USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1022 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 45 THR OG1 : rot 153:sc= -0.235 USER MOD Set 1.2: A 60 GLN : amide:sc= 0.371 K(o=0.31,f=0.92) USER MOD Set 1.3: A 78 THR OG1 : rot 180:sc= 0.17 USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.104 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -59:sc= 0.00326 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 169:sc= -0.0478 (180deg=-0.279) USER MOD Single : A 16 ASN : amide:sc= -1.59 K(o=-1.6,f=-0.082) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -1.32 K(o=-1.3,f=-6!) USER MOD Single : A 24 SER OG : rot 51:sc= 0.885 USER MOD Single : A 25 TYR OH : rot 0:sc= -0.717 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 HIS : no HE2:sc= -4.81 X(o=-4.8,f=-4.9) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 69:sc= 0.459 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 66:sc= 1.04 USER MOD Single : A 65 ASN : amide:sc= -0.0676 X(o=-0.068,f=-0.077) USER MOD Single : A 70 HIS : no HD1:sc= -0.813 K(o=-0.81,f=0.029) USER MOD Single : A 73 CYS SG : rot -52:sc= -4.72! USER MOD Single : A 76 HIS : no HD1:sc= 0.189 K(o=0.19,f=-2!) USER MOD Single : A 77 THR OG1 : rot -150:sc= 0.854 USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00911) USER MOD Single : A 87 ASN : amide:sc= -1.57 K(o=-1.6,f=-3.5!) USER MOD Single : A 93 GLN : amide:sc= 0.211 X(o=0.21,f=-0.11) USER MOD Single : A 94 CYS SG : rot 61:sc= -2.64 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.155 USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 120:sc= -2.25 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 106 CYS SG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0113) USER MOD Single : A 111 GLN : amide:sc= -0.186 K(o=-0.19,f=-2.8!) USER MOD Single : A 112 SER OG : rot -56:sc= 0.172 USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -29.336 7.022 -0.368 1.00 0.00 N ATOM 2 CA GLY A 1 -29.852 7.780 -1.493 1.00 0.00 C ATOM 3 C GLY A 1 -29.439 7.191 -2.827 1.00 0.00 C ATOM 4 O GLY A 1 -28.836 6.119 -2.880 1.00 0.00 O ATOM 0 H1 GLY A 1 -30.128 6.671 0.207 1.00 0.00 H new ATOM 0 H2 GLY A 1 -28.779 6.217 -0.718 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.730 7.634 0.215 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -30.940 7.814 -1.436 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -29.497 8.808 -1.428 1.00 0.00 H new ATOM 8 N SER A 2 -29.766 7.891 -3.909 1.00 0.00 N ATOM 9 CA SER A 2 -29.429 7.428 -5.250 1.00 0.00 C ATOM 10 C SER A 2 -28.276 8.239 -5.831 1.00 0.00 C ATOM 11 O SER A 2 -28.282 8.591 -7.011 1.00 0.00 O ATOM 12 CB SER A 2 -30.650 7.526 -6.167 1.00 0.00 C ATOM 13 OG SER A 2 -31.594 6.512 -5.869 1.00 0.00 O ATOM 0 H SER A 2 -30.264 8.781 -3.883 1.00 0.00 H new ATOM 0 HA SER A 2 -29.118 6.386 -5.181 1.00 0.00 H new ATOM 0 HB2 SER A 2 -31.116 8.505 -6.055 1.00 0.00 H new ATOM 0 HB3 SER A 2 -30.335 7.440 -7.207 1.00 0.00 H new ATOM 0 HG SER A 2 -32.365 6.597 -6.467 1.00 0.00 H new ATOM 19 N SER A 3 -27.286 8.533 -4.994 1.00 0.00 N ATOM 20 CA SER A 3 -26.127 9.307 -5.422 1.00 0.00 C ATOM 21 C SER A 3 -24.833 8.552 -5.131 1.00 0.00 C ATOM 22 O SER A 3 -24.408 8.445 -3.982 1.00 0.00 O ATOM 23 CB SER A 3 -26.106 10.666 -4.721 1.00 0.00 C ATOM 24 OG SER A 3 -25.043 11.471 -5.200 1.00 0.00 O ATOM 0 H SER A 3 -27.264 8.247 -4.015 1.00 0.00 H new ATOM 0 HA SER A 3 -26.203 9.463 -6.498 1.00 0.00 H new ATOM 0 HB2 SER A 3 -27.055 11.177 -4.883 1.00 0.00 H new ATOM 0 HB3 SER A 3 -26.001 10.522 -3.646 1.00 0.00 H new ATOM 0 HG SER A 3 -25.053 12.335 -4.737 1.00 0.00 H new ATOM 30 N GLY A 4 -24.210 8.030 -6.184 1.00 0.00 N ATOM 31 CA GLY A 4 -22.971 7.291 -6.022 1.00 0.00 C ATOM 32 C GLY A 4 -22.603 6.498 -7.260 1.00 0.00 C ATOM 33 O GLY A 4 -23.250 5.503 -7.583 1.00 0.00 O ATOM 0 H GLY A 4 -24.541 8.106 -7.146 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.165 7.986 -5.787 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -23.064 6.612 -5.174 1.00 0.00 H new ATOM 37 N SER A 5 -21.560 6.941 -7.956 1.00 0.00 N ATOM 38 CA SER A 5 -21.110 6.269 -9.169 1.00 0.00 C ATOM 39 C SER A 5 -20.376 4.975 -8.832 1.00 0.00 C ATOM 40 O SER A 5 -20.764 3.894 -9.277 1.00 0.00 O ATOM 41 CB SER A 5 -20.196 7.191 -9.979 1.00 0.00 C ATOM 42 OG SER A 5 -19.856 6.606 -11.224 1.00 0.00 O ATOM 0 H SER A 5 -21.011 7.762 -7.700 1.00 0.00 H new ATOM 0 HA SER A 5 -21.988 6.024 -9.766 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.694 8.146 -10.146 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.289 7.399 -9.412 1.00 0.00 H new ATOM 0 HG SER A 5 -19.273 7.215 -11.723 1.00 0.00 H new ATOM 48 N SER A 6 -19.313 5.093 -8.043 1.00 0.00 N ATOM 49 CA SER A 6 -18.521 3.934 -7.649 1.00 0.00 C ATOM 50 C SER A 6 -18.353 2.967 -8.817 1.00 0.00 C ATOM 51 O SER A 6 -18.603 1.770 -8.687 1.00 0.00 O ATOM 52 CB SER A 6 -19.180 3.217 -6.469 1.00 0.00 C ATOM 53 OG SER A 6 -18.252 2.383 -5.797 1.00 0.00 O ATOM 0 H SER A 6 -18.980 5.980 -7.664 1.00 0.00 H new ATOM 0 HA SER A 6 -17.534 4.285 -7.347 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.584 3.952 -5.773 1.00 0.00 H new ATOM 0 HB3 SER A 6 -20.019 2.620 -6.825 1.00 0.00 H new ATOM 0 HG SER A 6 -17.893 1.721 -6.424 1.00 0.00 H new ATOM 59 N GLY A 7 -17.929 3.498 -9.960 1.00 0.00 N ATOM 60 CA GLY A 7 -17.735 2.670 -11.136 1.00 0.00 C ATOM 61 C GLY A 7 -16.900 1.438 -10.846 1.00 0.00 C ATOM 62 O GLY A 7 -17.291 0.321 -11.185 1.00 0.00 O ATOM 0 H GLY A 7 -17.716 4.487 -10.092 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.706 2.364 -11.525 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.250 3.258 -11.915 1.00 0.00 H new ATOM 66 N VAL A 8 -15.746 1.641 -10.219 1.00 0.00 N ATOM 67 CA VAL A 8 -14.854 0.538 -9.884 1.00 0.00 C ATOM 68 C VAL A 8 -15.530 -0.450 -8.941 1.00 0.00 C ATOM 69 O VAL A 8 -16.649 -0.219 -8.481 1.00 0.00 O ATOM 70 CB VAL A 8 -13.554 1.046 -9.231 1.00 0.00 C ATOM 71 CG1 VAL A 8 -13.728 1.176 -7.726 1.00 0.00 C ATOM 72 CG2 VAL A 8 -12.394 0.120 -9.564 1.00 0.00 C ATOM 0 H VAL A 8 -15.407 2.559 -9.933 1.00 0.00 H new ATOM 0 HA VAL A 8 -14.610 0.034 -10.819 1.00 0.00 H new ATOM 0 HB VAL A 8 -13.328 2.034 -9.633 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.800 1.536 -7.282 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -14.530 1.882 -7.512 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -13.979 0.203 -7.303 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -11.484 0.494 -9.095 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.609 -0.881 -9.191 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.256 0.083 -10.645 1.00 0.00 H new ATOM 82 N ASP A 9 -14.845 -1.552 -8.657 1.00 0.00 N ATOM 83 CA ASP A 9 -15.379 -2.576 -7.767 1.00 0.00 C ATOM 84 C ASP A 9 -14.578 -2.642 -6.471 1.00 0.00 C ATOM 85 O ASP A 9 -13.490 -3.216 -6.431 1.00 0.00 O ATOM 86 CB ASP A 9 -15.367 -3.941 -8.458 1.00 0.00 C ATOM 87 CG ASP A 9 -16.446 -4.063 -9.516 1.00 0.00 C ATOM 88 OD1 ASP A 9 -16.386 -3.316 -10.515 1.00 0.00 O ATOM 89 OD2 ASP A 9 -17.350 -4.907 -9.346 1.00 0.00 O ATOM 0 H ASP A 9 -13.919 -1.759 -9.030 1.00 0.00 H new ATOM 0 HA ASP A 9 -16.408 -2.309 -7.524 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.392 -4.104 -8.917 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -15.503 -4.724 -7.712 1.00 0.00 H new ATOM 94 N GLU A 10 -15.123 -2.049 -5.413 1.00 0.00 N ATOM 95 CA GLU A 10 -14.456 -2.039 -4.116 1.00 0.00 C ATOM 96 C GLU A 10 -13.696 -3.342 -3.885 1.00 0.00 C ATOM 97 O GLU A 10 -14.119 -4.419 -4.304 1.00 0.00 O ATOM 98 CB GLU A 10 -15.476 -1.825 -2.995 1.00 0.00 C ATOM 99 CG GLU A 10 -15.934 -0.383 -2.856 1.00 0.00 C ATOM 100 CD GLU A 10 -16.642 -0.120 -1.541 1.00 0.00 C ATOM 101 OE1 GLU A 10 -16.390 -0.864 -0.572 1.00 0.00 O ATOM 102 OE2 GLU A 10 -17.448 0.832 -1.483 1.00 0.00 O ATOM 0 H GLU A 10 -16.023 -1.570 -5.429 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.742 -1.216 -4.110 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -16.345 -2.457 -3.180 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -15.040 -2.151 -2.051 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -15.071 0.278 -2.938 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -16.603 -0.137 -3.680 1.00 0.00 H new ATOM 109 N PRO A 11 -12.546 -3.242 -3.201 1.00 0.00 N ATOM 110 CA PRO A 11 -11.702 -4.402 -2.899 1.00 0.00 C ATOM 111 C PRO A 11 -12.343 -5.334 -1.876 1.00 0.00 C ATOM 112 O PRO A 11 -11.726 -6.303 -1.435 1.00 0.00 O ATOM 113 CB PRO A 11 -10.429 -3.774 -2.326 1.00 0.00 C ATOM 114 CG PRO A 11 -10.868 -2.460 -1.778 1.00 0.00 C ATOM 115 CD PRO A 11 -11.982 -1.990 -2.671 1.00 0.00 C ATOM 0 HA PRO A 11 -11.530 -5.021 -3.779 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -9.993 -4.402 -1.548 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -9.669 -3.647 -3.097 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -11.210 -2.561 -0.748 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -10.045 -1.745 -1.772 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -12.726 -1.417 -2.118 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -11.613 -1.346 -3.469 1.00 0.00 H new ATOM 123 N GLU A 12 -13.583 -5.034 -1.504 1.00 0.00 N ATOM 124 CA GLU A 12 -14.306 -5.846 -0.532 1.00 0.00 C ATOM 125 C GLU A 12 -13.939 -7.320 -0.674 1.00 0.00 C ATOM 126 O GLU A 12 -13.507 -7.958 0.285 1.00 0.00 O ATOM 127 CB GLU A 12 -15.816 -5.666 -0.706 1.00 0.00 C ATOM 128 CG GLU A 12 -16.276 -5.751 -2.152 1.00 0.00 C ATOM 129 CD GLU A 12 -17.584 -5.023 -2.391 1.00 0.00 C ATOM 130 OE1 GLU A 12 -18.541 -5.252 -1.622 1.00 0.00 O ATOM 131 OE2 GLU A 12 -17.651 -4.224 -3.349 1.00 0.00 O ATOM 0 H GLU A 12 -14.108 -4.235 -1.860 1.00 0.00 H new ATOM 0 HA GLU A 12 -14.020 -5.513 0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.334 -6.428 -0.123 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -16.108 -4.699 -0.297 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.507 -5.330 -2.800 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.391 -6.798 -2.432 1.00 0.00 H new ATOM 138 N SER A 13 -14.115 -7.854 -1.879 1.00 0.00 N ATOM 139 CA SER A 13 -13.806 -9.254 -2.147 1.00 0.00 C ATOM 140 C SER A 13 -12.325 -9.537 -1.918 1.00 0.00 C ATOM 141 O SER A 13 -11.954 -10.601 -1.423 1.00 0.00 O ATOM 142 CB SER A 13 -14.191 -9.617 -3.582 1.00 0.00 C ATOM 143 OG SER A 13 -14.530 -10.989 -3.687 1.00 0.00 O ATOM 0 H SER A 13 -14.470 -7.339 -2.685 1.00 0.00 H new ATOM 0 HA SER A 13 -14.386 -9.867 -1.457 1.00 0.00 H new ATOM 0 HB2 SER A 13 -15.035 -9.005 -3.901 1.00 0.00 H new ATOM 0 HB3 SER A 13 -13.362 -9.392 -4.253 1.00 0.00 H new ATOM 0 HG SER A 13 -14.774 -11.196 -4.613 1.00 0.00 H new ATOM 149 N MET A 14 -11.482 -8.576 -2.283 1.00 0.00 N ATOM 150 CA MET A 14 -10.040 -8.721 -2.117 1.00 0.00 C ATOM 151 C MET A 14 -9.645 -8.576 -0.651 1.00 0.00 C ATOM 152 O MET A 14 -10.360 -7.956 0.137 1.00 0.00 O ATOM 153 CB MET A 14 -9.301 -7.682 -2.962 1.00 0.00 C ATOM 154 CG MET A 14 -9.403 -7.931 -4.458 1.00 0.00 C ATOM 155 SD MET A 14 -9.426 -6.405 -5.417 1.00 0.00 S ATOM 156 CE MET A 14 -7.975 -5.577 -4.771 1.00 0.00 C ATOM 0 H MET A 14 -11.772 -7.689 -2.695 1.00 0.00 H new ATOM 0 HA MET A 14 -9.759 -9.719 -2.454 1.00 0.00 H new ATOM 0 HB2 MET A 14 -9.701 -6.693 -2.739 1.00 0.00 H new ATOM 0 HB3 MET A 14 -8.250 -7.673 -2.674 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.561 -8.544 -4.778 1.00 0.00 H new ATOM 0 HG3 MET A 14 -10.309 -8.500 -4.667 1.00 0.00 H new ATOM 0 HE1 MET A 14 -7.741 -4.714 -5.394 1.00 0.00 H new ATOM 0 HE2 MET A 14 -8.169 -5.246 -3.751 1.00 0.00 H new ATOM 0 HE3 MET A 14 -7.131 -6.267 -4.774 1.00 0.00 H new ATOM 166 N VAL A 15 -8.502 -9.151 -0.291 1.00 0.00 N ATOM 167 CA VAL A 15 -8.011 -9.085 1.081 1.00 0.00 C ATOM 168 C VAL A 15 -6.938 -8.012 1.229 1.00 0.00 C ATOM 169 O VAL A 15 -6.119 -7.811 0.333 1.00 0.00 O ATOM 170 CB VAL A 15 -7.435 -10.439 1.536 1.00 0.00 C ATOM 171 CG1 VAL A 15 -6.853 -10.327 2.937 1.00 0.00 C ATOM 172 CG2 VAL A 15 -8.504 -11.519 1.479 1.00 0.00 C ATOM 0 H VAL A 15 -7.898 -9.668 -0.930 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.863 -8.831 1.711 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.631 -10.720 0.855 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.451 -11.293 3.242 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.056 -9.584 2.941 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.635 -10.024 3.633 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -8.079 -12.469 1.804 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.331 -11.248 2.136 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.869 -11.616 0.457 1.00 0.00 H new ATOM 182 N ASN A 16 -6.948 -7.327 2.368 1.00 0.00 N ATOM 183 CA ASN A 16 -5.974 -6.274 2.634 1.00 0.00 C ATOM 184 C ASN A 16 -4.940 -6.735 3.657 1.00 0.00 C ATOM 185 O ASN A 16 -5.274 -7.019 4.808 1.00 0.00 O ATOM 186 CB ASN A 16 -6.681 -5.014 3.139 1.00 0.00 C ATOM 187 CG ASN A 16 -7.679 -4.469 2.135 1.00 0.00 C ATOM 188 OD1 ASN A 16 -8.890 -4.597 2.315 1.00 0.00 O ATOM 189 ND2 ASN A 16 -7.173 -3.858 1.070 1.00 0.00 N ATOM 0 H ASN A 16 -7.619 -7.482 3.121 1.00 0.00 H new ATOM 0 HA ASN A 16 -5.459 -6.045 1.701 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -7.196 -5.239 4.073 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -5.938 -4.248 3.361 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -7.795 -3.472 0.360 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -6.162 -3.775 0.962 1.00 0.00 H new ATOM 196 N LEU A 17 -3.685 -6.806 3.229 1.00 0.00 N ATOM 197 CA LEU A 17 -2.600 -7.232 4.107 1.00 0.00 C ATOM 198 C LEU A 17 -2.283 -6.157 5.142 1.00 0.00 C ATOM 199 O LEU A 17 -2.415 -4.964 4.871 1.00 0.00 O ATOM 200 CB LEU A 17 -1.349 -7.552 3.287 1.00 0.00 C ATOM 201 CG LEU A 17 -1.527 -8.572 2.162 1.00 0.00 C ATOM 202 CD1 LEU A 17 -0.371 -8.487 1.178 1.00 0.00 C ATOM 203 CD2 LEU A 17 -1.644 -9.979 2.730 1.00 0.00 C ATOM 0 H LEU A 17 -3.393 -6.574 2.280 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.922 -8.131 4.632 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -0.976 -6.624 2.853 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -0.579 -7.919 3.965 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.449 -8.340 1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.514 -9.220 0.384 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.334 -7.487 0.746 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.565 -8.693 1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.770 -10.691 1.915 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.740 -10.223 3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.506 -10.032 3.395 1.00 0.00 H new ATOM 215 N ALA A 18 -1.863 -6.588 6.326 1.00 0.00 N ATOM 216 CA ALA A 18 -1.523 -5.663 7.400 1.00 0.00 C ATOM 217 C ALA A 18 -0.012 -5.496 7.523 1.00 0.00 C ATOM 218 O ALA A 18 0.481 -4.406 7.812 1.00 0.00 O ATOM 219 CB ALA A 18 -2.112 -6.143 8.718 1.00 0.00 C ATOM 0 H ALA A 18 -1.750 -7.573 6.566 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.951 -4.691 7.157 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -1.850 -5.442 9.510 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.197 -6.203 8.631 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -1.712 -7.128 8.958 1.00 0.00 H new ATOM 225 N PHE A 19 0.718 -6.584 7.302 1.00 0.00 N ATOM 226 CA PHE A 19 2.174 -6.559 7.390 1.00 0.00 C ATOM 227 C PHE A 19 2.795 -7.553 6.412 1.00 0.00 C ATOM 228 O PHE A 19 2.493 -8.746 6.447 1.00 0.00 O ATOM 229 CB PHE A 19 2.625 -6.879 8.816 1.00 0.00 C ATOM 230 CG PHE A 19 4.005 -7.469 8.890 1.00 0.00 C ATOM 231 CD1 PHE A 19 5.078 -6.831 8.289 1.00 0.00 C ATOM 232 CD2 PHE A 19 4.228 -8.660 9.561 1.00 0.00 C ATOM 233 CE1 PHE A 19 6.348 -7.373 8.355 1.00 0.00 C ATOM 234 CE2 PHE A 19 5.496 -9.206 9.631 1.00 0.00 C ATOM 235 CZ PHE A 19 6.558 -8.561 9.028 1.00 0.00 C ATOM 0 H PHE A 19 0.326 -7.494 7.061 1.00 0.00 H new ATOM 0 HA PHE A 19 2.512 -5.557 7.126 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.596 -5.966 9.411 1.00 0.00 H new ATOM 0 HB3 PHE A 19 1.916 -7.575 9.265 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.921 -5.901 7.764 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.401 -9.168 10.035 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.176 -6.868 7.880 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.656 -10.136 10.157 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.550 -8.984 9.082 1.00 0.00 H new ATOM 245 N VAL A 20 3.665 -7.051 5.541 1.00 0.00 N ATOM 246 CA VAL A 20 4.330 -7.894 4.554 1.00 0.00 C ATOM 247 C VAL A 20 5.842 -7.874 4.744 1.00 0.00 C ATOM 248 O VAL A 20 6.468 -6.813 4.731 1.00 0.00 O ATOM 249 CB VAL A 20 3.998 -7.445 3.119 1.00 0.00 C ATOM 250 CG1 VAL A 20 4.924 -8.122 2.120 1.00 0.00 C ATOM 251 CG2 VAL A 20 2.542 -7.739 2.792 1.00 0.00 C ATOM 0 H VAL A 20 3.926 -6.066 5.499 1.00 0.00 H new ATOM 0 HA VAL A 20 3.962 -8.909 4.704 1.00 0.00 H new ATOM 0 HB VAL A 20 4.152 -6.368 3.049 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.674 -7.793 1.111 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.957 -7.856 2.343 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.805 -9.203 2.188 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.325 -7.415 1.774 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.359 -8.810 2.879 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.897 -7.203 3.488 1.00 0.00 H new ATOM 261 N LYS A 21 6.426 -9.054 4.922 1.00 0.00 N ATOM 262 CA LYS A 21 7.867 -9.175 5.113 1.00 0.00 C ATOM 263 C LYS A 21 8.625 -8.560 3.941 1.00 0.00 C ATOM 264 O LYS A 21 8.668 -9.128 2.851 1.00 0.00 O ATOM 265 CB LYS A 21 8.259 -10.645 5.273 1.00 0.00 C ATOM 266 CG LYS A 21 9.432 -10.863 6.213 1.00 0.00 C ATOM 267 CD LYS A 21 10.666 -10.105 5.751 1.00 0.00 C ATOM 268 CE LYS A 21 11.651 -9.896 6.891 1.00 0.00 C ATOM 269 NZ LYS A 21 11.391 -8.625 7.623 1.00 0.00 N ATOM 0 H LYS A 21 5.923 -9.941 4.938 1.00 0.00 H new ATOM 0 HA LYS A 21 8.135 -8.633 6.020 1.00 0.00 H new ATOM 0 HB2 LYS A 21 7.399 -11.203 5.643 1.00 0.00 H new ATOM 0 HB3 LYS A 21 8.508 -11.055 4.294 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.160 -10.539 7.217 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.659 -11.927 6.272 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.152 -10.655 4.945 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.369 -9.139 5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.587 -10.734 7.585 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.667 -9.886 6.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 12.083 -8.519 8.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.477 -7.823 6.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.431 -8.644 8.022 1.00 0.00 H new ATOM 283 N ASN A 22 9.222 -7.396 4.174 1.00 0.00 N ATOM 284 CA ASN A 22 9.980 -6.704 3.137 1.00 0.00 C ATOM 285 C ASN A 22 11.043 -5.799 3.752 1.00 0.00 C ATOM 286 O ASN A 22 11.016 -5.518 4.951 1.00 0.00 O ATOM 287 CB ASN A 22 9.041 -5.880 2.254 1.00 0.00 C ATOM 288 CG ASN A 22 8.629 -4.576 2.909 1.00 0.00 C ATOM 289 OD1 ASN A 22 8.906 -3.494 2.391 1.00 0.00 O ATOM 290 ND2 ASN A 22 7.963 -4.673 4.054 1.00 0.00 N ATOM 0 H ASN A 22 9.196 -6.912 5.071 1.00 0.00 H new ATOM 0 HA ASN A 22 10.478 -7.455 2.524 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.533 -5.667 1.305 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.151 -6.467 2.028 1.00 0.00 H new ATOM 0 HD21 ASN A 22 7.659 -3.829 4.540 1.00 0.00 H new ATOM 0 HD22 ASN A 22 7.755 -5.591 4.447 1.00 0.00 H new ATOM 297 N ASP A 23 11.977 -5.346 2.924 1.00 0.00 N ATOM 298 CA ASP A 23 13.049 -4.471 3.385 1.00 0.00 C ATOM 299 C ASP A 23 13.368 -3.405 2.341 1.00 0.00 C ATOM 300 O ASP A 23 13.693 -3.721 1.197 1.00 0.00 O ATOM 301 CB ASP A 23 14.304 -5.287 3.698 1.00 0.00 C ATOM 302 CG ASP A 23 15.160 -4.644 4.772 1.00 0.00 C ATOM 303 OD1 ASP A 23 15.803 -3.614 4.480 1.00 0.00 O ATOM 304 OD2 ASP A 23 15.187 -5.171 5.903 1.00 0.00 O ATOM 0 H ASP A 23 12.014 -5.570 1.930 1.00 0.00 H new ATOM 0 HA ASP A 23 12.712 -3.974 4.295 1.00 0.00 H new ATOM 0 HB2 ASP A 23 14.013 -6.287 4.020 1.00 0.00 H new ATOM 0 HB3 ASP A 23 14.894 -5.404 2.789 1.00 0.00 H new ATOM 309 N SER A 24 13.270 -2.142 2.743 1.00 0.00 N ATOM 310 CA SER A 24 13.543 -1.030 1.841 1.00 0.00 C ATOM 311 C SER A 24 14.690 -0.172 2.368 1.00 0.00 C ATOM 312 O SER A 24 14.712 0.202 3.541 1.00 0.00 O ATOM 313 CB SER A 24 12.290 -0.171 1.662 1.00 0.00 C ATOM 314 OG SER A 24 12.608 1.081 1.080 1.00 0.00 O ATOM 0 H SER A 24 13.004 -1.864 3.687 1.00 0.00 H new ATOM 0 HA SER A 24 13.834 -1.442 0.875 1.00 0.00 H new ATOM 0 HB2 SER A 24 11.572 -0.696 1.032 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.811 -0.015 2.629 1.00 0.00 H new ATOM 0 HG SER A 24 13.141 0.939 0.270 1.00 0.00 H new ATOM 320 N TYR A 25 15.640 0.136 1.493 1.00 0.00 N ATOM 321 CA TYR A 25 16.792 0.948 1.869 1.00 0.00 C ATOM 322 C TYR A 25 16.761 2.299 1.161 1.00 0.00 C ATOM 323 O TYR A 25 16.214 2.425 0.066 1.00 0.00 O ATOM 324 CB TYR A 25 18.091 0.214 1.533 1.00 0.00 C ATOM 325 CG TYR A 25 18.238 -0.117 0.065 1.00 0.00 C ATOM 326 CD1 TYR A 25 17.670 -1.267 -0.469 1.00 0.00 C ATOM 327 CD2 TYR A 25 18.943 0.723 -0.789 1.00 0.00 C ATOM 328 CE1 TYR A 25 17.803 -1.573 -1.809 1.00 0.00 C ATOM 329 CE2 TYR A 25 19.079 0.425 -2.131 1.00 0.00 C ATOM 330 CZ TYR A 25 18.508 -0.724 -2.636 1.00 0.00 C ATOM 331 OH TYR A 25 18.641 -1.024 -3.973 1.00 0.00 O ATOM 0 H TYR A 25 15.636 -0.164 0.518 1.00 0.00 H new ATOM 0 HA TYR A 25 16.747 1.120 2.944 1.00 0.00 H new ATOM 0 HB2 TYR A 25 18.936 0.828 1.845 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.137 -0.709 2.111 1.00 0.00 H new ATOM 0 HD1 TYR A 25 17.115 -1.933 0.175 1.00 0.00 H new ATOM 0 HD2 TYR A 25 19.392 1.624 -0.397 1.00 0.00 H new ATOM 0 HE1 TYR A 25 17.357 -2.472 -2.207 1.00 0.00 H new ATOM 0 HE2 TYR A 25 19.630 1.089 -2.781 1.00 0.00 H new ATOM 0 HH TYR A 25 18.179 -1.866 -4.167 1.00 0.00 H new ATOM 341 N GLU A 26 17.352 3.306 1.796 1.00 0.00 N ATOM 342 CA GLU A 26 17.392 4.648 1.228 1.00 0.00 C ATOM 343 C GLU A 26 18.385 4.720 0.071 1.00 0.00 C ATOM 344 O GLU A 26 19.587 4.891 0.279 1.00 0.00 O ATOM 345 CB GLU A 26 17.769 5.670 2.303 1.00 0.00 C ATOM 346 CG GLU A 26 16.693 5.872 3.355 1.00 0.00 C ATOM 347 CD GLU A 26 16.709 4.793 4.421 1.00 0.00 C ATOM 348 OE1 GLU A 26 16.036 3.759 4.229 1.00 0.00 O ATOM 349 OE2 GLU A 26 17.395 4.983 5.446 1.00 0.00 O ATOM 0 H GLU A 26 17.809 3.218 2.703 1.00 0.00 H new ATOM 0 HA GLU A 26 16.398 4.883 0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 26 18.688 5.347 2.793 1.00 0.00 H new ATOM 0 HB3 GLU A 26 17.982 6.626 1.825 1.00 0.00 H new ATOM 0 HG2 GLU A 26 16.829 6.845 3.826 1.00 0.00 H new ATOM 0 HG3 GLU A 26 15.716 5.886 2.872 1.00 0.00 H new ATOM 356 N LYS A 27 17.875 4.587 -1.148 1.00 0.00 N ATOM 357 CA LYS A 27 18.714 4.637 -2.339 1.00 0.00 C ATOM 358 C LYS A 27 18.771 6.052 -2.906 1.00 0.00 C ATOM 359 O LYS A 27 17.857 6.850 -2.702 1.00 0.00 O ATOM 360 CB LYS A 27 18.185 3.672 -3.402 1.00 0.00 C ATOM 361 CG LYS A 27 18.982 3.694 -4.695 1.00 0.00 C ATOM 362 CD LYS A 27 18.259 2.955 -5.809 1.00 0.00 C ATOM 363 CE LYS A 27 18.639 1.483 -5.838 1.00 0.00 C ATOM 364 NZ LYS A 27 19.940 1.259 -6.527 1.00 0.00 N ATOM 0 H LYS A 27 16.883 4.444 -1.337 1.00 0.00 H new ATOM 0 HA LYS A 27 19.723 4.337 -2.054 1.00 0.00 H new ATOM 0 HB2 LYS A 27 18.193 2.660 -2.998 1.00 0.00 H new ATOM 0 HB3 LYS A 27 17.146 3.920 -3.621 1.00 0.00 H new ATOM 0 HG2 LYS A 27 19.159 4.726 -4.997 1.00 0.00 H new ATOM 0 HG3 LYS A 27 19.958 3.239 -4.529 1.00 0.00 H new ATOM 0 HD2 LYS A 27 17.182 3.051 -5.672 1.00 0.00 H new ATOM 0 HD3 LYS A 27 18.501 3.413 -6.768 1.00 0.00 H new ATOM 0 HE2 LYS A 27 18.698 1.103 -4.818 1.00 0.00 H new ATOM 0 HE3 LYS A 27 17.858 0.916 -6.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 20.163 0.243 -6.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 19.876 1.598 -7.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.691 1.779 -6.029 1.00 0.00 H new ATOM 378 N GLY A 28 19.852 6.357 -3.618 1.00 0.00 N ATOM 379 CA GLY A 28 20.007 7.676 -4.204 1.00 0.00 C ATOM 380 C GLY A 28 19.599 8.784 -3.254 1.00 0.00 C ATOM 381 O GLY A 28 19.376 8.559 -2.064 1.00 0.00 O ATOM 0 H GLY A 28 20.623 5.714 -3.799 1.00 0.00 H new ATOM 0 HA2 GLY A 28 21.046 7.819 -4.499 1.00 0.00 H new ATOM 0 HA3 GLY A 28 19.406 7.740 -5.111 1.00 0.00 H new ATOM 385 N PRO A 29 19.497 10.013 -3.780 1.00 0.00 N ATOM 386 CA PRO A 29 19.114 11.185 -2.988 1.00 0.00 C ATOM 387 C PRO A 29 17.652 11.142 -2.558 1.00 0.00 C ATOM 388 O PRO A 29 17.337 11.287 -1.377 1.00 0.00 O ATOM 389 CB PRO A 29 19.357 12.355 -3.944 1.00 0.00 C ATOM 390 CG PRO A 29 19.236 11.762 -5.306 1.00 0.00 C ATOM 391 CD PRO A 29 19.748 10.353 -5.191 1.00 0.00 C ATOM 0 HA PRO A 29 19.681 11.252 -2.059 1.00 0.00 H new ATOM 0 HB2 PRO A 29 18.626 13.149 -3.792 1.00 0.00 H new ATOM 0 HB3 PRO A 29 20.342 12.795 -3.790 1.00 0.00 H new ATOM 0 HG2 PRO A 29 18.201 11.774 -5.646 1.00 0.00 H new ATOM 0 HG3 PRO A 29 19.817 12.330 -6.032 1.00 0.00 H new ATOM 0 HD2 PRO A 29 19.222 9.678 -5.867 1.00 0.00 H new ATOM 0 HD3 PRO A 29 20.808 10.289 -5.437 1.00 0.00 H new ATOM 399 N ASP A 30 16.762 10.941 -3.525 1.00 0.00 N ATOM 400 CA ASP A 30 15.332 10.877 -3.246 1.00 0.00 C ATOM 401 C ASP A 30 14.749 9.542 -3.701 1.00 0.00 C ATOM 402 O ASP A 30 13.548 9.428 -3.942 1.00 0.00 O ATOM 403 CB ASP A 30 14.604 12.029 -3.941 1.00 0.00 C ATOM 404 CG ASP A 30 15.309 12.482 -5.204 1.00 0.00 C ATOM 405 OD1 ASP A 30 16.418 13.044 -5.094 1.00 0.00 O ATOM 406 OD2 ASP A 30 14.751 12.275 -6.302 1.00 0.00 O ATOM 0 H ASP A 30 17.006 10.820 -4.508 1.00 0.00 H new ATOM 0 HA ASP A 30 15.192 10.966 -2.169 1.00 0.00 H new ATOM 0 HB2 ASP A 30 13.589 11.717 -4.187 1.00 0.00 H new ATOM 0 HB3 ASP A 30 14.521 12.870 -3.253 1.00 0.00 H new ATOM 411 N SER A 31 15.609 8.536 -3.817 1.00 0.00 N ATOM 412 CA SER A 31 15.181 7.210 -4.247 1.00 0.00 C ATOM 413 C SER A 31 14.995 6.283 -3.049 1.00 0.00 C ATOM 414 O SER A 31 15.606 6.479 -1.998 1.00 0.00 O ATOM 415 CB SER A 31 16.201 6.611 -5.217 1.00 0.00 C ATOM 416 OG SER A 31 16.581 7.553 -6.204 1.00 0.00 O ATOM 0 H SER A 31 16.607 8.614 -3.619 1.00 0.00 H new ATOM 0 HA SER A 31 14.223 7.312 -4.756 1.00 0.00 H new ATOM 0 HB2 SER A 31 17.082 6.282 -4.666 1.00 0.00 H new ATOM 0 HB3 SER A 31 15.777 5.729 -5.696 1.00 0.00 H new ATOM 0 HG SER A 31 17.235 7.146 -6.810 1.00 0.00 H new ATOM 422 N VAL A 32 14.147 5.273 -3.216 1.00 0.00 N ATOM 423 CA VAL A 32 13.881 4.315 -2.150 1.00 0.00 C ATOM 424 C VAL A 32 13.459 2.964 -2.718 1.00 0.00 C ATOM 425 O VAL A 32 12.365 2.823 -3.264 1.00 0.00 O ATOM 426 CB VAL A 32 12.783 4.825 -1.198 1.00 0.00 C ATOM 427 CG1 VAL A 32 12.423 3.756 -0.177 1.00 0.00 C ATOM 428 CG2 VAL A 32 13.230 6.105 -0.508 1.00 0.00 C ATOM 0 H VAL A 32 13.633 5.097 -4.079 1.00 0.00 H new ATOM 0 HA VAL A 32 14.810 4.197 -1.591 1.00 0.00 H new ATOM 0 HB VAL A 32 11.892 5.048 -1.784 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.646 4.134 0.487 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.059 2.868 -0.693 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.306 3.499 0.408 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.442 6.452 0.161 1.00 0.00 H new ATOM 0 HG22 VAL A 32 14.135 5.911 0.067 1.00 0.00 H new ATOM 0 HG23 VAL A 32 13.433 6.870 -1.257 1.00 0.00 H new ATOM 438 N VAL A 33 14.334 1.973 -2.585 1.00 0.00 N ATOM 439 CA VAL A 33 14.052 0.632 -3.084 1.00 0.00 C ATOM 440 C VAL A 33 13.411 -0.232 -2.004 1.00 0.00 C ATOM 441 O VAL A 33 13.682 -0.062 -0.815 1.00 0.00 O ATOM 442 CB VAL A 33 15.332 -0.061 -3.587 1.00 0.00 C ATOM 443 CG1 VAL A 33 15.078 -1.540 -3.833 1.00 0.00 C ATOM 444 CG2 VAL A 33 15.844 0.618 -4.849 1.00 0.00 C ATOM 0 H VAL A 33 15.244 2.073 -2.136 1.00 0.00 H new ATOM 0 HA VAL A 33 13.357 0.744 -3.917 1.00 0.00 H new ATOM 0 HB VAL A 33 16.099 0.028 -2.817 1.00 0.00 H new ATOM 0 HG11 VAL A 33 15.994 -2.012 -4.188 1.00 0.00 H new ATOM 0 HG12 VAL A 33 14.762 -2.014 -2.904 1.00 0.00 H new ATOM 0 HG13 VAL A 33 14.296 -1.655 -4.584 1.00 0.00 H new ATOM 0 HG21 VAL A 33 16.749 0.116 -5.191 1.00 0.00 H new ATOM 0 HG22 VAL A 33 15.082 0.562 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL A 33 16.068 1.663 -4.635 1.00 0.00 H new ATOM 454 N VAL A 34 12.558 -1.161 -2.425 1.00 0.00 N ATOM 455 CA VAL A 34 11.879 -2.054 -1.494 1.00 0.00 C ATOM 456 C VAL A 34 12.045 -3.511 -1.911 1.00 0.00 C ATOM 457 O VAL A 34 11.919 -3.850 -3.088 1.00 0.00 O ATOM 458 CB VAL A 34 10.377 -1.727 -1.398 1.00 0.00 C ATOM 459 CG1 VAL A 34 9.726 -2.529 -0.281 1.00 0.00 C ATOM 460 CG2 VAL A 34 10.170 -0.235 -1.184 1.00 0.00 C ATOM 0 H VAL A 34 12.321 -1.314 -3.405 1.00 0.00 H new ATOM 0 HA VAL A 34 12.339 -1.904 -0.517 1.00 0.00 H new ATOM 0 HB VAL A 34 9.901 -2.006 -2.338 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.665 -2.285 -0.228 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.844 -3.594 -0.481 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.202 -2.284 0.668 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.103 -0.021 -1.118 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.659 0.071 -0.259 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.599 0.316 -2.021 1.00 0.00 H new ATOM 470 N HIS A 35 12.327 -4.371 -0.937 1.00 0.00 N ATOM 471 CA HIS A 35 12.509 -5.794 -1.202 1.00 0.00 C ATOM 472 C HIS A 35 11.462 -6.622 -0.464 1.00 0.00 C ATOM 473 O HIS A 35 11.576 -6.855 0.740 1.00 0.00 O ATOM 474 CB HIS A 35 13.912 -6.236 -0.787 1.00 0.00 C ATOM 475 CG HIS A 35 14.993 -5.719 -1.685 1.00 0.00 C ATOM 476 ND1 HIS A 35 16.240 -6.302 -1.775 1.00 0.00 N ATOM 477 CD2 HIS A 35 15.009 -4.668 -2.538 1.00 0.00 C ATOM 478 CE1 HIS A 35 16.976 -5.631 -2.643 1.00 0.00 C ATOM 479 NE2 HIS A 35 16.252 -4.635 -3.120 1.00 0.00 N ATOM 0 H HIS A 35 12.434 -4.107 0.042 1.00 0.00 H new ATOM 0 HA HIS A 35 12.387 -5.958 -2.273 1.00 0.00 H new ATOM 0 HB2 HIS A 35 14.104 -5.898 0.231 1.00 0.00 H new ATOM 0 HB3 HIS A 35 13.952 -7.325 -0.774 1.00 0.00 H new ATOM 0 HD1 HIS A 35 16.546 -7.123 -1.253 1.00 0.00 H new ATOM 0 HD2 HIS A 35 14.195 -3.983 -2.726 1.00 0.00 H new ATOM 0 HE1 HIS A 35 17.996 -5.858 -2.916 1.00 0.00 H new ATOM 488 N VAL A 36 10.442 -7.063 -1.192 1.00 0.00 N ATOM 489 CA VAL A 36 9.374 -7.866 -0.607 1.00 0.00 C ATOM 490 C VAL A 36 9.689 -9.354 -0.705 1.00 0.00 C ATOM 491 O VAL A 36 10.007 -9.863 -1.780 1.00 0.00 O ATOM 492 CB VAL A 36 8.024 -7.592 -1.294 1.00 0.00 C ATOM 493 CG1 VAL A 36 6.900 -8.320 -0.574 1.00 0.00 C ATOM 494 CG2 VAL A 36 7.750 -6.096 -1.352 1.00 0.00 C ATOM 0 H VAL A 36 10.332 -6.878 -2.189 1.00 0.00 H new ATOM 0 HA VAL A 36 9.303 -7.581 0.443 1.00 0.00 H new ATOM 0 HB VAL A 36 8.073 -7.970 -2.315 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.954 -8.114 -1.074 1.00 0.00 H new ATOM 0 HG12 VAL A 36 7.093 -9.393 -0.590 1.00 0.00 H new ATOM 0 HG13 VAL A 36 6.847 -7.976 0.459 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.792 -5.920 -1.841 1.00 0.00 H new ATOM 0 HG22 VAL A 36 7.721 -5.692 -0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.541 -5.603 -1.917 1.00 0.00 H new ATOM 504 N TYR A 37 9.598 -10.048 0.424 1.00 0.00 N ATOM 505 CA TYR A 37 9.875 -11.479 0.466 1.00 0.00 C ATOM 506 C TYR A 37 8.651 -12.284 0.038 1.00 0.00 C ATOM 507 O TYR A 37 7.669 -12.381 0.774 1.00 0.00 O ATOM 508 CB TYR A 37 10.306 -11.895 1.874 1.00 0.00 C ATOM 509 CG TYR A 37 11.679 -11.394 2.259 1.00 0.00 C ATOM 510 CD1 TYR A 37 12.315 -10.409 1.514 1.00 0.00 C ATOM 511 CD2 TYR A 37 12.342 -11.907 3.368 1.00 0.00 C ATOM 512 CE1 TYR A 37 13.570 -9.948 1.862 1.00 0.00 C ATOM 513 CE2 TYR A 37 13.596 -11.451 3.724 1.00 0.00 C ATOM 514 CZ TYR A 37 14.206 -10.472 2.968 1.00 0.00 C ATOM 515 OH TYR A 37 15.457 -10.017 3.319 1.00 0.00 O ATOM 0 H TYR A 37 9.335 -9.643 1.322 1.00 0.00 H new ATOM 0 HA TYR A 37 10.686 -11.687 -0.232 1.00 0.00 H new ATOM 0 HB2 TYR A 37 9.577 -11.521 2.593 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.293 -12.983 1.943 1.00 0.00 H new ATOM 0 HD1 TYR A 37 11.820 -9.996 0.648 1.00 0.00 H new ATOM 0 HD2 TYR A 37 11.868 -12.675 3.961 1.00 0.00 H new ATOM 0 HE1 TYR A 37 14.050 -9.182 1.271 1.00 0.00 H new ATOM 0 HE2 TYR A 37 14.096 -11.859 4.590 1.00 0.00 H new ATOM 0 HH TYR A 37 15.763 -10.488 4.122 1.00 0.00 H new ATOM 525 N VAL A 38 8.719 -12.860 -1.158 1.00 0.00 N ATOM 526 CA VAL A 38 7.619 -13.659 -1.685 1.00 0.00 C ATOM 527 C VAL A 38 8.020 -14.363 -2.976 1.00 0.00 C ATOM 528 O VAL A 38 8.838 -13.856 -3.745 1.00 0.00 O ATOM 529 CB VAL A 38 6.374 -12.792 -1.951 1.00 0.00 C ATOM 530 CG1 VAL A 38 6.638 -11.811 -3.083 1.00 0.00 C ATOM 531 CG2 VAL A 38 5.171 -13.669 -2.265 1.00 0.00 C ATOM 0 H VAL A 38 9.524 -12.788 -1.780 1.00 0.00 H new ATOM 0 HA VAL A 38 7.378 -14.405 -0.928 1.00 0.00 H new ATOM 0 HB VAL A 38 6.153 -12.220 -1.050 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.747 -11.207 -3.256 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.470 -11.161 -2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.886 -12.361 -3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.300 -13.040 -2.450 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.380 -14.269 -3.150 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.970 -14.327 -1.420 1.00 0.00 H new ATOM 541 N LYS A 39 7.439 -15.535 -3.210 1.00 0.00 N ATOM 542 CA LYS A 39 7.734 -16.310 -4.409 1.00 0.00 C ATOM 543 C LYS A 39 6.450 -16.827 -5.051 1.00 0.00 C ATOM 544 O LYS A 39 5.363 -16.677 -4.495 1.00 0.00 O ATOM 545 CB LYS A 39 8.655 -17.483 -4.069 1.00 0.00 C ATOM 546 CG LYS A 39 9.953 -17.063 -3.402 1.00 0.00 C ATOM 547 CD LYS A 39 10.904 -18.238 -3.243 1.00 0.00 C ATOM 548 CE LYS A 39 11.521 -18.639 -4.574 1.00 0.00 C ATOM 549 NZ LYS A 39 11.982 -20.055 -4.568 1.00 0.00 N ATOM 0 H LYS A 39 6.760 -15.969 -2.584 1.00 0.00 H new ATOM 0 HA LYS A 39 8.238 -15.656 -5.120 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.125 -18.172 -3.411 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.886 -18.029 -4.983 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.432 -16.284 -3.995 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.738 -16.633 -2.424 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.694 -17.976 -2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.368 -19.087 -2.819 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.790 -18.499 -5.370 1.00 0.00 H new ATOM 0 HE3 LYS A 39 12.363 -17.984 -4.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.396 -20.289 -5.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.698 -20.184 -3.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 11.174 -20.682 -4.382 1.00 0.00 H new ATOM 563 N GLU A 40 6.585 -17.437 -6.225 1.00 0.00 N ATOM 564 CA GLU A 40 5.436 -17.977 -6.941 1.00 0.00 C ATOM 565 C GLU A 40 4.349 -16.917 -7.103 1.00 0.00 C ATOM 566 O GLU A 40 3.178 -17.165 -6.814 1.00 0.00 O ATOM 567 CB GLU A 40 4.872 -19.193 -6.203 1.00 0.00 C ATOM 568 CG GLU A 40 5.936 -20.046 -5.534 1.00 0.00 C ATOM 569 CD GLU A 40 5.460 -21.458 -5.254 1.00 0.00 C ATOM 570 OE1 GLU A 40 4.480 -21.892 -5.896 1.00 0.00 O ATOM 571 OE2 GLU A 40 6.065 -22.129 -4.392 1.00 0.00 O ATOM 0 H GLU A 40 7.478 -17.569 -6.699 1.00 0.00 H new ATOM 0 HA GLU A 40 5.770 -18.285 -7.932 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.163 -18.853 -5.448 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.315 -19.809 -6.908 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.820 -20.084 -6.171 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.238 -19.576 -4.598 1.00 0.00 H new ATOM 578 N ILE A 41 4.747 -15.737 -7.566 1.00 0.00 N ATOM 579 CA ILE A 41 3.808 -14.641 -7.767 1.00 0.00 C ATOM 580 C ILE A 41 3.381 -14.543 -9.228 1.00 0.00 C ATOM 581 O ILE A 41 4.160 -14.841 -10.134 1.00 0.00 O ATOM 582 CB ILE A 41 4.414 -13.294 -7.330 1.00 0.00 C ATOM 583 CG1 ILE A 41 4.313 -13.132 -5.812 1.00 0.00 C ATOM 584 CG2 ILE A 41 3.713 -12.143 -8.038 1.00 0.00 C ATOM 585 CD1 ILE A 41 4.298 -11.690 -5.357 1.00 0.00 C ATOM 0 H ILE A 41 5.713 -15.516 -7.809 1.00 0.00 H new ATOM 0 HA ILE A 41 2.936 -14.856 -7.150 1.00 0.00 H new ATOM 0 HB ILE A 41 5.468 -13.280 -7.609 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.406 -13.624 -5.462 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.154 -13.643 -5.344 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.152 -11.198 -7.719 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.832 -12.253 -9.116 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.652 -12.153 -7.787 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.225 -11.652 -4.270 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.217 -11.198 -5.676 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.441 -11.179 -5.796 1.00 0.00 H new ATOM 597 N CYS A 42 2.140 -14.124 -9.449 1.00 0.00 N ATOM 598 CA CYS A 42 1.608 -13.986 -10.800 1.00 0.00 C ATOM 599 C CYS A 42 1.738 -12.548 -11.291 1.00 0.00 C ATOM 600 O CYS A 42 0.968 -11.674 -10.893 1.00 0.00 O ATOM 601 CB CYS A 42 0.143 -14.421 -10.841 1.00 0.00 C ATOM 602 SG CYS A 42 -0.374 -15.126 -12.424 1.00 0.00 S ATOM 0 H CYS A 42 1.483 -13.874 -8.710 1.00 0.00 H new ATOM 0 HA CYS A 42 2.189 -14.630 -11.460 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -0.029 -15.156 -10.055 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -0.487 -13.560 -10.616 1.00 0.00 H new ATOM 0 HG CYS A 42 -1.627 -15.466 -12.359 1.00 0.00 H new ATOM 608 N ARG A 43 2.718 -12.309 -12.156 1.00 0.00 N ATOM 609 CA ARG A 43 2.951 -10.977 -12.699 1.00 0.00 C ATOM 610 C ARG A 43 1.803 -10.553 -13.612 1.00 0.00 C ATOM 611 O ARG A 43 1.725 -9.399 -14.032 1.00 0.00 O ATOM 612 CB ARG A 43 4.270 -10.941 -13.472 1.00 0.00 C ATOM 613 CG ARG A 43 5.454 -11.476 -12.682 1.00 0.00 C ATOM 614 CD ARG A 43 6.774 -11.129 -13.353 1.00 0.00 C ATOM 615 NE ARG A 43 6.815 -11.573 -14.743 1.00 0.00 N ATOM 616 CZ ARG A 43 7.938 -11.697 -15.442 1.00 0.00 C ATOM 617 NH1 ARG A 43 9.106 -11.414 -14.883 1.00 0.00 N ATOM 618 NH2 ARG A 43 7.894 -12.108 -16.703 1.00 0.00 N ATOM 0 H ARG A 43 3.364 -13.022 -12.496 1.00 0.00 H new ATOM 0 HA ARG A 43 3.007 -10.278 -11.865 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.161 -11.524 -14.387 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.478 -9.914 -13.771 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.437 -11.062 -11.674 1.00 0.00 H new ATOM 0 HG3 ARG A 43 5.368 -12.558 -12.584 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.929 -10.051 -13.312 1.00 0.00 H new ATOM 0 HD3 ARG A 43 7.593 -11.590 -12.801 1.00 0.00 H new ATOM 0 HE ARG A 43 5.933 -11.800 -15.203 1.00 0.00 H new ATOM 0 HH11 ARG A 43 9.145 -11.100 -13.913 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.966 -11.510 -15.422 1.00 0.00 H new ATOM 0 HH21 ARG A 43 6.997 -12.329 -17.136 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.757 -12.203 -17.239 1.00 0.00 H new ATOM 632 N ASP A 44 0.916 -11.495 -13.913 1.00 0.00 N ATOM 633 CA ASP A 44 -0.228 -11.220 -14.775 1.00 0.00 C ATOM 634 C ASP A 44 -1.404 -10.687 -13.963 1.00 0.00 C ATOM 635 O ASP A 44 -2.207 -9.895 -14.458 1.00 0.00 O ATOM 636 CB ASP A 44 -0.643 -12.485 -15.527 1.00 0.00 C ATOM 637 CG ASP A 44 0.293 -12.810 -16.675 1.00 0.00 C ATOM 638 OD1 ASP A 44 0.848 -11.864 -17.274 1.00 0.00 O ATOM 639 OD2 ASP A 44 0.473 -14.009 -16.973 1.00 0.00 O ATOM 0 H ASP A 44 0.967 -12.455 -13.573 1.00 0.00 H new ATOM 0 HA ASP A 44 0.067 -10.458 -15.497 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.667 -13.325 -14.833 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.655 -12.360 -15.912 1.00 0.00 H new ATOM 644 N THR A 45 -1.502 -11.128 -12.712 1.00 0.00 N ATOM 645 CA THR A 45 -2.581 -10.698 -11.832 1.00 0.00 C ATOM 646 C THR A 45 -2.042 -9.894 -10.654 1.00 0.00 C ATOM 647 O THR A 45 -2.750 -9.660 -9.675 1.00 0.00 O ATOM 648 CB THR A 45 -3.381 -11.900 -11.296 1.00 0.00 C ATOM 649 OG1 THR A 45 -2.593 -12.629 -10.348 1.00 0.00 O ATOM 650 CG2 THR A 45 -3.800 -12.821 -12.432 1.00 0.00 C ATOM 0 H THR A 45 -0.846 -11.783 -12.286 1.00 0.00 H new ATOM 0 HA THR A 45 -3.242 -10.067 -12.427 1.00 0.00 H new ATOM 0 HB THR A 45 -4.279 -11.522 -10.807 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.184 -13.080 -9.710 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.364 -13.663 -12.029 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.424 -12.270 -13.136 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.913 -13.191 -12.946 1.00 0.00 H new ATOM 658 N SER A 46 -0.785 -9.474 -10.756 1.00 0.00 N ATOM 659 CA SER A 46 -0.151 -8.698 -9.696 1.00 0.00 C ATOM 660 C SER A 46 0.277 -7.327 -10.209 1.00 0.00 C ATOM 661 O SER A 46 1.111 -7.220 -11.109 1.00 0.00 O ATOM 662 CB SER A 46 1.062 -9.449 -9.142 1.00 0.00 C ATOM 663 OG SER A 46 0.691 -10.726 -8.653 1.00 0.00 O ATOM 0 H SER A 46 -0.186 -9.658 -11.561 1.00 0.00 H new ATOM 0 HA SER A 46 -0.879 -8.557 -8.897 1.00 0.00 H new ATOM 0 HB2 SER A 46 1.813 -9.560 -9.924 1.00 0.00 H new ATOM 0 HB3 SER A 46 1.519 -8.868 -8.341 1.00 0.00 H new ATOM 0 HG SER A 46 0.430 -11.300 -9.403 1.00 0.00 H new ATOM 669 N ARG A 47 -0.300 -6.279 -9.630 1.00 0.00 N ATOM 670 CA ARG A 47 0.019 -4.913 -10.028 1.00 0.00 C ATOM 671 C ARG A 47 0.390 -4.066 -8.814 1.00 0.00 C ATOM 672 O ARG A 47 0.395 -4.551 -7.683 1.00 0.00 O ATOM 673 CB ARG A 47 -1.166 -4.283 -10.761 1.00 0.00 C ATOM 674 CG ARG A 47 -2.458 -4.302 -9.961 1.00 0.00 C ATOM 675 CD ARG A 47 -3.362 -3.139 -10.335 1.00 0.00 C ATOM 676 NE ARG A 47 -4.766 -3.422 -10.046 1.00 0.00 N ATOM 677 CZ ARG A 47 -5.565 -4.090 -10.869 1.00 0.00 C ATOM 678 NH1 ARG A 47 -5.102 -4.543 -12.026 1.00 0.00 N ATOM 679 NH2 ARG A 47 -6.831 -4.308 -10.535 1.00 0.00 N ATOM 0 H ARG A 47 -0.991 -6.350 -8.883 1.00 0.00 H new ATOM 0 HA ARG A 47 0.876 -4.947 -10.701 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.920 -3.251 -11.013 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.323 -4.812 -11.701 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -2.982 -5.242 -10.136 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -2.229 -4.258 -8.896 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.052 -2.248 -9.788 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.248 -2.918 -11.396 1.00 0.00 H new ATOM 0 HE ARG A 47 -5.153 -3.088 -9.164 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.129 -4.379 -12.286 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -5.718 -5.056 -12.656 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.191 -3.962 -9.645 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.444 -4.821 -11.168 1.00 0.00 H new ATOM 693 N VAL A 48 0.700 -2.796 -9.058 1.00 0.00 N ATOM 694 CA VAL A 48 1.071 -1.881 -7.986 1.00 0.00 C ATOM 695 C VAL A 48 0.587 -0.465 -8.280 1.00 0.00 C ATOM 696 O VAL A 48 0.920 0.115 -9.313 1.00 0.00 O ATOM 697 CB VAL A 48 2.597 -1.855 -7.773 1.00 0.00 C ATOM 698 CG1 VAL A 48 2.980 -0.762 -6.787 1.00 0.00 C ATOM 699 CG2 VAL A 48 3.090 -3.213 -7.295 1.00 0.00 C ATOM 0 H VAL A 48 0.701 -2.378 -9.989 1.00 0.00 H new ATOM 0 HA VAL A 48 0.590 -2.246 -7.078 1.00 0.00 H new ATOM 0 HB VAL A 48 3.077 -1.634 -8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 48 4.061 -0.759 -6.649 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.661 0.206 -7.174 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.493 -0.948 -5.830 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.170 -3.178 -7.149 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.605 -3.465 -6.352 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.849 -3.971 -8.041 1.00 0.00 H new ATOM 709 N LEU A 49 -0.202 0.086 -7.363 1.00 0.00 N ATOM 710 CA LEU A 49 -0.733 1.435 -7.523 1.00 0.00 C ATOM 711 C LEU A 49 0.069 2.437 -6.699 1.00 0.00 C ATOM 712 O LEU A 49 -0.017 2.457 -5.471 1.00 0.00 O ATOM 713 CB LEU A 49 -2.205 1.477 -7.107 1.00 0.00 C ATOM 714 CG LEU A 49 -3.127 0.471 -7.796 1.00 0.00 C ATOM 715 CD1 LEU A 49 -4.417 0.303 -7.010 1.00 0.00 C ATOM 716 CD2 LEU A 49 -3.423 0.910 -9.223 1.00 0.00 C ATOM 0 H LEU A 49 -0.488 -0.381 -6.502 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.651 1.709 -8.575 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.262 1.314 -6.031 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.587 2.480 -7.298 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.620 -0.493 -7.831 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -5.060 -0.417 -7.516 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.188 -0.057 -6.007 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -4.929 1.263 -6.942 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -4.081 0.182 -9.699 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -3.910 1.885 -9.210 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.491 0.977 -9.784 1.00 0.00 H new ATOM 728 N PHE A 50 0.847 3.269 -7.383 1.00 0.00 N ATOM 729 CA PHE A 50 1.664 4.275 -6.715 1.00 0.00 C ATOM 730 C PHE A 50 0.872 5.560 -6.495 1.00 0.00 C ATOM 731 O PHE A 50 0.568 6.285 -7.443 1.00 0.00 O ATOM 732 CB PHE A 50 2.920 4.571 -7.538 1.00 0.00 C ATOM 733 CG PHE A 50 3.898 3.431 -7.571 1.00 0.00 C ATOM 734 CD1 PHE A 50 4.499 2.983 -6.406 1.00 0.00 C ATOM 735 CD2 PHE A 50 4.214 2.807 -8.767 1.00 0.00 C ATOM 736 CE1 PHE A 50 5.399 1.935 -6.434 1.00 0.00 C ATOM 737 CE2 PHE A 50 5.114 1.758 -8.800 1.00 0.00 C ATOM 738 CZ PHE A 50 5.706 1.321 -7.632 1.00 0.00 C ATOM 0 H PHE A 50 0.929 3.266 -8.400 1.00 0.00 H new ATOM 0 HA PHE A 50 1.960 3.880 -5.743 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.626 4.817 -8.558 1.00 0.00 H new ATOM 0 HB3 PHE A 50 3.414 5.452 -7.128 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.261 3.458 -5.466 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.752 3.144 -9.683 1.00 0.00 H new ATOM 0 HE1 PHE A 50 5.862 1.596 -5.519 1.00 0.00 H new ATOM 0 HE2 PHE A 50 5.354 1.281 -9.739 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.408 0.500 -7.655 1.00 0.00 H new ATOM 748 N ARG A 51 0.541 5.837 -5.238 1.00 0.00 N ATOM 749 CA ARG A 51 -0.218 7.033 -4.893 1.00 0.00 C ATOM 750 C ARG A 51 0.717 8.203 -4.598 1.00 0.00 C ATOM 751 O ARG A 51 1.937 8.073 -4.692 1.00 0.00 O ATOM 752 CB ARG A 51 -1.113 6.764 -3.682 1.00 0.00 C ATOM 753 CG ARG A 51 -2.494 6.247 -4.049 1.00 0.00 C ATOM 754 CD ARG A 51 -3.482 7.387 -4.245 1.00 0.00 C ATOM 755 NE ARG A 51 -3.268 8.085 -5.510 1.00 0.00 N ATOM 756 CZ ARG A 51 -3.684 9.324 -5.744 1.00 0.00 C ATOM 757 NH1 ARG A 51 -4.332 9.999 -4.805 1.00 0.00 N ATOM 758 NH2 ARG A 51 -3.452 9.892 -6.921 1.00 0.00 N ATOM 0 H ARG A 51 0.787 5.249 -4.441 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.843 7.295 -5.747 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -0.623 6.038 -3.033 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.220 7.684 -3.108 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.432 5.657 -4.963 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.855 5.582 -3.264 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -4.499 6.995 -4.215 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -3.388 8.094 -3.421 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.772 7.594 -6.254 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.513 9.567 -3.899 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -4.650 10.951 -4.989 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.954 9.377 -7.647 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -3.772 10.844 -7.100 1.00 0.00 H new ATOM 772 N GLU A 52 0.135 9.343 -4.242 1.00 0.00 N ATOM 773 CA GLU A 52 0.916 10.536 -3.935 1.00 0.00 C ATOM 774 C GLU A 52 1.449 10.484 -2.506 1.00 0.00 C ATOM 775 O GLU A 52 2.585 10.877 -2.242 1.00 0.00 O ATOM 776 CB GLU A 52 0.066 11.793 -4.129 1.00 0.00 C ATOM 777 CG GLU A 52 -1.025 11.958 -3.084 1.00 0.00 C ATOM 778 CD GLU A 52 -2.227 12.718 -3.610 1.00 0.00 C ATOM 779 OE1 GLU A 52 -2.027 13.709 -4.343 1.00 0.00 O ATOM 780 OE2 GLU A 52 -3.367 12.322 -3.290 1.00 0.00 O ATOM 0 H GLU A 52 -0.874 9.466 -4.159 1.00 0.00 H new ATOM 0 HA GLU A 52 1.764 10.571 -4.620 1.00 0.00 H new ATOM 0 HB2 GLU A 52 0.716 12.668 -4.105 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.391 11.763 -5.118 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.344 10.974 -2.739 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.618 12.482 -2.219 1.00 0.00 H new ATOM 787 N GLN A 53 0.619 9.997 -1.588 1.00 0.00 N ATOM 788 CA GLN A 53 1.006 9.895 -0.186 1.00 0.00 C ATOM 789 C GLN A 53 0.967 8.445 0.285 1.00 0.00 C ATOM 790 O GLN A 53 0.897 8.174 1.484 1.00 0.00 O ATOM 791 CB GLN A 53 0.083 10.752 0.683 1.00 0.00 C ATOM 792 CG GLN A 53 0.628 11.009 2.078 1.00 0.00 C ATOM 793 CD GLN A 53 -0.469 11.231 3.101 1.00 0.00 C ATOM 794 OE1 GLN A 53 -1.042 12.317 3.188 1.00 0.00 O ATOM 795 NE2 GLN A 53 -0.767 10.199 3.883 1.00 0.00 N ATOM 0 H GLN A 53 -0.325 9.667 -1.790 1.00 0.00 H new ATOM 0 HA GLN A 53 2.028 10.262 -0.089 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -0.086 11.707 0.186 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -0.886 10.259 0.765 1.00 0.00 H new ATOM 0 HG2 GLN A 53 1.241 10.162 2.386 1.00 0.00 H new ATOM 0 HG3 GLN A 53 1.280 11.882 2.054 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -0.266 9.317 3.776 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -1.497 10.289 4.590 1.00 0.00 H new ATOM 804 N ASP A 54 1.012 7.518 -0.665 1.00 0.00 N ATOM 805 CA ASP A 54 0.982 6.095 -0.347 1.00 0.00 C ATOM 806 C ASP A 54 1.281 5.255 -1.584 1.00 0.00 C ATOM 807 O ASP A 54 1.526 5.790 -2.666 1.00 0.00 O ATOM 808 CB ASP A 54 -0.381 5.708 0.230 1.00 0.00 C ATOM 809 CG ASP A 54 -1.509 6.548 -0.335 1.00 0.00 C ATOM 810 OD1 ASP A 54 -1.592 7.744 0.016 1.00 0.00 O ATOM 811 OD2 ASP A 54 -2.309 6.010 -1.129 1.00 0.00 O ATOM 0 H ASP A 54 1.069 7.726 -1.662 1.00 0.00 H new ATOM 0 HA ASP A 54 1.753 5.899 0.398 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -0.575 4.656 0.021 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.358 5.818 1.314 1.00 0.00 H new ATOM 816 N PHE A 55 1.262 3.937 -1.417 1.00 0.00 N ATOM 817 CA PHE A 55 1.533 3.023 -2.521 1.00 0.00 C ATOM 818 C PHE A 55 0.985 1.631 -2.221 1.00 0.00 C ATOM 819 O PHE A 55 1.444 0.954 -1.299 1.00 0.00 O ATOM 820 CB PHE A 55 3.038 2.944 -2.787 1.00 0.00 C ATOM 821 CG PHE A 55 3.756 1.977 -1.889 1.00 0.00 C ATOM 822 CD1 PHE A 55 3.889 0.646 -2.249 1.00 0.00 C ATOM 823 CD2 PHE A 55 4.297 2.400 -0.686 1.00 0.00 C ATOM 824 CE1 PHE A 55 4.550 -0.246 -1.425 1.00 0.00 C ATOM 825 CE2 PHE A 55 4.958 1.512 0.142 1.00 0.00 C ATOM 826 CZ PHE A 55 5.084 0.187 -0.228 1.00 0.00 C ATOM 0 H PHE A 55 1.062 3.478 -0.528 1.00 0.00 H new ATOM 0 HA PHE A 55 1.033 3.408 -3.410 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.201 2.653 -3.825 1.00 0.00 H new ATOM 0 HB3 PHE A 55 3.473 3.935 -2.662 1.00 0.00 H new ATOM 0 HD1 PHE A 55 3.472 0.301 -3.184 1.00 0.00 H new ATOM 0 HD2 PHE A 55 4.201 3.435 -0.392 1.00 0.00 H new ATOM 0 HE1 PHE A 55 4.648 -1.281 -1.718 1.00 0.00 H new ATOM 0 HE2 PHE A 55 5.376 1.854 1.077 1.00 0.00 H new ATOM 0 HZ PHE A 55 5.599 -0.509 0.418 1.00 0.00 H new ATOM 836 N THR A 56 -0.002 1.208 -3.005 1.00 0.00 N ATOM 837 CA THR A 56 -0.615 -0.102 -2.824 1.00 0.00 C ATOM 838 C THR A 56 0.046 -1.146 -3.716 1.00 0.00 C ATOM 839 O THR A 56 0.439 -0.853 -4.846 1.00 0.00 O ATOM 840 CB THR A 56 -2.124 -0.062 -3.129 1.00 0.00 C ATOM 841 OG1 THR A 56 -2.652 1.233 -2.825 1.00 0.00 O ATOM 842 CG2 THR A 56 -2.867 -1.119 -2.326 1.00 0.00 C ATOM 0 H THR A 56 -0.394 1.754 -3.772 1.00 0.00 H new ATOM 0 HA THR A 56 -0.470 -0.378 -1.779 1.00 0.00 H new ATOM 0 HB THR A 56 -2.263 -0.270 -4.190 1.00 0.00 H new ATOM 0 HG1 THR A 56 -3.612 1.250 -3.024 1.00 0.00 H new ATOM 0 HG21 THR A 56 -3.931 -1.071 -2.558 1.00 0.00 H new ATOM 0 HG22 THR A 56 -2.484 -2.107 -2.582 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.720 -0.937 -1.261 1.00 0.00 H new ATOM 850 N LEU A 57 0.164 -2.366 -3.203 1.00 0.00 N ATOM 851 CA LEU A 57 0.777 -3.456 -3.955 1.00 0.00 C ATOM 852 C LEU A 57 -0.145 -4.671 -4.001 1.00 0.00 C ATOM 853 O LEU A 57 -0.326 -5.362 -2.999 1.00 0.00 O ATOM 854 CB LEU A 57 2.118 -3.842 -3.329 1.00 0.00 C ATOM 855 CG LEU A 57 2.600 -5.267 -3.602 1.00 0.00 C ATOM 856 CD1 LEU A 57 3.052 -5.410 -5.047 1.00 0.00 C ATOM 857 CD2 LEU A 57 3.727 -5.640 -2.650 1.00 0.00 C ATOM 0 H LEU A 57 -0.156 -2.625 -2.270 1.00 0.00 H new ATOM 0 HA LEU A 57 0.945 -3.112 -4.975 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.877 -3.148 -3.689 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.046 -3.705 -2.250 1.00 0.00 H new ATOM 0 HG LEU A 57 1.767 -5.950 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.392 -6.431 -5.223 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.219 -5.185 -5.713 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.870 -4.717 -5.243 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.058 -6.657 -2.859 1.00 0.00 H new ATOM 0 HD22 LEU A 57 4.561 -4.952 -2.787 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.370 -5.578 -1.622 1.00 0.00 H new ATOM 869 N ILE A 58 -0.721 -4.925 -5.171 1.00 0.00 N ATOM 870 CA ILE A 58 -1.620 -6.059 -5.348 1.00 0.00 C ATOM 871 C ILE A 58 -0.937 -7.188 -6.111 1.00 0.00 C ATOM 872 O ILE A 58 -0.593 -7.041 -7.283 1.00 0.00 O ATOM 873 CB ILE A 58 -2.901 -5.649 -6.098 1.00 0.00 C ATOM 874 CG1 ILE A 58 -3.680 -4.608 -5.291 1.00 0.00 C ATOM 875 CG2 ILE A 58 -3.767 -6.869 -6.374 1.00 0.00 C ATOM 876 CD1 ILE A 58 -3.014 -3.250 -5.254 1.00 0.00 C ATOM 0 H ILE A 58 -0.582 -4.362 -6.010 1.00 0.00 H new ATOM 0 HA ILE A 58 -1.888 -6.408 -4.351 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.619 -5.205 -7.052 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.678 -4.503 -5.716 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.805 -4.970 -4.271 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.669 -6.563 -6.905 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -3.210 -7.580 -6.985 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.043 -7.340 -5.431 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.621 -2.563 -4.665 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -2.027 -3.341 -4.801 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.913 -2.866 -6.269 1.00 0.00 H new ATOM 888 N PHE A 59 -0.746 -8.318 -5.438 1.00 0.00 N ATOM 889 CA PHE A 59 -0.104 -9.475 -6.052 1.00 0.00 C ATOM 890 C PHE A 59 -0.616 -10.773 -5.434 1.00 0.00 C ATOM 891 O PHE A 59 -0.821 -10.857 -4.223 1.00 0.00 O ATOM 892 CB PHE A 59 1.415 -9.386 -5.894 1.00 0.00 C ATOM 893 CG PHE A 59 1.895 -9.725 -4.511 1.00 0.00 C ATOM 894 CD1 PHE A 59 1.821 -11.025 -4.038 1.00 0.00 C ATOM 895 CD2 PHE A 59 2.419 -8.744 -3.686 1.00 0.00 C ATOM 896 CE1 PHE A 59 2.261 -11.340 -2.766 1.00 0.00 C ATOM 897 CE2 PHE A 59 2.861 -9.052 -2.413 1.00 0.00 C ATOM 898 CZ PHE A 59 2.783 -10.352 -1.953 1.00 0.00 C ATOM 0 H PHE A 59 -1.027 -8.457 -4.467 1.00 0.00 H new ATOM 0 HA PHE A 59 -0.352 -9.476 -7.113 1.00 0.00 H new ATOM 0 HB2 PHE A 59 1.887 -10.060 -6.609 1.00 0.00 H new ATOM 0 HB3 PHE A 59 1.740 -8.376 -6.145 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.415 -11.801 -4.670 1.00 0.00 H new ATOM 0 HD2 PHE A 59 2.483 -7.726 -4.041 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.197 -12.357 -2.408 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.267 -8.277 -1.779 1.00 0.00 H new ATOM 0 HZ PHE A 59 3.129 -10.596 -0.960 1.00 0.00 H new ATOM 908 N GLN A 60 -0.821 -11.781 -6.275 1.00 0.00 N ATOM 909 CA GLN A 60 -1.310 -13.074 -5.812 1.00 0.00 C ATOM 910 C GLN A 60 -0.180 -14.096 -5.757 1.00 0.00 C ATOM 911 O GLN A 60 0.301 -14.564 -6.790 1.00 0.00 O ATOM 912 CB GLN A 60 -2.426 -13.579 -6.729 1.00 0.00 C ATOM 913 CG GLN A 60 -3.799 -13.031 -6.375 1.00 0.00 C ATOM 914 CD GLN A 60 -4.765 -13.081 -7.542 1.00 0.00 C ATOM 915 OE1 GLN A 60 -4.626 -13.908 -8.444 1.00 0.00 O ATOM 916 NE2 GLN A 60 -5.754 -12.194 -7.531 1.00 0.00 N ATOM 0 H GLN A 60 -0.656 -11.727 -7.280 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.707 -12.944 -4.805 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -2.190 -13.308 -7.758 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -2.456 -14.668 -6.685 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -4.211 -13.602 -5.543 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.698 -12.000 -6.035 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -5.832 -11.526 -6.764 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.435 -12.181 -8.290 1.00 0.00 H new ATOM 925 N THR A 61 0.243 -14.439 -4.544 1.00 0.00 N ATOM 926 CA THR A 61 1.318 -15.405 -4.354 1.00 0.00 C ATOM 927 C THR A 61 0.765 -16.787 -4.028 1.00 0.00 C ATOM 928 O THR A 61 -0.260 -16.913 -3.358 1.00 0.00 O ATOM 929 CB THR A 61 2.273 -14.967 -3.227 1.00 0.00 C ATOM 930 OG1 THR A 61 3.362 -15.891 -3.121 1.00 0.00 O ATOM 931 CG2 THR A 61 1.539 -14.886 -1.897 1.00 0.00 C ATOM 0 H THR A 61 -0.143 -14.062 -3.678 1.00 0.00 H new ATOM 0 HA THR A 61 1.871 -15.451 -5.292 1.00 0.00 H new ATOM 0 HB THR A 61 2.659 -13.978 -3.472 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.906 -15.851 -3.935 1.00 0.00 H new ATOM 0 HG21 THR A 61 2.233 -14.575 -1.117 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.729 -14.161 -1.972 1.00 0.00 H new ATOM 0 HG23 THR A 61 1.128 -15.864 -1.648 1.00 0.00 H new ATOM 939 N ARG A 62 1.450 -17.821 -4.505 1.00 0.00 N ATOM 940 CA ARG A 62 1.026 -19.195 -4.264 1.00 0.00 C ATOM 941 C ARG A 62 2.118 -19.983 -3.547 1.00 0.00 C ATOM 942 O ARG A 62 2.110 -21.214 -3.546 1.00 0.00 O ATOM 943 CB ARG A 62 0.671 -19.881 -5.585 1.00 0.00 C ATOM 944 CG ARG A 62 1.873 -20.139 -6.479 1.00 0.00 C ATOM 945 CD ARG A 62 1.449 -20.655 -7.846 1.00 0.00 C ATOM 946 NE ARG A 62 2.591 -20.842 -8.737 1.00 0.00 N ATOM 947 CZ ARG A 62 2.475 -21.161 -10.022 1.00 0.00 C ATOM 948 NH1 ARG A 62 1.275 -21.326 -10.562 1.00 0.00 N ATOM 949 NH2 ARG A 62 3.561 -21.314 -10.769 1.00 0.00 N ATOM 0 H ARG A 62 2.301 -17.733 -5.061 1.00 0.00 H new ATOM 0 HA ARG A 62 0.142 -19.169 -3.627 1.00 0.00 H new ATOM 0 HB2 ARG A 62 0.178 -20.829 -5.371 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -0.046 -19.263 -6.124 1.00 0.00 H new ATOM 0 HG2 ARG A 62 2.444 -19.218 -6.597 1.00 0.00 H new ATOM 0 HG3 ARG A 62 2.533 -20.865 -6.003 1.00 0.00 H new ATOM 0 HD2 ARG A 62 0.921 -21.602 -7.729 1.00 0.00 H new ATOM 0 HD3 ARG A 62 0.748 -19.953 -8.297 1.00 0.00 H new ATOM 0 HE ARG A 62 3.528 -20.721 -8.352 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.438 -21.208 -9.991 1.00 0.00 H new ATOM 0 HH12 ARG A 62 1.189 -21.571 -11.548 1.00 0.00 H new ATOM 0 HH21 ARG A 62 4.485 -21.187 -10.357 1.00 0.00 H new ATOM 0 HH22 ARG A 62 3.471 -21.559 -11.755 1.00 0.00 H new ATOM 963 N ASP A 63 3.055 -19.265 -2.938 1.00 0.00 N ATOM 964 CA ASP A 63 4.154 -19.897 -2.216 1.00 0.00 C ATOM 965 C ASP A 63 3.704 -20.350 -0.831 1.00 0.00 C ATOM 966 O ASP A 63 3.510 -19.533 0.068 1.00 0.00 O ATOM 967 CB ASP A 63 5.333 -18.931 -2.093 1.00 0.00 C ATOM 968 CG ASP A 63 6.623 -19.637 -1.724 1.00 0.00 C ATOM 969 OD1 ASP A 63 6.663 -20.882 -1.808 1.00 0.00 O ATOM 970 OD2 ASP A 63 7.593 -18.944 -1.349 1.00 0.00 O ATOM 0 H ASP A 63 3.076 -18.245 -2.930 1.00 0.00 H new ATOM 0 HA ASP A 63 4.471 -20.774 -2.780 1.00 0.00 H new ATOM 0 HB2 ASP A 63 5.468 -18.404 -3.038 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.105 -18.178 -1.338 1.00 0.00 H new ATOM 975 N GLY A 64 3.540 -21.660 -0.666 1.00 0.00 N ATOM 976 CA GLY A 64 3.113 -22.199 0.612 1.00 0.00 C ATOM 977 C GLY A 64 3.780 -21.508 1.784 1.00 0.00 C ATOM 978 O GLY A 64 3.178 -21.352 2.846 1.00 0.00 O ATOM 0 H GLY A 64 3.695 -22.357 -1.395 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.031 -22.098 0.702 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.338 -23.265 0.647 1.00 0.00 H new ATOM 982 N ASN A 65 5.029 -21.094 1.593 1.00 0.00 N ATOM 983 CA ASN A 65 5.779 -20.417 2.645 1.00 0.00 C ATOM 984 C ASN A 65 5.152 -19.067 2.979 1.00 0.00 C ATOM 985 O ASN A 65 5.077 -18.676 4.144 1.00 0.00 O ATOM 986 CB ASN A 65 7.235 -20.224 2.217 1.00 0.00 C ATOM 987 CG ASN A 65 7.862 -21.505 1.702 1.00 0.00 C ATOM 988 OD1 ASN A 65 7.752 -22.558 2.330 1.00 0.00 O ATOM 989 ND2 ASN A 65 8.524 -21.420 0.554 1.00 0.00 N ATOM 0 H ASN A 65 5.543 -21.215 0.720 1.00 0.00 H new ATOM 0 HA ASN A 65 5.749 -21.041 3.538 1.00 0.00 H new ATOM 0 HB2 ASN A 65 7.284 -19.461 1.440 1.00 0.00 H new ATOM 0 HB3 ASN A 65 7.814 -19.855 3.064 1.00 0.00 H new ATOM 0 HD21 ASN A 65 8.967 -22.249 0.158 1.00 0.00 H new ATOM 0 HD22 ASN A 65 8.589 -20.526 0.068 1.00 0.00 H new ATOM 996 N PHE A 66 4.701 -18.359 1.948 1.00 0.00 N ATOM 997 CA PHE A 66 4.080 -17.053 2.131 1.00 0.00 C ATOM 998 C PHE A 66 2.609 -17.198 2.510 1.00 0.00 C ATOM 999 O PHE A 66 2.079 -16.416 3.299 1.00 0.00 O ATOM 1000 CB PHE A 66 4.210 -16.219 0.855 1.00 0.00 C ATOM 1001 CG PHE A 66 3.750 -14.799 1.017 1.00 0.00 C ATOM 1002 CD1 PHE A 66 2.408 -14.507 1.197 1.00 0.00 C ATOM 1003 CD2 PHE A 66 4.661 -13.754 0.991 1.00 0.00 C ATOM 1004 CE1 PHE A 66 1.982 -13.201 1.346 1.00 0.00 C ATOM 1005 CE2 PHE A 66 4.241 -12.446 1.140 1.00 0.00 C ATOM 1006 CZ PHE A 66 2.900 -12.169 1.319 1.00 0.00 C ATOM 0 H PHE A 66 4.754 -18.668 0.978 1.00 0.00 H new ATOM 0 HA PHE A 66 4.598 -16.544 2.944 1.00 0.00 H new ATOM 0 HB2 PHE A 66 5.252 -16.221 0.534 1.00 0.00 H new ATOM 0 HB3 PHE A 66 3.631 -16.692 0.061 1.00 0.00 H new ATOM 0 HD1 PHE A 66 1.686 -15.310 1.221 1.00 0.00 H new ATOM 0 HD2 PHE A 66 5.711 -13.965 0.853 1.00 0.00 H new ATOM 0 HE1 PHE A 66 0.932 -12.987 1.483 1.00 0.00 H new ATOM 0 HE2 PHE A 66 4.961 -11.641 1.116 1.00 0.00 H new ATOM 0 HZ PHE A 66 2.570 -11.148 1.438 1.00 0.00 H new ATOM 1016 N LEU A 67 1.955 -18.204 1.940 1.00 0.00 N ATOM 1017 CA LEU A 67 0.544 -18.453 2.216 1.00 0.00 C ATOM 1018 C LEU A 67 0.348 -18.949 3.645 1.00 0.00 C ATOM 1019 O LEU A 67 -0.481 -18.421 4.387 1.00 0.00 O ATOM 1020 CB LEU A 67 -0.016 -19.478 1.228 1.00 0.00 C ATOM 1021 CG LEU A 67 -0.342 -18.952 -0.171 1.00 0.00 C ATOM 1022 CD1 LEU A 67 -1.018 -20.031 -1.002 1.00 0.00 C ATOM 1023 CD2 LEU A 67 -1.222 -17.714 -0.084 1.00 0.00 C ATOM 0 H LEU A 67 2.379 -18.860 1.284 1.00 0.00 H new ATOM 0 HA LEU A 67 0.005 -17.513 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.704 -20.290 1.130 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.923 -19.906 1.654 1.00 0.00 H new ATOM 0 HG LEU A 67 0.592 -18.676 -0.661 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.243 -19.639 -1.994 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.353 -20.890 -1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.944 -20.339 -0.515 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.444 -17.354 -1.089 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.153 -17.964 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.701 -16.936 0.474 1.00 0.00 H new ATOM 1035 N ARG A 68 1.117 -19.964 4.025 1.00 0.00 N ATOM 1036 CA ARG A 68 1.029 -20.530 5.365 1.00 0.00 C ATOM 1037 C ARG A 68 0.921 -19.427 6.415 1.00 0.00 C ATOM 1038 O ARG A 68 0.197 -19.564 7.402 1.00 0.00 O ATOM 1039 CB ARG A 68 2.249 -21.406 5.654 1.00 0.00 C ATOM 1040 CG ARG A 68 2.089 -22.845 5.191 1.00 0.00 C ATOM 1041 CD ARG A 68 3.100 -23.761 5.862 1.00 0.00 C ATOM 1042 NE ARG A 68 2.950 -25.149 5.432 1.00 0.00 N ATOM 1043 CZ ARG A 68 3.492 -25.638 4.322 1.00 0.00 C ATOM 1044 NH1 ARG A 68 4.216 -24.855 3.534 1.00 0.00 N ATOM 1045 NH2 ARG A 68 3.310 -26.912 3.999 1.00 0.00 N ATOM 0 H ARG A 68 1.808 -20.411 3.423 1.00 0.00 H new ATOM 0 HA ARG A 68 0.130 -21.144 5.414 1.00 0.00 H new ATOM 0 HB2 ARG A 68 3.122 -20.971 5.166 1.00 0.00 H new ATOM 0 HB3 ARG A 68 2.446 -21.398 6.726 1.00 0.00 H new ATOM 0 HG2 ARG A 68 1.079 -23.190 5.414 1.00 0.00 H new ATOM 0 HG3 ARG A 68 2.212 -22.896 4.109 1.00 0.00 H new ATOM 0 HD2 ARG A 68 4.109 -23.417 5.633 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.981 -23.702 6.944 1.00 0.00 H new ATOM 0 HE ARG A 68 2.399 -25.777 6.016 1.00 0.00 H new ATOM 0 HH11 ARG A 68 4.358 -23.875 3.780 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.631 -25.232 2.682 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.754 -27.517 4.603 1.00 0.00 H new ATOM 0 HH22 ARG A 68 3.727 -27.287 3.147 1.00 0.00 H new ATOM 1059 N LEU A 69 1.646 -18.336 6.195 1.00 0.00 N ATOM 1060 CA LEU A 69 1.633 -17.210 7.122 1.00 0.00 C ATOM 1061 C LEU A 69 0.238 -16.601 7.219 1.00 0.00 C ATOM 1062 O LEU A 69 -0.208 -16.214 8.300 1.00 0.00 O ATOM 1063 CB LEU A 69 2.637 -16.145 6.676 1.00 0.00 C ATOM 1064 CG LEU A 69 3.990 -16.662 6.185 1.00 0.00 C ATOM 1065 CD1 LEU A 69 4.877 -15.506 5.750 1.00 0.00 C ATOM 1066 CD2 LEU A 69 4.673 -17.483 7.269 1.00 0.00 C ATOM 0 H LEU A 69 2.250 -18.207 5.383 1.00 0.00 H new ATOM 0 HA LEU A 69 1.918 -17.579 8.107 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.183 -15.558 5.877 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.811 -15.466 7.511 1.00 0.00 H new ATOM 0 HG LEU A 69 3.820 -17.307 5.323 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.835 -15.893 5.404 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.392 -14.960 4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.040 -14.835 6.593 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.634 -17.843 6.902 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.831 -16.862 8.151 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.044 -18.333 7.532 1.00 0.00 H new ATOM 1078 N HIS A 70 -0.447 -16.520 6.083 1.00 0.00 N ATOM 1079 CA HIS A 70 -1.794 -15.960 6.041 1.00 0.00 C ATOM 1080 C HIS A 70 -2.835 -17.063 5.878 1.00 0.00 C ATOM 1081 O HIS A 70 -3.197 -17.450 4.767 1.00 0.00 O ATOM 1082 CB HIS A 70 -1.915 -14.956 4.895 1.00 0.00 C ATOM 1083 CG HIS A 70 -0.888 -13.867 4.941 1.00 0.00 C ATOM 1084 ND1 HIS A 70 -1.166 -12.588 5.377 1.00 0.00 N ATOM 1085 CD2 HIS A 70 0.424 -13.871 4.606 1.00 0.00 C ATOM 1086 CE1 HIS A 70 -0.070 -11.853 5.305 1.00 0.00 C ATOM 1087 NE2 HIS A 70 0.909 -12.608 4.841 1.00 0.00 N ATOM 0 H HIS A 70 -0.092 -16.835 5.180 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.978 -15.447 6.985 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -1.827 -15.487 3.947 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -2.909 -14.508 4.919 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.985 -14.712 4.225 1.00 0.00 H new ATOM 0 HE1 HIS A 70 0.011 -10.812 5.579 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.869 -12.303 4.683 1.00 0.00 H new ATOM 1096 N PRO A 71 -3.329 -17.583 7.012 1.00 0.00 N ATOM 1097 CA PRO A 71 -4.335 -18.649 7.022 1.00 0.00 C ATOM 1098 C PRO A 71 -5.697 -18.164 6.535 1.00 0.00 C ATOM 1099 O PRO A 71 -6.035 -16.990 6.674 1.00 0.00 O ATOM 1100 CB PRO A 71 -4.408 -19.055 8.496 1.00 0.00 C ATOM 1101 CG PRO A 71 -3.964 -17.846 9.244 1.00 0.00 C ATOM 1102 CD PRO A 71 -2.943 -17.170 8.372 1.00 0.00 C ATOM 0 HA PRO A 71 -4.068 -19.468 6.353 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -5.420 -19.345 8.777 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -3.763 -19.908 8.704 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -4.805 -17.182 9.447 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.534 -18.120 10.208 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.971 -16.086 8.486 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.930 -17.490 8.617 1.00 0.00 H new ATOM 1110 N GLY A 72 -6.476 -19.078 5.964 1.00 0.00 N ATOM 1111 CA GLY A 72 -7.793 -18.724 5.467 1.00 0.00 C ATOM 1112 C GLY A 72 -7.771 -18.323 4.005 1.00 0.00 C ATOM 1113 O GLY A 72 -8.802 -18.350 3.332 1.00 0.00 O ATOM 0 H GLY A 72 -6.219 -20.057 5.837 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.467 -19.570 5.599 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.193 -17.902 6.060 1.00 0.00 H new ATOM 1117 N CYS A 73 -6.595 -17.949 3.513 1.00 0.00 N ATOM 1118 CA CYS A 73 -6.444 -17.537 2.122 1.00 0.00 C ATOM 1119 C CYS A 73 -5.692 -18.595 1.321 1.00 0.00 C ATOM 1120 O CYS A 73 -5.254 -19.606 1.867 1.00 0.00 O ATOM 1121 CB CYS A 73 -5.708 -16.199 2.041 1.00 0.00 C ATOM 1122 SG CYS A 73 -6.669 -14.790 2.641 1.00 0.00 S ATOM 0 H CYS A 73 -5.732 -17.923 4.057 1.00 0.00 H new ATOM 0 HA CYS A 73 -7.439 -17.421 1.693 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -4.786 -16.268 2.618 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -5.423 -16.016 1.005 1.00 0.00 H new ATOM 0 HG CYS A 73 -7.827 -14.772 2.050 1.00 0.00 H new ATOM 1128 N GLY A 74 -5.548 -18.354 0.021 1.00 0.00 N ATOM 1129 CA GLY A 74 -4.850 -19.295 -0.835 1.00 0.00 C ATOM 1130 C GLY A 74 -4.113 -18.611 -1.969 1.00 0.00 C ATOM 1131 O GLY A 74 -3.875 -17.403 -1.944 1.00 0.00 O ATOM 0 H GLY A 74 -5.902 -17.524 -0.454 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -4.140 -19.867 -0.238 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -5.566 -20.006 -1.248 1.00 0.00 H new ATOM 1135 N PRO A 75 -3.736 -19.393 -2.991 1.00 0.00 N ATOM 1136 CA PRO A 75 -3.014 -18.877 -4.158 1.00 0.00 C ATOM 1137 C PRO A 75 -3.889 -17.986 -5.034 1.00 0.00 C ATOM 1138 O PRO A 75 -3.395 -17.077 -5.701 1.00 0.00 O ATOM 1139 CB PRO A 75 -2.613 -20.144 -4.917 1.00 0.00 C ATOM 1140 CG PRO A 75 -3.621 -21.164 -4.510 1.00 0.00 C ATOM 1141 CD PRO A 75 -3.985 -20.841 -3.087 1.00 0.00 C ATOM 0 HA PRO A 75 -2.169 -18.251 -3.870 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.627 -19.981 -5.995 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.603 -20.459 -4.656 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.498 -21.125 -5.156 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -3.211 -22.171 -4.589 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -5.026 -21.085 -2.873 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.374 -21.401 -2.379 1.00 0.00 H new ATOM 1149 N HIS A 76 -5.191 -18.253 -5.026 1.00 0.00 N ATOM 1150 CA HIS A 76 -6.136 -17.474 -5.820 1.00 0.00 C ATOM 1151 C HIS A 76 -6.720 -16.328 -4.998 1.00 0.00 C ATOM 1152 O HIS A 76 -7.708 -15.708 -5.393 1.00 0.00 O ATOM 1153 CB HIS A 76 -7.260 -18.371 -6.337 1.00 0.00 C ATOM 1154 CG HIS A 76 -7.600 -19.500 -5.413 1.00 0.00 C ATOM 1155 ND1 HIS A 76 -7.675 -19.355 -4.044 1.00 0.00 N ATOM 1156 CD2 HIS A 76 -7.888 -20.797 -5.669 1.00 0.00 C ATOM 1157 CE1 HIS A 76 -7.992 -20.515 -3.498 1.00 0.00 C ATOM 1158 NE2 HIS A 76 -8.127 -21.407 -4.462 1.00 0.00 N ATOM 0 H HIS A 76 -5.616 -19.002 -4.479 1.00 0.00 H new ATOM 0 HA HIS A 76 -5.599 -17.052 -6.669 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -8.151 -17.765 -6.500 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -6.971 -18.780 -7.305 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -7.923 -21.265 -6.642 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -8.119 -20.702 -2.442 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -8.369 -22.389 -4.332 1.00 0.00 H new ATOM 1167 N THR A 77 -6.103 -16.053 -3.853 1.00 0.00 N ATOM 1168 CA THR A 77 -6.562 -14.984 -2.976 1.00 0.00 C ATOM 1169 C THR A 77 -5.783 -13.697 -3.223 1.00 0.00 C ATOM 1170 O THR A 77 -4.569 -13.646 -3.025 1.00 0.00 O ATOM 1171 CB THR A 77 -6.426 -15.377 -1.493 1.00 0.00 C ATOM 1172 OG1 THR A 77 -7.244 -16.518 -1.211 1.00 0.00 O ATOM 1173 CG2 THR A 77 -6.828 -14.222 -0.588 1.00 0.00 C ATOM 0 H THR A 77 -5.284 -16.556 -3.512 1.00 0.00 H new ATOM 0 HA THR A 77 -7.615 -14.817 -3.205 1.00 0.00 H new ATOM 0 HB THR A 77 -5.382 -15.623 -1.300 1.00 0.00 H new ATOM 0 HG1 THR A 77 -7.540 -16.485 -0.277 1.00 0.00 H new ATOM 0 HG21 THR A 77 -6.724 -14.523 0.454 1.00 0.00 H new ATOM 0 HG22 THR A 77 -6.184 -13.365 -0.784 1.00 0.00 H new ATOM 0 HG23 THR A 77 -7.865 -13.949 -0.785 1.00 0.00 H new ATOM 1181 N THR A 78 -6.489 -12.656 -3.655 1.00 0.00 N ATOM 1182 CA THR A 78 -5.863 -11.369 -3.929 1.00 0.00 C ATOM 1183 C THR A 78 -5.385 -10.705 -2.643 1.00 0.00 C ATOM 1184 O THR A 78 -6.128 -10.614 -1.666 1.00 0.00 O ATOM 1185 CB THR A 78 -6.832 -10.417 -4.655 1.00 0.00 C ATOM 1186 OG1 THR A 78 -7.562 -11.132 -5.658 1.00 0.00 O ATOM 1187 CG2 THR A 78 -6.077 -9.263 -5.297 1.00 0.00 C ATOM 0 H THR A 78 -7.495 -12.680 -3.822 1.00 0.00 H new ATOM 0 HA THR A 78 -5.006 -11.565 -4.573 1.00 0.00 H new ATOM 0 HB THR A 78 -7.527 -10.012 -3.920 1.00 0.00 H new ATOM 0 HG1 THR A 78 -8.177 -10.520 -6.114 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.782 -8.604 -5.804 1.00 0.00 H new ATOM 0 HG22 THR A 78 -5.546 -8.703 -4.528 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.362 -9.654 -6.020 1.00 0.00 H new ATOM 1195 N PHE A 79 -4.139 -10.242 -2.649 1.00 0.00 N ATOM 1196 CA PHE A 79 -3.562 -9.586 -1.482 1.00 0.00 C ATOM 1197 C PHE A 79 -3.250 -8.123 -1.780 1.00 0.00 C ATOM 1198 O PHE A 79 -2.476 -7.813 -2.686 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.288 -10.311 -1.042 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.531 -11.717 -0.570 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -3.551 -11.994 0.326 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -1.740 -12.760 -1.024 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -3.776 -13.287 0.761 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -1.961 -14.054 -0.592 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.981 -14.318 0.301 1.00 0.00 C ATOM 0 H PHE A 79 -3.510 -10.309 -3.449 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.293 -9.626 -0.674 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -1.585 -10.332 -1.875 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.815 -9.744 -0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.177 -11.192 0.688 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.942 -12.560 -1.723 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.573 -13.491 1.460 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.337 -14.858 -0.952 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.156 -15.329 0.639 1.00 0.00 H new ATOM 1215 N ARG A 80 -3.858 -7.226 -1.010 1.00 0.00 N ATOM 1216 CA ARG A 80 -3.648 -5.795 -1.192 1.00 0.00 C ATOM 1217 C ARG A 80 -2.852 -5.211 -0.028 1.00 0.00 C ATOM 1218 O ARG A 80 -3.358 -5.097 1.088 1.00 0.00 O ATOM 1219 CB ARG A 80 -4.990 -5.072 -1.319 1.00 0.00 C ATOM 1220 CG ARG A 80 -4.898 -3.737 -2.039 1.00 0.00 C ATOM 1221 CD ARG A 80 -5.969 -2.770 -1.560 1.00 0.00 C ATOM 1222 NE ARG A 80 -6.209 -1.698 -2.523 1.00 0.00 N ATOM 1223 CZ ARG A 80 -6.897 -0.598 -2.241 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -7.409 -0.424 -1.031 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -7.073 0.333 -3.171 1.00 0.00 N ATOM 0 H ARG A 80 -4.500 -7.465 -0.254 1.00 0.00 H new ATOM 0 HA ARG A 80 -3.078 -5.651 -2.110 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -5.690 -5.715 -1.852 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -5.401 -4.910 -0.323 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -3.913 -3.301 -1.874 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -5.002 -3.894 -3.113 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -6.897 -3.314 -1.385 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -5.667 -2.339 -0.605 1.00 0.00 H new ATOM 0 HE ARG A 80 -5.827 -1.800 -3.463 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -7.275 -1.136 -0.313 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -7.937 0.422 -0.818 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -6.680 0.204 -4.103 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -7.602 1.178 -2.953 1.00 0.00 H new ATOM 1239 N TRP A 81 -1.605 -4.842 -0.298 1.00 0.00 N ATOM 1240 CA TRP A 81 -0.739 -4.270 0.727 1.00 0.00 C ATOM 1241 C TRP A 81 -0.697 -2.750 0.618 1.00 0.00 C ATOM 1242 O TRP A 81 -0.010 -2.200 -0.242 1.00 0.00 O ATOM 1243 CB TRP A 81 0.675 -4.841 0.605 1.00 0.00 C ATOM 1244 CG TRP A 81 1.537 -4.550 1.796 1.00 0.00 C ATOM 1245 CD1 TRP A 81 1.145 -4.515 3.104 1.00 0.00 C ATOM 1246 CD2 TRP A 81 2.938 -4.252 1.788 1.00 0.00 C ATOM 1247 NE1 TRP A 81 2.216 -4.213 3.909 1.00 0.00 N ATOM 1248 CE2 TRP A 81 3.328 -4.047 3.126 1.00 0.00 C ATOM 1249 CE3 TRP A 81 3.900 -4.139 0.781 1.00 0.00 C ATOM 1250 CZ2 TRP A 81 4.638 -3.736 3.479 1.00 0.00 C ATOM 1251 CZ3 TRP A 81 5.200 -3.830 1.133 1.00 0.00 C ATOM 1252 CH2 TRP A 81 5.560 -3.632 2.473 1.00 0.00 C ATOM 0 H TRP A 81 -1.171 -4.928 -1.217 1.00 0.00 H new ATOM 0 HA TRP A 81 -1.148 -4.535 1.702 1.00 0.00 H new ATOM 0 HB2 TRP A 81 0.613 -5.920 0.465 1.00 0.00 H new ATOM 0 HB3 TRP A 81 1.149 -4.431 -0.287 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.140 -4.698 3.454 1.00 0.00 H new ATOM 0 HE1 TRP A 81 2.188 -4.126 4.925 1.00 0.00 H new ATOM 0 HE3 TRP A 81 3.632 -4.290 -0.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 4.917 -3.582 4.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 5.951 -3.740 0.363 1.00 0.00 H new ATOM 0 HH2 TRP A 81 6.585 -3.393 2.716 1.00 0.00 H new ATOM 1263 N GLN A 82 -1.436 -2.078 1.494 1.00 0.00 N ATOM 1264 CA GLN A 82 -1.483 -0.620 1.495 1.00 0.00 C ATOM 1265 C GLN A 82 -0.525 -0.045 2.533 1.00 0.00 C ATOM 1266 O GLN A 82 -0.611 -0.367 3.718 1.00 0.00 O ATOM 1267 CB GLN A 82 -2.906 -0.135 1.773 1.00 0.00 C ATOM 1268 CG GLN A 82 -3.105 1.349 1.510 1.00 0.00 C ATOM 1269 CD GLN A 82 -4.536 1.796 1.738 1.00 0.00 C ATOM 1270 OE1 GLN A 82 -4.997 1.884 2.876 1.00 0.00 O ATOM 1271 NE2 GLN A 82 -5.248 2.080 0.653 1.00 0.00 N ATOM 0 H GLN A 82 -2.010 -2.519 2.212 1.00 0.00 H new ATOM 0 HA GLN A 82 -1.174 -0.271 0.510 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -3.602 -0.702 1.154 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.157 -0.348 2.812 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -2.442 1.921 2.159 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -2.818 1.574 0.483 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -4.826 1.993 -0.271 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.217 2.385 0.744 1.00 0.00 H new ATOM 1280 N VAL A 83 0.389 0.807 2.081 1.00 0.00 N ATOM 1281 CA VAL A 83 1.363 1.428 2.970 1.00 0.00 C ATOM 1282 C VAL A 83 1.128 2.930 3.080 1.00 0.00 C ATOM 1283 O VAL A 83 1.012 3.627 2.071 1.00 0.00 O ATOM 1284 CB VAL A 83 2.804 1.178 2.487 1.00 0.00 C ATOM 1285 CG1 VAL A 83 3.803 1.857 3.412 1.00 0.00 C ATOM 1286 CG2 VAL A 83 3.082 -0.314 2.391 1.00 0.00 C ATOM 0 H VAL A 83 0.475 1.083 1.103 1.00 0.00 H new ATOM 0 HA VAL A 83 1.233 0.971 3.951 1.00 0.00 H new ATOM 0 HB VAL A 83 2.915 1.610 1.492 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.816 1.669 3.055 1.00 0.00 H new ATOM 0 HG12 VAL A 83 3.616 2.931 3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.694 1.458 4.421 1.00 0.00 H new ATOM 0 HG21 VAL A 83 4.105 -0.472 2.048 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.953 -0.772 3.372 1.00 0.00 H new ATOM 0 HG23 VAL A 83 2.388 -0.769 1.684 1.00 0.00 H new ATOM 1296 N LYS A 84 1.059 3.425 4.311 1.00 0.00 N ATOM 1297 CA LYS A 84 0.840 4.846 4.554 1.00 0.00 C ATOM 1298 C LYS A 84 2.166 5.577 4.736 1.00 0.00 C ATOM 1299 O LYS A 84 2.884 5.351 5.711 1.00 0.00 O ATOM 1300 CB LYS A 84 -0.037 5.043 5.793 1.00 0.00 C ATOM 1301 CG LYS A 84 -0.859 6.320 5.759 1.00 0.00 C ATOM 1302 CD LYS A 84 -1.887 6.351 6.877 1.00 0.00 C ATOM 1303 CE LYS A 84 -2.535 7.721 7.001 1.00 0.00 C ATOM 1304 NZ LYS A 84 -1.634 8.702 7.669 1.00 0.00 N ATOM 0 H LYS A 84 1.152 2.862 5.157 1.00 0.00 H new ATOM 0 HA LYS A 84 0.331 5.264 3.685 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.709 4.191 5.891 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.597 5.053 6.679 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.198 7.182 5.848 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -1.364 6.403 4.797 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.654 5.600 6.688 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -1.408 6.087 7.820 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.801 8.088 6.010 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -3.462 7.634 7.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.141 9.599 7.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.333 8.325 8.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -0.798 8.868 7.073 1.00 0.00 H new ATOM 1318 N LEU A 85 2.486 6.456 3.792 1.00 0.00 N ATOM 1319 CA LEU A 85 3.726 7.223 3.849 1.00 0.00 C ATOM 1320 C LEU A 85 3.516 8.543 4.583 1.00 0.00 C ATOM 1321 O LEU A 85 2.638 9.330 4.227 1.00 0.00 O ATOM 1322 CB LEU A 85 4.249 7.488 2.436 1.00 0.00 C ATOM 1323 CG LEU A 85 4.233 6.296 1.479 1.00 0.00 C ATOM 1324 CD1 LEU A 85 4.278 6.770 0.035 1.00 0.00 C ATOM 1325 CD2 LEU A 85 5.398 5.361 1.772 1.00 0.00 C ATOM 0 H LEU A 85 1.904 6.655 2.978 1.00 0.00 H new ATOM 0 HA LEU A 85 4.463 6.637 4.398 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.656 8.290 1.995 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.273 7.853 2.512 1.00 0.00 H new ATOM 0 HG LEU A 85 3.304 5.746 1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 85 4.266 5.908 -0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.411 7.398 -0.169 1.00 0.00 H new ATOM 0 HD13 LEU A 85 5.189 7.344 -0.131 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.371 4.518 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.337 5.900 1.649 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.321 4.994 2.795 1.00 0.00 H new ATOM 1337 N ARG A 86 4.330 8.781 5.606 1.00 0.00 N ATOM 1338 CA ARG A 86 4.234 10.007 6.390 1.00 0.00 C ATOM 1339 C ARG A 86 4.234 11.233 5.482 1.00 0.00 C ATOM 1340 O ARG A 86 3.319 12.055 5.533 1.00 0.00 O ATOM 1341 CB ARG A 86 5.394 10.095 7.383 1.00 0.00 C ATOM 1342 CG ARG A 86 5.240 9.175 8.583 1.00 0.00 C ATOM 1343 CD ARG A 86 4.421 9.829 9.684 1.00 0.00 C ATOM 1344 NE ARG A 86 5.236 10.694 10.533 1.00 0.00 N ATOM 1345 CZ ARG A 86 4.731 11.521 11.441 1.00 0.00 C ATOM 1346 NH1 ARG A 86 3.419 11.595 11.618 1.00 0.00 N ATOM 1347 NH2 ARG A 86 5.538 12.276 12.175 1.00 0.00 N ATOM 0 H ARG A 86 5.063 8.141 5.912 1.00 0.00 H new ATOM 0 HA ARG A 86 3.294 9.984 6.941 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.323 9.852 6.866 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.484 11.123 7.733 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.759 8.247 8.272 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.224 8.910 8.969 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.616 10.413 9.238 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.954 9.057 10.296 1.00 0.00 H new ATOM 0 HE ARG A 86 6.249 10.661 10.422 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.795 11.016 11.056 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.034 12.231 12.316 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.548 12.222 12.042 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.149 12.911 12.872 1.00 0.00 H new ATOM 1361 N ASN A 87 5.266 11.349 4.652 1.00 0.00 N ATOM 1362 CA ASN A 87 5.385 12.476 3.734 1.00 0.00 C ATOM 1363 C ASN A 87 4.839 12.114 2.356 1.00 0.00 C ATOM 1364 O ASN A 87 4.356 11.002 2.139 1.00 0.00 O ATOM 1365 CB ASN A 87 6.846 12.914 3.617 1.00 0.00 C ATOM 1366 CG ASN A 87 6.985 14.340 3.121 1.00 0.00 C ATOM 1367 OD1 ASN A 87 6.099 15.169 3.326 1.00 0.00 O ATOM 1368 ND2 ASN A 87 8.101 14.631 2.463 1.00 0.00 N ATOM 0 H ASN A 87 6.031 10.677 4.596 1.00 0.00 H new ATOM 0 HA ASN A 87 4.797 13.302 4.134 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.329 12.822 4.590 1.00 0.00 H new ATOM 0 HB3 ASN A 87 7.370 12.243 2.936 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.250 15.574 2.104 1.00 0.00 H new ATOM 0 HD22 ASN A 87 8.809 13.911 2.316 1.00 0.00 H new ATOM 1375 N LEU A 88 4.921 13.060 1.426 1.00 0.00 N ATOM 1376 CA LEU A 88 4.436 12.842 0.068 1.00 0.00 C ATOM 1377 C LEU A 88 5.517 12.207 -0.801 1.00 0.00 C ATOM 1378 O LEU A 88 6.690 12.175 -0.425 1.00 0.00 O ATOM 1379 CB LEU A 88 3.980 14.165 -0.551 1.00 0.00 C ATOM 1380 CG LEU A 88 2.591 14.654 -0.140 1.00 0.00 C ATOM 1381 CD1 LEU A 88 2.318 16.033 -0.720 1.00 0.00 C ATOM 1382 CD2 LEU A 88 1.524 13.665 -0.586 1.00 0.00 C ATOM 0 H LEU A 88 5.319 13.985 1.588 1.00 0.00 H new ATOM 0 HA LEU A 88 3.588 12.160 0.117 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.706 14.935 -0.290 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.001 14.062 -1.636 1.00 0.00 H new ATOM 0 HG LEU A 88 2.559 14.727 0.947 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.325 16.365 -0.417 1.00 0.00 H new ATOM 0 HD12 LEU A 88 3.064 16.737 -0.351 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.369 15.987 -1.808 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.542 14.029 -0.285 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.556 13.560 -1.670 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.709 12.696 -0.122 1.00 0.00 H new ATOM 1394 N ILE A 89 5.116 11.705 -1.963 1.00 0.00 N ATOM 1395 CA ILE A 89 6.051 11.074 -2.886 1.00 0.00 C ATOM 1396 C ILE A 89 5.666 11.353 -4.335 1.00 0.00 C ATOM 1397 O ILE A 89 4.709 12.078 -4.604 1.00 0.00 O ATOM 1398 CB ILE A 89 6.117 9.551 -2.668 1.00 0.00 C ATOM 1399 CG1 ILE A 89 4.722 8.935 -2.798 1.00 0.00 C ATOM 1400 CG2 ILE A 89 6.717 9.236 -1.306 1.00 0.00 C ATOM 1401 CD1 ILE A 89 4.736 7.508 -3.300 1.00 0.00 C ATOM 0 H ILE A 89 4.149 11.723 -2.288 1.00 0.00 H new ATOM 0 HA ILE A 89 7.032 11.504 -2.684 1.00 0.00 H new ATOM 0 HB ILE A 89 6.759 9.116 -3.434 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.228 8.965 -1.827 1.00 0.00 H new ATOM 0 HG13 ILE A 89 4.126 9.545 -3.477 1.00 0.00 H new ATOM 0 HG21 ILE A 89 6.757 8.156 -1.167 1.00 0.00 H new ATOM 0 HG22 ILE A 89 7.725 9.647 -1.249 1.00 0.00 H new ATOM 0 HG23 ILE A 89 6.100 9.680 -0.525 1.00 0.00 H new ATOM 0 HD11 ILE A 89 3.714 7.136 -3.367 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.200 7.474 -4.286 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.304 6.885 -2.609 1.00 0.00 H new ATOM 1413 N GLU A 90 6.418 10.771 -5.264 1.00 0.00 N ATOM 1414 CA GLU A 90 6.154 10.957 -6.686 1.00 0.00 C ATOM 1415 C GLU A 90 5.900 9.617 -7.372 1.00 0.00 C ATOM 1416 O GLU A 90 6.822 8.941 -7.829 1.00 0.00 O ATOM 1417 CB GLU A 90 7.330 11.670 -7.357 1.00 0.00 C ATOM 1418 CG GLU A 90 7.217 13.185 -7.331 1.00 0.00 C ATOM 1419 CD GLU A 90 8.569 13.871 -7.298 1.00 0.00 C ATOM 1420 OE1 GLU A 90 9.494 13.393 -7.986 1.00 0.00 O ATOM 1421 OE2 GLU A 90 8.701 14.886 -6.583 1.00 0.00 O ATOM 0 H GLU A 90 7.214 10.167 -5.058 1.00 0.00 H new ATOM 0 HA GLU A 90 5.260 11.573 -6.786 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.254 11.374 -6.861 1.00 0.00 H new ATOM 0 HB3 GLU A 90 7.403 11.337 -8.392 1.00 0.00 H new ATOM 0 HG2 GLU A 90 6.666 13.519 -8.210 1.00 0.00 H new ATOM 0 HG3 GLU A 90 6.639 13.487 -6.458 1.00 0.00 H new ATOM 1428 N PRO A 91 4.620 9.224 -7.445 1.00 0.00 N ATOM 1429 CA PRO A 91 4.214 7.963 -8.073 1.00 0.00 C ATOM 1430 C PRO A 91 4.397 7.984 -9.587 1.00 0.00 C ATOM 1431 O PRO A 91 4.566 6.939 -10.214 1.00 0.00 O ATOM 1432 CB PRO A 91 2.730 7.850 -7.715 1.00 0.00 C ATOM 1433 CG PRO A 91 2.285 9.255 -7.497 1.00 0.00 C ATOM 1434 CD PRO A 91 3.470 9.980 -6.922 1.00 0.00 C ATOM 0 HA PRO A 91 4.815 7.123 -7.726 1.00 0.00 H new ATOM 0 HB2 PRO A 91 2.164 7.375 -8.517 1.00 0.00 H new ATOM 0 HB3 PRO A 91 2.584 7.245 -6.820 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.964 9.712 -8.433 1.00 0.00 H new ATOM 0 HG3 PRO A 91 1.435 9.294 -6.815 1.00 0.00 H new ATOM 0 HD2 PRO A 91 3.496 11.022 -7.240 1.00 0.00 H new ATOM 0 HD3 PRO A 91 3.451 9.980 -5.832 1.00 0.00 H new ATOM 1442 N GLU A 92 4.362 9.180 -10.166 1.00 0.00 N ATOM 1443 CA GLU A 92 4.523 9.334 -11.607 1.00 0.00 C ATOM 1444 C GLU A 92 5.885 8.816 -12.061 1.00 0.00 C ATOM 1445 O GLU A 92 6.097 8.553 -13.244 1.00 0.00 O ATOM 1446 CB GLU A 92 4.366 10.804 -12.005 1.00 0.00 C ATOM 1447 CG GLU A 92 2.921 11.225 -12.216 1.00 0.00 C ATOM 1448 CD GLU A 92 2.796 12.461 -13.086 1.00 0.00 C ATOM 1449 OE1 GLU A 92 2.998 13.578 -12.564 1.00 0.00 O ATOM 1450 OE2 GLU A 92 2.495 12.311 -14.289 1.00 0.00 O ATOM 0 H GLU A 92 4.224 10.055 -9.660 1.00 0.00 H new ATOM 0 HA GLU A 92 3.748 8.746 -12.099 1.00 0.00 H new ATOM 0 HB2 GLU A 92 4.809 11.431 -11.231 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.926 10.986 -12.922 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.370 10.404 -12.676 1.00 0.00 H new ATOM 0 HG3 GLU A 92 2.457 11.417 -11.249 1.00 0.00 H new ATOM 1457 N GLN A 93 6.804 8.674 -11.111 1.00 0.00 N ATOM 1458 CA GLN A 93 8.145 8.189 -11.413 1.00 0.00 C ATOM 1459 C GLN A 93 8.385 6.822 -10.781 1.00 0.00 C ATOM 1460 O GLN A 93 9.269 6.077 -11.206 1.00 0.00 O ATOM 1461 CB GLN A 93 9.194 9.185 -10.916 1.00 0.00 C ATOM 1462 CG GLN A 93 8.856 10.633 -11.232 1.00 0.00 C ATOM 1463 CD GLN A 93 10.090 11.498 -11.396 1.00 0.00 C ATOM 1464 OE1 GLN A 93 10.989 11.175 -12.173 1.00 0.00 O ATOM 1465 NE2 GLN A 93 10.140 12.604 -10.663 1.00 0.00 N ATOM 0 H GLN A 93 6.644 8.888 -10.127 1.00 0.00 H new ATOM 0 HA GLN A 93 8.233 8.089 -12.495 1.00 0.00 H new ATOM 0 HB2 GLN A 93 9.306 9.074 -9.838 1.00 0.00 H new ATOM 0 HB3 GLN A 93 10.157 8.939 -11.364 1.00 0.00 H new ATOM 0 HG2 GLN A 93 8.265 10.673 -12.147 1.00 0.00 H new ATOM 0 HG3 GLN A 93 8.235 11.040 -10.434 1.00 0.00 H new ATOM 0 HE21 GLN A 93 9.372 12.833 -10.032 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.946 13.225 -10.731 1.00 0.00 H new ATOM 1474 N CYS A 94 7.593 6.498 -9.764 1.00 0.00 N ATOM 1475 CA CYS A 94 7.720 5.221 -9.073 1.00 0.00 C ATOM 1476 C CYS A 94 7.662 4.060 -10.060 1.00 0.00 C ATOM 1477 O CYS A 94 7.081 4.176 -11.139 1.00 0.00 O ATOM 1478 CB CYS A 94 6.615 5.072 -8.026 1.00 0.00 C ATOM 1479 SG CYS A 94 6.857 6.084 -6.547 1.00 0.00 S ATOM 0 H CYS A 94 6.856 7.103 -9.400 1.00 0.00 H new ATOM 0 HA CYS A 94 8.689 5.201 -8.574 1.00 0.00 H new ATOM 0 HB2 CYS A 94 5.660 5.336 -8.481 1.00 0.00 H new ATOM 0 HB3 CYS A 94 6.549 4.025 -7.730 1.00 0.00 H new ATOM 0 HG CYS A 94 6.874 7.341 -6.879 1.00 0.00 H new ATOM 1485 N THR A 95 8.270 2.939 -9.684 1.00 0.00 N ATOM 1486 CA THR A 95 8.290 1.757 -10.536 1.00 0.00 C ATOM 1487 C THR A 95 8.161 0.481 -9.712 1.00 0.00 C ATOM 1488 O THR A 95 8.682 0.394 -8.600 1.00 0.00 O ATOM 1489 CB THR A 95 9.584 1.687 -11.369 1.00 0.00 C ATOM 1490 OG1 THR A 95 10.723 1.656 -10.503 1.00 0.00 O ATOM 1491 CG2 THR A 95 9.687 2.880 -12.308 1.00 0.00 C ATOM 0 H THR A 95 8.755 2.825 -8.794 1.00 0.00 H new ATOM 0 HA THR A 95 7.436 1.839 -11.209 1.00 0.00 H new ATOM 0 HB THR A 95 9.557 0.775 -11.966 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.541 1.610 -11.040 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.608 2.810 -12.886 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.833 2.885 -12.985 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.693 3.802 -11.726 1.00 0.00 H new ATOM 1499 N PHE A 96 7.464 -0.506 -10.263 1.00 0.00 N ATOM 1500 CA PHE A 96 7.266 -1.778 -9.578 1.00 0.00 C ATOM 1501 C PHE A 96 7.574 -2.950 -10.506 1.00 0.00 C ATOM 1502 O PHE A 96 7.005 -3.060 -11.593 1.00 0.00 O ATOM 1503 CB PHE A 96 5.830 -1.886 -9.061 1.00 0.00 C ATOM 1504 CG PHE A 96 4.864 -2.415 -10.082 1.00 0.00 C ATOM 1505 CD1 PHE A 96 4.711 -3.779 -10.269 1.00 0.00 C ATOM 1506 CD2 PHE A 96 4.108 -1.548 -10.855 1.00 0.00 C ATOM 1507 CE1 PHE A 96 3.823 -4.270 -11.207 1.00 0.00 C ATOM 1508 CE2 PHE A 96 3.218 -2.033 -11.794 1.00 0.00 C ATOM 1509 CZ PHE A 96 3.076 -3.395 -11.971 1.00 0.00 C ATOM 0 H PHE A 96 7.026 -0.450 -11.183 1.00 0.00 H new ATOM 0 HA PHE A 96 7.953 -1.817 -8.732 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.815 -2.537 -8.187 1.00 0.00 H new ATOM 0 HB3 PHE A 96 5.496 -0.902 -8.732 1.00 0.00 H new ATOM 0 HD1 PHE A 96 5.293 -4.467 -9.674 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.216 -0.482 -10.722 1.00 0.00 H new ATOM 0 HE1 PHE A 96 3.713 -5.336 -11.342 1.00 0.00 H new ATOM 0 HE2 PHE A 96 2.634 -1.347 -12.389 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.382 -3.775 -12.706 1.00 0.00 H new ATOM 1519 N CYS A 97 8.476 -3.821 -10.070 1.00 0.00 N ATOM 1520 CA CYS A 97 8.861 -4.984 -10.861 1.00 0.00 C ATOM 1521 C CYS A 97 9.283 -6.140 -9.960 1.00 0.00 C ATOM 1522 O CYS A 97 10.091 -5.966 -9.046 1.00 0.00 O ATOM 1523 CB CYS A 97 10.001 -4.623 -11.815 1.00 0.00 C ATOM 1524 SG CYS A 97 10.156 -5.734 -13.234 1.00 0.00 S ATOM 0 H CYS A 97 8.955 -3.744 -9.173 1.00 0.00 H new ATOM 0 HA CYS A 97 7.995 -5.299 -11.443 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.849 -3.607 -12.178 1.00 0.00 H new ATOM 0 HB3 CYS A 97 10.939 -4.626 -11.260 1.00 0.00 H new ATOM 0 HG CYS A 97 11.145 -5.346 -13.983 1.00 0.00 H new ATOM 1530 N PHE A 98 8.731 -7.320 -10.221 1.00 0.00 N ATOM 1531 CA PHE A 98 9.048 -8.504 -9.432 1.00 0.00 C ATOM 1532 C PHE A 98 10.460 -8.998 -9.735 1.00 0.00 C ATOM 1533 O PHE A 98 11.019 -8.707 -10.793 1.00 0.00 O ATOM 1534 CB PHE A 98 8.036 -9.616 -9.713 1.00 0.00 C ATOM 1535 CG PHE A 98 6.607 -9.161 -9.630 1.00 0.00 C ATOM 1536 CD1 PHE A 98 6.006 -8.521 -10.701 1.00 0.00 C ATOM 1537 CD2 PHE A 98 5.864 -9.373 -8.479 1.00 0.00 C ATOM 1538 CE1 PHE A 98 4.691 -8.101 -10.628 1.00 0.00 C ATOM 1539 CE2 PHE A 98 4.549 -8.956 -8.400 1.00 0.00 C ATOM 1540 CZ PHE A 98 3.962 -8.318 -9.475 1.00 0.00 C ATOM 0 H PHE A 98 8.062 -7.482 -10.973 1.00 0.00 H new ATOM 0 HA PHE A 98 8.995 -8.232 -8.378 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.222 -10.023 -10.707 1.00 0.00 H new ATOM 0 HB3 PHE A 98 8.193 -10.427 -9.002 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.572 -8.348 -11.605 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.318 -9.870 -7.634 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.234 -7.604 -11.471 1.00 0.00 H new ATOM 0 HE2 PHE A 98 3.981 -9.129 -7.498 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.935 -7.989 -9.414 1.00 0.00 H new ATOM 1550 N THR A 99 11.032 -9.747 -8.797 1.00 0.00 N ATOM 1551 CA THR A 99 12.379 -10.280 -8.962 1.00 0.00 C ATOM 1552 C THR A 99 12.402 -11.790 -8.750 1.00 0.00 C ATOM 1553 O THR A 99 11.355 -12.431 -8.668 1.00 0.00 O ATOM 1554 CB THR A 99 13.367 -9.621 -7.982 1.00 0.00 C ATOM 1555 OG1 THR A 99 13.531 -10.444 -6.822 1.00 0.00 O ATOM 1556 CG2 THR A 99 12.878 -8.242 -7.566 1.00 0.00 C ATOM 0 H THR A 99 10.584 -9.998 -7.916 1.00 0.00 H new ATOM 0 HA THR A 99 12.686 -10.054 -9.983 1.00 0.00 H new ATOM 0 HB THR A 99 14.326 -9.512 -8.488 1.00 0.00 H new ATOM 0 HG1 THR A 99 14.471 -10.706 -6.737 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.592 -7.796 -6.874 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.783 -7.608 -8.448 1.00 0.00 H new ATOM 0 HG23 THR A 99 11.908 -8.332 -7.078 1.00 0.00 H new ATOM 1564 N ALA A 100 13.603 -12.352 -8.662 1.00 0.00 N ATOM 1565 CA ALA A 100 13.762 -13.786 -8.457 1.00 0.00 C ATOM 1566 C ALA A 100 12.779 -14.304 -7.413 1.00 0.00 C ATOM 1567 O ALA A 100 11.761 -14.909 -7.751 1.00 0.00 O ATOM 1568 CB ALA A 100 15.191 -14.105 -8.043 1.00 0.00 C ATOM 0 H ALA A 100 14.480 -11.836 -8.730 1.00 0.00 H new ATOM 0 HA ALA A 100 13.548 -14.288 -9.400 1.00 0.00 H new ATOM 0 HB1 ALA A 100 15.295 -15.180 -7.893 1.00 0.00 H new ATOM 0 HB2 ALA A 100 15.878 -13.779 -8.824 1.00 0.00 H new ATOM 0 HB3 ALA A 100 15.425 -13.585 -7.114 1.00 0.00 H new ATOM 1574 N SER A 101 13.090 -14.063 -6.143 1.00 0.00 N ATOM 1575 CA SER A 101 12.235 -14.509 -5.049 1.00 0.00 C ATOM 1576 C SER A 101 11.774 -13.326 -4.203 1.00 0.00 C ATOM 1577 O SER A 101 11.393 -13.489 -3.044 1.00 0.00 O ATOM 1578 CB SER A 101 12.979 -15.518 -4.172 1.00 0.00 C ATOM 1579 OG SER A 101 14.027 -14.893 -3.452 1.00 0.00 O ATOM 0 H SER A 101 13.927 -13.562 -5.847 1.00 0.00 H new ATOM 0 HA SER A 101 11.357 -14.990 -5.479 1.00 0.00 H new ATOM 0 HB2 SER A 101 12.281 -15.983 -3.475 1.00 0.00 H new ATOM 0 HB3 SER A 101 13.386 -16.315 -4.794 1.00 0.00 H new ATOM 0 HG SER A 101 14.486 -15.559 -2.898 1.00 0.00 H new ATOM 1585 N ARG A 102 11.811 -12.135 -4.792 1.00 0.00 N ATOM 1586 CA ARG A 102 11.398 -10.924 -4.093 1.00 0.00 C ATOM 1587 C ARG A 102 10.847 -9.892 -5.073 1.00 0.00 C ATOM 1588 O ARG A 102 10.987 -10.038 -6.288 1.00 0.00 O ATOM 1589 CB ARG A 102 12.576 -10.330 -3.319 1.00 0.00 C ATOM 1590 CG ARG A 102 13.512 -9.495 -4.179 1.00 0.00 C ATOM 1591 CD ARG A 102 14.332 -8.532 -3.336 1.00 0.00 C ATOM 1592 NE ARG A 102 15.260 -7.748 -4.147 1.00 0.00 N ATOM 1593 CZ ARG A 102 14.897 -6.691 -4.864 1.00 0.00 C ATOM 1594 NH1 ARG A 102 13.632 -6.292 -4.870 1.00 0.00 N ATOM 1595 NH2 ARG A 102 15.799 -6.029 -5.577 1.00 0.00 N ATOM 0 H ARG A 102 12.123 -11.983 -5.751 1.00 0.00 H new ATOM 0 HA ARG A 102 10.608 -11.191 -3.391 1.00 0.00 H new ATOM 0 HB2 ARG A 102 12.192 -9.711 -2.508 1.00 0.00 H new ATOM 0 HB3 ARG A 102 13.143 -11.140 -2.860 1.00 0.00 H new ATOM 0 HG2 ARG A 102 14.180 -10.152 -4.736 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.932 -8.935 -4.912 1.00 0.00 H new ATOM 0 HD2 ARG A 102 13.663 -7.860 -2.799 1.00 0.00 H new ATOM 0 HD3 ARG A 102 14.890 -9.092 -2.586 1.00 0.00 H new ATOM 0 HE ARG A 102 16.241 -8.028 -4.163 1.00 0.00 H new ATOM 0 HH11 ARG A 102 12.935 -6.797 -4.323 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.356 -5.480 -5.422 1.00 0.00 H new ATOM 0 HH21 ARG A 102 16.773 -6.332 -5.575 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.518 -5.217 -6.127 1.00 0.00 H new ATOM 1609 N ILE A 103 10.221 -8.850 -4.537 1.00 0.00 N ATOM 1610 CA ILE A 103 9.649 -7.795 -5.364 1.00 0.00 C ATOM 1611 C ILE A 103 10.415 -6.487 -5.192 1.00 0.00 C ATOM 1612 O ILE A 103 10.797 -6.120 -4.080 1.00 0.00 O ATOM 1613 CB ILE A 103 8.166 -7.556 -5.026 1.00 0.00 C ATOM 1614 CG1 ILE A 103 7.432 -8.890 -4.880 1.00 0.00 C ATOM 1615 CG2 ILE A 103 7.510 -6.699 -6.099 1.00 0.00 C ATOM 1616 CD1 ILE A 103 6.139 -8.787 -4.102 1.00 0.00 C ATOM 0 H ILE A 103 10.097 -8.714 -3.534 1.00 0.00 H new ATOM 0 HA ILE A 103 9.728 -8.127 -6.399 1.00 0.00 H new ATOM 0 HB ILE A 103 8.106 -7.024 -4.076 1.00 0.00 H new ATOM 0 HG12 ILE A 103 7.219 -9.288 -5.872 1.00 0.00 H new ATOM 0 HG13 ILE A 103 8.089 -9.604 -4.384 1.00 0.00 H new ATOM 0 HG21 ILE A 103 6.462 -6.539 -5.846 1.00 0.00 H new ATOM 0 HG22 ILE A 103 8.020 -5.738 -6.159 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.578 -7.206 -7.061 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.673 -9.770 -4.038 1.00 0.00 H new ATOM 0 HD12 ILE A 103 6.347 -8.418 -3.098 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.463 -8.098 -4.609 1.00 0.00 H new ATOM 1628 N ASP A 104 10.635 -5.787 -6.299 1.00 0.00 N ATOM 1629 CA ASP A 104 11.353 -4.518 -6.272 1.00 0.00 C ATOM 1630 C ASP A 104 10.404 -3.351 -6.529 1.00 0.00 C ATOM 1631 O ASP A 104 9.595 -3.390 -7.457 1.00 0.00 O ATOM 1632 CB ASP A 104 12.473 -4.519 -7.313 1.00 0.00 C ATOM 1633 CG ASP A 104 13.479 -3.408 -7.082 1.00 0.00 C ATOM 1634 OD1 ASP A 104 14.312 -3.544 -6.162 1.00 0.00 O ATOM 1635 OD2 ASP A 104 13.432 -2.402 -7.821 1.00 0.00 O ATOM 0 H ASP A 104 10.326 -6.077 -7.227 1.00 0.00 H new ATOM 0 HA ASP A 104 11.789 -4.397 -5.280 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.986 -5.480 -7.290 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.041 -4.413 -8.308 1.00 0.00 H new ATOM 1640 N ILE A 105 10.508 -2.317 -5.702 1.00 0.00 N ATOM 1641 CA ILE A 105 9.660 -1.140 -5.840 1.00 0.00 C ATOM 1642 C ILE A 105 10.451 0.140 -5.594 1.00 0.00 C ATOM 1643 O ILE A 105 10.910 0.394 -4.480 1.00 0.00 O ATOM 1644 CB ILE A 105 8.467 -1.188 -4.867 1.00 0.00 C ATOM 1645 CG1 ILE A 105 7.594 -2.411 -5.156 1.00 0.00 C ATOM 1646 CG2 ILE A 105 7.649 0.090 -4.968 1.00 0.00 C ATOM 1647 CD1 ILE A 105 6.829 -2.907 -3.949 1.00 0.00 C ATOM 0 H ILE A 105 11.172 -2.270 -4.929 1.00 0.00 H new ATOM 0 HA ILE A 105 9.284 -1.141 -6.863 1.00 0.00 H new ATOM 0 HB ILE A 105 8.850 -1.271 -3.850 1.00 0.00 H new ATOM 0 HG12 ILE A 105 6.887 -2.163 -5.948 1.00 0.00 H new ATOM 0 HG13 ILE A 105 8.225 -3.216 -5.532 1.00 0.00 H new ATOM 0 HG21 ILE A 105 6.810 0.041 -4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 105 8.277 0.945 -4.717 1.00 0.00 H new ATOM 0 HG23 ILE A 105 7.273 0.202 -5.985 1.00 0.00 H new ATOM 0 HD11 ILE A 105 6.232 -3.775 -4.228 1.00 0.00 H new ATOM 0 HD12 ILE A 105 7.531 -3.186 -3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.172 -2.117 -3.585 1.00 0.00 H new ATOM 1659 N CYS A 106 10.604 0.944 -6.640 1.00 0.00 N ATOM 1660 CA CYS A 106 11.339 2.200 -6.538 1.00 0.00 C ATOM 1661 C CYS A 106 10.399 3.355 -6.208 1.00 0.00 C ATOM 1662 O CYS A 106 9.509 3.688 -6.992 1.00 0.00 O ATOM 1663 CB CYS A 106 12.083 2.488 -7.843 1.00 0.00 C ATOM 1664 SG CYS A 106 13.528 3.556 -7.649 1.00 0.00 S ATOM 0 H CYS A 106 10.229 0.749 -7.568 1.00 0.00 H new ATOM 0 HA CYS A 106 12.064 2.103 -5.730 1.00 0.00 H new ATOM 0 HB2 CYS A 106 12.400 1.543 -8.284 1.00 0.00 H new ATOM 0 HB3 CYS A 106 11.393 2.953 -8.547 1.00 0.00 H new ATOM 0 HG CYS A 106 14.091 3.739 -8.806 1.00 0.00 H new ATOM 1670 N LEU A 107 10.602 3.962 -5.044 1.00 0.00 N ATOM 1671 CA LEU A 107 9.771 5.080 -4.610 1.00 0.00 C ATOM 1672 C LEU A 107 10.544 6.393 -4.680 1.00 0.00 C ATOM 1673 O LEU A 107 11.540 6.576 -3.981 1.00 0.00 O ATOM 1674 CB LEU A 107 9.271 4.845 -3.183 1.00 0.00 C ATOM 1675 CG LEU A 107 8.215 3.752 -3.013 1.00 0.00 C ATOM 1676 CD1 LEU A 107 8.325 3.113 -1.638 1.00 0.00 C ATOM 1677 CD2 LEU A 107 6.820 4.320 -3.229 1.00 0.00 C ATOM 0 H LEU A 107 11.334 3.699 -4.384 1.00 0.00 H new ATOM 0 HA LEU A 107 8.916 5.147 -5.282 1.00 0.00 H new ATOM 0 HB2 LEU A 107 10.127 4.596 -2.556 1.00 0.00 H new ATOM 0 HB3 LEU A 107 8.860 5.781 -2.805 1.00 0.00 H new ATOM 0 HG LEU A 107 8.392 2.982 -3.764 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.566 2.338 -1.535 1.00 0.00 H new ATOM 0 HD12 LEU A 107 9.314 2.670 -1.521 1.00 0.00 H new ATOM 0 HD13 LEU A 107 8.174 3.872 -0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 107 6.081 3.528 -3.104 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.632 5.110 -2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.746 4.730 -4.236 1.00 0.00 H new ATOM 1689 N ARG A 108 10.077 7.304 -5.528 1.00 0.00 N ATOM 1690 CA ARG A 108 10.724 8.600 -5.688 1.00 0.00 C ATOM 1691 C ARG A 108 10.105 9.636 -4.754 1.00 0.00 C ATOM 1692 O ARG A 108 8.958 10.046 -4.935 1.00 0.00 O ATOM 1693 CB ARG A 108 10.611 9.074 -7.139 1.00 0.00 C ATOM 1694 CG ARG A 108 11.133 10.484 -7.361 1.00 0.00 C ATOM 1695 CD ARG A 108 12.654 10.518 -7.380 1.00 0.00 C ATOM 1696 NE ARG A 108 13.201 9.865 -8.566 1.00 0.00 N ATOM 1697 CZ ARG A 108 14.502 9.753 -8.809 1.00 0.00 C ATOM 1698 NH1 ARG A 108 15.385 10.248 -7.952 1.00 0.00 N ATOM 1699 NH2 ARG A 108 14.923 9.145 -9.910 1.00 0.00 N ATOM 0 H ARG A 108 9.253 7.168 -6.114 1.00 0.00 H new ATOM 0 HA ARG A 108 11.777 8.487 -5.430 1.00 0.00 H new ATOM 0 HB2 ARG A 108 11.162 8.386 -7.781 1.00 0.00 H new ATOM 0 HB3 ARG A 108 9.566 9.030 -7.447 1.00 0.00 H new ATOM 0 HG2 ARG A 108 10.747 10.872 -8.304 1.00 0.00 H new ATOM 0 HG3 ARG A 108 10.763 11.139 -6.572 1.00 0.00 H new ATOM 0 HD2 ARG A 108 12.994 11.553 -7.347 1.00 0.00 H new ATOM 0 HD3 ARG A 108 13.039 10.027 -6.486 1.00 0.00 H new ATOM 0 HE ARG A 108 12.548 9.473 -9.245 1.00 0.00 H new ATOM 0 HH11 ARG A 108 15.066 10.716 -7.104 1.00 0.00 H new ATOM 0 HH12 ARG A 108 16.384 10.161 -8.141 1.00 0.00 H new ATOM 0 HH21 ARG A 108 14.247 8.763 -10.572 1.00 0.00 H new ATOM 0 HH22 ARG A 108 15.922 9.060 -10.095 1.00 0.00 H new ATOM 1713 N LYS A 109 10.873 10.056 -3.754 1.00 0.00 N ATOM 1714 CA LYS A 109 10.402 11.045 -2.791 1.00 0.00 C ATOM 1715 C LYS A 109 10.492 12.453 -3.369 1.00 0.00 C ATOM 1716 O LYS A 109 11.257 12.704 -4.300 1.00 0.00 O ATOM 1717 CB LYS A 109 11.219 10.958 -1.500 1.00 0.00 C ATOM 1718 CG LYS A 109 11.209 9.578 -0.865 1.00 0.00 C ATOM 1719 CD LYS A 109 11.514 9.646 0.622 1.00 0.00 C ATOM 1720 CE LYS A 109 12.967 10.016 0.877 1.00 0.00 C ATOM 1721 NZ LYS A 109 13.471 9.438 2.153 1.00 0.00 N ATOM 0 H LYS A 109 11.824 9.727 -3.589 1.00 0.00 H new ATOM 0 HA LYS A 109 9.357 10.830 -2.568 1.00 0.00 H new ATOM 0 HB2 LYS A 109 12.249 11.244 -1.712 1.00 0.00 H new ATOM 0 HB3 LYS A 109 10.829 11.681 -0.784 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.234 9.114 -1.017 1.00 0.00 H new ATOM 0 HG3 LYS A 109 11.945 8.944 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 109 10.862 10.381 1.095 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.296 8.683 1.083 1.00 0.00 H new ATOM 0 HE2 LYS A 109 13.582 9.662 0.050 1.00 0.00 H new ATOM 0 HE3 LYS A 109 13.066 11.101 0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.442 9.768 2.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 12.859 9.741 2.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.464 8.400 2.090 1.00 0.00 H new ATOM 1735 N ARG A 110 9.708 13.369 -2.810 1.00 0.00 N ATOM 1736 CA ARG A 110 9.700 14.752 -3.270 1.00 0.00 C ATOM 1737 C ARG A 110 11.071 15.396 -3.079 1.00 0.00 C ATOM 1738 O ARG A 110 11.543 16.138 -3.940 1.00 0.00 O ATOM 1739 CB ARG A 110 8.638 15.556 -2.517 1.00 0.00 C ATOM 1740 CG ARG A 110 7.243 15.420 -3.104 1.00 0.00 C ATOM 1741 CD ARG A 110 6.185 15.967 -2.158 1.00 0.00 C ATOM 1742 NE ARG A 110 5.932 17.388 -2.382 1.00 0.00 N ATOM 1743 CZ ARG A 110 5.401 18.192 -1.469 1.00 0.00 C ATOM 1744 NH1 ARG A 110 5.069 17.719 -0.275 1.00 0.00 N ATOM 1745 NH2 ARG A 110 5.201 19.474 -1.748 1.00 0.00 N ATOM 0 H ARG A 110 9.070 13.178 -2.038 1.00 0.00 H new ATOM 0 HA ARG A 110 9.461 14.754 -4.334 1.00 0.00 H new ATOM 0 HB2 ARG A 110 8.619 15.232 -1.477 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.923 16.608 -2.518 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.193 15.952 -4.054 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.037 14.371 -3.315 1.00 0.00 H new ATOM 0 HD2 ARG A 110 5.258 15.409 -2.289 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.506 15.814 -1.128 1.00 0.00 H new ATOM 0 HE ARG A 110 6.177 17.784 -3.290 1.00 0.00 H new ATOM 0 HH11 ARG A 110 5.222 16.735 -0.056 1.00 0.00 H new ATOM 0 HH12 ARG A 110 4.661 18.340 0.424 1.00 0.00 H new ATOM 0 HH21 ARG A 110 5.455 19.842 -2.665 1.00 0.00 H new ATOM 0 HH22 ARG A 110 4.793 20.091 -1.046 1.00 0.00 H new ATOM 1759 N GLN A 111 11.702 15.107 -1.946 1.00 0.00 N ATOM 1760 CA GLN A 111 13.017 15.659 -1.643 1.00 0.00 C ATOM 1761 C GLN A 111 13.861 14.658 -0.861 1.00 0.00 C ATOM 1762 O GLN A 111 13.448 13.519 -0.644 1.00 0.00 O ATOM 1763 CB GLN A 111 12.877 16.958 -0.847 1.00 0.00 C ATOM 1764 CG GLN A 111 12.701 18.190 -1.719 1.00 0.00 C ATOM 1765 CD GLN A 111 13.948 18.527 -2.512 1.00 0.00 C ATOM 1766 OE1 GLN A 111 14.993 17.897 -2.346 1.00 0.00 O ATOM 1767 NE2 GLN A 111 13.846 19.526 -3.381 1.00 0.00 N ATOM 0 H GLN A 111 11.324 14.494 -1.223 1.00 0.00 H new ATOM 0 HA GLN A 111 13.520 15.872 -2.586 1.00 0.00 H new ATOM 0 HB2 GLN A 111 12.022 16.873 -0.176 1.00 0.00 H new ATOM 0 HB3 GLN A 111 13.761 17.089 -0.222 1.00 0.00 H new ATOM 0 HG2 GLN A 111 11.871 18.028 -2.406 1.00 0.00 H new ATOM 0 HG3 GLN A 111 12.434 19.040 -1.091 1.00 0.00 H new ATOM 0 HE21 GLN A 111 12.961 20.021 -3.487 1.00 0.00 H new ATOM 0 HE22 GLN A 111 14.653 19.798 -3.943 1.00 0.00 H new ATOM 1776 N SER A 112 15.045 15.091 -0.440 1.00 0.00 N ATOM 1777 CA SER A 112 15.949 14.231 0.315 1.00 0.00 C ATOM 1778 C SER A 112 15.662 14.321 1.811 1.00 0.00 C ATOM 1779 O SER A 112 16.571 14.524 2.616 1.00 0.00 O ATOM 1780 CB SER A 112 17.404 14.616 0.039 1.00 0.00 C ATOM 1781 OG SER A 112 18.296 13.641 0.549 1.00 0.00 O ATOM 0 H SER A 112 15.401 16.032 -0.609 1.00 0.00 H new ATOM 0 HA SER A 112 15.786 13.203 -0.007 1.00 0.00 H new ATOM 0 HB2 SER A 112 17.557 14.727 -1.035 1.00 0.00 H new ATOM 0 HB3 SER A 112 17.620 15.583 0.493 1.00 0.00 H new ATOM 0 HG SER A 112 18.134 13.519 1.508 1.00 0.00 H new ATOM 1787 N GLN A 113 14.393 14.169 2.174 1.00 0.00 N ATOM 1788 CA GLN A 113 13.986 14.234 3.572 1.00 0.00 C ATOM 1789 C GLN A 113 13.489 12.876 4.058 1.00 0.00 C ATOM 1790 O GLN A 113 12.607 12.272 3.448 1.00 0.00 O ATOM 1791 CB GLN A 113 12.892 15.287 3.759 1.00 0.00 C ATOM 1792 CG GLN A 113 12.187 15.200 5.102 1.00 0.00 C ATOM 1793 CD GLN A 113 11.588 16.524 5.534 1.00 0.00 C ATOM 1794 OE1 GLN A 113 12.309 17.473 5.844 1.00 0.00 O ATOM 1795 NE2 GLN A 113 10.262 16.595 5.556 1.00 0.00 N ATOM 0 H GLN A 113 13.629 14.000 1.520 1.00 0.00 H new ATOM 0 HA GLN A 113 14.856 14.516 4.164 1.00 0.00 H new ATOM 0 HB2 GLN A 113 13.332 16.279 3.653 1.00 0.00 H new ATOM 0 HB3 GLN A 113 12.155 15.178 2.963 1.00 0.00 H new ATOM 0 HG2 GLN A 113 11.398 14.450 5.046 1.00 0.00 H new ATOM 0 HG3 GLN A 113 12.895 14.862 5.859 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.703 15.784 5.291 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.802 17.461 5.838 1.00 0.00 H new ATOM 1804 N ARG A 114 14.061 12.402 5.160 1.00 0.00 N ATOM 1805 CA ARG A 114 13.678 11.115 5.727 1.00 0.00 C ATOM 1806 C ARG A 114 12.440 11.256 6.608 1.00 0.00 C ATOM 1807 O ARG A 114 12.214 12.303 7.214 1.00 0.00 O ATOM 1808 CB ARG A 114 14.832 10.527 6.540 1.00 0.00 C ATOM 1809 CG ARG A 114 15.018 11.186 7.898 1.00 0.00 C ATOM 1810 CD ARG A 114 14.208 10.481 8.974 1.00 0.00 C ATOM 1811 NE ARG A 114 14.852 9.252 9.428 1.00 0.00 N ATOM 1812 CZ ARG A 114 15.861 9.226 10.291 1.00 0.00 C ATOM 1813 NH1 ARG A 114 16.338 10.357 10.792 1.00 0.00 N ATOM 1814 NH2 ARG A 114 16.395 8.067 10.656 1.00 0.00 N ATOM 0 H ARG A 114 14.792 12.890 5.678 1.00 0.00 H new ATOM 0 HA ARG A 114 13.442 10.440 4.904 1.00 0.00 H new ATOM 0 HB2 ARG A 114 14.658 9.461 6.684 1.00 0.00 H new ATOM 0 HB3 ARG A 114 15.755 10.625 5.968 1.00 0.00 H new ATOM 0 HG2 ARG A 114 16.074 11.173 8.169 1.00 0.00 H new ATOM 0 HG3 ARG A 114 14.717 12.232 7.841 1.00 0.00 H new ATOM 0 HD2 ARG A 114 14.070 11.152 9.822 1.00 0.00 H new ATOM 0 HD3 ARG A 114 13.216 10.248 8.587 1.00 0.00 H new ATOM 0 HE ARG A 114 14.508 8.364 9.062 1.00 0.00 H new ATOM 0 HH11 ARG A 114 15.930 11.250 10.515 1.00 0.00 H new ATOM 0 HH12 ARG A 114 17.113 10.334 11.455 1.00 0.00 H new ATOM 0 HH21 ARG A 114 16.030 7.195 10.274 1.00 0.00 H new ATOM 0 HH22 ARG A 114 17.170 8.049 11.319 1.00 0.00 H new ATOM 1828 N TRP A 115 11.643 10.196 6.674 1.00 0.00 N ATOM 1829 CA TRP A 115 10.428 10.202 7.481 1.00 0.00 C ATOM 1830 C TRP A 115 10.650 9.479 8.805 1.00 0.00 C ATOM 1831 O TRP A 115 10.025 9.805 9.813 1.00 0.00 O ATOM 1832 CB TRP A 115 9.278 9.547 6.714 1.00 0.00 C ATOM 1833 CG TRP A 115 9.283 9.866 5.250 1.00 0.00 C ATOM 1834 CD1 TRP A 115 9.721 11.019 4.664 1.00 0.00 C ATOM 1835 CD2 TRP A 115 8.827 9.021 4.187 1.00 0.00 C ATOM 1836 NE1 TRP A 115 9.564 10.942 3.301 1.00 0.00 N ATOM 1837 CE2 TRP A 115 9.018 9.727 2.983 1.00 0.00 C ATOM 1838 CE3 TRP A 115 8.277 7.738 4.136 1.00 0.00 C ATOM 1839 CZ2 TRP A 115 8.678 9.190 1.744 1.00 0.00 C ATOM 1840 CZ3 TRP A 115 7.939 7.207 2.906 1.00 0.00 C ATOM 1841 CH2 TRP A 115 8.141 7.931 1.723 1.00 0.00 C ATOM 0 H TRP A 115 11.816 9.321 6.179 1.00 0.00 H new ATOM 0 HA TRP A 115 10.169 11.239 7.694 1.00 0.00 H new ATOM 0 HB2 TRP A 115 9.334 8.466 6.843 1.00 0.00 H new ATOM 0 HB3 TRP A 115 8.331 9.871 7.146 1.00 0.00 H new ATOM 0 HD1 TRP A 115 10.130 11.866 5.194 1.00 0.00 H new ATOM 0 HE1 TRP A 115 9.814 11.672 2.634 1.00 0.00 H new ATOM 0 HE3 TRP A 115 8.119 7.171 5.042 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 8.833 9.747 0.832 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 7.512 6.216 2.855 1.00 0.00 H new ATOM 0 HH2 TRP A 115 7.868 7.487 0.777 1.00 0.00 H new ATOM 1852 N GLY A 116 11.545 8.496 8.795 1.00 0.00 N ATOM 1853 CA GLY A 116 11.833 7.742 10.001 1.00 0.00 C ATOM 1854 C GLY A 116 10.913 6.550 10.174 1.00 0.00 C ATOM 1855 O GLY A 116 10.635 6.129 11.296 1.00 0.00 O ATOM 0 H GLY A 116 12.076 8.208 7.973 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.867 7.398 9.972 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.739 8.398 10.867 1.00 0.00 H new ATOM 1859 N GLY A 117 10.436 6.006 9.058 1.00 0.00 N ATOM 1860 CA GLY A 117 9.546 4.861 9.114 1.00 0.00 C ATOM 1861 C GLY A 117 8.666 4.751 7.884 1.00 0.00 C ATOM 1862 O GLY A 117 7.619 5.394 7.800 1.00 0.00 O ATOM 0 H GLY A 117 10.650 6.338 8.117 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.136 3.950 9.218 1.00 0.00 H new ATOM 0 HA3 GLY A 117 8.917 4.936 10.001 1.00 0.00 H new ATOM 1866 N LEU A 118 9.093 3.936 6.925 1.00 0.00 N ATOM 1867 CA LEU A 118 8.337 3.745 5.692 1.00 0.00 C ATOM 1868 C LEU A 118 6.837 3.819 5.955 1.00 0.00 C ATOM 1869 O LEU A 118 6.131 4.625 5.349 1.00 0.00 O ATOM 1870 CB LEU A 118 8.689 2.398 5.059 1.00 0.00 C ATOM 1871 CG LEU A 118 8.060 2.112 3.695 1.00 0.00 C ATOM 1872 CD1 LEU A 118 8.907 2.706 2.580 1.00 0.00 C ATOM 1873 CD2 LEU A 118 7.883 0.614 3.492 1.00 0.00 C ATOM 0 H LEU A 118 9.958 3.398 6.978 1.00 0.00 H new ATOM 0 HA LEU A 118 8.606 4.546 5.003 1.00 0.00 H new ATOM 0 HB2 LEU A 118 9.773 2.340 4.956 1.00 0.00 H new ATOM 0 HB3 LEU A 118 8.391 1.607 5.747 1.00 0.00 H new ATOM 0 HG LEU A 118 7.077 2.581 3.665 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.443 2.492 1.617 1.00 0.00 H new ATOM 0 HD12 LEU A 118 8.981 3.785 2.715 1.00 0.00 H new ATOM 0 HD13 LEU A 118 9.904 2.267 2.608 1.00 0.00 H new ATOM 0 HD21 LEU A 118 7.434 0.430 2.516 1.00 0.00 H new ATOM 0 HD22 LEU A 118 8.855 0.123 3.543 1.00 0.00 H new ATOM 0 HD23 LEU A 118 7.233 0.215 4.271 1.00 0.00 H new ATOM 1885 N GLU A 119 6.358 2.976 6.864 1.00 0.00 N ATOM 1886 CA GLU A 119 4.941 2.948 7.207 1.00 0.00 C ATOM 1887 C GLU A 119 4.633 3.940 8.326 1.00 0.00 C ATOM 1888 O GLU A 119 5.390 4.061 9.288 1.00 0.00 O ATOM 1889 CB GLU A 119 4.524 1.538 7.632 1.00 0.00 C ATOM 1890 CG GLU A 119 4.846 0.471 6.599 1.00 0.00 C ATOM 1891 CD GLU A 119 4.374 -0.907 7.017 1.00 0.00 C ATOM 1892 OE1 GLU A 119 3.316 -0.997 7.675 1.00 0.00 O ATOM 1893 OE2 GLU A 119 5.062 -1.896 6.688 1.00 0.00 O ATOM 0 H GLU A 119 6.930 2.304 7.376 1.00 0.00 H new ATOM 0 HA GLU A 119 4.373 3.236 6.322 1.00 0.00 H new ATOM 0 HB2 GLU A 119 5.023 1.287 8.568 1.00 0.00 H new ATOM 0 HB3 GLU A 119 3.452 1.529 7.829 1.00 0.00 H new ATOM 0 HG2 GLU A 119 4.381 0.738 5.650 1.00 0.00 H new ATOM 0 HG3 GLU A 119 5.923 0.447 6.431 1.00 0.00 H new ATOM 1900 N ALA A 120 3.516 4.647 8.190 1.00 0.00 N ATOM 1901 CA ALA A 120 3.107 5.627 9.188 1.00 0.00 C ATOM 1902 C ALA A 120 2.356 4.960 10.336 1.00 0.00 C ATOM 1903 O ALA A 120 1.790 3.877 10.193 1.00 0.00 O ATOM 1904 CB ALA A 120 2.245 6.705 8.547 1.00 0.00 C ATOM 0 H ALA A 120 2.879 4.559 7.399 1.00 0.00 H new ATOM 0 HA ALA A 120 4.005 6.090 9.596 1.00 0.00 H new ATOM 0 HB1 ALA A 120 1.947 7.430 9.304 1.00 0.00 H new ATOM 0 HB2 ALA A 120 2.814 7.209 7.766 1.00 0.00 H new ATOM 0 HB3 ALA A 120 1.356 6.249 8.111 1.00 0.00 H new ATOM 1910 N PRO A 121 2.351 5.621 11.504 1.00 0.00 N ATOM 1911 CA PRO A 121 1.674 5.110 12.699 1.00 0.00 C ATOM 1912 C PRO A 121 0.155 5.141 12.563 1.00 0.00 C ATOM 1913 O PRO A 121 -0.376 5.499 11.512 1.00 0.00 O ATOM 1914 CB PRO A 121 2.131 6.067 13.802 1.00 0.00 C ATOM 1915 CG PRO A 121 2.472 7.331 13.090 1.00 0.00 C ATOM 1916 CD PRO A 121 3.006 6.917 11.746 1.00 0.00 C ATOM 0 HA PRO A 121 1.921 4.066 12.892 1.00 0.00 H new ATOM 0 HB2 PRO A 121 1.343 6.227 14.538 1.00 0.00 H new ATOM 0 HB3 PRO A 121 2.993 5.670 14.339 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.594 7.967 12.982 1.00 0.00 H new ATOM 0 HG3 PRO A 121 3.214 7.904 13.646 1.00 0.00 H new ATOM 0 HD2 PRO A 121 2.757 7.644 10.973 1.00 0.00 H new ATOM 0 HD3 PRO A 121 4.092 6.823 11.757 1.00 0.00 H new ATOM 1924 N ALA A 122 -0.538 4.764 13.632 1.00 0.00 N ATOM 1925 CA ALA A 122 -1.996 4.751 13.632 1.00 0.00 C ATOM 1926 C ALA A 122 -2.544 4.602 15.047 1.00 0.00 C ATOM 1927 O ALA A 122 -2.035 3.809 15.839 1.00 0.00 O ATOM 1928 CB ALA A 122 -2.514 3.630 12.742 1.00 0.00 C ATOM 0 H ALA A 122 -0.114 4.463 14.509 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.343 5.705 13.235 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.604 3.632 12.751 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.160 3.782 11.722 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.150 2.672 13.114 1.00 0.00 H new ATOM 1934 N ALA A 123 -3.583 5.369 15.358 1.00 0.00 N ATOM 1935 CA ALA A 123 -4.200 5.321 16.678 1.00 0.00 C ATOM 1936 C ALA A 123 -5.672 5.715 16.610 1.00 0.00 C ATOM 1937 O ALA A 123 -6.116 6.330 15.641 1.00 0.00 O ATOM 1938 CB ALA A 123 -3.453 6.229 17.644 1.00 0.00 C ATOM 0 H ALA A 123 -4.016 6.031 14.714 1.00 0.00 H new ATOM 0 HA ALA A 123 -4.141 4.295 17.042 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -3.925 6.183 18.625 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -2.417 5.901 17.724 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -3.482 7.254 17.275 1.00 0.00 H new ATOM 1944 N ARG A 124 -6.424 5.355 17.645 1.00 0.00 N ATOM 1945 CA ARG A 124 -7.847 5.669 17.702 1.00 0.00 C ATOM 1946 C ARG A 124 -8.091 6.937 18.515 1.00 0.00 C ATOM 1947 O ARG A 124 -9.016 6.999 19.325 1.00 0.00 O ATOM 1948 CB ARG A 124 -8.625 4.502 18.311 1.00 0.00 C ATOM 1949 CG ARG A 124 -10.049 4.382 17.793 1.00 0.00 C ATOM 1950 CD ARG A 124 -10.121 3.495 16.561 1.00 0.00 C ATOM 1951 NE ARG A 124 -9.494 4.120 15.399 1.00 0.00 N ATOM 1952 CZ ARG A 124 -10.056 5.097 14.697 1.00 0.00 C ATOM 1953 NH1 ARG A 124 -11.251 5.560 15.038 1.00 0.00 N ATOM 1954 NH2 ARG A 124 -9.423 5.615 13.653 1.00 0.00 N ATOM 0 H ARG A 124 -6.072 4.846 18.455 1.00 0.00 H new ATOM 0 HA ARG A 124 -8.198 5.837 16.684 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -8.093 3.574 18.103 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -8.650 4.619 19.394 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -10.688 3.973 18.575 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -10.434 5.373 17.552 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -9.631 2.544 16.770 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -11.164 3.273 16.335 1.00 0.00 H new ATOM 0 HE ARG A 124 -8.574 3.788 15.111 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.741 5.166 15.841 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -11.681 6.311 14.497 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -8.503 5.263 13.388 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -9.856 6.365 13.115 1.00 0.00 H new ATOM 1968 N VAL A 125 -7.255 7.947 18.293 1.00 0.00 N ATOM 1969 CA VAL A 125 -7.381 9.213 19.005 1.00 0.00 C ATOM 1970 C VAL A 125 -8.411 10.118 18.338 1.00 0.00 C ATOM 1971 O VAL A 125 -8.215 11.328 18.232 1.00 0.00 O ATOM 1972 CB VAL A 125 -6.032 9.954 19.074 1.00 0.00 C ATOM 1973 CG1 VAL A 125 -5.590 10.390 17.685 1.00 0.00 C ATOM 1974 CG2 VAL A 125 -6.128 11.148 20.011 1.00 0.00 C ATOM 0 H VAL A 125 -6.484 7.913 17.626 1.00 0.00 H new ATOM 0 HA VAL A 125 -7.710 8.976 20.017 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.281 9.270 19.470 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -4.635 10.912 17.754 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.479 9.514 17.047 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -6.338 11.058 17.258 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -5.166 11.660 20.048 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -6.891 11.836 19.647 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.395 10.805 21.011 1.00 0.00 H new ATOM 1984 N GLY A 126 -9.513 9.522 17.891 1.00 0.00 N ATOM 1985 CA GLY A 126 -10.559 10.289 17.240 1.00 0.00 C ATOM 1986 C GLY A 126 -10.522 10.156 15.731 1.00 0.00 C ATOM 1987 O GLY A 126 -11.549 9.916 15.097 1.00 0.00 O ATOM 0 H GLY A 126 -9.700 8.522 17.968 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -11.530 9.957 17.607 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -10.457 11.340 17.512 1.00 0.00 H new ATOM 1991 N GLY A 127 -9.335 10.314 15.153 1.00 0.00 N ATOM 1992 CA GLY A 127 -9.192 10.209 13.713 1.00 0.00 C ATOM 1993 C GLY A 127 -7.895 10.815 13.213 1.00 0.00 C ATOM 1994 O GLY A 127 -7.012 11.145 14.004 1.00 0.00 O ATOM 0 H GLY A 127 -8.470 10.513 15.656 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -9.235 9.159 13.422 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -10.032 10.708 13.230 1.00 0.00 H new ATOM 1998 N ALA A 128 -7.780 10.960 11.897 1.00 0.00 N ATOM 1999 CA ALA A 128 -6.582 11.531 11.294 1.00 0.00 C ATOM 2000 C ALA A 128 -6.891 12.858 10.610 1.00 0.00 C ATOM 2001 O ALA A 128 -6.363 13.902 10.993 1.00 0.00 O ATOM 2002 CB ALA A 128 -5.974 10.552 10.300 1.00 0.00 C ATOM 0 H ALA A 128 -8.501 10.690 11.228 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.860 11.721 12.088 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.080 10.991 9.857 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.708 9.629 10.815 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.698 10.334 9.515 1.00 0.00 H new ATOM 2008 N SER A 129 -7.748 12.810 9.595 1.00 0.00 N ATOM 2009 CA SER A 129 -8.124 14.009 8.855 1.00 0.00 C ATOM 2010 C SER A 129 -9.567 13.917 8.369 1.00 0.00 C ATOM 2011 O SER A 129 -10.230 12.896 8.547 1.00 0.00 O ATOM 2012 CB SER A 129 -7.185 14.214 7.665 1.00 0.00 C ATOM 2013 OG SER A 129 -7.430 13.256 6.650 1.00 0.00 O ATOM 0 H SER A 129 -8.195 11.954 9.266 1.00 0.00 H new ATOM 0 HA SER A 129 -8.039 14.863 9.527 1.00 0.00 H new ATOM 0 HB2 SER A 129 -7.318 15.218 7.262 1.00 0.00 H new ATOM 0 HB3 SER A 129 -6.150 14.139 7.998 1.00 0.00 H new ATOM 0 HG SER A 129 -6.818 13.410 5.900 1.00 0.00 H new ATOM 2019 N GLY A 130 -10.047 14.994 7.753 1.00 0.00 N ATOM 2020 CA GLY A 130 -11.408 15.015 7.250 1.00 0.00 C ATOM 2021 C GLY A 130 -11.986 16.416 7.199 1.00 0.00 C ATOM 2022 O GLY A 130 -12.931 16.747 7.916 1.00 0.00 O ATOM 0 H GLY A 130 -9.518 15.851 7.594 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -11.430 14.580 6.251 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -12.036 14.389 7.884 1.00 0.00 H new ATOM 2026 N PRO A 131 -11.410 17.266 6.336 1.00 0.00 N ATOM 2027 CA PRO A 131 -11.857 18.653 6.175 1.00 0.00 C ATOM 2028 C PRO A 131 -13.225 18.748 5.508 1.00 0.00 C ATOM 2029 O PRO A 131 -13.843 17.732 5.192 1.00 0.00 O ATOM 2030 CB PRO A 131 -10.781 19.270 5.279 1.00 0.00 C ATOM 2031 CG PRO A 131 -10.212 18.120 4.522 1.00 0.00 C ATOM 2032 CD PRO A 131 -10.280 16.939 5.451 1.00 0.00 C ATOM 0 HA PRO A 131 -11.974 19.158 7.134 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -11.206 20.015 4.606 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -10.015 19.773 5.869 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -10.780 17.933 3.611 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -9.184 18.321 4.221 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -10.451 16.010 4.908 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -9.353 16.815 6.012 1.00 0.00 H new ATOM 2040 N SER A 132 -13.691 19.975 5.297 1.00 0.00 N ATOM 2041 CA SER A 132 -14.988 20.202 4.671 1.00 0.00 C ATOM 2042 C SER A 132 -15.209 21.688 4.403 1.00 0.00 C ATOM 2043 O SER A 132 -14.589 22.543 5.035 1.00 0.00 O ATOM 2044 CB SER A 132 -16.109 19.660 5.559 1.00 0.00 C ATOM 2045 OG SER A 132 -17.322 19.541 4.835 1.00 0.00 O ATOM 0 H SER A 132 -13.190 20.827 5.550 1.00 0.00 H new ATOM 0 HA SER A 132 -15.001 19.673 3.718 1.00 0.00 H new ATOM 0 HB2 SER A 132 -15.823 18.687 5.958 1.00 0.00 H new ATOM 0 HB3 SER A 132 -16.254 20.323 6.412 1.00 0.00 H new ATOM 0 HG SER A 132 -18.022 19.191 5.425 1.00 0.00 H new ATOM 2051 N SER A 133 -16.098 21.987 3.461 1.00 0.00 N ATOM 2052 CA SER A 133 -16.399 23.369 3.105 1.00 0.00 C ATOM 2053 C SER A 133 -17.773 23.777 3.628 1.00 0.00 C ATOM 2054 O SER A 133 -17.915 24.795 4.303 1.00 0.00 O ATOM 2055 CB SER A 133 -16.344 23.550 1.587 1.00 0.00 C ATOM 2056 OG SER A 133 -15.038 23.900 1.162 1.00 0.00 O ATOM 0 H SER A 133 -16.622 21.291 2.931 1.00 0.00 H new ATOM 0 HA SER A 133 -15.648 24.010 3.567 1.00 0.00 H new ATOM 0 HB2 SER A 133 -16.655 22.628 1.096 1.00 0.00 H new ATOM 0 HB3 SER A 133 -17.048 24.325 1.284 1.00 0.00 H new ATOM 0 HG SER A 133 -15.029 24.008 0.188 1.00 0.00 H new ATOM 2062 N GLY A 134 -18.783 22.973 3.310 1.00 0.00 N ATOM 2063 CA GLY A 134 -20.133 23.267 3.754 1.00 0.00 C ATOM 2064 C GLY A 134 -20.718 22.156 4.603 1.00 0.00 C ATOM 2065 O GLY A 134 -21.132 22.386 5.739 1.00 0.00 O ATOM 0 H GLY A 134 -18.690 22.124 2.753 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -20.130 24.195 4.326 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -20.771 23.431 2.885 1.00 0.00 H new TER 2069 GLY A 134