USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 758 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 130:sc= 0.114 (180deg=-0.0119) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -149:sc= -1.74 (180deg=-4.44!) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -106:sc= 0.394 (180deg=-0.0353) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.079 USER MOD Single : A 26 ASN : amide:sc= -0.737 K(o=-0.74,f=-11!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 35 ASN : amide:sc= -0.18 K(o=-0.18,f=-2.9!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 68:sc= 0.404 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -104:sc= 0.129 USER MOD Single : A 56 ASN : amide:sc=-4.17e-05 K(o=-4.2e-05,f=-1.4) USER MOD Single : A 58 MET CE :methyl -168:sc= -3.07! (180deg=-3.56) USER MOD Single : A 60 THR OG1 : rot -40:sc= 0.288 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0.0324 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= -1.22 X(o=-1.2,f=-1.6) USER MOD Single : A 82 LYS NZ :NH3+ 146:sc= -0.351 (180deg=-1.65!) USER MOD Single : A 83 SER OG : rot 180:sc= 0.0715 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.00234 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 81:sc= 0.967 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -1.12 K(o=-1.1,f=-1.7) USER MOD Single : A 96 LYS NZ :NH3+ -137:sc= -0.0113 (180deg=-0.158) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.458 6.685 -22.531 1.00 0.00 N ATOM 2 CA MET A 1 17.350 5.837 -22.107 1.00 0.00 C ATOM 3 C MET A 1 16.609 6.460 -20.929 1.00 0.00 C ATOM 4 O MET A 1 16.944 7.557 -20.483 1.00 0.00 O ATOM 5 CB MET A 1 17.861 4.446 -21.725 1.00 0.00 C ATOM 6 CG MET A 1 18.851 4.458 -20.572 1.00 0.00 C ATOM 7 SD MET A 1 19.119 2.819 -19.869 1.00 0.00 S ATOM 8 CE MET A 1 20.070 3.228 -18.408 1.00 0.00 C ATOM 0 H1 MET A 1 19.324 6.113 -22.606 1.00 0.00 H new ATOM 0 H2 MET A 1 18.239 7.105 -23.457 1.00 0.00 H new ATOM 0 H3 MET A 1 18.603 7.442 -21.833 1.00 0.00 H new ATOM 0 HA MET A 1 16.656 5.744 -22.942 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.012 3.817 -21.458 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.334 3.990 -22.595 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.803 4.860 -20.920 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.487 5.128 -19.793 1.00 0.00 H new ATOM 0 HE1 MET A 1 20.313 2.315 -17.865 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.991 3.732 -18.702 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.485 3.887 -17.766 1.00 0.00 H new ATOM 18 N ALA A 2 15.601 5.753 -20.429 1.00 0.00 N ATOM 19 CA ALA A 2 14.814 6.237 -19.302 1.00 0.00 C ATOM 20 C ALA A 2 14.568 5.126 -18.287 1.00 0.00 C ATOM 21 O ALA A 2 14.242 3.997 -18.655 1.00 0.00 O ATOM 22 CB ALA A 2 13.491 6.811 -19.789 1.00 0.00 C ATOM 0 H ALA A 2 15.310 4.843 -20.787 1.00 0.00 H new ATOM 0 HA ALA A 2 15.380 7.027 -18.808 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.914 7.169 -18.936 1.00 0.00 H new ATOM 0 HB2 ALA A 2 13.683 7.640 -20.471 1.00 0.00 H new ATOM 0 HB3 ALA A 2 12.928 6.036 -20.309 1.00 0.00 H new ATOM 28 N ARG A 3 14.727 5.453 -17.009 1.00 0.00 N ATOM 29 CA ARG A 3 14.523 4.481 -15.941 1.00 0.00 C ATOM 30 C ARG A 3 13.237 4.776 -15.174 1.00 0.00 C ATOM 31 O ARG A 3 13.255 4.958 -13.958 1.00 0.00 O ATOM 32 CB ARG A 3 15.715 4.491 -14.980 1.00 0.00 C ATOM 33 CG ARG A 3 16.937 3.767 -15.520 1.00 0.00 C ATOM 34 CD ARG A 3 16.764 2.257 -15.459 1.00 0.00 C ATOM 35 NE ARG A 3 16.706 1.768 -14.084 1.00 0.00 N ATOM 36 CZ ARG A 3 16.609 0.483 -13.764 1.00 0.00 C ATOM 37 NH1 ARG A 3 16.558 -0.439 -14.716 1.00 0.00 N ATOM 38 NH2 ARG A 3 16.562 0.117 -12.489 1.00 0.00 N ATOM 0 H ARG A 3 14.996 6.383 -16.688 1.00 0.00 H new ATOM 0 HA ARG A 3 14.437 3.494 -16.395 1.00 0.00 H new ATOM 0 HB2 ARG A 3 15.983 5.524 -14.758 1.00 0.00 H new ATOM 0 HB3 ARG A 3 15.416 4.030 -14.039 1.00 0.00 H new ATOM 0 HG2 ARG A 3 17.116 4.072 -16.551 1.00 0.00 H new ATOM 0 HG3 ARG A 3 17.816 4.057 -14.945 1.00 0.00 H new ATOM 0 HD2 ARG A 3 15.851 1.975 -15.983 1.00 0.00 H new ATOM 0 HD3 ARG A 3 17.592 1.776 -15.980 1.00 0.00 H new ATOM 0 HE ARG A 3 16.742 2.451 -13.328 1.00 0.00 H new ATOM 0 HH11 ARG A 3 16.593 -0.162 -15.697 1.00 0.00 H new ATOM 0 HH12 ARG A 3 16.484 -1.425 -14.467 1.00 0.00 H new ATOM 0 HH21 ARG A 3 16.600 0.823 -11.754 1.00 0.00 H new ATOM 0 HH22 ARG A 3 16.487 -0.870 -12.244 1.00 0.00 H new ATOM 52 N GLY A 4 12.122 4.822 -15.897 1.00 0.00 N ATOM 53 CA GLY A 4 10.842 5.096 -15.269 1.00 0.00 C ATOM 54 C GLY A 4 9.673 4.829 -16.195 1.00 0.00 C ATOM 55 O GLY A 4 8.612 5.437 -16.058 1.00 0.00 O ATOM 0 H GLY A 4 12.082 4.675 -16.905 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.741 4.481 -14.375 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.815 6.137 -14.945 1.00 0.00 H new ATOM 59 N SER A 5 9.867 3.916 -17.143 1.00 0.00 N ATOM 60 CA SER A 5 8.821 3.574 -18.100 1.00 0.00 C ATOM 61 C SER A 5 7.775 2.667 -17.459 1.00 0.00 C ATOM 62 O SER A 5 7.806 2.418 -16.253 1.00 0.00 O ATOM 63 CB SER A 5 9.426 2.887 -19.325 1.00 0.00 C ATOM 64 OG SER A 5 10.392 3.716 -19.949 1.00 0.00 O ATOM 0 H SER A 5 10.738 3.401 -17.268 1.00 0.00 H new ATOM 0 HA SER A 5 8.334 4.497 -18.414 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.888 1.946 -19.027 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.637 2.644 -20.036 1.00 0.00 H new ATOM 0 HG SER A 5 10.765 3.254 -20.728 1.00 0.00 H new ATOM 70 N VAL A 6 6.848 2.176 -18.275 1.00 0.00 N ATOM 71 CA VAL A 6 5.792 1.295 -17.790 1.00 0.00 C ATOM 72 C VAL A 6 5.046 0.642 -18.948 1.00 0.00 C ATOM 73 O VAL A 6 4.482 1.327 -19.801 1.00 0.00 O ATOM 74 CB VAL A 6 4.784 2.058 -16.910 1.00 0.00 C ATOM 75 CG1 VAL A 6 4.221 3.256 -17.659 1.00 0.00 C ATOM 76 CG2 VAL A 6 3.668 1.132 -16.453 1.00 0.00 C ATOM 0 H VAL A 6 6.807 2.373 -19.275 1.00 0.00 H new ATOM 0 HA VAL A 6 6.275 0.523 -17.191 1.00 0.00 H new ATOM 0 HB VAL A 6 5.305 2.425 -16.026 1.00 0.00 H new ATOM 0 HG11 VAL A 6 3.511 3.783 -17.022 1.00 0.00 H new ATOM 0 HG12 VAL A 6 5.034 3.930 -17.931 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.715 2.915 -18.562 1.00 0.00 H new ATOM 0 HG21 VAL A 6 2.965 1.688 -15.832 1.00 0.00 H new ATOM 0 HG22 VAL A 6 3.147 0.733 -17.323 1.00 0.00 H new ATOM 0 HG23 VAL A 6 4.091 0.310 -15.875 1.00 0.00 H new ATOM 86 N SER A 7 5.047 -0.687 -18.971 1.00 0.00 N ATOM 87 CA SER A 7 4.372 -1.433 -20.027 1.00 0.00 C ATOM 88 C SER A 7 2.876 -1.136 -20.031 1.00 0.00 C ATOM 89 O SER A 7 2.364 -0.458 -19.141 1.00 0.00 O ATOM 90 CB SER A 7 4.606 -2.935 -19.848 1.00 0.00 C ATOM 91 OG SER A 7 5.944 -3.283 -20.154 1.00 0.00 O ATOM 0 H SER A 7 5.507 -1.269 -18.271 1.00 0.00 H new ATOM 0 HA SER A 7 4.789 -1.119 -20.984 1.00 0.00 H new ATOM 0 HB2 SER A 7 4.378 -3.222 -18.821 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.926 -3.491 -20.493 1.00 0.00 H new ATOM 0 HG SER A 7 6.068 -4.247 -20.030 1.00 0.00 H new ATOM 97 N ASP A 8 2.180 -1.651 -21.040 1.00 0.00 N ATOM 98 CA ASP A 8 0.742 -1.442 -21.162 1.00 0.00 C ATOM 99 C ASP A 8 -0.008 -2.170 -20.049 1.00 0.00 C ATOM 100 O ASP A 8 -0.765 -1.558 -19.297 1.00 0.00 O ATOM 101 CB ASP A 8 0.249 -1.925 -22.526 1.00 0.00 C ATOM 102 CG ASP A 8 0.948 -1.225 -23.675 1.00 0.00 C ATOM 103 OD1 ASP A 8 0.962 0.024 -23.689 1.00 0.00 O ATOM 104 OD2 ASP A 8 1.481 -1.925 -24.560 1.00 0.00 O ATOM 0 H ASP A 8 2.589 -2.216 -21.785 1.00 0.00 H new ATOM 0 HA ASP A 8 0.545 -0.374 -21.071 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.410 -3.000 -22.607 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -0.825 -1.757 -22.601 1.00 0.00 H new ATOM 109 N GLU A 9 0.208 -3.477 -19.954 1.00 0.00 N ATOM 110 CA GLU A 9 -0.450 -4.287 -18.935 1.00 0.00 C ATOM 111 C GLU A 9 -0.197 -3.719 -17.541 1.00 0.00 C ATOM 112 O GLU A 9 -1.109 -3.635 -16.720 1.00 0.00 O ATOM 113 CB GLU A 9 0.044 -5.733 -19.005 1.00 0.00 C ATOM 114 CG GLU A 9 1.555 -5.866 -18.925 1.00 0.00 C ATOM 115 CD GLU A 9 2.036 -7.267 -19.248 1.00 0.00 C ATOM 116 OE1 GLU A 9 2.866 -7.411 -20.171 1.00 0.00 O ATOM 117 OE2 GLU A 9 1.584 -8.219 -18.579 1.00 0.00 O ATOM 0 H GLU A 9 0.833 -3.998 -20.569 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.523 -4.267 -19.128 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.406 -6.301 -18.191 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.303 -6.182 -19.936 1.00 0.00 H new ATOM 0 HG2 GLU A 9 2.015 -5.160 -19.616 1.00 0.00 H new ATOM 0 HG3 GLU A 9 1.887 -5.594 -17.923 1.00 0.00 H new ATOM 124 N GLU A 10 1.048 -3.329 -17.284 1.00 0.00 N ATOM 125 CA GLU A 10 1.420 -2.770 -15.990 1.00 0.00 C ATOM 126 C GLU A 10 0.798 -1.391 -15.794 1.00 0.00 C ATOM 127 O GLU A 10 0.222 -1.101 -14.745 1.00 0.00 O ATOM 128 CB GLU A 10 2.943 -2.678 -15.869 1.00 0.00 C ATOM 129 CG GLU A 10 3.418 -2.233 -14.496 1.00 0.00 C ATOM 130 CD GLU A 10 3.885 -3.393 -13.637 1.00 0.00 C ATOM 131 OE1 GLU A 10 4.983 -3.925 -13.907 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.155 -3.767 -12.697 1.00 0.00 O ATOM 0 H GLU A 10 1.815 -3.390 -17.954 1.00 0.00 H new ATOM 0 HA GLU A 10 1.040 -3.433 -15.213 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.377 -3.652 -16.096 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.317 -1.980 -16.618 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.234 -1.519 -14.611 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.608 -1.711 -13.987 1.00 0.00 H new ATOM 139 N MET A 11 0.920 -0.543 -16.810 1.00 0.00 N ATOM 140 CA MET A 11 0.370 0.806 -16.750 1.00 0.00 C ATOM 141 C MET A 11 -1.099 0.776 -16.338 1.00 0.00 C ATOM 142 O MET A 11 -1.541 1.585 -15.523 1.00 0.00 O ATOM 143 CB MET A 11 0.517 1.501 -18.105 1.00 0.00 C ATOM 144 CG MET A 11 -0.048 2.912 -18.129 1.00 0.00 C ATOM 145 SD MET A 11 0.827 4.029 -17.015 1.00 0.00 S ATOM 146 CE MET A 11 -0.419 4.297 -15.758 1.00 0.00 C ATOM 0 H MET A 11 1.395 -0.766 -17.685 1.00 0.00 H new ATOM 0 HA MET A 11 0.929 1.366 -16.000 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.573 1.537 -18.373 1.00 0.00 H new ATOM 0 HB3 MET A 11 0.015 0.904 -18.866 1.00 0.00 H new ATOM 0 HG2 MET A 11 0.005 3.303 -19.145 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.102 2.882 -17.853 1.00 0.00 H new ATOM 0 HE1 MET A 11 -0.304 5.297 -15.339 1.00 0.00 H new ATOM 0 HE2 MET A 11 -1.410 4.201 -16.202 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.303 3.556 -14.967 1.00 0.00 H new ATOM 156 N MET A 12 -1.849 -0.162 -16.907 1.00 0.00 N ATOM 157 CA MET A 12 -3.268 -0.297 -16.597 1.00 0.00 C ATOM 158 C MET A 12 -3.466 -0.885 -15.203 1.00 0.00 C ATOM 159 O MET A 12 -4.118 -0.279 -14.352 1.00 0.00 O ATOM 160 CB MET A 12 -3.958 -1.180 -17.638 1.00 0.00 C ATOM 161 CG MET A 12 -3.835 -0.654 -19.058 1.00 0.00 C ATOM 162 SD MET A 12 -4.059 -1.943 -20.299 1.00 0.00 S ATOM 163 CE MET A 12 -4.805 -1.005 -21.630 1.00 0.00 C ATOM 0 H MET A 12 -1.499 -0.839 -17.584 1.00 0.00 H new ATOM 0 HA MET A 12 -3.716 0.697 -16.620 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.532 -2.182 -17.592 1.00 0.00 H new ATOM 0 HB3 MET A 12 -5.014 -1.271 -17.383 1.00 0.00 H new ATOM 0 HG2 MET A 12 -4.576 0.130 -19.216 1.00 0.00 H new ATOM 0 HG3 MET A 12 -2.854 -0.197 -19.188 1.00 0.00 H new ATOM 0 HE1 MET A 12 -5.004 -1.666 -22.474 1.00 0.00 H new ATOM 0 HE2 MET A 12 -5.741 -0.565 -21.285 1.00 0.00 H new ATOM 0 HE3 MET A 12 -4.125 -0.213 -21.943 1.00 0.00 H new ATOM 173 N GLU A 13 -2.902 -2.066 -14.977 1.00 0.00 N ATOM 174 CA GLU A 13 -3.019 -2.735 -13.686 1.00 0.00 C ATOM 175 C GLU A 13 -2.634 -1.793 -12.550 1.00 0.00 C ATOM 176 O GLU A 13 -3.155 -1.896 -11.438 1.00 0.00 O ATOM 177 CB GLU A 13 -2.133 -3.982 -13.651 1.00 0.00 C ATOM 178 CG GLU A 13 -2.836 -5.240 -14.133 1.00 0.00 C ATOM 179 CD GLU A 13 -3.448 -5.075 -15.510 1.00 0.00 C ATOM 180 OE1 GLU A 13 -4.513 -4.430 -15.611 1.00 0.00 O ATOM 181 OE2 GLU A 13 -2.864 -5.589 -16.486 1.00 0.00 O ATOM 0 H GLU A 13 -2.359 -2.580 -15.671 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.059 -3.033 -13.552 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.252 -3.809 -14.268 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.782 -4.140 -12.631 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.124 -6.065 -14.153 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.617 -5.510 -13.422 1.00 0.00 H new ATOM 188 N LEU A 14 -1.718 -0.874 -12.834 1.00 0.00 N ATOM 189 CA LEU A 14 -1.262 0.088 -11.836 1.00 0.00 C ATOM 190 C LEU A 14 -2.268 1.224 -11.675 1.00 0.00 C ATOM 191 O LEU A 14 -2.830 1.419 -10.597 1.00 0.00 O ATOM 192 CB LEU A 14 0.104 0.653 -12.230 1.00 0.00 C ATOM 193 CG LEU A 14 1.315 -0.211 -11.876 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.577 0.355 -12.509 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.474 -0.313 -10.365 1.00 0.00 C ATOM 0 H LEU A 14 -1.276 -0.774 -13.748 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.172 -0.431 -10.882 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.107 0.824 -13.306 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.224 1.625 -11.752 1.00 0.00 H new ATOM 0 HG LEU A 14 1.151 -1.213 -12.273 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.429 -0.273 -12.246 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.462 0.376 -13.593 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.746 1.367 -12.142 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.341 -0.931 -10.131 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.616 0.683 -9.946 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.580 -0.764 -9.935 1.00 0.00 H new ATOM 207 N ARG A 15 -2.491 1.967 -12.753 1.00 0.00 N ATOM 208 CA ARG A 15 -3.429 3.083 -12.732 1.00 0.00 C ATOM 209 C ARG A 15 -4.778 2.647 -12.167 1.00 0.00 C ATOM 210 O ARG A 15 -5.434 3.402 -11.450 1.00 0.00 O ATOM 211 CB ARG A 15 -3.613 3.650 -14.141 1.00 0.00 C ATOM 212 CG ARG A 15 -4.658 2.913 -14.962 1.00 0.00 C ATOM 213 CD ARG A 15 -6.048 3.492 -14.744 1.00 0.00 C ATOM 214 NE ARG A 15 -6.919 3.275 -15.896 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.090 3.880 -16.056 1.00 0.00 C ATOM 216 NH1 ARG A 15 -8.528 4.738 -15.144 1.00 0.00 N ATOM 217 NH2 ARG A 15 -8.825 3.631 -17.132 1.00 0.00 N ATOM 0 H ARG A 15 -2.035 1.817 -13.653 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.017 3.859 -12.087 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -3.896 4.700 -14.067 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.658 3.613 -14.666 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.400 2.972 -16.019 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -4.656 1.857 -14.692 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.496 3.037 -13.860 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -5.968 4.561 -14.546 1.00 0.00 H new ATOM 0 HE ARG A 15 -6.611 2.623 -16.617 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -7.965 4.935 -14.317 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.428 5.201 -15.270 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.491 2.974 -17.837 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -9.724 4.096 -17.254 1.00 0.00 H new ATOM 231 N GLU A 16 -5.185 1.425 -12.496 1.00 0.00 N ATOM 232 CA GLU A 16 -6.456 0.890 -12.022 1.00 0.00 C ATOM 233 C GLU A 16 -6.359 0.475 -10.557 1.00 0.00 C ATOM 234 O GLU A 16 -7.310 0.633 -9.791 1.00 0.00 O ATOM 235 CB GLU A 16 -6.882 -0.306 -12.876 1.00 0.00 C ATOM 236 CG GLU A 16 -6.048 -1.553 -12.635 1.00 0.00 C ATOM 237 CD GLU A 16 -6.625 -2.439 -11.548 1.00 0.00 C ATOM 238 OE1 GLU A 16 -7.780 -2.889 -11.699 1.00 0.00 O ATOM 239 OE2 GLU A 16 -5.921 -2.684 -10.545 1.00 0.00 O ATOM 0 H GLU A 16 -4.653 0.787 -13.088 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.207 1.675 -12.110 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -7.928 -0.534 -12.672 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.815 -0.032 -13.929 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.975 -2.122 -13.562 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.035 -1.260 -12.360 1.00 0.00 H new ATOM 246 N ALA A 17 -5.204 -0.060 -10.174 1.00 0.00 N ATOM 247 CA ALA A 17 -4.981 -0.498 -8.802 1.00 0.00 C ATOM 248 C ALA A 17 -5.117 0.667 -7.826 1.00 0.00 C ATOM 249 O ALA A 17 -5.606 0.499 -6.709 1.00 0.00 O ATOM 250 CB ALA A 17 -3.609 -1.142 -8.670 1.00 0.00 C ATOM 0 H ALA A 17 -4.408 -0.200 -10.796 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.742 -1.237 -8.554 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.456 -1.464 -7.640 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.547 -2.005 -9.333 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.840 -0.419 -8.942 1.00 0.00 H new ATOM 256 N PHE A 18 -4.679 1.846 -8.255 1.00 0.00 N ATOM 257 CA PHE A 18 -4.752 3.038 -7.417 1.00 0.00 C ATOM 258 C PHE A 18 -6.172 3.593 -7.383 1.00 0.00 C ATOM 259 O PHE A 18 -6.734 3.821 -6.312 1.00 0.00 O ATOM 260 CB PHE A 18 -3.786 4.107 -7.932 1.00 0.00 C ATOM 261 CG PHE A 18 -2.480 3.550 -8.423 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.792 2.605 -7.680 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.941 3.972 -9.628 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.591 2.090 -8.129 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.740 3.461 -10.081 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.064 2.519 -9.331 1.00 0.00 C ATOM 0 H PHE A 18 -4.270 2.002 -9.176 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.467 2.758 -6.403 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.264 4.657 -8.742 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.589 4.822 -7.133 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.199 2.267 -6.739 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.465 4.708 -10.219 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -0.065 1.353 -7.540 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.330 3.798 -11.022 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.875 2.119 -9.684 1.00 0.00 H new ATOM 276 N ALA A 19 -6.745 3.810 -8.561 1.00 0.00 N ATOM 277 CA ALA A 19 -8.100 4.337 -8.667 1.00 0.00 C ATOM 278 C ALA A 19 -9.080 3.502 -7.850 1.00 0.00 C ATOM 279 O ALA A 19 -10.109 4.001 -7.396 1.00 0.00 O ATOM 280 CB ALA A 19 -8.535 4.388 -10.124 1.00 0.00 C ATOM 0 H ALA A 19 -6.292 3.629 -9.457 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.101 5.349 -8.263 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.549 4.784 -10.187 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.858 5.033 -10.683 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.510 3.383 -10.546 1.00 0.00 H new ATOM 286 N LYS A 20 -8.753 2.227 -7.666 1.00 0.00 N ATOM 287 CA LYS A 20 -9.604 1.322 -6.902 1.00 0.00 C ATOM 288 C LYS A 20 -9.802 1.832 -5.479 1.00 0.00 C ATOM 289 O LYS A 20 -10.929 2.088 -5.053 1.00 0.00 O ATOM 290 CB LYS A 20 -8.991 -0.081 -6.872 1.00 0.00 C ATOM 291 CG LYS A 20 -9.876 -1.145 -7.499 1.00 0.00 C ATOM 292 CD LYS A 20 -10.232 -0.797 -8.935 1.00 0.00 C ATOM 293 CE LYS A 20 -9.988 -1.973 -9.869 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.362 -1.650 -11.274 1.00 0.00 N ATOM 0 H LYS A 20 -7.905 1.797 -8.035 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.577 1.278 -7.391 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.035 -0.062 -7.394 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.784 -0.356 -5.838 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.365 -2.107 -7.473 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.788 -1.253 -6.913 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -11.279 -0.498 -8.990 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.639 0.058 -9.261 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.936 -2.257 -9.829 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.564 -2.833 -9.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.251 -2.133 -11.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.489 -0.622 -11.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.608 -1.969 -11.916 1.00 0.00 H new ATOM 308 N VAL A 21 -8.702 1.980 -4.748 1.00 0.00 N ATOM 309 CA VAL A 21 -8.756 2.461 -3.373 1.00 0.00 C ATOM 310 C VAL A 21 -9.131 3.939 -3.324 1.00 0.00 C ATOM 311 O VAL A 21 -9.502 4.461 -2.273 1.00 0.00 O ATOM 312 CB VAL A 21 -7.408 2.262 -2.655 1.00 0.00 C ATOM 313 CG1 VAL A 21 -7.563 2.481 -1.158 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.851 0.876 -2.945 1.00 0.00 C ATOM 0 H VAL A 21 -7.762 1.773 -5.086 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.521 1.876 -2.862 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.701 3.000 -3.034 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.600 2.336 -0.667 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.915 3.496 -0.973 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -8.285 1.768 -0.759 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.898 0.752 -2.430 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.554 0.121 -2.594 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.701 0.761 -4.019 1.00 0.00 H new ATOM 324 N ASP A 22 -9.034 4.606 -4.469 1.00 0.00 N ATOM 325 CA ASP A 22 -9.366 6.024 -4.557 1.00 0.00 C ATOM 326 C ASP A 22 -10.872 6.238 -4.448 1.00 0.00 C ATOM 327 O ASP A 22 -11.558 6.425 -5.454 1.00 0.00 O ATOM 328 CB ASP A 22 -8.849 6.610 -5.872 1.00 0.00 C ATOM 329 CG ASP A 22 -8.543 8.091 -5.764 1.00 0.00 C ATOM 330 OD1 ASP A 22 -8.256 8.714 -6.809 1.00 0.00 O ATOM 331 OD2 ASP A 22 -8.592 8.627 -4.638 1.00 0.00 O ATOM 0 H ASP A 22 -8.729 4.188 -5.348 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.884 6.537 -3.725 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -7.948 6.077 -6.175 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.591 6.451 -6.654 1.00 0.00 H new ATOM 336 N THR A 23 -11.383 6.206 -3.221 1.00 0.00 N ATOM 337 CA THR A 23 -12.808 6.394 -2.980 1.00 0.00 C ATOM 338 C THR A 23 -13.212 7.850 -3.180 1.00 0.00 C ATOM 339 O THR A 23 -14.255 8.140 -3.767 1.00 0.00 O ATOM 340 CB THR A 23 -13.200 5.954 -1.558 1.00 0.00 C ATOM 341 OG1 THR A 23 -12.153 6.281 -0.637 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.476 4.459 -1.510 1.00 0.00 C ATOM 0 H THR A 23 -10.830 6.051 -2.378 1.00 0.00 H new ATOM 0 HA THR A 23 -13.336 5.771 -3.703 1.00 0.00 H new ATOM 0 HB THR A 23 -14.110 6.484 -1.276 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.411 5.999 0.265 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.751 4.172 -0.495 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.294 4.218 -2.189 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.581 3.914 -1.811 1.00 0.00 H new ATOM 350 N ASP A 24 -12.380 8.762 -2.690 1.00 0.00 N ATOM 351 CA ASP A 24 -12.650 10.190 -2.817 1.00 0.00 C ATOM 352 C ASP A 24 -12.192 10.711 -4.175 1.00 0.00 C ATOM 353 O ASP A 24 -12.514 11.834 -4.561 1.00 0.00 O ATOM 354 CB ASP A 24 -11.951 10.964 -1.697 1.00 0.00 C ATOM 355 CG ASP A 24 -10.463 11.117 -1.941 1.00 0.00 C ATOM 356 OD1 ASP A 24 -9.882 12.111 -1.459 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.880 10.241 -2.613 1.00 0.00 O ATOM 0 H ASP A 24 -11.513 8.538 -2.201 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.726 10.340 -2.735 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.404 11.951 -1.604 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.110 10.449 -0.749 1.00 0.00 H new ATOM 362 N GLY A 25 -11.437 9.888 -4.896 1.00 0.00 N ATOM 363 CA GLY A 25 -10.946 10.284 -6.202 1.00 0.00 C ATOM 364 C GLY A 25 -10.001 11.467 -6.132 1.00 0.00 C ATOM 365 O GLY A 25 -10.265 12.517 -6.717 1.00 0.00 O ATOM 0 H GLY A 25 -11.157 8.954 -4.598 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.434 9.441 -6.665 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.791 10.535 -6.843 1.00 0.00 H new ATOM 369 N ASN A 26 -8.897 11.298 -5.413 1.00 0.00 N ATOM 370 CA ASN A 26 -7.910 12.362 -5.266 1.00 0.00 C ATOM 371 C ASN A 26 -6.604 11.993 -5.963 1.00 0.00 C ATOM 372 O ASN A 26 -5.757 12.850 -6.211 1.00 0.00 O ATOM 373 CB ASN A 26 -7.649 12.643 -3.785 1.00 0.00 C ATOM 374 CG ASN A 26 -6.984 11.475 -3.083 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.943 10.362 -3.609 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.459 11.723 -1.889 1.00 0.00 N ATOM 0 H ASN A 26 -8.663 10.435 -4.923 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.310 13.261 -5.735 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.018 13.527 -3.692 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.593 12.872 -3.290 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -5.998 10.976 -1.369 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -6.516 12.661 -1.492 1.00 0.00 H new ATOM 383 N GLY A 27 -6.449 10.711 -6.277 1.00 0.00 N ATOM 384 CA GLY A 27 -5.245 10.249 -6.942 1.00 0.00 C ATOM 385 C GLY A 27 -4.083 10.076 -5.985 1.00 0.00 C ATOM 386 O GLY A 27 -2.926 10.032 -6.403 1.00 0.00 O ATOM 0 H GLY A 27 -7.137 9.983 -6.082 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.449 9.299 -7.436 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.968 10.960 -7.720 1.00 0.00 H new ATOM 390 N TYR A 28 -4.390 9.978 -4.696 1.00 0.00 N ATOM 391 CA TYR A 28 -3.363 9.812 -3.676 1.00 0.00 C ATOM 392 C TYR A 28 -3.713 8.666 -2.731 1.00 0.00 C ATOM 393 O TYR A 28 -4.884 8.340 -2.540 1.00 0.00 O ATOM 394 CB TYR A 28 -3.190 11.107 -2.881 1.00 0.00 C ATOM 395 CG TYR A 28 -2.323 12.133 -3.576 1.00 0.00 C ATOM 396 CD1 TYR A 28 -0.962 11.915 -3.753 1.00 0.00 C ATOM 397 CD2 TYR A 28 -2.864 13.320 -4.055 1.00 0.00 C ATOM 398 CE1 TYR A 28 -0.166 12.849 -4.387 1.00 0.00 C ATOM 399 CE2 TYR A 28 -2.076 14.258 -4.691 1.00 0.00 C ATOM 400 CZ TYR A 28 -0.727 14.019 -4.855 1.00 0.00 C ATOM 401 OH TYR A 28 0.061 14.953 -5.486 1.00 0.00 O ATOM 0 H TYR A 28 -5.343 10.011 -4.333 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.425 9.572 -4.177 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.172 11.541 -2.692 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.753 10.872 -1.910 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -0.519 11.000 -3.389 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -3.919 13.512 -3.927 1.00 0.00 H new ATOM 0 HE1 TYR A 28 0.890 12.664 -4.516 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -2.513 15.175 -5.058 1.00 0.00 H new ATOM 0 HH TYR A 28 -0.490 15.718 -5.755 1.00 0.00 H new ATOM 411 N ILE A 29 -2.687 8.058 -2.143 1.00 0.00 N ATOM 412 CA ILE A 29 -2.886 6.950 -1.217 1.00 0.00 C ATOM 413 C ILE A 29 -2.051 7.133 0.046 1.00 0.00 C ATOM 414 O ILE A 29 -0.863 7.445 -0.023 1.00 0.00 O ATOM 415 CB ILE A 29 -2.523 5.602 -1.868 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.589 5.202 -2.890 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.371 4.524 -0.804 1.00 0.00 C ATOM 418 CD1 ILE A 29 -3.324 3.864 -3.546 1.00 0.00 C ATOM 0 H ILE A 29 -1.711 8.314 -2.292 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.943 6.944 -0.953 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.571 5.710 -2.387 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.560 5.170 -2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.648 5.970 -3.661 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.114 3.577 -1.279 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.580 4.807 -0.109 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.309 4.415 -0.260 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -4.119 3.644 -4.258 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.368 3.898 -4.068 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.294 3.085 -2.784 1.00 0.00 H new ATOM 430 N SER A 30 -2.681 6.935 1.199 1.00 0.00 N ATOM 431 CA SER A 30 -1.998 7.080 2.478 1.00 0.00 C ATOM 432 C SER A 30 -1.683 5.715 3.084 1.00 0.00 C ATOM 433 O SER A 30 -1.852 4.682 2.437 1.00 0.00 O ATOM 434 CB SER A 30 -2.855 7.895 3.448 1.00 0.00 C ATOM 435 OG SER A 30 -3.545 8.932 2.772 1.00 0.00 O ATOM 0 H SER A 30 -3.664 6.674 1.273 1.00 0.00 H new ATOM 0 HA SER A 30 -1.059 7.606 2.303 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.572 7.240 3.943 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.223 8.322 4.226 1.00 0.00 H new ATOM 0 HG SER A 30 -4.087 9.437 3.414 1.00 0.00 H new ATOM 441 N PHE A 31 -1.224 5.720 4.330 1.00 0.00 N ATOM 442 CA PHE A 31 -0.883 4.483 5.025 1.00 0.00 C ATOM 443 C PHE A 31 -2.143 3.735 5.452 1.00 0.00 C ATOM 444 O PHE A 31 -2.186 2.506 5.425 1.00 0.00 O ATOM 445 CB PHE A 31 -0.014 4.783 6.248 1.00 0.00 C ATOM 446 CG PHE A 31 -0.212 3.811 7.376 1.00 0.00 C ATOM 447 CD1 PHE A 31 0.556 2.660 7.459 1.00 0.00 C ATOM 448 CD2 PHE A 31 -1.164 4.047 8.353 1.00 0.00 C ATOM 449 CE1 PHE A 31 0.378 1.763 8.495 1.00 0.00 C ATOM 450 CE2 PHE A 31 -1.347 3.154 9.393 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.576 2.010 9.463 1.00 0.00 C ATOM 0 H PHE A 31 -1.079 6.566 4.880 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.322 3.851 4.337 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.034 4.773 5.950 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.235 5.790 6.603 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.303 2.462 6.704 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.771 4.939 8.302 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.984 0.870 8.548 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -2.092 3.351 10.150 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.719 1.310 10.273 1.00 0.00 H new ATOM 461 N ASN A 32 -3.164 4.487 5.849 1.00 0.00 N ATOM 462 CA ASN A 32 -4.425 3.896 6.283 1.00 0.00 C ATOM 463 C ASN A 32 -5.067 3.094 5.156 1.00 0.00 C ATOM 464 O ASN A 32 -5.563 1.989 5.372 1.00 0.00 O ATOM 465 CB ASN A 32 -5.386 4.987 6.760 1.00 0.00 C ATOM 466 CG ASN A 32 -6.763 4.442 7.088 1.00 0.00 C ATOM 467 OD1 ASN A 32 -6.892 3.384 7.705 1.00 0.00 O ATOM 468 ND2 ASN A 32 -7.799 5.164 6.676 1.00 0.00 N ATOM 0 H ASN A 32 -3.143 5.506 5.879 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.214 3.219 7.111 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.971 5.472 7.643 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -5.475 5.752 5.988 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.750 4.848 6.868 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.644 6.035 6.168 1.00 0.00 H new ATOM 475 N GLU A 33 -5.054 3.659 3.952 1.00 0.00 N ATOM 476 CA GLU A 33 -5.635 2.996 2.791 1.00 0.00 C ATOM 477 C GLU A 33 -4.935 1.668 2.515 1.00 0.00 C ATOM 478 O GLU A 33 -5.573 0.617 2.458 1.00 0.00 O ATOM 479 CB GLU A 33 -5.542 3.900 1.560 1.00 0.00 C ATOM 480 CG GLU A 33 -5.877 5.354 1.845 1.00 0.00 C ATOM 481 CD GLU A 33 -6.318 6.105 0.604 1.00 0.00 C ATOM 482 OE1 GLU A 33 -5.793 7.213 0.364 1.00 0.00 O ATOM 483 OE2 GLU A 33 -7.188 5.586 -0.126 1.00 0.00 O ATOM 0 H GLU A 33 -4.648 4.574 3.756 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.684 2.795 3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.533 3.842 1.153 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.218 3.524 0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.668 5.401 2.594 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.004 5.847 2.272 1.00 0.00 H new ATOM 490 N LEU A 34 -3.619 1.724 2.343 1.00 0.00 N ATOM 491 CA LEU A 34 -2.830 0.528 2.074 1.00 0.00 C ATOM 492 C LEU A 34 -2.986 -0.493 3.197 1.00 0.00 C ATOM 493 O LEU A 34 -3.418 -1.622 2.968 1.00 0.00 O ATOM 494 CB LEU A 34 -1.355 0.893 1.902 1.00 0.00 C ATOM 495 CG LEU A 34 -0.961 1.474 0.543 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.536 1.735 0.488 1.00 0.00 C ATOM 497 CD2 LEU A 34 -1.383 0.537 -0.580 1.00 0.00 C ATOM 0 H LEU A 34 -3.076 2.586 2.385 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.197 0.082 1.150 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.087 1.614 2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.757 -0.001 2.080 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.479 2.424 0.411 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.798 2.148 -0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.811 2.444 1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.074 0.800 0.642 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.095 0.966 -1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.893 -0.428 -0.452 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.464 0.401 -0.553 1.00 0.00 H new ATOM 509 N ASN A 35 -2.633 -0.085 4.412 1.00 0.00 N ATOM 510 CA ASN A 35 -2.735 -0.963 5.571 1.00 0.00 C ATOM 511 C ASN A 35 -4.122 -1.594 5.656 1.00 0.00 C ATOM 512 O ASN A 35 -4.265 -2.756 6.041 1.00 0.00 O ATOM 513 CB ASN A 35 -2.437 -0.185 6.854 1.00 0.00 C ATOM 514 CG ASN A 35 -2.569 -1.045 8.097 1.00 0.00 C ATOM 515 OD1 ASN A 35 -1.615 -1.700 8.516 1.00 0.00 O ATOM 516 ND2 ASN A 35 -3.756 -1.048 8.690 1.00 0.00 N ATOM 0 H ASN A 35 -2.274 0.847 4.619 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.000 -1.759 5.458 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.427 0.222 6.803 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.118 0.663 6.928 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.906 -1.609 9.529 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -4.519 -0.489 8.307 1.00 0.00 H new ATOM 523 N ASP A 36 -5.140 -0.822 5.293 1.00 0.00 N ATOM 524 CA ASP A 36 -6.515 -1.305 5.326 1.00 0.00 C ATOM 525 C ASP A 36 -6.729 -2.408 4.295 1.00 0.00 C ATOM 526 O ASP A 36 -7.275 -3.468 4.606 1.00 0.00 O ATOM 527 CB ASP A 36 -7.489 -0.154 5.068 1.00 0.00 C ATOM 528 CG ASP A 36 -8.935 -0.608 5.066 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.645 -0.322 4.079 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.356 -1.250 6.050 1.00 0.00 O ATOM 0 H ASP A 36 -5.039 0.141 4.972 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.705 -1.717 6.317 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.353 0.611 5.832 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.255 0.308 4.109 1.00 0.00 H new ATOM 535 N LEU A 37 -6.295 -2.154 3.065 1.00 0.00 N ATOM 536 CA LEU A 37 -6.439 -3.125 1.986 1.00 0.00 C ATOM 537 C LEU A 37 -5.679 -4.408 2.305 1.00 0.00 C ATOM 538 O LEU A 37 -6.088 -5.499 1.908 1.00 0.00 O ATOM 539 CB LEU A 37 -5.934 -2.533 0.670 1.00 0.00 C ATOM 540 CG LEU A 37 -5.974 -3.463 -0.544 1.00 0.00 C ATOM 541 CD1 LEU A 37 -6.717 -2.806 -1.696 1.00 0.00 C ATOM 542 CD2 LEU A 37 -4.564 -3.847 -0.968 1.00 0.00 C ATOM 0 H LEU A 37 -5.840 -1.283 2.790 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.497 -3.366 1.885 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.526 -1.646 0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.906 -2.201 0.815 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.509 -4.371 -0.264 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.735 -3.483 -2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -7.739 -2.582 -1.389 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.211 -1.882 -1.976 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.612 -4.509 -1.833 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.005 -2.948 -1.229 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.064 -4.359 -0.146 1.00 0.00 H new ATOM 554 N PHE A 38 -4.570 -4.271 3.024 1.00 0.00 N ATOM 555 CA PHE A 38 -3.753 -5.419 3.397 1.00 0.00 C ATOM 556 C PHE A 38 -4.322 -6.114 4.631 1.00 0.00 C ATOM 557 O PHE A 38 -4.144 -7.318 4.818 1.00 0.00 O ATOM 558 CB PHE A 38 -2.311 -4.981 3.664 1.00 0.00 C ATOM 559 CG PHE A 38 -1.705 -4.194 2.538 1.00 0.00 C ATOM 560 CD1 PHE A 38 -2.092 -4.425 1.227 1.00 0.00 C ATOM 561 CD2 PHE A 38 -0.750 -3.224 2.789 1.00 0.00 C ATOM 562 CE1 PHE A 38 -1.537 -3.702 0.188 1.00 0.00 C ATOM 563 CE2 PHE A 38 -0.191 -2.498 1.754 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.584 -2.739 0.452 1.00 0.00 C ATOM 0 H PHE A 38 -4.216 -3.375 3.360 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.763 -6.125 2.567 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.285 -4.379 4.572 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.700 -5.864 3.849 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.836 -5.179 1.015 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.438 -3.032 3.805 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.848 -3.890 -0.829 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.552 -1.743 1.963 1.00 0.00 H new ATOM 0 HZ PHE A 38 -0.146 -2.175 -0.358 1.00 0.00 H new ATOM 574 N LYS A 39 -5.009 -5.347 5.471 1.00 0.00 N ATOM 575 CA LYS A 39 -5.605 -5.886 6.687 1.00 0.00 C ATOM 576 C LYS A 39 -6.914 -6.608 6.377 1.00 0.00 C ATOM 577 O LYS A 39 -7.315 -7.521 7.097 1.00 0.00 O ATOM 578 CB LYS A 39 -5.856 -4.764 7.697 1.00 0.00 C ATOM 579 CG LYS A 39 -4.765 -4.636 8.746 1.00 0.00 C ATOM 580 CD LYS A 39 -5.096 -5.434 9.996 1.00 0.00 C ATOM 581 CE LYS A 39 -5.253 -6.915 9.686 1.00 0.00 C ATOM 582 NZ LYS A 39 -5.124 -7.755 10.910 1.00 0.00 N ATOM 0 H LYS A 39 -5.167 -4.349 5.331 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.907 -6.604 7.117 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.947 -3.819 7.162 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.809 -4.941 8.195 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -3.818 -4.983 8.332 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -4.632 -3.586 9.008 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.307 -5.298 10.736 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.017 -5.054 10.438 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.226 -7.089 9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -4.499 -7.216 8.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.237 -8.757 10.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.186 -7.609 11.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -5.859 -7.486 11.595 1.00 0.00 H new ATOM 596 N ALA A 40 -7.574 -6.190 5.302 1.00 0.00 N ATOM 597 CA ALA A 40 -8.834 -6.798 4.896 1.00 0.00 C ATOM 598 C ALA A 40 -8.595 -8.019 4.012 1.00 0.00 C ATOM 599 O ALA A 40 -9.441 -8.909 3.925 1.00 0.00 O ATOM 600 CB ALA A 40 -9.702 -5.781 4.169 1.00 0.00 C ATOM 0 H ALA A 40 -7.257 -5.433 4.697 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.355 -7.128 5.795 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.640 -6.250 3.872 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.910 -4.941 4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.178 -5.423 3.283 1.00 0.00 H new ATOM 606 N ALA A 41 -7.439 -8.054 3.358 1.00 0.00 N ATOM 607 CA ALA A 41 -7.089 -9.165 2.484 1.00 0.00 C ATOM 608 C ALA A 41 -7.154 -10.493 3.230 1.00 0.00 C ATOM 609 O ALA A 41 -7.335 -11.549 2.623 1.00 0.00 O ATOM 610 CB ALA A 41 -5.702 -8.956 1.893 1.00 0.00 C ATOM 0 H ALA A 41 -6.729 -7.324 3.417 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.816 -9.199 1.673 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.454 -9.794 1.242 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.688 -8.032 1.316 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.969 -8.892 2.698 1.00 0.00 H new ATOM 616 N CYS A 42 -7.004 -10.433 4.549 1.00 0.00 N ATOM 617 CA CYS A 42 -7.043 -11.632 5.378 1.00 0.00 C ATOM 618 C CYS A 42 -6.078 -12.690 4.853 1.00 0.00 C ATOM 619 O CYS A 42 -6.478 -13.610 4.139 1.00 0.00 O ATOM 620 CB CYS A 42 -8.463 -12.198 5.424 1.00 0.00 C ATOM 621 SG CYS A 42 -9.655 -11.135 6.274 1.00 0.00 S ATOM 0 H CYS A 42 -6.854 -9.567 5.067 1.00 0.00 H new ATOM 0 HA CYS A 42 -6.736 -11.356 6.387 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -8.808 -12.369 4.404 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.440 -13.169 5.920 1.00 0.00 H new ATOM 0 HG CYS A 42 -9.843 -10.052 5.580 1.00 0.00 H new ATOM 627 N LEU A 43 -4.806 -12.550 5.208 1.00 0.00 N ATOM 628 CA LEU A 43 -3.782 -13.493 4.770 1.00 0.00 C ATOM 629 C LEU A 43 -3.147 -14.199 5.964 1.00 0.00 C ATOM 630 O LEU A 43 -3.174 -13.709 7.092 1.00 0.00 O ATOM 631 CB LEU A 43 -2.705 -12.767 3.961 1.00 0.00 C ATOM 632 CG LEU A 43 -3.039 -12.493 2.494 1.00 0.00 C ATOM 633 CD1 LEU A 43 -1.924 -11.697 1.833 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.277 -13.799 1.749 1.00 0.00 C ATOM 0 H LEU A 43 -4.459 -11.793 5.797 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.259 -14.243 4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.492 -11.816 4.448 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.789 -13.357 4.000 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.954 -11.902 2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.179 -11.511 0.790 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.799 -10.746 2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.994 -12.263 1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.513 -13.585 0.707 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.379 -14.415 1.799 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.109 -14.333 2.208 1.00 0.00 H new ATOM 646 N PRO A 44 -2.560 -15.379 5.710 1.00 0.00 N ATOM 647 CA PRO A 44 -1.905 -16.176 6.750 1.00 0.00 C ATOM 648 C PRO A 44 -0.617 -15.532 7.250 1.00 0.00 C ATOM 649 O PRO A 44 0.483 -15.974 6.913 1.00 0.00 O ATOM 650 CB PRO A 44 -1.601 -17.500 6.044 1.00 0.00 C ATOM 651 CG PRO A 44 -1.513 -17.146 4.599 1.00 0.00 C ATOM 652 CD PRO A 44 -2.490 -16.023 4.388 1.00 0.00 C ATOM 0 HA PRO A 44 -2.531 -16.283 7.636 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -0.668 -17.935 6.403 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.386 -18.235 6.225 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.502 -16.838 4.333 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -1.761 -18.002 3.972 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.145 -15.329 3.621 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.464 -16.393 4.069 1.00 0.00 H new ATOM 660 N LEU A 45 -0.758 -14.485 8.056 1.00 0.00 N ATOM 661 CA LEU A 45 0.395 -13.780 8.603 1.00 0.00 C ATOM 662 C LEU A 45 0.001 -12.962 9.830 1.00 0.00 C ATOM 663 O LEU A 45 -1.161 -12.603 10.020 1.00 0.00 O ATOM 664 CB LEU A 45 1.010 -12.865 7.543 1.00 0.00 C ATOM 665 CG LEU A 45 0.028 -11.997 6.754 1.00 0.00 C ATOM 666 CD1 LEU A 45 0.100 -10.551 7.221 1.00 0.00 C ATOM 667 CD2 LEU A 45 0.310 -12.092 5.263 1.00 0.00 C ATOM 0 H LEU A 45 -1.660 -14.106 8.345 1.00 0.00 H new ATOM 0 HA LEU A 45 1.133 -14.523 8.905 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.731 -12.210 8.031 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.566 -13.482 6.838 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.981 -12.367 6.936 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.605 -9.948 6.649 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.153 -10.498 8.280 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.110 -10.170 7.069 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.398 -11.468 4.718 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.325 -11.749 5.062 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.206 -13.127 4.938 1.00 0.00 H new ATOM 679 N PRO A 46 0.992 -12.658 10.682 1.00 0.00 N ATOM 680 CA PRO A 46 0.775 -11.876 11.902 1.00 0.00 C ATOM 681 C PRO A 46 0.448 -10.416 11.605 1.00 0.00 C ATOM 682 O PRO A 46 0.226 -10.041 10.456 1.00 0.00 O ATOM 683 CB PRO A 46 2.111 -11.987 12.638 1.00 0.00 C ATOM 684 CG PRO A 46 3.113 -12.243 11.566 1.00 0.00 C ATOM 685 CD PRO A 46 2.401 -13.053 10.518 1.00 0.00 C ATOM 0 HA PRO A 46 -0.074 -12.245 12.477 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.340 -11.072 13.184 1.00 0.00 H new ATOM 0 HB3 PRO A 46 2.095 -12.797 13.367 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.486 -11.307 11.149 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.975 -12.783 11.958 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.768 -12.827 9.517 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.539 -14.123 10.674 1.00 0.00 H new ATOM 693 N GLY A 47 0.422 -9.596 12.652 1.00 0.00 N ATOM 694 CA GLY A 47 0.124 -8.186 12.482 1.00 0.00 C ATOM 695 C GLY A 47 1.316 -7.397 11.977 1.00 0.00 C ATOM 696 O GLY A 47 1.202 -6.633 11.018 1.00 0.00 O ATOM 0 H GLY A 47 0.602 -9.883 13.614 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.704 -8.075 11.782 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.206 -7.770 13.434 1.00 0.00 H new ATOM 700 N TYR A 48 2.461 -7.581 12.624 1.00 0.00 N ATOM 701 CA TYR A 48 3.678 -6.877 12.238 1.00 0.00 C ATOM 702 C TYR A 48 3.963 -7.057 10.750 1.00 0.00 C ATOM 703 O TYR A 48 4.590 -6.206 10.119 1.00 0.00 O ATOM 704 CB TYR A 48 4.866 -7.380 13.060 1.00 0.00 C ATOM 705 CG TYR A 48 5.620 -8.514 12.404 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.697 -8.264 11.562 1.00 0.00 C ATOM 707 CD2 TYR A 48 5.254 -9.837 12.624 1.00 0.00 C ATOM 708 CE1 TYR A 48 7.388 -9.296 10.960 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.942 -10.875 12.027 1.00 0.00 C ATOM 710 CZ TYR A 48 7.007 -10.601 11.195 1.00 0.00 C ATOM 711 OH TYR A 48 7.693 -11.633 10.599 1.00 0.00 O ATOM 0 H TYR A 48 2.572 -8.212 13.418 1.00 0.00 H new ATOM 0 HA TYR A 48 3.531 -5.815 12.436 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.553 -6.552 13.235 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.508 -7.709 14.036 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.999 -7.244 11.375 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.418 -10.057 13.272 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.223 -9.083 10.308 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.647 -11.898 12.211 1.00 0.00 H new ATOM 0 HH TYR A 48 7.298 -12.488 10.870 1.00 0.00 H new ATOM 721 N ARG A 49 3.496 -8.171 10.195 1.00 0.00 N ATOM 722 CA ARG A 49 3.700 -8.464 8.782 1.00 0.00 C ATOM 723 C ARG A 49 3.040 -7.403 7.906 1.00 0.00 C ATOM 724 O ARG A 49 3.713 -6.692 7.160 1.00 0.00 O ATOM 725 CB ARG A 49 3.138 -9.845 8.440 1.00 0.00 C ATOM 726 CG ARG A 49 4.209 -10.904 8.234 1.00 0.00 C ATOM 727 CD ARG A 49 5.123 -10.552 7.071 1.00 0.00 C ATOM 728 NE ARG A 49 5.220 -11.640 6.102 1.00 0.00 N ATOM 729 CZ ARG A 49 5.925 -11.563 4.978 1.00 0.00 C ATOM 730 NH1 ARG A 49 6.591 -10.455 4.684 1.00 0.00 N ATOM 731 NH2 ARG A 49 5.964 -12.596 4.146 1.00 0.00 N ATOM 0 H ARG A 49 2.974 -8.885 10.703 1.00 0.00 H new ATOM 0 HA ARG A 49 4.772 -8.457 8.586 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.471 -10.165 9.241 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.535 -9.769 7.535 1.00 0.00 H new ATOM 0 HG2 ARG A 49 4.800 -11.008 9.144 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.737 -11.869 8.049 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.749 -9.657 6.574 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.117 -10.315 7.450 1.00 0.00 H new ATOM 0 HE ARG A 49 4.719 -12.507 6.299 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.563 -9.659 5.321 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.131 -10.399 3.821 1.00 0.00 H new ATOM 0 HH21 ARG A 49 5.453 -13.450 4.369 1.00 0.00 H new ATOM 0 HH22 ARG A 49 6.505 -12.536 3.284 1.00 0.00 H new ATOM 745 N VAL A 50 1.718 -7.304 8.001 1.00 0.00 N ATOM 746 CA VAL A 50 0.966 -6.330 7.218 1.00 0.00 C ATOM 747 C VAL A 50 1.417 -4.908 7.530 1.00 0.00 C ATOM 748 O VAL A 50 1.472 -4.055 6.645 1.00 0.00 O ATOM 749 CB VAL A 50 -0.548 -6.446 7.480 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.836 -6.388 8.972 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.302 -5.353 6.739 1.00 0.00 C ATOM 0 H VAL A 50 1.145 -7.886 8.612 1.00 0.00 H new ATOM 0 HA VAL A 50 1.163 -6.549 6.168 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.892 -7.410 7.105 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.910 -6.471 9.139 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.326 -7.211 9.473 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.479 -5.440 9.375 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.370 -5.450 6.935 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.957 -4.377 7.081 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.120 -5.447 5.668 1.00 0.00 H new ATOM 761 N ARG A 51 1.739 -4.659 8.796 1.00 0.00 N ATOM 762 CA ARG A 51 2.185 -3.339 9.226 1.00 0.00 C ATOM 763 C ARG A 51 3.569 -3.025 8.669 1.00 0.00 C ATOM 764 O ARG A 51 3.911 -1.862 8.451 1.00 0.00 O ATOM 765 CB ARG A 51 2.207 -3.258 10.754 1.00 0.00 C ATOM 766 CG ARG A 51 1.919 -1.868 11.295 1.00 0.00 C ATOM 767 CD ARG A 51 2.660 -1.611 12.597 1.00 0.00 C ATOM 768 NE ARG A 51 1.934 -0.690 13.467 1.00 0.00 N ATOM 769 CZ ARG A 51 2.318 -0.391 14.704 1.00 0.00 C ATOM 770 NH1 ARG A 51 3.414 -0.938 15.212 1.00 0.00 N ATOM 771 NH2 ARG A 51 1.605 0.458 15.433 1.00 0.00 N ATOM 0 H ARG A 51 1.699 -5.354 9.541 1.00 0.00 H new ATOM 0 HA ARG A 51 1.482 -2.601 8.840 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.472 -3.955 11.157 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.184 -3.583 11.112 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.210 -1.122 10.556 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.847 -1.755 11.457 1.00 0.00 H new ATOM 0 HD2 ARG A 51 2.815 -2.556 13.118 1.00 0.00 H new ATOM 0 HD3 ARG A 51 3.646 -1.202 12.378 1.00 0.00 H new ATOM 0 HE ARG A 51 1.086 -0.252 13.106 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.965 -1.590 14.653 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.706 -0.707 16.161 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.762 0.881 15.044 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.900 0.687 16.382 1.00 0.00 H new ATOM 785 N GLU A 52 4.360 -4.068 8.439 1.00 0.00 N ATOM 786 CA GLU A 52 5.708 -3.901 7.908 1.00 0.00 C ATOM 787 C GLU A 52 5.669 -3.588 6.414 1.00 0.00 C ATOM 788 O GLU A 52 6.355 -2.681 5.942 1.00 0.00 O ATOM 789 CB GLU A 52 6.537 -5.164 8.154 1.00 0.00 C ATOM 790 CG GLU A 52 7.979 -5.045 7.690 1.00 0.00 C ATOM 791 CD GLU A 52 8.617 -6.393 7.417 1.00 0.00 C ATOM 792 OE1 GLU A 52 9.145 -7.003 8.370 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.588 -6.839 6.251 1.00 0.00 O ATOM 0 H GLU A 52 4.091 -5.037 8.612 1.00 0.00 H new ATOM 0 HA GLU A 52 6.174 -3.063 8.426 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.525 -5.395 9.219 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.067 -6.003 7.641 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.017 -4.439 6.784 1.00 0.00 H new ATOM 0 HG3 GLU A 52 8.559 -4.520 8.449 1.00 0.00 H new ATOM 800 N ILE A 53 4.862 -4.345 5.678 1.00 0.00 N ATOM 801 CA ILE A 53 4.734 -4.148 4.240 1.00 0.00 C ATOM 802 C ILE A 53 4.113 -2.791 3.923 1.00 0.00 C ATOM 803 O ILE A 53 4.509 -2.121 2.969 1.00 0.00 O ATOM 804 CB ILE A 53 3.878 -5.254 3.594 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.496 -5.305 4.248 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.576 -6.600 3.711 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.597 -6.380 3.677 1.00 0.00 C ATOM 0 H ILE A 53 4.288 -5.100 6.054 1.00 0.00 H new ATOM 0 HA ILE A 53 5.741 -4.190 3.826 1.00 0.00 H new ATOM 0 HB ILE A 53 3.751 -5.024 2.536 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.615 -5.473 5.318 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.011 -4.336 4.130 1.00 0.00 H new ATOM 0 HG21 ILE A 53 3.959 -7.371 3.250 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.540 -6.555 3.204 1.00 0.00 H new ATOM 0 HG23 ILE A 53 4.730 -6.840 4.763 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.634 -6.358 4.188 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.447 -6.201 2.612 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.061 -7.356 3.819 1.00 0.00 H new ATOM 819 N THR A 54 3.140 -2.389 4.734 1.00 0.00 N ATOM 820 CA THR A 54 2.464 -1.111 4.542 1.00 0.00 C ATOM 821 C THR A 54 3.360 0.051 4.954 1.00 0.00 C ATOM 822 O THR A 54 3.365 1.100 4.310 1.00 0.00 O ATOM 823 CB THR A 54 1.152 -1.043 5.346 1.00 0.00 C ATOM 824 OG1 THR A 54 0.419 0.133 4.989 1.00 0.00 O ATOM 825 CG2 THR A 54 1.433 -1.038 6.840 1.00 0.00 C ATOM 0 H THR A 54 2.802 -2.930 5.530 1.00 0.00 H new ATOM 0 HA THR A 54 2.234 -1.031 3.479 1.00 0.00 H new ATOM 0 HB THR A 54 0.559 -1.926 5.107 1.00 0.00 H new ATOM 0 HG1 THR A 54 0.505 0.801 5.701 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.492 -0.990 7.387 1.00 0.00 H new ATOM 0 HG22 THR A 54 1.965 -1.949 7.113 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.044 -0.172 7.092 1.00 0.00 H new ATOM 833 N GLU A 55 4.117 -0.143 6.029 1.00 0.00 N ATOM 834 CA GLU A 55 5.017 0.892 6.526 1.00 0.00 C ATOM 835 C GLU A 55 6.158 1.137 5.543 1.00 0.00 C ATOM 836 O GLU A 55 6.463 2.280 5.204 1.00 0.00 O ATOM 837 CB GLU A 55 5.581 0.494 7.891 1.00 0.00 C ATOM 838 CG GLU A 55 4.683 0.876 9.056 1.00 0.00 C ATOM 839 CD GLU A 55 5.275 0.494 10.398 1.00 0.00 C ATOM 840 OE1 GLU A 55 5.233 1.331 11.324 1.00 0.00 O ATOM 841 OE2 GLU A 55 5.780 -0.641 10.524 1.00 0.00 O ATOM 0 H GLU A 55 4.125 -1.006 6.572 1.00 0.00 H new ATOM 0 HA GLU A 55 4.447 1.815 6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.744 -0.584 7.907 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.555 0.966 8.024 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.504 1.951 9.035 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.715 0.389 8.938 1.00 0.00 H new ATOM 848 N ASN A 56 6.784 0.056 5.090 1.00 0.00 N ATOM 849 CA ASN A 56 7.892 0.154 4.147 1.00 0.00 C ATOM 850 C ASN A 56 7.411 0.666 2.793 1.00 0.00 C ATOM 851 O ASN A 56 8.058 1.510 2.171 1.00 0.00 O ATOM 852 CB ASN A 56 8.568 -1.209 3.980 1.00 0.00 C ATOM 853 CG ASN A 56 9.279 -1.662 5.241 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.229 -0.988 6.270 1.00 0.00 O ATOM 855 ND2 ASN A 56 9.947 -2.806 5.165 1.00 0.00 N ATOM 0 H ASN A 56 6.543 -0.898 5.360 1.00 0.00 H new ATOM 0 HA ASN A 56 8.615 0.864 4.547 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.819 -1.951 3.702 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.285 -1.158 3.161 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.447 -3.160 5.981 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.961 -3.331 4.291 1.00 0.00 H new ATOM 862 N LEU A 57 6.273 0.150 2.343 1.00 0.00 N ATOM 863 CA LEU A 57 5.703 0.555 1.062 1.00 0.00 C ATOM 864 C LEU A 57 5.387 2.047 1.055 1.00 0.00 C ATOM 865 O LEU A 57 5.642 2.741 0.071 1.00 0.00 O ATOM 866 CB LEU A 57 4.436 -0.248 0.768 1.00 0.00 C ATOM 867 CG LEU A 57 3.801 -0.023 -0.604 1.00 0.00 C ATOM 868 CD1 LEU A 57 4.829 -0.221 -1.706 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.615 -0.955 -0.803 1.00 0.00 C ATOM 0 H LEU A 57 5.726 -0.549 2.845 1.00 0.00 H new ATOM 0 HA LEU A 57 6.440 0.355 0.284 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.670 -1.308 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.695 -0.012 1.532 1.00 0.00 H new ATOM 0 HG LEU A 57 3.441 1.005 -0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.359 -0.057 -2.676 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.646 0.489 -1.574 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.221 -1.237 -1.660 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.176 -0.780 -1.785 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.950 -1.990 -0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.868 -0.763 -0.032 1.00 0.00 H new ATOM 881 N MET A 58 4.831 2.535 2.160 1.00 0.00 N ATOM 882 CA MET A 58 4.484 3.946 2.281 1.00 0.00 C ATOM 883 C MET A 58 5.737 4.809 2.369 1.00 0.00 C ATOM 884 O MET A 58 5.796 5.895 1.792 1.00 0.00 O ATOM 885 CB MET A 58 3.606 4.172 3.514 1.00 0.00 C ATOM 886 CG MET A 58 2.180 3.677 3.344 1.00 0.00 C ATOM 887 SD MET A 58 1.265 4.606 2.099 1.00 0.00 S ATOM 888 CE MET A 58 1.418 6.272 2.740 1.00 0.00 C ATOM 0 H MET A 58 4.612 1.974 2.983 1.00 0.00 H new ATOM 0 HA MET A 58 3.928 4.236 1.389 1.00 0.00 H new ATOM 0 HB2 MET A 58 4.057 3.668 4.368 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.587 5.237 3.746 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.196 2.623 3.066 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.659 3.747 4.299 1.00 0.00 H new ATOM 0 HE1 MET A 58 0.733 6.931 2.207 1.00 0.00 H new ATOM 0 HE2 MET A 58 1.173 6.277 3.802 1.00 0.00 H new ATOM 0 HE3 MET A 58 2.441 6.623 2.602 1.00 0.00 H new ATOM 898 N ALA A 59 6.738 4.320 3.094 1.00 0.00 N ATOM 899 CA ALA A 59 7.991 5.047 3.255 1.00 0.00 C ATOM 900 C ALA A 59 8.752 5.128 1.937 1.00 0.00 C ATOM 901 O ALA A 59 9.197 6.201 1.529 1.00 0.00 O ATOM 902 CB ALA A 59 8.851 4.386 4.324 1.00 0.00 C ATOM 0 H ALA A 59 6.705 3.423 3.579 1.00 0.00 H new ATOM 0 HA ALA A 59 7.755 6.063 3.571 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.784 4.939 4.434 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.315 4.386 5.273 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.070 3.359 4.031 1.00 0.00 H new ATOM 908 N THR A 60 8.901 3.985 1.273 1.00 0.00 N ATOM 909 CA THR A 60 9.610 3.927 0.001 1.00 0.00 C ATOM 910 C THR A 60 8.714 4.372 -1.149 1.00 0.00 C ATOM 911 O THR A 60 9.167 4.510 -2.284 1.00 0.00 O ATOM 912 CB THR A 60 10.130 2.506 -0.287 1.00 0.00 C ATOM 913 OG1 THR A 60 11.021 2.528 -1.408 1.00 0.00 O ATOM 914 CG2 THR A 60 8.976 1.555 -0.570 1.00 0.00 C ATOM 0 H THR A 60 8.540 3.087 1.596 1.00 0.00 H new ATOM 0 HA THR A 60 10.458 4.607 0.080 1.00 0.00 H new ATOM 0 HB THR A 60 10.664 2.153 0.595 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.671 3.137 -2.092 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.367 0.558 -0.771 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.314 1.518 0.295 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.419 1.907 -1.438 1.00 0.00 H new ATOM 922 N GLY A 61 7.438 4.596 -0.848 1.00 0.00 N ATOM 923 CA GLY A 61 6.499 5.024 -1.868 1.00 0.00 C ATOM 924 C GLY A 61 6.339 6.530 -1.912 1.00 0.00 C ATOM 925 O GLY A 61 5.929 7.088 -2.931 1.00 0.00 O ATOM 0 H GLY A 61 7.038 4.489 0.084 1.00 0.00 H new ATOM 0 HA2 GLY A 61 6.838 4.669 -2.841 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.529 4.564 -1.681 1.00 0.00 H new ATOM 929 N ASP A 62 6.660 7.191 -0.806 1.00 0.00 N ATOM 930 CA ASP A 62 6.549 8.642 -0.722 1.00 0.00 C ATOM 931 C ASP A 62 7.916 9.302 -0.871 1.00 0.00 C ATOM 932 O ASP A 62 8.748 9.244 0.035 1.00 0.00 O ATOM 933 CB ASP A 62 5.914 9.052 0.607 1.00 0.00 C ATOM 934 CG ASP A 62 4.500 9.571 0.439 1.00 0.00 C ATOM 935 OD1 ASP A 62 4.339 10.785 0.191 1.00 0.00 O ATOM 936 OD2 ASP A 62 3.554 8.765 0.553 1.00 0.00 O ATOM 0 H ASP A 62 7.000 6.744 0.046 1.00 0.00 H new ATOM 0 HA ASP A 62 5.911 8.979 -1.539 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.906 8.196 1.281 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.527 9.822 1.077 1.00 0.00 H new ATOM 941 N LEU A 63 8.143 9.928 -2.021 1.00 0.00 N ATOM 942 CA LEU A 63 9.411 10.597 -2.290 1.00 0.00 C ATOM 943 C LEU A 63 9.528 11.887 -1.482 1.00 0.00 C ATOM 944 O LEU A 63 10.492 12.081 -0.741 1.00 0.00 O ATOM 945 CB LEU A 63 9.542 10.905 -3.783 1.00 0.00 C ATOM 946 CG LEU A 63 9.990 9.743 -4.671 1.00 0.00 C ATOM 947 CD1 LEU A 63 11.346 9.221 -4.222 1.00 0.00 C ATOM 948 CD2 LEU A 63 8.954 8.628 -4.652 1.00 0.00 C ATOM 0 H LEU A 63 7.466 9.986 -2.782 1.00 0.00 H new ATOM 0 HA LEU A 63 10.217 9.927 -1.991 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.578 11.263 -4.146 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.252 11.723 -3.904 1.00 0.00 H new ATOM 0 HG LEU A 63 10.084 10.107 -5.694 1.00 0.00 H new ATOM 0 HD11 LEU A 63 11.649 8.395 -4.865 1.00 0.00 H new ATOM 0 HD12 LEU A 63 12.084 10.021 -4.287 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.279 8.873 -3.191 1.00 0.00 H new ATOM 0 HD21 LEU A 63 9.289 7.809 -5.289 1.00 0.00 H new ATOM 0 HD22 LEU A 63 8.828 8.266 -3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.002 9.009 -5.022 1.00 0.00 H new ATOM 960 N ASP A 64 8.540 12.762 -1.628 1.00 0.00 N ATOM 961 CA ASP A 64 8.529 14.031 -0.909 1.00 0.00 C ATOM 962 C ASP A 64 8.256 13.812 0.575 1.00 0.00 C ATOM 963 O ASP A 64 8.520 14.687 1.400 1.00 0.00 O ATOM 964 CB ASP A 64 7.477 14.969 -1.502 1.00 0.00 C ATOM 965 CG ASP A 64 7.439 14.914 -3.017 1.00 0.00 C ATOM 966 OD1 ASP A 64 8.252 15.615 -3.656 1.00 0.00 O ATOM 967 OD2 ASP A 64 6.599 14.170 -3.562 1.00 0.00 O ATOM 0 H ASP A 64 7.736 12.616 -2.238 1.00 0.00 H new ATOM 0 HA ASP A 64 9.512 14.489 -1.015 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.496 14.705 -1.107 1.00 0.00 H new ATOM 0 HB3 ASP A 64 7.685 15.991 -1.184 1.00 0.00 H new ATOM 972 N GLN A 65 7.726 12.640 0.908 1.00 0.00 N ATOM 973 CA GLN A 65 7.415 12.308 2.293 1.00 0.00 C ATOM 974 C GLN A 65 6.337 13.234 2.846 1.00 0.00 C ATOM 975 O GLN A 65 6.541 13.907 3.857 1.00 0.00 O ATOM 976 CB GLN A 65 8.674 12.399 3.156 1.00 0.00 C ATOM 977 CG GLN A 65 9.874 11.681 2.559 1.00 0.00 C ATOM 978 CD GLN A 65 11.151 11.935 3.336 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.624 11.071 4.076 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.719 13.124 3.171 1.00 0.00 N ATOM 0 H GLN A 65 7.503 11.904 0.238 1.00 0.00 H new ATOM 0 HA GLN A 65 7.038 11.286 2.319 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.927 13.449 3.306 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.462 11.979 4.139 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.676 10.609 2.533 1.00 0.00 H new ATOM 0 HG3 GLN A 65 10.010 12.005 1.527 1.00 0.00 H new ATOM 0 HE21 GLN A 65 11.293 13.810 2.548 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.581 13.351 3.667 1.00 0.00 H new ATOM 989 N ASP A 66 5.189 13.264 2.177 1.00 0.00 N ATOM 990 CA ASP A 66 4.078 14.108 2.603 1.00 0.00 C ATOM 991 C ASP A 66 2.970 13.270 3.234 1.00 0.00 C ATOM 992 O ASP A 66 2.121 13.789 3.957 1.00 0.00 O ATOM 993 CB ASP A 66 3.525 14.896 1.414 1.00 0.00 C ATOM 994 CG ASP A 66 4.615 15.354 0.466 1.00 0.00 C ATOM 995 OD1 ASP A 66 5.728 15.659 0.943 1.00 0.00 O ATOM 996 OD2 ASP A 66 4.355 15.406 -0.754 1.00 0.00 O ATOM 0 H ASP A 66 5.004 12.714 1.338 1.00 0.00 H new ATOM 0 HA ASP A 66 4.450 14.807 3.352 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.812 14.276 0.871 1.00 0.00 H new ATOM 0 HB3 ASP A 66 2.978 15.764 1.780 1.00 0.00 H new ATOM 1001 N GLY A 67 2.985 11.970 2.953 1.00 0.00 N ATOM 1002 CA GLY A 67 1.977 11.082 3.500 1.00 0.00 C ATOM 1003 C GLY A 67 0.945 10.672 2.469 1.00 0.00 C ATOM 1004 O GLY A 67 -0.168 10.276 2.816 1.00 0.00 O ATOM 0 H GLY A 67 3.677 11.517 2.356 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.461 10.191 3.900 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.477 11.575 4.334 1.00 0.00 H new ATOM 1008 N ARG A 68 1.313 10.766 1.195 1.00 0.00 N ATOM 1009 CA ARG A 68 0.410 10.405 0.109 1.00 0.00 C ATOM 1010 C ARG A 68 1.192 9.949 -1.119 1.00 0.00 C ATOM 1011 O ARG A 68 2.194 10.561 -1.491 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.486 11.590 -0.254 1.00 0.00 C ATOM 1013 CG ARG A 68 0.260 12.910 -0.350 1.00 0.00 C ATOM 1014 CD ARG A 68 -0.666 14.045 -0.761 1.00 0.00 C ATOM 1015 NE ARG A 68 -1.380 14.610 0.382 1.00 0.00 N ATOM 1016 CZ ARG A 68 -2.122 15.710 0.314 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -2.248 16.358 -0.835 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -2.741 16.161 1.397 1.00 0.00 N ATOM 0 H ARG A 68 2.231 11.089 0.890 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.214 9.578 0.449 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -0.973 11.387 -1.208 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.274 11.681 0.493 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.717 13.142 0.612 1.00 0.00 H new ATOM 0 HG3 ARG A 68 1.070 12.820 -1.074 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -0.085 14.828 -1.249 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -1.386 13.679 -1.493 1.00 0.00 H new ATOM 0 HE ARG A 68 -1.305 14.134 1.281 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -1.775 16.013 -1.670 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -2.818 17.202 -0.885 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -2.647 15.663 2.282 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -3.311 17.006 1.344 1.00 0.00 H new ATOM 1032 N ILE A 69 0.728 8.874 -1.745 1.00 0.00 N ATOM 1033 CA ILE A 69 1.384 8.338 -2.931 1.00 0.00 C ATOM 1034 C ILE A 69 0.539 8.572 -4.179 1.00 0.00 C ATOM 1035 O ILE A 69 -0.630 8.189 -4.231 1.00 0.00 O ATOM 1036 CB ILE A 69 1.660 6.829 -2.789 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.301 6.532 -1.431 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.555 6.345 -3.920 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.654 5.074 -1.236 1.00 0.00 C ATOM 0 H ILE A 69 -0.100 8.356 -1.451 1.00 0.00 H new ATOM 0 HA ILE A 69 2.333 8.865 -3.032 1.00 0.00 H new ATOM 0 HB ILE A 69 0.712 6.294 -2.848 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.204 7.133 -1.325 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.617 6.841 -0.640 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.741 5.277 -3.805 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.064 6.527 -4.876 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.502 6.883 -3.890 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.104 4.937 -0.253 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.751 4.468 -1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.362 4.765 -2.005 1.00 0.00 H new ATOM 1051 N SER A 70 1.140 9.202 -5.184 1.00 0.00 N ATOM 1052 CA SER A 70 0.443 9.490 -6.431 1.00 0.00 C ATOM 1053 C SER A 70 0.656 8.369 -7.444 1.00 0.00 C ATOM 1054 O SER A 70 1.526 7.516 -7.269 1.00 0.00 O ATOM 1055 CB SER A 70 0.926 10.819 -7.016 1.00 0.00 C ATOM 1056 OG SER A 70 2.061 10.629 -7.843 1.00 0.00 O ATOM 0 H SER A 70 2.108 9.522 -5.158 1.00 0.00 H new ATOM 0 HA SER A 70 -0.623 9.563 -6.214 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.124 11.279 -7.594 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.172 11.508 -6.208 1.00 0.00 H new ATOM 0 HG SER A 70 2.349 11.492 -8.206 1.00 0.00 H new ATOM 1062 N PHE A 71 -0.146 8.376 -8.503 1.00 0.00 N ATOM 1063 CA PHE A 71 -0.047 7.359 -9.544 1.00 0.00 C ATOM 1064 C PHE A 71 1.398 7.189 -10.003 1.00 0.00 C ATOM 1065 O PHE A 71 1.940 6.085 -9.984 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.932 7.733 -10.736 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.370 7.336 -10.563 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -3.070 6.749 -11.605 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -3.020 7.548 -9.359 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.394 6.383 -11.450 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.344 7.182 -9.197 1.00 0.00 C ATOM 1072 CZ PHE A 71 -5.031 6.600 -10.244 1.00 0.00 C ATOM 0 H PHE A 71 -0.872 9.074 -8.663 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.391 6.412 -9.127 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.877 8.810 -10.895 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.538 7.258 -11.634 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.575 6.575 -12.549 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.487 8.004 -8.538 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.929 5.928 -12.270 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.840 7.351 -8.253 1.00 0.00 H new ATOM 0 HZ PHE A 71 -6.065 6.315 -10.120 1.00 0.00 H new ATOM 1082 N ASP A 72 2.016 8.291 -10.414 1.00 0.00 N ATOM 1083 CA ASP A 72 3.399 8.265 -10.876 1.00 0.00 C ATOM 1084 C ASP A 72 4.325 7.729 -9.790 1.00 0.00 C ATOM 1085 O ASP A 72 5.265 6.988 -10.074 1.00 0.00 O ATOM 1086 CB ASP A 72 3.843 9.666 -11.299 1.00 0.00 C ATOM 1087 CG ASP A 72 4.998 9.635 -12.281 1.00 0.00 C ATOM 1088 OD1 ASP A 72 5.521 10.719 -12.618 1.00 0.00 O ATOM 1089 OD2 ASP A 72 5.381 8.528 -12.711 1.00 0.00 O ATOM 0 H ASP A 72 1.581 9.213 -10.437 1.00 0.00 H new ATOM 0 HA ASP A 72 3.457 7.599 -11.737 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.000 10.190 -11.750 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.136 10.233 -10.416 1.00 0.00 H new ATOM 1094 N GLU A 73 4.054 8.113 -8.546 1.00 0.00 N ATOM 1095 CA GLU A 73 4.866 7.672 -7.417 1.00 0.00 C ATOM 1096 C GLU A 73 4.854 6.150 -7.301 1.00 0.00 C ATOM 1097 O GLU A 73 5.890 5.498 -7.438 1.00 0.00 O ATOM 1098 CB GLU A 73 4.354 8.298 -6.118 1.00 0.00 C ATOM 1099 CG GLU A 73 5.062 9.590 -5.746 1.00 0.00 C ATOM 1100 CD GLU A 73 4.492 10.227 -4.493 1.00 0.00 C ATOM 1101 OE1 GLU A 73 5.049 9.987 -3.401 1.00 0.00 O ATOM 1102 OE2 GLU A 73 3.491 10.963 -4.604 1.00 0.00 O ATOM 0 H GLU A 73 3.280 8.728 -8.295 1.00 0.00 H new ATOM 0 HA GLU A 73 5.892 7.998 -7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.286 8.493 -6.215 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.475 7.581 -5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.123 9.389 -5.597 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.985 10.294 -6.575 1.00 0.00 H new ATOM 1109 N PHE A 74 3.676 5.591 -7.046 1.00 0.00 N ATOM 1110 CA PHE A 74 3.529 4.146 -6.909 1.00 0.00 C ATOM 1111 C PHE A 74 4.161 3.421 -8.094 1.00 0.00 C ATOM 1112 O PHE A 74 5.000 2.536 -7.917 1.00 0.00 O ATOM 1113 CB PHE A 74 2.050 3.771 -6.798 1.00 0.00 C ATOM 1114 CG PHE A 74 1.688 3.147 -5.481 1.00 0.00 C ATOM 1115 CD1 PHE A 74 0.598 3.607 -4.758 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.436 2.102 -4.965 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.262 3.035 -3.546 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.104 1.525 -3.754 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.016 1.993 -3.043 1.00 0.00 C ATOM 0 H PHE A 74 2.809 6.116 -6.930 1.00 0.00 H new ATOM 0 HA PHE A 74 4.044 3.838 -5.999 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.444 4.665 -6.946 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.798 3.078 -7.601 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.005 4.422 -5.147 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.289 1.734 -5.516 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.589 3.402 -2.992 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.694 0.709 -3.364 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.756 1.545 -2.096 1.00 0.00 H new ATOM 1129 N ILE A 75 3.753 3.801 -9.299 1.00 0.00 N ATOM 1130 CA ILE A 75 4.280 3.188 -10.512 1.00 0.00 C ATOM 1131 C ILE A 75 5.796 3.329 -10.585 1.00 0.00 C ATOM 1132 O ILE A 75 6.499 2.401 -10.987 1.00 0.00 O ATOM 1133 CB ILE A 75 3.656 3.811 -11.774 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.130 3.733 -11.707 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.173 3.109 -13.022 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.434 4.646 -12.691 1.00 0.00 C ATOM 0 H ILE A 75 3.059 4.531 -9.462 1.00 0.00 H new ATOM 0 HA ILE A 75 4.018 2.131 -10.471 1.00 0.00 H new ATOM 0 HB ILE A 75 3.945 4.861 -11.824 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.818 2.705 -11.894 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.805 3.985 -10.698 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.723 3.560 -13.906 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.257 3.211 -13.074 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.910 2.052 -12.980 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.354 4.538 -12.587 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.716 5.680 -12.491 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.729 4.380 -13.706 1.00 0.00 H new ATOM 1148 N LYS A 76 6.296 4.496 -10.194 1.00 0.00 N ATOM 1149 CA LYS A 76 7.730 4.760 -10.212 1.00 0.00 C ATOM 1150 C LYS A 76 8.474 3.785 -9.304 1.00 0.00 C ATOM 1151 O LYS A 76 9.624 3.430 -9.568 1.00 0.00 O ATOM 1152 CB LYS A 76 8.011 6.198 -9.772 1.00 0.00 C ATOM 1153 CG LYS A 76 8.021 7.194 -10.919 1.00 0.00 C ATOM 1154 CD LYS A 76 8.118 8.624 -10.415 1.00 0.00 C ATOM 1155 CE LYS A 76 8.657 9.558 -11.487 1.00 0.00 C ATOM 1156 NZ LYS A 76 8.789 10.955 -10.990 1.00 0.00 N ATOM 0 H LYS A 76 5.729 5.275 -9.860 1.00 0.00 H new ATOM 0 HA LYS A 76 8.086 4.623 -11.233 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.257 6.501 -9.046 1.00 0.00 H new ATOM 0 HB3 LYS A 76 8.975 6.232 -9.264 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.862 6.982 -11.579 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.114 7.077 -11.512 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.134 8.966 -10.095 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.767 8.659 -9.540 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.629 9.200 -11.826 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.993 9.541 -12.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.159 11.560 -11.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.857 11.306 -10.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.443 10.976 -10.182 1.00 0.00 H new ATOM 1170 N ILE A 77 7.810 3.355 -8.236 1.00 0.00 N ATOM 1171 CA ILE A 77 8.409 2.419 -7.292 1.00 0.00 C ATOM 1172 C ILE A 77 8.301 0.984 -7.797 1.00 0.00 C ATOM 1173 O ILE A 77 9.147 0.143 -7.495 1.00 0.00 O ATOM 1174 CB ILE A 77 7.744 2.516 -5.906 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.388 3.636 -5.085 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.850 1.187 -5.174 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.024 5.023 -5.564 1.00 0.00 C ATOM 0 H ILE A 77 6.859 3.639 -8.003 1.00 0.00 H new ATOM 0 HA ILE A 77 9.461 2.691 -7.201 1.00 0.00 H new ATOM 0 HB ILE A 77 6.688 2.751 -6.041 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.087 3.530 -4.043 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.472 3.522 -5.117 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.376 1.271 -4.196 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.350 0.411 -5.754 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.900 0.925 -5.046 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.516 5.766 -4.936 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.349 5.148 -6.597 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.944 5.156 -5.505 1.00 0.00 H new ATOM 1189 N PHE A 78 7.253 0.712 -8.568 1.00 0.00 N ATOM 1190 CA PHE A 78 7.034 -0.622 -9.116 1.00 0.00 C ATOM 1191 C PHE A 78 7.946 -0.875 -10.313 1.00 0.00 C ATOM 1192 O PHE A 78 8.295 -2.017 -10.612 1.00 0.00 O ATOM 1193 CB PHE A 78 5.572 -0.792 -9.531 1.00 0.00 C ATOM 1194 CG PHE A 78 4.691 -1.305 -8.426 1.00 0.00 C ATOM 1195 CD1 PHE A 78 3.805 -2.345 -8.655 1.00 0.00 C ATOM 1196 CD2 PHE A 78 4.750 -0.746 -7.160 1.00 0.00 C ATOM 1197 CE1 PHE A 78 2.994 -2.819 -7.641 1.00 0.00 C ATOM 1198 CE2 PHE A 78 3.943 -1.216 -6.142 1.00 0.00 C ATOM 1199 CZ PHE A 78 3.063 -2.253 -6.383 1.00 0.00 C ATOM 0 H PHE A 78 6.543 1.397 -8.827 1.00 0.00 H new ATOM 0 HA PHE A 78 7.272 -1.350 -8.340 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.187 0.167 -9.876 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.520 -1.479 -10.375 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.747 -2.791 -9.637 1.00 0.00 H new ATOM 0 HD2 PHE A 78 5.435 0.067 -6.967 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.308 -3.631 -7.832 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.000 -0.773 -5.159 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.430 -2.621 -5.589 1.00 0.00 H new ATOM 1209 N HIS A 79 8.329 0.200 -10.996 1.00 0.00 N ATOM 1210 CA HIS A 79 9.200 0.096 -12.161 1.00 0.00 C ATOM 1211 C HIS A 79 10.588 0.646 -11.851 1.00 0.00 C ATOM 1212 O HIS A 79 11.523 0.476 -12.633 1.00 0.00 O ATOM 1213 CB HIS A 79 8.593 0.847 -13.346 1.00 0.00 C ATOM 1214 CG HIS A 79 8.006 -0.054 -14.388 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.701 -0.467 -15.505 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.781 -0.623 -14.478 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.929 -1.249 -16.238 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.759 -1.361 -15.636 1.00 0.00 N ATOM 0 H HIS A 79 8.050 1.153 -10.762 1.00 0.00 H new ATOM 0 HA HIS A 79 9.296 -0.958 -12.420 1.00 0.00 H new ATOM 0 HB2 HIS A 79 7.817 1.520 -12.980 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.363 1.467 -13.805 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.972 -0.516 -13.771 1.00 0.00 H new ATOM 0 HE1 HIS A 79 8.207 -1.717 -17.171 1.00 0.00 H new ATOM 0 HE2 HIS A 79 5.967 -1.907 -15.976 1.00 0.00 H new ATOM 1226 N GLY A 80 10.717 1.308 -10.704 1.00 0.00 N ATOM 1227 CA GLY A 80 11.994 1.874 -10.313 1.00 0.00 C ATOM 1228 C GLY A 80 12.817 0.920 -9.470 1.00 0.00 C ATOM 1229 O GLY A 80 14.005 1.148 -9.242 1.00 0.00 O ATOM 0 H GLY A 80 9.959 1.462 -10.039 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.557 2.143 -11.206 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.824 2.794 -9.754 1.00 0.00 H new ATOM 1233 N LEU A 81 12.184 -0.151 -9.003 1.00 0.00 N ATOM 1234 CA LEU A 81 12.865 -1.142 -8.177 1.00 0.00 C ATOM 1235 C LEU A 81 12.373 -2.550 -8.501 1.00 0.00 C ATOM 1236 O LEU A 81 11.217 -2.744 -8.878 1.00 0.00 O ATOM 1237 CB LEU A 81 12.642 -0.841 -6.695 1.00 0.00 C ATOM 1238 CG LEU A 81 12.821 0.618 -6.272 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.485 1.346 -6.288 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.459 0.699 -4.894 1.00 0.00 C ATOM 0 H LEU A 81 11.201 -0.355 -9.182 1.00 0.00 H new ATOM 0 HA LEU A 81 13.932 -1.089 -8.395 1.00 0.00 H new ATOM 0 HB2 LEU A 81 11.632 -1.154 -6.429 1.00 0.00 H new ATOM 0 HB3 LEU A 81 13.330 -1.454 -6.113 1.00 0.00 H new ATOM 0 HG LEU A 81 13.485 1.105 -6.986 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.632 2.383 -5.984 1.00 0.00 H new ATOM 0 HD12 LEU A 81 11.068 1.318 -7.295 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.797 0.859 -5.597 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.579 1.744 -4.609 1.00 0.00 H new ATOM 0 HD22 LEU A 81 12.821 0.196 -4.167 1.00 0.00 H new ATOM 0 HD23 LEU A 81 14.435 0.215 -4.916 1.00 0.00 H new ATOM 1252 N LYS A 82 13.258 -3.529 -8.349 1.00 0.00 N ATOM 1253 CA LYS A 82 12.914 -4.920 -8.622 1.00 0.00 C ATOM 1254 C LYS A 82 11.631 -5.315 -7.899 1.00 0.00 C ATOM 1255 O LYS A 82 11.168 -4.607 -7.006 1.00 0.00 O ATOM 1256 CB LYS A 82 14.059 -5.842 -8.194 1.00 0.00 C ATOM 1257 CG LYS A 82 15.212 -5.879 -9.181 1.00 0.00 C ATOM 1258 CD LYS A 82 16.463 -6.473 -8.556 1.00 0.00 C ATOM 1259 CE LYS A 82 17.271 -5.421 -7.815 1.00 0.00 C ATOM 1260 NZ LYS A 82 16.813 -5.259 -6.407 1.00 0.00 N ATOM 0 H LYS A 82 14.219 -3.385 -8.038 1.00 0.00 H new ATOM 0 HA LYS A 82 12.752 -5.025 -9.695 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.433 -5.516 -7.223 1.00 0.00 H new ATOM 0 HB3 LYS A 82 13.671 -6.852 -8.063 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.926 -6.466 -10.054 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.424 -4.869 -9.532 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.183 -7.270 -7.867 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.079 -6.925 -9.333 1.00 0.00 H new ATOM 0 HE2 LYS A 82 18.325 -5.700 -7.824 1.00 0.00 H new ATOM 0 HE3 LYS A 82 17.189 -4.467 -8.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 17.628 -5.036 -5.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 16.120 -4.485 -6.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 16.371 -6.142 -6.082 1.00 0.00 H new ATOM 1274 N SER A 83 11.062 -6.451 -8.290 1.00 0.00 N ATOM 1275 CA SER A 83 9.832 -6.939 -7.680 1.00 0.00 C ATOM 1276 C SER A 83 9.975 -7.031 -6.164 1.00 0.00 C ATOM 1277 O SER A 83 10.575 -7.970 -5.641 1.00 0.00 O ATOM 1278 CB SER A 83 9.462 -8.309 -8.252 1.00 0.00 C ATOM 1279 OG SER A 83 9.942 -8.454 -9.578 1.00 0.00 O ATOM 0 H SER A 83 11.434 -7.050 -9.027 1.00 0.00 H new ATOM 0 HA SER A 83 9.037 -6.230 -7.910 1.00 0.00 H new ATOM 0 HB2 SER A 83 9.880 -9.095 -7.622 1.00 0.00 H new ATOM 0 HB3 SER A 83 8.379 -8.432 -8.238 1.00 0.00 H new ATOM 0 HG SER A 83 9.694 -9.338 -9.921 1.00 0.00 H new ATOM 1285 N THR A 84 9.420 -6.047 -5.463 1.00 0.00 N ATOM 1286 CA THR A 84 9.486 -6.014 -4.008 1.00 0.00 C ATOM 1287 C THR A 84 8.297 -6.738 -3.387 1.00 0.00 C ATOM 1288 O THR A 84 7.209 -6.767 -3.959 1.00 0.00 O ATOM 1289 CB THR A 84 9.525 -4.567 -3.480 1.00 0.00 C ATOM 1290 OG1 THR A 84 9.969 -3.681 -4.513 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.449 -4.455 -2.276 1.00 0.00 C ATOM 0 H THR A 84 8.920 -5.262 -5.880 1.00 0.00 H new ATOM 0 HA THR A 84 10.407 -6.522 -3.722 1.00 0.00 H new ATOM 0 HB THR A 84 8.517 -4.288 -3.171 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.990 -2.763 -4.170 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.460 -3.425 -1.921 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.091 -5.109 -1.481 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.458 -4.751 -2.563 1.00 0.00 H new ATOM 1299 N ASP A 85 8.513 -7.319 -2.212 1.00 0.00 N ATOM 1300 CA ASP A 85 7.458 -8.043 -1.511 1.00 0.00 C ATOM 1301 C ASP A 85 6.203 -7.184 -1.384 1.00 0.00 C ATOM 1302 O ASP A 85 5.097 -7.635 -1.677 1.00 0.00 O ATOM 1303 CB ASP A 85 7.939 -8.474 -0.125 1.00 0.00 C ATOM 1304 CG ASP A 85 9.334 -9.069 -0.156 1.00 0.00 C ATOM 1305 OD1 ASP A 85 10.075 -8.891 0.833 1.00 0.00 O ATOM 1306 OD2 ASP A 85 9.682 -9.711 -1.168 1.00 0.00 O ATOM 0 H ASP A 85 9.409 -7.303 -1.725 1.00 0.00 H new ATOM 0 HA ASP A 85 7.212 -8.931 -2.093 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.929 -7.613 0.544 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.244 -9.206 0.286 1.00 0.00 H new ATOM 1311 N VAL A 86 6.385 -5.943 -0.940 1.00 0.00 N ATOM 1312 CA VAL A 86 5.268 -5.020 -0.773 1.00 0.00 C ATOM 1313 C VAL A 86 4.593 -4.726 -2.109 1.00 0.00 C ATOM 1314 O VAL A 86 3.372 -4.593 -2.182 1.00 0.00 O ATOM 1315 CB VAL A 86 5.726 -3.695 -0.138 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.266 -3.932 1.264 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.771 -3.018 -1.013 1.00 0.00 C ATOM 0 H VAL A 86 7.294 -5.555 -0.690 1.00 0.00 H new ATOM 0 HA VAL A 86 4.553 -5.505 -0.108 1.00 0.00 H new ATOM 0 HB VAL A 86 4.864 -3.032 -0.062 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.585 -2.984 1.696 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.485 -4.370 1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.116 -4.613 1.216 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.084 -2.083 -0.549 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.634 -3.675 -1.123 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.345 -2.811 -1.995 1.00 0.00 H new ATOM 1327 N ALA A 87 5.398 -4.626 -3.162 1.00 0.00 N ATOM 1328 CA ALA A 87 4.879 -4.349 -4.496 1.00 0.00 C ATOM 1329 C ALA A 87 3.925 -5.448 -4.953 1.00 0.00 C ATOM 1330 O ALA A 87 2.761 -5.188 -5.256 1.00 0.00 O ATOM 1331 CB ALA A 87 6.024 -4.195 -5.486 1.00 0.00 C ATOM 0 H ALA A 87 6.411 -4.733 -3.117 1.00 0.00 H new ATOM 0 HA ALA A 87 4.321 -3.414 -4.455 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.622 -3.989 -6.478 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.665 -3.370 -5.175 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.606 -5.116 -5.515 1.00 0.00 H new ATOM 1337 N LYS A 88 4.427 -6.678 -4.999 1.00 0.00 N ATOM 1338 CA LYS A 88 3.621 -7.818 -5.419 1.00 0.00 C ATOM 1339 C LYS A 88 2.384 -7.963 -4.537 1.00 0.00 C ATOM 1340 O LYS A 88 1.276 -8.171 -5.033 1.00 0.00 O ATOM 1341 CB LYS A 88 4.450 -9.102 -5.367 1.00 0.00 C ATOM 1342 CG LYS A 88 3.690 -10.337 -5.822 1.00 0.00 C ATOM 1343 CD LYS A 88 4.251 -11.600 -5.191 1.00 0.00 C ATOM 1344 CE LYS A 88 5.265 -12.276 -6.101 1.00 0.00 C ATOM 1345 NZ LYS A 88 5.871 -13.476 -5.460 1.00 0.00 N ATOM 0 H LYS A 88 5.389 -6.910 -4.750 1.00 0.00 H new ATOM 0 HA LYS A 88 3.297 -7.644 -6.445 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.334 -8.979 -5.992 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.800 -9.257 -4.347 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.637 -10.235 -5.560 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.741 -10.418 -6.908 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.722 -11.354 -4.239 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.437 -12.292 -4.974 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.780 -12.568 -7.032 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.051 -11.566 -6.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 6.557 -13.909 -6.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 6.356 -13.194 -4.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.124 -14.164 -5.236 1.00 0.00 H new ATOM 1359 N THR A 89 2.580 -7.852 -3.227 1.00 0.00 N ATOM 1360 CA THR A 89 1.482 -7.970 -2.277 1.00 0.00 C ATOM 1361 C THR A 89 0.428 -6.894 -2.517 1.00 0.00 C ATOM 1362 O THR A 89 -0.767 -7.133 -2.345 1.00 0.00 O ATOM 1363 CB THR A 89 1.982 -7.868 -0.824 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.903 -8.929 -0.547 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.819 -7.930 0.155 1.00 0.00 C ATOM 0 H THR A 89 3.490 -7.680 -2.800 1.00 0.00 H new ATOM 0 HA THR A 89 1.036 -8.952 -2.431 1.00 0.00 H new ATOM 0 HB THR A 89 2.486 -6.909 -0.703 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.789 -8.691 -0.890 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.197 -7.856 1.175 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.135 -7.103 -0.039 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.290 -8.875 0.032 1.00 0.00 H new ATOM 1373 N PHE A 90 0.880 -5.710 -2.915 1.00 0.00 N ATOM 1374 CA PHE A 90 -0.024 -4.597 -3.179 1.00 0.00 C ATOM 1375 C PHE A 90 -0.877 -4.869 -4.414 1.00 0.00 C ATOM 1376 O PHE A 90 -2.103 -4.943 -4.330 1.00 0.00 O ATOM 1377 CB PHE A 90 0.769 -3.302 -3.367 1.00 0.00 C ATOM 1378 CG PHE A 90 -0.033 -2.192 -3.987 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.058 -2.022 -5.362 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.762 -1.321 -3.194 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -0.795 -1.003 -5.934 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -1.501 -0.300 -3.761 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.517 -0.140 -5.133 1.00 0.00 C ATOM 0 H PHE A 90 1.867 -5.496 -3.062 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.686 -4.488 -2.320 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.144 -2.971 -2.399 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.638 -3.505 -3.993 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.505 -2.693 -5.993 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.753 -1.441 -2.121 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.807 -0.881 -7.007 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.066 0.372 -3.132 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.093 0.658 -5.578 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.219 -5.017 -5.559 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.916 -5.280 -6.812 1.00 0.00 C ATOM 1395 C ARG A 91 -1.792 -6.524 -6.697 1.00 0.00 C ATOM 1396 O ARG A 91 -2.826 -6.633 -7.356 1.00 0.00 O ATOM 1397 CB ARG A 91 0.088 -5.455 -7.952 1.00 0.00 C ATOM 1398 CG ARG A 91 1.179 -6.471 -7.652 1.00 0.00 C ATOM 1399 CD ARG A 91 2.477 -6.120 -8.362 1.00 0.00 C ATOM 1400 NE ARG A 91 2.980 -7.231 -9.165 1.00 0.00 N ATOM 1401 CZ ARG A 91 4.226 -7.304 -9.619 1.00 0.00 C ATOM 1402 NH1 ARG A 91 5.092 -6.337 -9.351 1.00 0.00 N ATOM 1403 NH2 ARG A 91 4.609 -8.349 -10.344 1.00 0.00 N ATOM 0 H ARG A 91 0.796 -4.959 -5.645 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.556 -4.425 -7.028 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -0.446 -5.763 -8.851 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.550 -4.492 -8.169 1.00 0.00 H new ATOM 0 HG2 ARG A 91 1.351 -6.515 -6.577 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.850 -7.463 -7.962 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.316 -5.253 -9.003 1.00 0.00 H new ATOM 0 HD3 ARG A 91 3.228 -5.837 -7.625 1.00 0.00 H new ATOM 0 HE ARG A 91 2.340 -7.992 -9.389 1.00 0.00 H new ATOM 0 HH11 ARG A 91 4.802 -5.533 -8.794 1.00 0.00 H new ATOM 0 HH12 ARG A 91 6.048 -6.397 -9.702 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.946 -9.096 -10.552 1.00 0.00 H new ATOM 0 HH22 ARG A 91 5.566 -8.405 -10.693 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.372 -7.462 -5.854 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.117 -8.698 -5.650 1.00 0.00 C ATOM 1419 C LYS A 92 -3.355 -8.453 -4.794 1.00 0.00 C ATOM 1420 O LYS A 92 -4.477 -8.734 -5.213 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.226 -9.751 -4.987 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.356 -10.517 -5.969 1.00 0.00 C ATOM 1423 CD LYS A 92 -0.502 -12.019 -5.788 1.00 0.00 C ATOM 1424 CE LYS A 92 0.444 -12.784 -6.701 1.00 0.00 C ATOM 1425 NZ LYS A 92 1.105 -13.915 -5.992 1.00 0.00 N ATOM 0 H LYS A 92 -0.518 -7.389 -5.301 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.438 -9.064 -6.625 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.586 -9.263 -4.252 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.854 -10.457 -4.444 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.629 -10.244 -6.988 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.687 -10.233 -5.831 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.300 -12.283 -4.750 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.530 -12.314 -5.998 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.109 -13.167 -7.559 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.203 -12.105 -7.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.742 -14.411 -6.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.654 -13.548 -5.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.382 -14.577 -5.644 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.143 -7.924 -3.594 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.242 -7.637 -2.681 1.00 0.00 C ATOM 1441 C ALA A 93 -5.212 -6.630 -3.288 1.00 0.00 C ATOM 1442 O ALA A 93 -6.376 -6.558 -2.892 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.705 -7.121 -1.353 1.00 0.00 C ATOM 0 H ALA A 93 -2.220 -7.685 -3.231 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.786 -8.565 -2.505 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.537 -6.911 -0.681 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.058 -7.875 -0.905 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.135 -6.207 -1.521 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.727 -5.855 -4.251 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.552 -4.853 -4.914 1.00 0.00 C ATOM 1451 C ILE A 94 -6.177 -5.410 -6.189 1.00 0.00 C ATOM 1452 O ILE A 94 -7.199 -4.913 -6.660 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.737 -3.593 -5.264 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.574 -2.335 -5.024 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.263 -3.654 -6.708 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.872 -1.293 -4.183 1.00 0.00 C ATOM 0 H ILE A 94 -3.766 -5.901 -4.590 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.342 -4.582 -4.213 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.861 -3.552 -4.616 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.839 -1.896 -5.986 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.506 -2.617 -4.535 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.689 -2.757 -6.941 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.635 -4.534 -6.848 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.125 -3.715 -7.372 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.525 -0.429 -4.054 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.631 -1.715 -3.207 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.953 -0.982 -4.681 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.555 -6.446 -6.741 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.051 -7.073 -7.962 1.00 0.00 C ATOM 1470 C ASN A 95 -7.385 -7.770 -7.712 1.00 0.00 C ATOM 1471 O ASN A 95 -8.368 -7.524 -8.412 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.028 -8.079 -8.494 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.241 -7.535 -9.672 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -4.770 -6.786 -10.493 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -2.971 -7.912 -9.758 1.00 0.00 N ATOM 0 H ASN A 95 -4.707 -6.869 -6.363 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.204 -6.292 -8.707 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.339 -8.350 -7.694 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.542 -8.992 -8.794 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -2.391 -7.579 -10.528 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -2.575 -8.535 -9.054 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.411 -8.642 -6.709 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.624 -9.374 -6.365 1.00 0.00 C ATOM 1484 C LYS A 96 -9.798 -8.421 -6.166 1.00 0.00 C ATOM 1485 O LYS A 96 -10.900 -8.664 -6.660 1.00 0.00 O ATOM 1486 CB LYS A 96 -8.404 -10.199 -5.094 1.00 0.00 C ATOM 1487 CG LYS A 96 -7.873 -9.386 -3.926 1.00 0.00 C ATOM 1488 CD LYS A 96 -7.323 -10.280 -2.828 1.00 0.00 C ATOM 1489 CE LYS A 96 -7.518 -9.659 -1.453 1.00 0.00 C ATOM 1490 NZ LYS A 96 -8.947 -9.674 -1.036 1.00 0.00 N ATOM 0 H LYS A 96 -6.606 -8.859 -6.121 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.859 -10.045 -7.191 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.347 -10.663 -4.804 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -7.705 -11.007 -5.311 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -7.089 -8.714 -4.276 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -8.671 -8.762 -3.523 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.820 -11.250 -2.864 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -6.262 -10.459 -3.000 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -6.920 -10.202 -0.721 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -7.153 -8.632 -1.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -9.192 -8.760 -0.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -9.550 -9.837 -1.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -9.099 -10.435 -0.344 1.00 0.00 H new ATOM 1504 N LYS A 97 -9.556 -7.334 -5.441 1.00 0.00 N ATOM 1505 CA LYS A 97 -10.591 -6.341 -5.180 1.00 0.00 C ATOM 1506 C LYS A 97 -11.233 -5.868 -6.479 1.00 0.00 C ATOM 1507 O LYS A 97 -12.458 -5.885 -6.587 1.00 0.00 O ATOM 1508 CB LYS A 97 -10.002 -5.147 -4.425 1.00 0.00 C ATOM 1509 CG LYS A 97 -10.976 -4.498 -3.457 1.00 0.00 C ATOM 1510 CD LYS A 97 -11.254 -5.393 -2.261 1.00 0.00 C ATOM 1511 CE LYS A 97 -10.172 -5.256 -1.200 1.00 0.00 C ATOM 1512 NZ LYS A 97 -10.413 -4.088 -0.309 1.00 0.00 N ATOM 0 H LYS A 97 -8.651 -7.118 -5.023 1.00 0.00 H new ATOM 0 HA LYS A 97 -11.360 -6.809 -4.566 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.120 -5.475 -3.875 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -9.668 -4.401 -5.146 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -10.570 -3.547 -3.114 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -11.911 -4.278 -3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -12.222 -5.137 -1.830 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -11.315 -6.431 -2.588 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.132 -6.167 -0.602 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.201 -5.150 -1.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.654 -4.030 0.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.426 -3.216 -0.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.328 -4.201 0.172 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.837 8.129 -1.700 1.00 0.00 CA HETATM 1528 CA CA A 102 4.277 12.698 -2.195 1.00 0.00 CA