127 CZ PHE A 584 30.551 29.642 33.874 1.00 0.00 C ATOM 0 H PHE A 584 27.684 32.360 36.210 1.00 0.00 H new ATOM 0 HA PHE A 584 28.968 33.112 38.726 1.00 0.00 H new ATOM 0 HB2 PHE A 584 30.987 31.829 38.107 1.00 0.00 H new ATOM 0 HB3 PHE A 584 29.616 30.788 38.435 1.00 0.00 H new ATOM 0 HD1 PHE A 584 31.978 31.978 35.909 1.00 0.00 H new ATOM 0 HD2 PHE A 584 28.442 29.604 36.553 1.00 0.00 H new ATOM 0 HE1 PHE A 584 32.270 30.935 33.674 1.00 0.00 H new ATOM 0 HE2 PHE A 584 28.768 28.521 34.339 1.00 0.00 H new ATOM 0 HZ PHE A 584 30.698 29.164 32.917 1.00 0.00 H new ATOM 1137 N PRO A 585 30.623 34.680 37.462 1.00 0.00 N ATOM 1138 CA PRO A 585 31.384 35.675 36.709 1.00 0.00 C ATOM 1139 C PRO A 585 32.376 34.969 35.777 1.00 0.00 C ATOM 1140 O PRO A 585 33.342 34.363 36.240 1.00 0.00 O ATOM 1141 CB PRO A 585 32.084 36.524 37.772 1.00 0.00 C ATOM 1142 CG PRO A 585 32.260 35.570 38.955 1.00 0.00 C ATOM 1143 CD PRO A 585 31.066 34.630 38.854 1.00 0.00 C ATOM 0 HA PRO A 585 30.762 36.300 36.068 1.00 0.00 H new ATOM 0 HB2 PRO A 585 33.044 36.898 37.415 1.00 0.00 H new ATOM 0 HB3 PRO A 585 31.485 37.393 38.046 1.00 0.00 H new ATOM 0 HG2 PRO A 585 33.202 35.026 38.892 1.00 0.00 H new ATOM 0 HG3 PRO A 585 32.265 36.107 39.903 1.00 0.00 H new ATOM 0 HD2 PRO A 585 31.345 33.615 39.137 1.00 0.00 H new ATOM 0 HD3 PRO A 585 30.268 34.941 39.528 1.00 0.00 H new ATOM 1151 N GLU A 586 32.178 35.055 34.459 1.00 0.00 N ATOM 1152 CA GLU A 586 33.075 34.414 33.477 1.00 0.00 C ATOM 1153 C GLU A 586 34.538 34.885 33.620 1.00 0.00 C ATOM 1154 O GLU A 586 35.468 34.139 33.320 1.00 0.00 O ATOM 1155 CB GLU A 586 32.545 34.664 32.054 1.00 0.00 C ATOM 1156 CG GLU A 586 32.790 36.099 31.560 1.00 0.00 C ATOM 1157 CD GLU A 586 32.083 36.439 30.243 1.00 0.00 C ATOM 1158 OE1 GLU A 586 32.158 37.613 29.816 1.00 0.00 O ATOM 1159 OE2 GLU A 586 31.517 35.552 29.563 1.00 0.00 O ATOM 0 H GLU A 586 31.401 35.565 34.039 1.00 0.00 H new ATOM 0 HA GLU A 586 33.080 33.342 33.675 1.00 0.00 H new ATOM 0 HB2 GLU A 586 33.021 33.964 31.368 1.00 0.00 H new ATOM 0 HB3 GLU A 586 31.475 34.456 32.030 1.00 0.00 H new ATOM 0 HG2 GLU A 586 32.458 36.797 32.328 1.00 0.00 H new ATOM 0 HG3 GLU A 586 33.862 36.250 31.433 1.00 0.00 H new ATOM 1166 N ASN A 587 34.750 36.095 34.148 1.00 0.00 N ATOM 1167 CA ASN A 587 36.059 36.692 34.416 1.00 0.00 C ATOM 1168 C ASN A 587 36.830 36.064 35.602 1.00 0.00 C ATOM 1169 O ASN A 587 38.025 36.309 35.757 1.00 0.00 O ATOM 1170 CB ASN A 587 35.894 38.216 34.536 1.00 0.00 C ATOM 1171 CG ASN A 587 34.829 38.670 35.515 1.00 0.00 C ATOM 1172 OD1 ASN A 587 33.640 38.436 35.331 1.00 0.00 O ATOM 1173 ND2 ASN A 587 35.205 39.376 36.547 1.00 0.00 N ATOM 0 H ASN A 587 33.980 36.710 34.411 1.00 0.00 H new ATOM 0 HA ASN A 587 36.705 36.464 33.568 1.00 0.00 H new ATOM 0 HB2 ASN A 587 36.849 38.647 34.836 1.00 0.00 H new ATOM 0 HB3 ASN A 587 35.657 38.619 33.552 1.00 0.00 H new ATOM 0 HD21 ASN A 587 34.509 39.734 37.201 1.00 0.00 H new ATOM 0 HD22 ASN A 587 36.195 39.570 36.699 1.00 0.00 H new ATOM 1180 N PHE A 588 36.183 35.210 36.407 1.00 0.00 N ATOM 1181 CA PHE A 588 36.862 34.239 37.281 1.00 0.00 C ATOM 1182 C PHE A 588 37.456 32.992 36.609 1.00 0.00 C ATOM 1183 O PHE A 588 38.232 32.248 37.215 1.00 0.00 O ATOM 1184 CB PHE A 588 35.998 33.876 38.495 1.00 0.00 C ATOM 1185 CG PHE A 588 36.084 34.859 39.646 1.00 0.00 C ATOM 1186 CD1 PHE A 588 35.534 36.154 39.555 1.00 0.00 C ATOM 1187 CD2 PHE A 588 36.745 34.463 40.822 1.00 0.00 C ATOM 1188 CE1 PHE A 588 35.650 37.042 40.638 1.00 0.00 C ATOM 1189 CE2 PHE A 588 36.883 35.358 41.892 1.00 0.00 C ATOM 1190 CZ PHE A 588 36.330 36.646 41.803 1.00 0.00 C ATOM 0 H PHE A 588 35.166 35.172 36.472 1.00 0.00 H new ATOM 0 HA PHE A 588 37.748 34.779 37.614 1.00 0.00 H new ATOM 0 HB2 PHE A 588 34.959 33.801 38.175 1.00 0.00 H new ATOM 0 HB3 PHE A 588 36.294 32.890 38.853 1.00 0.00 H new ATOM 0 HD1 PHE A 588 35.024 36.463 38.654 1.00 0.00 H new ATOM 0 HD2 PHE A 588 37.148 33.464 40.901 1.00 0.00 H new ATOM 0 HE1 PHE A 588 35.217 38.029 40.575 1.00 0.00 H new ATOM 0 HE2 PHE A 588 37.414 35.058 42.783 1.00 0.00 H new ATOM 0 HZ PHE A 588 36.427 37.333 42.631 1.00 0.00 H new ATOM 1200 N THR A 589 37.070 32.748 35.359 1.00 0.00 N ATOM 1201 CA THR A 589 37.433 31.585 34.552 1.00 0.00 C ATOM 1202 C THR A 589 38.128 32.026 33.257 1.00 0.00 C ATOM 1203 O THR A 589 38.266 33.218 32.979 1.00 0.00 O ATOM 1204 CB THR A 589 36.183 30.728 34.272 1.00 0.00 C ATOM 1205 OG1 THR A 589 35.184 31.440 33.574 1.00 0.00 O ATOM 1206 CG2 THR A 589 35.526 30.133 35.526 1.00 0.00 C ATOM 0 H THR A 589 36.462 33.392 34.854 1.00 0.00 H new ATOM 0 HA THR A 589 38.142 30.969 35.105 1.00 0.00 H new ATOM 0 HB THR A 589 36.576 29.914 33.663 1.00 0.00 H new ATOM 0 HG1 THR A 589 35.478 32.365 33.435 1.00 0.00 H new ATOM 0 HG21 THR A 589 34.655 29.545 35.236 1.00 0.00 H new ATOM 0 HG22 THR A 589 36.241 29.492 36.042 1.00 0.00 H new ATOM 0 HG23 THR A 589 35.215 30.939 36.191 1.00 0.00 H new ATOM 1214 N GLU A 590 38.591 31.064 32.465 1.00 0.00 N ATOM 1215 CA GLU A 590 39.089 31.287 31.103 1.00 0.00 C ATOM 1216 C GLU A 590 38.315 30.384 30.141 1.00 0.00 C ATOM 1217 O GLU A 590 38.056 29.221 30.457 1.00 0.00 O ATOM 1218 CB GLU A 590 40.612 31.064 31.022 1.00 0.00 C ATOM 1219 CG GLU A 590 41.043 29.590 31.128 1.00 0.00 C ATOM 1220 CD GLU A 590 42.552 29.395 31.316 1.00 0.00 C ATOM 1221 OE1 GLU A 590 42.943 28.396 31.971 1.00 0.00 O ATOM 1222 OE2 GLU A 590 43.377 30.175 30.780 1.00 0.00 O ATOM 0 H GLU A 590 38.633 30.087 32.753 1.00 0.00 H new ATOM 0 HA GLU A 590 38.922 32.325 30.814 1.00 0.00 H new ATOM 0 HB2 GLU A 590 40.977 31.470 30.079 1.00 0.00 H new ATOM 0 HB3 GLU A 590 41.093 31.629 31.820 1.00 0.00 H new ATOM 0 HG2 GLU A 590 40.520 29.128 31.965 1.00 0.00 H new ATOM 0 HG3 GLU A 590 40.728 29.064 30.227 1.00 0.00 H new ATOM 1229 N ARG A 591 37.923 30.900 28.976 1.00 0.00 N ATOM 1230 CA ARG A 591 37.181 30.146 27.959 1.00 0.00 C ATOM 1231 C ARG A 591 38.124 29.145 27.289 1.00 0.00 C ATOM 1232 O ARG A 591 39.180 29.534 26.781 1.00 0.00 O ATOM 1233 CB ARG A 591 36.558 31.151 26.973 1.00 0.00 C ATOM 1234 CG ARG A 591 35.249 30.696 26.316 1.00 0.00 C ATOM 1235 CD ARG A 591 35.352 29.397 25.512 1.00 0.00 C ATOM 1236 NE ARG A 591 34.394 29.421 24.402 1.00 0.00 N ATOM 1237 CZ ARG A 591 34.376 28.662 23.333 1.00 0.00 C ATOM 1238 NH1 ARG A 591 35.157 27.630 23.189 1.00 0.00 N ATOM 1239 NH2 ARG A 591 33.525 28.958 22.402 1.00 0.00 N ATOM 0 H ARG A 591 38.113 31.865 28.706 1.00 0.00 H new ATOM 0 HA ARG A 591 36.368 29.566 28.396 1.00 0.00 H new ATOM 0 HB2 ARG A 591 36.375 32.087 27.501 1.00 0.00 H new ATOM 0 HB3 ARG A 591 37.284 31.364 26.189 1.00 0.00 H new ATOM 0 HG2 ARG A 591 34.495 30.568 27.092 1.00 0.00 H new ATOM 0 HG3 ARG A 591 34.895 31.488 25.656 1.00 0.00 H new ATOM 0 HD2 ARG A 591 36.365 29.276 25.127 1.00 0.00 H new ATOM 0 HD3 ARG A 591 35.152 28.542 26.158 1.00 0.00 H new ATOM 0 HE ARG A 591 33.649 30.114 24.470 1.00 0.00 H new ATOM 0 HH11 ARG A 591 35.818 27.384 23.926 1.00 0.00 H new ATOM 0 HH12 ARG A 591 35.108 27.068 22.339 1.00 0.00 H new ATOM 0 HH21 ARG A 591 32.901 29.757 22.517 1.00 0.00 H new ATOM 0 HH22 ARG A 591 33.479 28.392 21.554 1.00 0.00 H new ATOM 1253 N VAL A 592 37.749 27.867 27.283 1.00 0.00 N ATOM 1254 CA VAL A 592 38.567 26.747 26.768 1.00 0.00 C ATOM 1255 C VAL A 592 37.912 26.163 25.495 1.00 0.00 C ATOM 1256 O VAL A 592 36.708 26.362 25.281 1.00 0.00 O ATOM 1257 CB VAL A 592 38.761 25.677 27.870 1.00 0.00 C ATOM 1258 CG1 VAL A 592 39.749 26.171 28.932 1.00 0.00 C ATOM 1259 CG2 VAL A 592 37.468 25.277 28.585 1.00 0.00 C ATOM 0 H VAL A 592 36.845 27.563 27.644 1.00 0.00 H new ATOM 0 HA VAL A 592 39.557 27.110 26.493 1.00 0.00 H new ATOM 0 HB VAL A 592 39.141 24.799 27.347 1.00 0.00 H new ATOM 0 HG11 VAL A 592 39.873 25.406 29.698 1.00 0.00 H new ATOM 0 HG12 VAL A 592 40.712 26.376 28.465 1.00 0.00 H new ATOM 0 HG13 VAL A 592 39.366 27.083 29.389 1.00 0.00 H new ATOM 0 HG21 VAL A 592 37.689 24.524 29.342 1.00 0.00 H new ATOM 0 HG22 VAL A 592 37.030 26.154 29.062 1.00 0.00 H new ATOM 0 HG23 VAL A 592 36.763 24.868 27.861 1.00 0.00 H new ATOM 1269 N PRO A 593 38.675 25.491 24.609 1.00 0.00 N ATOM 1270 CA PRO A 593 38.195 24.977 23.317 1.00 0.00 C ATOM 1271 C PRO A 593 37.233 23.791 23.452 1.00 0.00 C ATOM 1272 O PRO A 593 37.527 22.833 24.203 1.00 0.00 O ATOM 1273 CB PRO A 593 39.454 24.617 22.518 1.00 0.00 C ATOM 1274 CG PRO A 593 40.484 24.298 23.599 1.00 0.00 C ATOM 1275 CD PRO A 593 40.110 25.263 24.722 1.00 0.00 C ATOM 1276 OXT PRO A 593 36.147 23.854 22.826 1.00 0.00 O ATOM 0 HA PRO A 593 37.599 25.733 22.806 1.00 0.00 H new ATOM 0 HB2 PRO A 593 39.283 23.763 21.863 1.00 0.00 H new ATOM 0 HB3 PRO A 593 39.778 25.444 21.886 1.00 0.00 H new ATOM 0 HG2 PRO A 593 40.422 23.259 23.922 1.00 0.00 H new ATOM 0 HG3 PRO A 593 41.503 24.462 23.248 1.00 0.00 H new ATOM 0 HD2 PRO A 593 40.361 24.842 25.695 1.00 0.00 H new ATOM 0 HD3 PRO A 593 40.660 26.199 24.629 1.00 0.00 H new TER 1284 PRO A 593 ATOM 1285 N SER B1728 44.597 45.929 43.657 1.00 0.00 N ATOM 1286 CA SER B1728 44.216 44.505 43.712 1.00 0.00 C ATOM 1287 C SER B1728 44.337 43.855 42.342 1.00 0.00 C ATOM 1288 O SER B1728 44.042 44.477 41.321 1.00 0.00 O ATOM 1289 CB SER B1728 42.815 44.330 44.293 1.00 0.00 C ATOM 1290 OG SER B1728 41.894 45.123 43.579 1.00 0.00 O ATOM 0 HA SER B1728 44.911 43.997 44.380 1.00 0.00 H new ATOM 0 HB2 SER B1728 42.520 43.282 44.243 1.00 0.00 H new ATOM 0 HB3 SER B1728 42.811 44.613 45.346 1.00 0.00 H new ATOM 0 HG SER B1728 42.337 45.940 43.269 1.00 0.00 H new ATOM 1298 N THR B1729 44.790 42.598 42.306 1.00 0.00 N ATOM 1299 CA THR B1729 45.068 41.812 41.084 1.00 0.00 C ATOM 1300 C THR B1729 44.023 40.732 40.772 1.00 0.00 C ATOM 1301 O THR B1729 43.911 40.266 39.632 1.00 0.00 O ATOM 1302 CB THR B1729 46.504 41.254 41.151 1.00 0.00 C ATOM 1303 OG1 THR B1729 46.889 40.656 39.931 1.00 0.00 O ATOM 1304 CG2 THR B1729 46.685 40.189 42.236 1.00 0.00 C ATOM 0 H THR B1729 44.983 42.072 43.158 1.00 0.00 H new ATOM 0 HA THR B1729 44.988 42.492 40.236 1.00 0.00 H new ATOM 0 HB THR B1729 47.123 42.122 41.379 1.00 0.00 H new ATOM 0 HG1 THR B1729 47.804 40.315 40.009 1.00 0.00 H new ATOM 0 HG21 THR B1729 47.716 39.837 42.232 1.00 0.00 H new ATOM 0 HG22 THR B1729 46.453 40.619 43.210 1.00 0.00 H new ATOM 0 HG23 THR B1729 46.015 39.352 42.040 1.00 0.00 H new ATOM 1312 N VAL B1730 43.210 40.358 41.761 1.00 0.00 N ATOM 1313 CA VAL B1730 42.081 39.425 41.580 1.00 0.00 C ATOM 1314 C VAL B1730 40.947 40.038 40.734 1.00 0.00 C ATOM 1315 O VAL B1730 40.752 41.263 40.761 1.00 0.00 O ATOM 1316 CB VAL B1730 41.542 38.883 42.923 1.00 0.00 C ATOM 1317 CG1 VAL B1730 42.648 38.188 43.726 1.00 0.00 C ATOM 1318 CG2 VAL B1730 40.871 39.956 43.793 1.00 0.00 C ATOM 0 H VAL B1730 43.311 40.693 42.719 1.00 0.00 H new ATOM 0 HA VAL B1730 42.480 38.576 41.026 1.00 0.00 H new ATOM 0 HB VAL B1730 40.773 38.159 42.654 1.00 0.00 H new ATOM 0 HG11 VAL B1730 42.238 37.818 44.665 1.00 0.00 H new ATOM 0 HG12 VAL B1730 43.046 37.353 43.150 1.00 0.00 H new ATOM 0 HG13 VAL B1730 43.448 38.899 43.935 1.00 0.00 H new ATOM 0 HG21 VAL B1730 40.517 39.504 44.719 1.00 0.00 H new ATOM 0 HG22 VAL B1730 41.592 40.740 44.024 1.00 0.00 H new ATOM 0 HG23 VAL B1730 40.027 40.386 43.254 1.00 0.00 H new ATOM 1328 N PRO B1731 40.185 39.216 39.985 1.00 0.00 N ATOM 1329 CA PRO B1731 38.974 39.650 39.291 1.00 0.00 C ATOM 1330 C PRO B1731 37.823 39.990 40.256 1.00 0.00 C ATOM 1331 O PRO B1731 37.850 39.644 41.442 1.00 0.00 O ATOM 1332 CB PRO B1731 38.614 38.493 38.350 1.00 0.00 C ATOM 1333 CG PRO B1731 39.155 37.265 39.074 1.00 0.00 C ATOM 1334 CD PRO B1731 40.422 37.798 39.737 1.00 0.00 C ATOM 0 HA PRO B1731 39.146 40.578 38.746 1.00 0.00 H new ATOM 0 HB2 PRO B1731 37.538 38.424 38.192 1.00 0.00 H new ATOM 0 HB3 PRO B1731 39.073 38.616 37.369 1.00 0.00 H new ATOM 0 HG2 PRO B1731 38.445 36.881 39.807 1.00 0.00 H new ATOM 0 HG3 PRO B1731 39.371 36.450 38.383 1.00 0.00 H new ATOM 0 HD2 PRO B1731 40.627 37.269 40.668 1.00 0.00 H new ATOM 0 HD3 PRO B1731 41.289 37.655 39.092 1.00 0.00 H new ATOM 1342 N VAL B1732 36.784 40.657 39.741 1.00 0.00 N ATOM 1343 CA VAL B1732 35.573 41.050 40.492 1.00 0.00 C ATOM 1344 C VAL B1732 34.285 40.776 39.723 1.00 0.00 C ATOM 1345 O VAL B1732 34.189 41.083 38.534 1.00 0.00 O ATOM 1346 CB VAL B1732 35.610 42.513 40.989 1.00 0.00 C ATOM 1347 CG1 VAL B1732 34.544 42.754 42.066 1.00 0.00 C ATOM 1348 CG2 VAL B1732 36.969 42.934 41.563 1.00 0.00 C ATOM 0 H VAL B1732 36.756 40.949 38.764 1.00 0.00 H new ATOM 0 HA VAL B1732 35.575 40.410 41.374 1.00 0.00 H new ATOM 0 HB VAL B1732 35.414 43.118 40.103 1.00 0.00 H new ATOM 0 HG11 VAL B1732 34.591 43.791 42.399 1.00 0.00 H new ATOM 0 HG12 VAL B1732 33.556 42.550 41.652 1.00 0.00 H new ATOM 0 HG13 VAL B1732 34.726 42.092 42.913 1.00 0.00 H new ATOM 0 HG21 VAL B1732 36.919 43.972 41.891 1.00 0.00 H new ATOM 0 HG22 VAL B1732 37.219 42.297 42.411 1.00 0.00 H new ATOM 0 HG23 VAL B1732 37.736 42.833 40.795 1.00 0.00 H new ATOM 1358 N ALA B1733 33.274 40.208 40.383 1.00 0.00 N ATOM 1359 CA ALA B1733 31.985 39.936 39.749 1.00 0.00 C ATOM 1360 C ALA B1733 31.285 41.234 39.258 1.00 0.00 C ATOM 1361 O ALA B1733 31.256 42.232 39.996 1.00 0.00 O ATOM 1362 CB ALA B1733 31.106 39.134 40.717 1.00 0.00 C ATOM 0 H ALA B1733 33.325 39.926 41.362 1.00 0.00 H new ATOM 0 HA ALA B1733 32.155 39.340 38.853 1.00 0.00 H new ATOM 0 HB1 ALA B1733 30.143 38.928 40.249 1.00 0.00 H new ATOM 0 HB2 ALA B1733 31.599 38.193 40.962 1.00 0.00 H new ATOM 0 HB3 ALA B1733 30.950 39.710 41.629 1.00 0.00 H new ATOM 1368 N PRO B1734 30.700 41.241 38.042 1.00 0.00 N ATOM 1369 CA PRO B1734 29.866 42.345 37.556 1.00 0.00 C ATOM 1370 C PRO B1734 28.507 42.394 38.286 1.00 0.00 C ATOM 1371 O PRO B1734 28.162 41.444 38.996 1.00 0.00 O ATOM 1372 CB PRO B1734 29.730 42.118 36.046 1.00 0.00 C ATOM 1373 CG PRO B1734 29.984 40.628 35.835 1.00 0.00 C ATOM 1374 CD PRO B1734 30.794 40.179 37.046 1.00 0.00 C ATOM 0 HA PRO B1734 30.314 43.318 37.758 1.00 0.00 H new ATOM 0 HB2 PRO B1734 28.738 42.401 35.694 1.00 0.00 H new ATOM 0 HB3 PRO B1734 30.449 42.721 35.492 1.00 0.00 H new ATOM 0 HG2 PRO B1734 29.047 40.076 35.763 1.00 0.00 H new ATOM 0 HG3 PRO B1734 30.531 40.450 34.909 1.00 0.00 H new ATOM 0 HD2 PRO B1734 30.405 39.242 37.444 1.00 0.00 H new ATOM 0 HD3 PRO B1734 31.833 40.001 36.770 1.00 0.00 H new ATOM 1382 N PRO B1735 27.710 43.471 38.150 1.00 0.00 N ATOM 1383 CA PRO B1735 26.410 43.587 38.823 1.00 0.00 C ATOM 1384 C PRO B1735 25.389 42.529 38.359 1.00 0.00 C ATOM 1385 O PRO B1735 25.579 41.877 37.328 1.00 0.00 O ATOM 1386 CB PRO B1735 25.942 45.021 38.551 1.00 0.00 C ATOM 1387 CG PRO B1735 26.643 45.398 37.249 1.00 0.00 C ATOM 1388 CD PRO B1735 27.976 44.658 37.346 1.00 0.00 C ATOM 0 HA PRO B1735 26.504 43.393 39.891 1.00 0.00 H new ATOM 0 HB2 PRO B1735 24.858 45.075 38.451 1.00 0.00 H new ATOM 0 HB3 PRO B1735 26.221 45.693 39.363 1.00 0.00 H new ATOM 0 HG2 PRO B1735 26.070 45.083 36.377 1.00 0.00 H new ATOM 0 HG3 PRO B1735 26.785 46.475 37.165 1.00 0.00 H new ATOM 0 HD2 PRO B1735 28.346 44.387 36.357 1.00 0.00 H new ATOM 0 HD3 PRO B1735 28.738 45.283 37.811 1.00 0.00 H new ATOM 1396 N ARG B1736 24.298 42.369 39.119 1.00 0.00 N ATOM 1397 CA ARG B1736 23.168 41.457 38.889 1.00 0.00 C ATOM 1398 C ARG B1736 21.897 42.190 39.334 1.00 0.00 C ATOM 1399 O ARG B1736 21.980 43.263 39.947 1.00 0.00 O ATOM 1400 CB ARG B1736 23.281 40.141 39.692 1.00 0.00 C ATOM 1401 CG ARG B1736 24.676 39.499 39.826 1.00 0.00 C ATOM 1402 CD ARG B1736 24.821 38.491 40.984 1.00 0.00 C ATOM 1403 NE ARG B1736 24.493 39.076 42.303 1.00 0.00 N ATOM 1404 CZ ARG B1736 23.759 38.572 43.280 1.00 0.00 C ATOM 1405 NH1 ARG B1736 23.164 37.420 43.238 1.00 0.00 N ATOM 1406 NH2 ARG B1736 23.610 39.228 44.389 1.00 0.00 N ATOM 0 H ARG B1736 24.172 42.913 39.973 1.00 0.00 H new ATOM 0 HA ARG B1736 23.154 41.187 37.833 1.00 0.00 H new ATOM 0 HB2 ARG B1736 22.900 40.327 40.696 1.00 0.00 H new ATOM 0 HB3 ARG B1736 22.618 39.409 39.231 1.00 0.00 H new ATOM 0 HG2 ARG B1736 24.918 38.993 38.891 1.00 0.00 H new ATOM 0 HG3 ARG B1736 25.413 40.291 39.959 1.00 0.00 H new ATOM 0 HD2 ARG B1736 24.169 37.637 40.799 1.00 0.00 H new ATOM 0 HD3 ARG B1736 25.843 38.113 41.004 1.00 0.00 H new ATOM 0 HE ARG B1736 24.889 39.998 42.484 1.00 0.00 H new ATOM 0 HH11 ARG B1736 23.246 36.834 42.408 1.00 0.00 H new ATOM 0 HH12 ARG B1736 22.614 37.101 44.035 1.00 0.00 H new ATOM 0 HH21 ARG B1736 24.060 40.136 44.509 1.00 0.00 H new ATOM 0 HH22 ARG B1736 23.043 38.836 45.141 1.00 0.00 H new ATOM 1420 N ARG B1737 20.729 41.609 39.055 1.00 0.00 N ATOM 1421 CA ARG B1737 19.430 42.252 39.316 1.00 0.00 C ATOM 1422 C ARG B1737 18.321 41.258 39.701 1.00 0.00 C ATOM 1423 O ARG B1737 18.428 40.056 39.438 1.00 0.00 O ATOM 1424 CB ARG B1737 19.116 43.139 38.107 1.00 0.00 C ATOM 1425 CG ARG B1737 18.734 42.294 36.905 1.00 0.00 C ATOM 1426 CD ARG B1737 18.799 43.121 35.621 1.00 0.00 C ATOM 1427 NE ARG B1737 17.954 42.564 34.549 1.00 0.00 N ATOM 1428 CZ ARG B1737 18.237 41.575 33.725 1.00 0.00 C ATOM 1429 NH1 ARG B1737 19.358 40.921 33.760 1.00 0.00 N ATOM 1430 NH2 ARG B1737 17.372 41.246 32.818 1.00 0.00 N ATOM 0 H ARG B1737 20.652 40.680 38.642 1.00 0.00 H new ATOM 0 HA ARG B1737 19.485 42.878 40.206 1.00 0.00 H new ATOM 0 HB2 ARG B1737 18.302 43.821 38.352 1.00 0.00 H new ATOM 0 HB3 ARG B1737 19.984 43.753 37.865 1.00 0.00 H new ATOM 0 HG2 ARG B1737 19.405 41.439 36.827 1.00 0.00 H new ATOM 0 HG3 ARG B1737 17.727 41.898 37.038 1.00 0.00 H new ATOM 0 HD2 ARG B1737 18.484 44.143 35.834 1.00 0.00 H new ATOM 0 HD3 ARG B1737 19.832 43.171 35.276 1.00 0.00 H new ATOM 0 HE ARG B1737 17.038 42.997 34.430 1.00 0.00 H new ATOM 0 HH11 ARG B1737 20.070 41.165 34.449 1.00 0.00 H new ATOM 0 HH12 ARG B1737 19.527 40.163 33.099 1.00 0.00 H new ATOM 0 HH21 ARG B1737 16.488 41.750 32.750 1.00 0.00 H new ATOM 0 HH22 ARG B1737 17.575 40.483 32.172 1.00 0.00 H new ATOM 1444 N ARG B1738 17.264 41.762 40.351 1.00 0.00 N ATOM 1445 CA ARG B1738 16.130 40.979 40.886 1.00 0.00 C ATOM 1446 C ARG B1738 15.185 40.514 39.771 1.00 0.00 C ATOM 1447 O ARG B1738 14.760 41.344 38.967 1.00 0.00 O ATOM 1448 CB ARG B1738 15.386 41.844 41.926 1.00 0.00 C ATOM 1449 CG ARG B1738 14.167 41.176 42.591 1.00 0.00 C ATOM 1450 CD ARG B1738 14.506 39.920 43.408 1.00 0.00 C ATOM 1451 NE ARG B1738 15.461 40.233 44.483 1.00 0.00 N ATOM 1452 CZ ARG B1738 16.676 39.757 44.679 1.00 0.00 C ATOM 1453 NH1 ARG B1738 17.221 38.822 43.953 1.00 0.00 N ATOM 1454 NH2 ARG B1738 17.389 40.274 45.631 1.00 0.00 N ATOM 0 H ARG B1738 17.166 42.762 40.528 1.00 0.00 H new ATOM 0 HA ARG B1738 16.510 40.075 41.363 1.00 0.00 H new ATOM 0 HB2 ARG B1738 16.091 42.132 42.706 1.00 0.00 H new ATOM 0 HB3 ARG B1738 15.056 42.762 41.440 1.00 0.00 H new ATOM 0 HG2 ARG B1738 13.681 41.901 43.244 1.00 0.00 H new ATOM 0 HG3 ARG B1738 13.446 40.910 41.818 1.00 0.00 H new ATOM 0 HD2 ARG B1738 13.594 39.503 43.836 1.00 0.00 H new ATOM 0 HD3 ARG B1738 14.928 39.158 42.752 1.00 0.00 H new ATOM 0 HE ARG B1738 15.139 40.912 45.172 1.00 0.00 H new ATOM 0 HH11 ARG B1738 16.702 38.411 43.177 1.00 0.00 H new ATOM 0 HH12 ARG B1738 18.166 38.501 44.161 1.00 0.00 H new ATOM 0 HH21 ARG B1738 17.007 41.027 46.203 1.00 0.00 H new ATOM 0 HH22 ARG B1738 18.332 39.928 45.808 1.00 0.00 H new ATOM 1468 N ARG B1739 14.822 39.225 39.751 1.00 0.00 N ATOM 1469 CA ARG B1739 13.948 38.625 38.722 1.00 0.00 C ATOM 1470 C ARG B1739 12.447 38.872 38.946 1.00 0.00 C ATOM 1471 O ARG B1739 11.989 39.032 40.078 1.00 0.00 O ATOM 1472 CB ARG B1739 14.288 37.134 38.505 1.00 0.00 C ATOM 1473 CG ARG B1739 15.595 36.932 37.712 1.00 0.00 C ATOM 1474 CD ARG B1739 16.875 37.005 38.564 1.00 0.00 C ATOM 1475 NE ARG B1739 18.031 37.501 37.800 1.00 0.00 N ATOM 1476 CZ ARG B1739 18.959 36.795 37.192 1.00 0.00 C ATOM 1477 NH1 ARG B1739 18.940 35.495 37.132 1.00 0.00 N ATOM 1478 NH2 ARG B1739 19.951 37.368 36.582 1.00 0.00 N ATOM 0 H ARG B1739 15.129 38.556 40.457 1.00 0.00 H new ATOM 0 HA ARG B1739 14.166 39.152 37.793 1.00 0.00 H new ATOM 0 HB2 ARG B1739 14.375 36.641 39.473 1.00 0.00 H new ATOM 0 HB3 ARG B1739 13.467 36.652 37.974 1.00 0.00 H new ATOM 0 HG2 ARG B1739 15.558 35.962 37.216 1.00 0.00 H new ATOM 0 HG3 ARG B1739 15.651 37.688 36.929 1.00 0.00 H new ATOM 0 HD2 ARG B1739 16.702 37.658 39.420 1.00 0.00 H new ATOM 0 HD3 ARG B1739 17.102 36.015 38.959 1.00 0.00 H new ATOM 0 HE ARG B1739 18.124 38.515 37.734 1.00 0.00 H new ATOM 0 HH11 ARG B1739 18.179 34.975 37.570 1.00 0.00 H new ATOM 0 HH12 ARG B1739 19.686 34.996 36.647 1.00 0.00 H new ATOM 0 HH21 ARG B1739 20.022 38.385 36.568 1.00 0.00 H new ATOM 0 HH22 ARG B1739 20.660 36.801 36.117 1.00 0.00 H new ATOM 1492 N GLY B1740 11.674 38.904 37.858 1.00 0.00 N ATOM 1493 CA GLY B1740 10.290 39.395 37.800 1.00 0.00 C ATOM 1494 C GLY B1740 9.272 38.731 38.739 1.00 0.00 C ATOM 1495 O GLY B1740 8.374 39.431 39.222 1.00 0.00 O ATOM 0 H GLY B1740 12.008 38.575 36.952 1.00 0.00 H new ATOM 0 HA2 GLY B1740 10.301 40.464 38.014 1.00 0.00 H new ATOM 0 HA3 GLY B1740 9.932 39.279 36.777 1.00 0.00 H new ATOM 1499 N ARG B1741 9.442 37.444 39.088 1.00 0.00 N ATOM 1500 CA ARG B1741 8.660 36.711 40.119 1.00 0.00 C ATOM 1501 C ARG B1741 8.686 37.336 41.528 1.00 0.00 C ATOM 1502 O ARG B1741 7.946 36.909 42.413 1.00 0.00 O ATOM 1503 CB ARG B1741 9.101 35.232 40.148 1.00 0.00 C ATOM 1504 CG ARG B1741 8.590 34.419 38.940 1.00 0.00 C ATOM 1505 CD ARG B1741 7.451 33.442 39.283 1.00 0.00 C ATOM 1506 NE ARG B1741 6.203 34.101 39.709 1.00 0.00 N ATOM 1507 CZ ARG B1741 5.141 34.362 38.969 1.00 0.00 C ATOM 1508 NH1 ARG B1741 5.110 34.264 37.673 1.00 0.00 N ATOM 1509 NH2 ARG B1741 4.042 34.734 39.547 1.00 0.00 N ATOM 0 H ARG B1741 10.151 36.858 38.649 1.00 0.00 H new ATOM 0 HA ARG B1741 7.615 36.786 39.817 1.00 0.00 H new ATOM 0 HB2 ARG B1741 10.190 35.185 40.174 1.00 0.00 H new ATOM 0 HB3 ARG B1741 8.740 34.770 41.067 1.00 0.00 H new ATOM 0 HG2 ARG B1741 8.244 35.109 38.170 1.00 0.00 H new ATOM 0 HG3 ARG B1741 9.422 33.857 38.514 1.00 0.00 H new ATOM 0 HD2 ARG B1741 7.243 32.822 38.411 1.00 0.00 H new ATOM 0 HD3 ARG B1741 7.786 32.774 40.076 1.00 0.00 H new ATOM 0 HE ARG B1741 6.154 34.388 40.687 1.00 0.00 H new ATOM 0 HH11 ARG B1741 5.943 33.969 37.164 1.00 0.00 H new ATOM 0 HH12 ARG B1741 4.253 34.482 37.165 1.00 0.00 H new ATOM 0 HH21 ARG B1741 4.004 34.822 40.562 1.00 0.00 H new ATOM 0 HH22 ARG B1741 3.215 34.939 38.986 1.00 0.00 H new ATOM 1523 N ASN B1742 9.469 38.395 41.720 1.00 0.00 N ATOM 1524 CA ASN B1742 9.408 39.338 42.839 1.00 0.00 C ATOM 1525 C ASN B1742 8.063 40.088 43.014 1.00 0.00 C ATOM 1526 O ASN B1742 7.856 40.721 44.048 1.00 0.00 O ATOM 1527 CB ASN B1742 10.600 40.287 42.628 1.00 0.00 C ATOM 1528 CG ASN B1742 10.696 41.419 43.628 1.00 0.00 C ATOM 1529 OD1 ASN B1742 10.534 42.581 43.282 1.00 0.00 O ATOM 1530 ND2 ASN B1742 11.034 41.124 44.856 1.00 0.00 N ATOM 0 H ASN B1742 10.209 38.634 41.059 1.00 0.00 H new ATOM 0 HA ASN B1742 9.469 38.792 43.780 1.00 0.00 H new ATOM 0 HB2 ASN B1742 11.521 39.705 42.670 1.00 0.00 H new ATOM 0 HB3 ASN B1742 10.536 40.711 41.626 1.00 0.00 H new ATOM 0 HD21 ASN B1742 11.166 41.868 45.541 1.00 0.00 H new ATOM 0 HD22 ASN B1742 11.165 40.150 45.129 1.00 0.00 H new ATOM 1537 N LEU B1743 7.137 40.024 42.047 1.00 0.00 N ATOM 1538 CA LEU B1743 5.790 40.599 42.188 1.00 0.00 C ATOM 1539 C LEU B1743 4.933 39.921 43.286 1.00 0.00 C ATOM 1540 O LEU B1743 5.252 38.833 43.774 1.00 0.00 O ATOM 1541 CB LEU B1743 5.095 40.673 40.810 1.00 0.00 C ATOM 1542 CG LEU B1743 4.279 39.443 40.362 1.00 0.00 C ATOM 1543 CD1 LEU B1743 3.568 39.763 39.047 1.00 0.00 C ATOM 1544 CD2 LEU B1743 5.155 38.212 40.139 1.00 0.00 C ATOM 0 H LEU B1743 7.299 39.573 41.146 1.00 0.00 H new ATOM 0 HA LEU B1743 5.904 41.620 42.553 1.00 0.00 H new ATOM 0 HB2 LEU B1743 4.429 41.536 40.814 1.00 0.00 H new ATOM 0 HB3 LEU B1743 5.859 40.863 40.057 1.00 0.00 H new ATOM 0 HG LEU B1743 3.569 39.220 41.159 1.00 0.00 H new ATOM 0 HD11 LEU B1743 2.990 38.897 38.726 1.00 0.00 H new ATOM 0 HD12 LEU B1743 2.900 40.612 39.192 1.00 0.00 H new ATOM 0 HD13 LEU B1743 4.307 40.009 38.284 1.00 0.00 H new ATOM 0 HD21 LEU B1743 4.532 37.374 39.825 1.00 0.00 H new ATOM 0 HD22 LEU B1743 5.893 38.426 39.366 1.00 0.00 H new ATOM 0 HD23 LEU B1743 5.666 37.956 41.067 1.00 0.00 H new ATOM 1556 N THR B1744 3.838 40.591 43.664 1.00 0.00 N ATOM 1557 CA THR B1744 2.916 40.241 44.771 1.00 0.00 C ATOM 1558 C THR B1744 2.445 38.796 44.910 1.00 0.00 C ATOM 1559 O THR B1744 1.951 38.224 43.912 1.00 0.00 O ATOM 1560 CB THR B1744 1.734 41.220 44.885 1.00 0.00 C ATOM 1561 OG1 THR B1744 2.047 42.476 44.318 1.00 0.00 O ATOM 1562 CG2 THR B1744 1.273 41.453 46.321 1.00 0.00 C ATOM 1563 OXT THR B1744 2.537 38.245 46.034 1.00 0.00 O ATOM 0 H THR B1744 3.548 41.442 43.183 1.00 0.00 H new ATOM 0 HA THR B1744 3.584 40.351 45.625 1.00 0.00 H new ATOM 0 HB THR B1744 0.923 40.742 44.336 1.00 0.00 H new ATOM 0 HG1 THR B1744 1.862 42.456 43.356 1.00 0.00 H new ATOM 0 HG21 THR B1744 0.438 42.153 46.326 1.00 0.00 H new ATOM 0 HG22 THR B1744 0.956 40.507 46.759 1.00 0.00 H new ATOM 0 HG23 THR B1744 2.096 41.866 46.905 1.00 0.00 H new TER 1571 THR B1744