USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 843 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 GLY N :NH3+ -125:sc= 0.122 (180deg=0) USER MOD Single : A 2 SER OG : rot 30:sc= 0.178 USER MOD Single : A 3 SER OG : rot 23:sc= 1.12 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 25:sc= 0.0571 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -173:sc= 1.26 (180deg=1.15) USER MOD Single : A 26 HIS : no HD1:sc= -4.51! C(o=-4.5!,f=-13!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.298 K(o=-0.3,f=-1.2) USER MOD Single : A 44 GLN : amide:sc= -0.0585 K(o=-0.059,f=-1.6!) USER MOD Single : A 48 SER OG : rot -53:sc= 0.744 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 162:sc= -0.277 (180deg=-1.1) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -150:sc= 0.465 (180deg=0.145) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -2.57! C(o=-2.6!,f=-4.2!) USER MOD Single : A 96 THR OG1 : rot 89:sc= 0.236 USER MOD Single : A 100 LYS NZ :NH3+ -143:sc= -0.195 (180deg=-0.755!) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ -167:sc= 0.0398 (180deg=-0.129) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.727 -12.960 15.145 1.00 0.00 N ATOM 2 CA GLY A 1 7.577 -13.113 16.021 1.00 0.00 C ATOM 3 C GLY A 1 6.491 -13.961 15.355 1.00 0.00 C ATOM 4 O GLY A 1 6.678 -14.457 14.245 1.00 0.00 O ATOM 0 H1 GLY A 1 9.585 -13.276 15.640 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.590 -13.534 14.289 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.830 -11.960 14.879 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.887 -13.581 16.956 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.174 -12.132 16.273 1.00 0.00 H new ATOM 8 N SER A 2 5.378 -14.100 16.061 1.00 0.00 N ATOM 9 CA SER A 2 4.262 -14.879 15.553 1.00 0.00 C ATOM 10 C SER A 2 2.999 -14.571 16.359 1.00 0.00 C ATOM 11 O SER A 2 3.000 -14.675 17.585 1.00 0.00 O ATOM 12 CB SER A 2 4.569 -16.377 15.599 1.00 0.00 C ATOM 13 OG SER A 2 4.876 -16.819 16.919 1.00 0.00 O ATOM 0 H SER A 2 5.226 -13.686 16.981 1.00 0.00 H new ATOM 0 HA SER A 2 4.098 -14.602 14.512 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.712 -16.934 15.220 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.409 -16.595 14.939 1.00 0.00 H new ATOM 0 HG SER A 2 4.392 -16.269 17.569 1.00 0.00 H new ATOM 19 N SER A 3 1.951 -14.198 15.639 1.00 0.00 N ATOM 20 CA SER A 3 0.684 -13.874 16.272 1.00 0.00 C ATOM 21 C SER A 3 -0.371 -13.571 15.207 1.00 0.00 C ATOM 22 O SER A 3 -0.038 -13.142 14.103 1.00 0.00 O ATOM 23 CB SER A 3 0.833 -12.687 17.226 1.00 0.00 C ATOM 24 OG SER A 3 1.383 -13.076 18.481 1.00 0.00 O ATOM 0 H SER A 3 1.954 -14.113 14.623 1.00 0.00 H new ATOM 0 HA SER A 3 0.363 -14.736 16.856 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.473 -11.932 16.768 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.141 -12.225 17.385 1.00 0.00 H new ATOM 0 HG SER A 3 1.887 -13.909 18.373 1.00 0.00 H new ATOM 30 N GLY A 4 -1.622 -13.806 15.575 1.00 0.00 N ATOM 31 CA GLY A 4 -2.728 -13.563 14.664 1.00 0.00 C ATOM 32 C GLY A 4 -3.418 -12.235 14.982 1.00 0.00 C ATOM 33 O GLY A 4 -2.988 -11.506 15.875 1.00 0.00 O ATOM 0 H GLY A 4 -1.894 -14.162 16.491 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.362 -13.550 13.637 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.449 -14.378 14.736 1.00 0.00 H new ATOM 37 N SER A 5 -4.477 -11.962 14.234 1.00 0.00 N ATOM 38 CA SER A 5 -5.232 -10.735 14.426 1.00 0.00 C ATOM 39 C SER A 5 -6.434 -10.707 13.480 1.00 0.00 C ATOM 40 O SER A 5 -6.494 -11.478 12.524 1.00 0.00 O ATOM 41 CB SER A 5 -4.350 -9.505 14.199 1.00 0.00 C ATOM 42 OG SER A 5 -4.497 -8.543 15.240 1.00 0.00 O ATOM 0 H SER A 5 -4.830 -12.569 13.494 1.00 0.00 H new ATOM 0 HA SER A 5 -5.587 -10.710 15.456 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.307 -9.814 14.136 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.606 -9.047 13.243 1.00 0.00 H new ATOM 0 HG SER A 5 -3.917 -7.774 15.059 1.00 0.00 H new ATOM 48 N SER A 6 -7.362 -9.810 13.780 1.00 0.00 N ATOM 49 CA SER A 6 -8.559 -9.671 12.968 1.00 0.00 C ATOM 50 C SER A 6 -9.088 -8.238 13.057 1.00 0.00 C ATOM 51 O SER A 6 -8.947 -7.583 14.088 1.00 0.00 O ATOM 52 CB SER A 6 -9.638 -10.664 13.405 1.00 0.00 C ATOM 53 OG SER A 6 -10.447 -11.089 12.312 1.00 0.00 O ATOM 0 H SER A 6 -7.309 -9.172 14.574 1.00 0.00 H new ATOM 0 HA SER A 6 -8.298 -9.891 11.933 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.167 -11.532 13.866 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.269 -10.203 14.165 1.00 0.00 H new ATOM 0 HG SER A 6 -11.122 -11.723 12.632 1.00 0.00 H new ATOM 59 N GLY A 7 -9.687 -7.794 11.961 1.00 0.00 N ATOM 60 CA GLY A 7 -10.238 -6.451 11.902 1.00 0.00 C ATOM 61 C GLY A 7 -11.603 -6.448 11.212 1.00 0.00 C ATOM 62 O GLY A 7 -12.221 -7.499 11.047 1.00 0.00 O ATOM 0 H GLY A 7 -9.803 -8.341 11.108 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.336 -6.050 12.911 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.553 -5.796 11.363 1.00 0.00 H new ATOM 66 N ALA A 8 -12.035 -5.256 10.829 1.00 0.00 N ATOM 67 CA ALA A 8 -13.316 -5.103 10.161 1.00 0.00 C ATOM 68 C ALA A 8 -13.112 -4.359 8.839 1.00 0.00 C ATOM 69 O ALA A 8 -12.905 -3.147 8.831 1.00 0.00 O ATOM 70 CB ALA A 8 -14.294 -4.382 11.091 1.00 0.00 C ATOM 0 H ALA A 8 -11.520 -4.386 10.969 1.00 0.00 H new ATOM 0 HA ALA A 8 -13.746 -6.077 9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -15.255 -4.267 10.590 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -14.427 -4.966 12.002 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -13.897 -3.399 11.345 1.00 0.00 H new ATOM 76 N PRO A 9 -13.179 -5.137 7.726 1.00 0.00 N ATOM 77 CA PRO A 9 -13.004 -4.565 6.402 1.00 0.00 C ATOM 78 C PRO A 9 -14.248 -3.783 5.973 1.00 0.00 C ATOM 79 O PRO A 9 -15.273 -3.820 6.652 1.00 0.00 O ATOM 80 CB PRO A 9 -12.707 -5.750 5.497 1.00 0.00 C ATOM 81 CG PRO A 9 -13.183 -6.980 6.252 1.00 0.00 C ATOM 82 CD PRO A 9 -13.423 -6.576 7.698 1.00 0.00 C ATOM 0 HA PRO A 9 -12.193 -3.837 6.363 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -13.225 -5.652 4.543 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -11.642 -5.815 5.276 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -14.099 -7.370 5.808 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -12.438 -7.774 6.196 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.440 -6.811 8.011 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.751 -7.105 8.374 1.00 0.00 H new ATOM 90 N ALA A 10 -14.117 -3.094 4.849 1.00 0.00 N ATOM 91 CA ALA A 10 -15.217 -2.305 4.322 1.00 0.00 C ATOM 92 C ALA A 10 -14.829 -1.749 2.951 1.00 0.00 C ATOM 93 O ALA A 10 -13.680 -1.871 2.530 1.00 0.00 O ATOM 94 CB ALA A 10 -15.577 -1.201 5.319 1.00 0.00 C ATOM 0 H ALA A 10 -13.265 -3.066 4.288 1.00 0.00 H new ATOM 0 HA ALA A 10 -16.104 -2.924 4.187 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -16.402 -0.609 4.924 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -15.874 -1.650 6.267 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -14.712 -0.557 5.477 1.00 0.00 H new ATOM 100 N GLU A 11 -15.810 -1.150 2.292 1.00 0.00 N ATOM 101 CA GLU A 11 -15.586 -0.575 0.976 1.00 0.00 C ATOM 102 C GLU A 11 -14.914 -1.597 0.058 1.00 0.00 C ATOM 103 O GLU A 11 -13.688 -1.702 0.031 1.00 0.00 O ATOM 104 CB GLU A 11 -14.755 0.706 1.072 1.00 0.00 C ATOM 105 CG GLU A 11 -15.595 1.866 1.612 1.00 0.00 C ATOM 106 CD GLU A 11 -15.942 1.651 3.087 1.00 0.00 C ATOM 107 OE1 GLU A 11 -15.011 1.302 3.844 1.00 0.00 O ATOM 108 OE2 GLU A 11 -17.131 1.841 3.424 1.00 0.00 O ATOM 0 H GLU A 11 -16.762 -1.050 2.645 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.552 -0.311 0.547 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -13.897 0.539 1.724 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.363 0.964 0.088 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.047 2.801 1.496 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -16.511 1.959 1.029 1.00 0.00 H new ATOM 115 N PRO A 12 -15.767 -2.344 -0.693 1.00 0.00 N ATOM 116 CA PRO A 12 -15.268 -3.354 -1.610 1.00 0.00 C ATOM 117 C PRO A 12 -14.674 -2.710 -2.865 1.00 0.00 C ATOM 118 O PRO A 12 -15.244 -1.768 -3.412 1.00 0.00 O ATOM 119 CB PRO A 12 -16.466 -4.241 -1.909 1.00 0.00 C ATOM 120 CG PRO A 12 -17.692 -3.430 -1.520 1.00 0.00 C ATOM 121 CD PRO A 12 -17.224 -2.247 -0.688 1.00 0.00 C ATOM 0 HA PRO A 12 -14.451 -3.939 -1.187 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -16.497 -4.514 -2.964 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -16.416 -5.170 -1.341 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -18.220 -3.086 -2.409 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -18.391 -4.044 -0.952 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -17.560 -1.303 -1.118 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -17.621 -2.294 0.326 1.00 0.00 H new ATOM 129 N ALA A 13 -13.536 -3.245 -3.283 1.00 0.00 N ATOM 130 CA ALA A 13 -12.858 -2.734 -4.463 1.00 0.00 C ATOM 131 C ALA A 13 -11.569 -3.525 -4.688 1.00 0.00 C ATOM 132 O ALA A 13 -10.820 -3.781 -3.745 1.00 0.00 O ATOM 133 CB ALA A 13 -12.601 -1.235 -4.295 1.00 0.00 C ATOM 0 H ALA A 13 -13.066 -4.027 -2.826 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.481 -2.861 -5.349 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -12.093 -0.852 -5.180 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -13.551 -0.715 -4.168 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.976 -1.069 -3.417 1.00 0.00 H new ATOM 139 N ALA A 14 -11.348 -3.892 -5.942 1.00 0.00 N ATOM 140 CA ALA A 14 -10.162 -4.649 -6.302 1.00 0.00 C ATOM 141 C ALA A 14 -10.365 -5.282 -7.681 1.00 0.00 C ATOM 142 O ALA A 14 -10.619 -6.481 -7.786 1.00 0.00 O ATOM 143 CB ALA A 14 -9.873 -5.691 -5.220 1.00 0.00 C ATOM 0 H ALA A 14 -11.971 -3.679 -6.721 1.00 0.00 H new ATOM 0 HA ALA A 14 -9.293 -3.994 -6.364 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -8.983 -6.259 -5.490 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.708 -5.189 -4.267 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -10.722 -6.368 -5.131 1.00 0.00 H new ATOM 149 N PRO A 15 -10.243 -4.425 -8.730 1.00 0.00 N ATOM 150 CA PRO A 15 -10.411 -4.887 -10.097 1.00 0.00 C ATOM 151 C PRO A 15 -9.189 -5.683 -10.560 1.00 0.00 C ATOM 152 O PRO A 15 -8.580 -5.357 -11.578 1.00 0.00 O ATOM 153 CB PRO A 15 -10.642 -3.626 -10.913 1.00 0.00 C ATOM 154 CG PRO A 15 -10.135 -2.476 -10.057 1.00 0.00 C ATOM 155 CD PRO A 15 -9.943 -2.999 -8.642 1.00 0.00 C ATOM 0 HA PRO A 15 -11.248 -5.576 -10.208 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -10.108 -3.672 -11.862 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -11.699 -3.501 -11.148 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -9.195 -2.091 -10.453 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -10.847 -1.651 -10.066 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -8.925 -2.829 -8.292 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -10.609 -2.497 -7.940 1.00 0.00 H new ATOM 163 N LYS A 16 -8.867 -6.713 -9.791 1.00 0.00 N ATOM 164 CA LYS A 16 -7.729 -7.558 -10.110 1.00 0.00 C ATOM 165 C LYS A 16 -6.571 -6.685 -10.595 1.00 0.00 C ATOM 166 O LYS A 16 -6.429 -6.445 -11.794 1.00 0.00 O ATOM 167 CB LYS A 16 -8.134 -8.650 -11.103 1.00 0.00 C ATOM 168 CG LYS A 16 -8.262 -10.006 -10.405 1.00 0.00 C ATOM 169 CD LYS A 16 -9.534 -10.732 -10.848 1.00 0.00 C ATOM 170 CE LYS A 16 -9.198 -12.073 -11.503 1.00 0.00 C ATOM 171 NZ LYS A 16 -10.354 -12.575 -12.279 1.00 0.00 N ATOM 0 H LYS A 16 -9.374 -6.981 -8.948 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.382 -8.082 -9.219 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.083 -8.387 -11.571 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -7.393 -8.715 -11.899 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.391 -10.620 -10.632 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.278 -9.863 -9.325 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.182 -10.896 -9.987 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.087 -10.108 -11.550 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.335 -11.958 -12.159 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -8.923 -12.799 -10.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -10.109 -13.486 -12.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -11.168 -12.704 -11.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -10.598 -11.889 -13.021 1.00 0.00 H new ATOM 185 N SER A 17 -5.772 -6.233 -9.640 1.00 0.00 N ATOM 186 CA SER A 17 -4.630 -5.391 -9.955 1.00 0.00 C ATOM 187 C SER A 17 -3.399 -5.868 -9.182 1.00 0.00 C ATOM 188 O SER A 17 -3.461 -6.063 -7.969 1.00 0.00 O ATOM 189 CB SER A 17 -4.922 -3.924 -9.635 1.00 0.00 C ATOM 190 OG SER A 17 -5.285 -3.737 -8.270 1.00 0.00 O ATOM 0 H SER A 17 -5.893 -6.434 -8.647 1.00 0.00 H new ATOM 0 HA SER A 17 -4.433 -5.469 -11.024 1.00 0.00 H new ATOM 0 HB2 SER A 17 -4.042 -3.322 -9.862 1.00 0.00 H new ATOM 0 HB3 SER A 17 -5.727 -3.566 -10.277 1.00 0.00 H new ATOM 0 HG SER A 17 -4.911 -4.464 -7.730 1.00 0.00 H new ATOM 196 N GLY A 18 -2.309 -6.042 -9.915 1.00 0.00 N ATOM 197 CA GLY A 18 -1.066 -6.492 -9.313 1.00 0.00 C ATOM 198 C GLY A 18 0.044 -6.597 -10.361 1.00 0.00 C ATOM 199 O GLY A 18 0.915 -5.732 -10.437 1.00 0.00 O ATOM 0 H GLY A 18 -2.261 -5.879 -10.921 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -0.766 -5.798 -8.528 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -1.217 -7.462 -8.840 1.00 0.00 H new ATOM 203 N GLU A 19 -0.023 -7.665 -11.142 1.00 0.00 N ATOM 204 CA GLU A 19 0.965 -7.895 -12.182 1.00 0.00 C ATOM 205 C GLU A 19 0.912 -6.774 -13.222 1.00 0.00 C ATOM 206 O GLU A 19 0.193 -6.876 -14.215 1.00 0.00 O ATOM 207 CB GLU A 19 0.762 -9.262 -12.839 1.00 0.00 C ATOM 208 CG GLU A 19 1.082 -10.393 -11.860 1.00 0.00 C ATOM 209 CD GLU A 19 1.496 -11.663 -12.607 1.00 0.00 C ATOM 210 OE1 GLU A 19 2.244 -11.520 -13.598 1.00 0.00 O ATOM 211 OE2 GLU A 19 1.056 -12.748 -12.169 1.00 0.00 O ATOM 0 H GLU A 19 -0.747 -8.381 -11.075 1.00 0.00 H new ATOM 0 HA GLU A 19 1.954 -7.892 -11.723 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -0.268 -9.355 -13.183 1.00 0.00 H new ATOM 0 HB3 GLU A 19 1.401 -9.345 -13.718 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.884 -10.083 -11.190 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.210 -10.599 -11.239 1.00 0.00 H new ATOM 218 N ALA A 20 1.682 -5.729 -12.958 1.00 0.00 N ATOM 219 CA ALA A 20 1.732 -4.589 -13.858 1.00 0.00 C ATOM 220 C ALA A 20 2.818 -3.619 -13.387 1.00 0.00 C ATOM 221 O ALA A 20 3.048 -3.475 -12.187 1.00 0.00 O ATOM 222 CB ALA A 20 0.353 -3.932 -13.927 1.00 0.00 C ATOM 0 H ALA A 20 2.277 -5.648 -12.133 1.00 0.00 H new ATOM 0 HA ALA A 20 1.991 -4.908 -14.867 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.391 -3.077 -14.602 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -0.376 -4.654 -14.296 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.060 -3.596 -12.932 1.00 0.00 H new ATOM 228 N GLU A 21 3.456 -2.979 -14.356 1.00 0.00 N ATOM 229 CA GLU A 21 4.511 -2.027 -14.055 1.00 0.00 C ATOM 230 C GLU A 21 4.114 -1.154 -12.863 1.00 0.00 C ATOM 231 O GLU A 21 2.943 -1.098 -12.492 1.00 0.00 O ATOM 232 CB GLU A 21 4.840 -1.168 -15.278 1.00 0.00 C ATOM 233 CG GLU A 21 5.797 -1.900 -16.221 1.00 0.00 C ATOM 234 CD GLU A 21 5.613 -1.427 -17.664 1.00 0.00 C ATOM 235 OE1 GLU A 21 5.875 -0.229 -17.906 1.00 0.00 O ATOM 236 OE2 GLU A 21 5.215 -2.274 -18.493 1.00 0.00 O ATOM 0 H GLU A 21 3.262 -3.101 -15.350 1.00 0.00 H new ATOM 0 HA GLU A 21 5.410 -2.583 -13.790 1.00 0.00 H new ATOM 0 HB2 GLU A 21 3.921 -0.918 -15.809 1.00 0.00 H new ATOM 0 HB3 GLU A 21 5.289 -0.228 -14.957 1.00 0.00 H new ATOM 0 HG2 GLU A 21 6.826 -1.727 -15.906 1.00 0.00 H new ATOM 0 HG3 GLU A 21 5.621 -2.974 -16.161 1.00 0.00 H new ATOM 243 N THR A 22 5.113 -0.494 -12.295 1.00 0.00 N ATOM 244 CA THR A 22 4.883 0.373 -11.152 1.00 0.00 C ATOM 245 C THR A 22 5.444 1.771 -11.422 1.00 0.00 C ATOM 246 O THR A 22 6.609 2.042 -11.135 1.00 0.00 O ATOM 247 CB THR A 22 5.492 -0.298 -9.919 1.00 0.00 C ATOM 248 OG1 THR A 22 4.819 -1.552 -9.839 1.00 0.00 O ATOM 249 CG2 THR A 22 5.112 0.412 -8.618 1.00 0.00 C ATOM 0 H THR A 22 6.083 -0.542 -12.605 1.00 0.00 H new ATOM 0 HA THR A 22 3.817 0.514 -10.970 1.00 0.00 H new ATOM 0 HB THR A 22 6.577 -0.320 -10.017 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.154 -2.054 -9.067 1.00 0.00 H new ATOM 0 HG21 THR A 22 5.570 -0.104 -7.774 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.467 1.442 -8.649 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.028 0.405 -8.503 1.00 0.00 H new ATOM 257 N PRO A 23 4.566 2.644 -11.984 1.00 0.00 N ATOM 258 CA PRO A 23 4.962 4.007 -12.296 1.00 0.00 C ATOM 259 C PRO A 23 5.047 4.857 -11.027 1.00 0.00 C ATOM 260 O PRO A 23 4.671 4.405 -9.946 1.00 0.00 O ATOM 261 CB PRO A 23 3.913 4.506 -13.276 1.00 0.00 C ATOM 262 CG PRO A 23 2.720 3.577 -13.120 1.00 0.00 C ATOM 263 CD PRO A 23 3.179 2.357 -12.337 1.00 0.00 C ATOM 0 HA PRO A 23 5.958 4.066 -12.735 1.00 0.00 H new ATOM 0 HB2 PRO A 23 3.635 5.538 -13.059 1.00 0.00 H new ATOM 0 HB3 PRO A 23 4.292 4.486 -14.298 1.00 0.00 H new ATOM 0 HG2 PRO A 23 1.908 4.083 -12.598 1.00 0.00 H new ATOM 0 HG3 PRO A 23 2.336 3.282 -14.096 1.00 0.00 H new ATOM 0 HD2 PRO A 23 2.568 2.204 -11.448 1.00 0.00 H new ATOM 0 HD3 PRO A 23 3.102 1.450 -12.936 1.00 0.00 H new ATOM 271 N PRO A 24 5.557 6.105 -11.204 1.00 0.00 N ATOM 272 CA PRO A 24 5.696 7.023 -10.086 1.00 0.00 C ATOM 273 C PRO A 24 4.339 7.597 -9.676 1.00 0.00 C ATOM 274 O PRO A 24 3.637 8.186 -10.497 1.00 0.00 O ATOM 275 CB PRO A 24 6.670 8.085 -10.569 1.00 0.00 C ATOM 276 CG PRO A 24 6.680 7.984 -12.085 1.00 0.00 C ATOM 277 CD PRO A 24 6.012 6.674 -12.470 1.00 0.00 C ATOM 0 HA PRO A 24 6.072 6.537 -9.186 1.00 0.00 H new ATOM 0 HB2 PRO A 24 6.357 9.078 -10.246 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.666 7.916 -10.160 1.00 0.00 H new ATOM 0 HG2 PRO A 24 6.149 8.827 -12.527 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.702 8.017 -12.463 1.00 0.00 H new ATOM 0 HD2 PRO A 24 5.178 6.840 -13.152 1.00 0.00 H new ATOM 0 HD3 PRO A 24 6.710 6.007 -12.976 1.00 0.00 H new ATOM 285 N LYS A 25 4.010 7.407 -8.407 1.00 0.00 N ATOM 286 CA LYS A 25 2.750 7.899 -7.878 1.00 0.00 C ATOM 287 C LYS A 25 2.963 8.401 -6.449 1.00 0.00 C ATOM 288 O LYS A 25 3.838 9.230 -6.202 1.00 0.00 O ATOM 289 CB LYS A 25 1.664 6.828 -7.998 1.00 0.00 C ATOM 290 CG LYS A 25 2.107 5.522 -7.336 1.00 0.00 C ATOM 291 CD LYS A 25 0.943 4.861 -6.594 1.00 0.00 C ATOM 292 CE LYS A 25 1.211 3.372 -6.369 1.00 0.00 C ATOM 293 NZ LYS A 25 0.167 2.553 -7.024 1.00 0.00 N ATOM 0 H LYS A 25 4.595 6.918 -7.729 1.00 0.00 H new ATOM 0 HA LYS A 25 2.396 8.747 -8.465 1.00 0.00 H new ATOM 0 HB2 LYS A 25 0.745 7.183 -7.532 1.00 0.00 H new ATOM 0 HB3 LYS A 25 1.439 6.649 -9.049 1.00 0.00 H new ATOM 0 HG2 LYS A 25 2.495 4.840 -8.093 1.00 0.00 H new ATOM 0 HG3 LYS A 25 2.921 5.721 -6.639 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.791 5.356 -5.635 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.024 4.986 -7.167 1.00 0.00 H new ATOM 0 HE2 LYS A 25 2.191 3.109 -6.767 1.00 0.00 H new ATOM 0 HE3 LYS A 25 1.233 3.158 -5.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.295 1.554 -6.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.772 2.874 -6.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 0.243 2.654 -8.056 1.00 0.00 H new ATOM 307 N HIS A 26 2.147 7.879 -5.544 1.00 0.00 N ATOM 308 CA HIS A 26 2.236 8.265 -4.146 1.00 0.00 C ATOM 309 C HIS A 26 2.985 7.185 -3.363 1.00 0.00 C ATOM 310 O HIS A 26 2.746 5.994 -3.556 1.00 0.00 O ATOM 311 CB HIS A 26 0.847 8.556 -3.574 1.00 0.00 C ATOM 312 CG HIS A 26 0.868 9.259 -2.238 1.00 0.00 C ATOM 313 ND1 HIS A 26 1.339 8.660 -1.083 1.00 0.00 N ATOM 314 CD2 HIS A 26 0.473 10.516 -1.886 1.00 0.00 C ATOM 315 CE1 HIS A 26 1.226 9.526 -0.086 1.00 0.00 C ATOM 316 NE2 HIS A 26 0.689 10.676 -0.586 1.00 0.00 N ATOM 0 H HIS A 26 1.422 7.193 -5.752 1.00 0.00 H new ATOM 0 HA HIS A 26 2.804 9.191 -4.055 1.00 0.00 H new ATOM 0 HB2 HIS A 26 0.293 9.168 -4.286 1.00 0.00 H new ATOM 0 HB3 HIS A 26 0.304 7.617 -3.470 1.00 0.00 H new ATOM 0 HD2 HIS A 26 0.055 11.256 -2.552 1.00 0.00 H new ATOM 0 HE1 HIS A 26 1.509 9.352 0.942 1.00 0.00 H new ATOM 0 HE2 HIS A 26 0.487 11.520 -0.050 1.00 0.00 H new ATOM 324 N PRO A 27 3.899 7.652 -2.471 1.00 0.00 N ATOM 325 CA PRO A 27 4.685 6.740 -1.657 1.00 0.00 C ATOM 326 C PRO A 27 3.839 6.144 -0.530 1.00 0.00 C ATOM 327 O PRO A 27 3.975 4.965 -0.204 1.00 0.00 O ATOM 328 CB PRO A 27 5.851 7.572 -1.148 1.00 0.00 C ATOM 329 CG PRO A 27 5.430 9.024 -1.311 1.00 0.00 C ATOM 330 CD PRO A 27 4.208 9.056 -2.214 1.00 0.00 C ATOM 0 HA PRO A 27 5.044 5.877 -2.219 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.068 7.343 -0.105 1.00 0.00 H new ATOM 0 HB3 PRO A 27 6.758 7.362 -1.716 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.200 9.466 -0.342 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.240 9.610 -1.744 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.373 9.563 -1.732 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.414 9.592 -3.140 1.00 0.00 H new ATOM 338 N GLY A 28 2.985 6.985 0.034 1.00 0.00 N ATOM 339 CA GLY A 28 2.117 6.555 1.118 1.00 0.00 C ATOM 340 C GLY A 28 1.270 5.353 0.698 1.00 0.00 C ATOM 341 O GLY A 28 0.841 4.566 1.541 1.00 0.00 O ATOM 0 H GLY A 28 2.875 7.962 -0.239 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.719 6.294 1.989 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.466 7.377 1.415 1.00 0.00 H new ATOM 345 N VAL A 29 1.054 5.247 -0.605 1.00 0.00 N ATOM 346 CA VAL A 29 0.265 4.154 -1.147 1.00 0.00 C ATOM 347 C VAL A 29 1.171 2.942 -1.374 1.00 0.00 C ATOM 348 O VAL A 29 0.892 1.852 -0.876 1.00 0.00 O ATOM 349 CB VAL A 29 -0.456 4.608 -2.418 1.00 0.00 C ATOM 350 CG1 VAL A 29 -1.375 3.507 -2.950 1.00 0.00 C ATOM 351 CG2 VAL A 29 -1.234 5.902 -2.174 1.00 0.00 C ATOM 0 H VAL A 29 1.412 5.901 -1.301 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.509 3.854 -0.441 1.00 0.00 H new ATOM 0 HB VAL A 29 0.299 4.810 -3.178 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -1.875 3.856 -3.854 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.785 2.620 -3.181 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -2.121 3.259 -2.195 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.737 6.203 -3.093 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.975 5.739 -1.391 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.545 6.688 -1.864 1.00 0.00 H new ATOM 361 N LEU A 30 2.237 3.172 -2.127 1.00 0.00 N ATOM 362 CA LEU A 30 3.185 2.112 -2.426 1.00 0.00 C ATOM 363 C LEU A 30 3.476 1.320 -1.151 1.00 0.00 C ATOM 364 O LEU A 30 3.668 0.106 -1.200 1.00 0.00 O ATOM 365 CB LEU A 30 4.437 2.686 -3.093 1.00 0.00 C ATOM 366 CG LEU A 30 4.203 3.511 -4.360 1.00 0.00 C ATOM 367 CD1 LEU A 30 5.208 4.661 -4.459 1.00 0.00 C ATOM 368 CD2 LEU A 30 4.226 2.622 -5.605 1.00 0.00 C ATOM 0 H LEU A 30 2.465 4.077 -2.539 1.00 0.00 H new ATOM 0 HA LEU A 30 2.760 1.413 -3.146 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.957 3.311 -2.367 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.105 1.860 -3.339 1.00 0.00 H new ATOM 0 HG LEU A 30 3.210 3.955 -4.299 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.020 5.232 -5.368 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.101 5.314 -3.593 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.220 4.258 -4.487 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.057 3.233 -6.492 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.195 2.130 -5.683 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.442 1.869 -5.529 1.00 0.00 H new ATOM 380 N LYS A 31 3.500 2.038 -0.038 1.00 0.00 N ATOM 381 CA LYS A 31 3.765 1.417 1.249 1.00 0.00 C ATOM 382 C LYS A 31 2.841 0.210 1.427 1.00 0.00 C ATOM 383 O LYS A 31 3.240 -0.802 2.002 1.00 0.00 O ATOM 384 CB LYS A 31 3.654 2.447 2.374 1.00 0.00 C ATOM 385 CG LYS A 31 4.853 2.356 3.321 1.00 0.00 C ATOM 386 CD LYS A 31 5.008 3.643 4.134 1.00 0.00 C ATOM 387 CE LYS A 31 6.450 3.817 4.614 1.00 0.00 C ATOM 388 NZ LYS A 31 6.683 5.209 5.061 1.00 0.00 N ATOM 0 H LYS A 31 3.340 3.045 -0.001 1.00 0.00 H new ATOM 0 HA LYS A 31 4.789 1.045 1.289 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.596 3.449 1.950 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.732 2.283 2.932 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.725 1.509 3.995 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.761 2.172 2.747 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.718 4.499 3.525 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.336 3.619 4.992 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.653 3.127 5.433 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.140 3.567 3.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.667 5.310 5.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 6.509 5.861 4.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 6.037 5.435 5.844 1.00 0.00 H new ATOM 402 N VAL A 32 1.625 0.356 0.923 1.00 0.00 N ATOM 403 CA VAL A 32 0.642 -0.710 1.019 1.00 0.00 C ATOM 404 C VAL A 32 0.819 -1.669 -0.160 1.00 0.00 C ATOM 405 O VAL A 32 0.841 -2.885 0.023 1.00 0.00 O ATOM 406 CB VAL A 32 -0.766 -0.117 1.101 1.00 0.00 C ATOM 407 CG1 VAL A 32 -0.740 1.271 1.746 1.00 0.00 C ATOM 408 CG2 VAL A 32 -1.422 -0.067 -0.280 1.00 0.00 C ATOM 0 H VAL A 32 1.298 1.196 0.447 1.00 0.00 H new ATOM 0 HA VAL A 32 0.791 -1.286 1.932 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.367 -0.770 1.734 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.753 1.670 1.792 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.333 1.196 2.755 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.115 1.937 1.151 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -2.422 0.359 -0.193 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.821 0.552 -0.946 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.491 -1.076 -0.687 1.00 0.00 H new ATOM 418 N GLU A 33 0.940 -1.085 -1.343 1.00 0.00 N ATOM 419 CA GLU A 33 1.114 -1.873 -2.552 1.00 0.00 C ATOM 420 C GLU A 33 2.317 -2.808 -2.407 1.00 0.00 C ATOM 421 O GLU A 33 2.309 -3.920 -2.931 1.00 0.00 O ATOM 422 CB GLU A 33 1.265 -0.970 -3.777 1.00 0.00 C ATOM 423 CG GLU A 33 0.080 -0.010 -3.901 1.00 0.00 C ATOM 424 CD GLU A 33 -0.643 -0.201 -5.236 1.00 0.00 C ATOM 425 OE1 GLU A 33 0.037 -0.058 -6.275 1.00 0.00 O ATOM 426 OE2 GLU A 33 -1.859 -0.485 -5.187 1.00 0.00 O ATOM 0 H GLU A 33 0.921 -0.076 -1.490 1.00 0.00 H new ATOM 0 HA GLU A 33 0.222 -2.482 -2.698 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.192 -0.401 -3.702 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.338 -1.581 -4.677 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.616 -0.178 -3.079 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.430 1.019 -3.817 1.00 0.00 H new ATOM 433 N ALA A 34 3.321 -2.321 -1.694 1.00 0.00 N ATOM 434 CA ALA A 34 4.529 -3.099 -1.474 1.00 0.00 C ATOM 435 C ALA A 34 4.174 -4.380 -0.715 1.00 0.00 C ATOM 436 O ALA A 34 4.765 -5.431 -0.956 1.00 0.00 O ATOM 437 CB ALA A 34 5.557 -2.246 -0.728 1.00 0.00 C ATOM 0 H ALA A 34 3.323 -1.398 -1.261 1.00 0.00 H new ATOM 0 HA ALA A 34 4.976 -3.391 -2.424 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.463 -2.829 -0.563 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.797 -1.364 -1.321 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.145 -1.937 0.232 1.00 0.00 H new ATOM 443 N ILE A 35 3.211 -4.249 0.185 1.00 0.00 N ATOM 444 CA ILE A 35 2.771 -5.382 0.980 1.00 0.00 C ATOM 445 C ILE A 35 1.795 -6.228 0.159 1.00 0.00 C ATOM 446 O ILE A 35 1.912 -7.451 0.116 1.00 0.00 O ATOM 447 CB ILE A 35 2.198 -4.909 2.318 1.00 0.00 C ATOM 448 CG1 ILE A 35 3.250 -4.143 3.123 1.00 0.00 C ATOM 449 CG2 ILE A 35 1.612 -6.080 3.108 1.00 0.00 C ATOM 450 CD1 ILE A 35 2.591 -3.127 4.058 1.00 0.00 C ATOM 0 H ILE A 35 2.723 -3.375 0.381 1.00 0.00 H new ATOM 0 HA ILE A 35 3.617 -6.022 1.230 1.00 0.00 H new ATOM 0 HB ILE A 35 1.380 -4.217 2.115 1.00 0.00 H new ATOM 0 HG12 ILE A 35 3.849 -4.843 3.705 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.930 -3.630 2.444 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.212 -5.716 4.054 1.00 0.00 H new ATOM 0 HG22 ILE A 35 0.813 -6.545 2.531 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.393 -6.815 3.303 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.360 -2.596 4.619 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.013 -2.414 3.471 1.00 0.00 H new ATOM 0 HD13 ILE A 35 1.930 -3.646 4.752 1.00 0.00 H new ATOM 462 N LEU A 36 0.854 -5.541 -0.473 1.00 0.00 N ATOM 463 CA LEU A 36 -0.141 -6.213 -1.291 1.00 0.00 C ATOM 464 C LEU A 36 0.557 -7.205 -2.224 1.00 0.00 C ATOM 465 O LEU A 36 0.165 -8.369 -2.304 1.00 0.00 O ATOM 466 CB LEU A 36 -1.013 -5.191 -2.023 1.00 0.00 C ATOM 467 CG LEU A 36 -2.366 -4.881 -1.380 1.00 0.00 C ATOM 468 CD1 LEU A 36 -3.236 -4.036 -2.313 1.00 0.00 C ATOM 469 CD2 LEU A 36 -3.073 -6.166 -0.944 1.00 0.00 C ATOM 0 H LEU A 36 0.760 -4.526 -0.435 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.822 -6.789 -0.664 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.452 -4.260 -2.109 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.189 -5.552 -3.036 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.190 -4.290 -0.481 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.192 -3.830 -1.832 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.729 -3.096 -2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.407 -4.579 -3.242 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.032 -5.917 -0.490 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.237 -6.804 -1.813 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.454 -6.694 -0.218 1.00 0.00 H new ATOM 481 N GLU A 37 1.579 -6.709 -2.905 1.00 0.00 N ATOM 482 CA GLU A 37 2.335 -7.538 -3.829 1.00 0.00 C ATOM 483 C GLU A 37 2.695 -8.872 -3.172 1.00 0.00 C ATOM 484 O GLU A 37 2.697 -9.911 -3.831 1.00 0.00 O ATOM 485 CB GLU A 37 3.590 -6.811 -4.316 1.00 0.00 C ATOM 486 CG GLU A 37 3.515 -6.533 -5.819 1.00 0.00 C ATOM 487 CD GLU A 37 4.551 -7.361 -6.582 1.00 0.00 C ATOM 488 OE1 GLU A 37 4.513 -8.601 -6.427 1.00 0.00 O ATOM 489 OE2 GLU A 37 5.357 -6.735 -7.304 1.00 0.00 O ATOM 0 H GLU A 37 1.902 -5.744 -2.836 1.00 0.00 H new ATOM 0 HA GLU A 37 1.711 -7.740 -4.699 1.00 0.00 H new ATOM 0 HB2 GLU A 37 3.704 -5.872 -3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.471 -7.414 -4.098 1.00 0.00 H new ATOM 0 HG2 GLU A 37 2.516 -6.766 -6.186 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.683 -5.472 -6.005 1.00 0.00 H new ATOM 496 N LYS A 38 2.991 -8.800 -1.883 1.00 0.00 N ATOM 497 CA LYS A 38 3.352 -9.990 -1.130 1.00 0.00 C ATOM 498 C LYS A 38 2.092 -10.812 -0.850 1.00 0.00 C ATOM 499 O LYS A 38 2.095 -12.032 -1.008 1.00 0.00 O ATOM 500 CB LYS A 38 4.132 -9.611 0.130 1.00 0.00 C ATOM 501 CG LYS A 38 5.459 -8.939 -0.228 1.00 0.00 C ATOM 502 CD LYS A 38 5.974 -8.087 0.934 1.00 0.00 C ATOM 503 CE LYS A 38 7.039 -8.838 1.735 1.00 0.00 C ATOM 504 NZ LYS A 38 8.384 -8.591 1.169 1.00 0.00 N ATOM 0 H LYS A 38 2.988 -7.936 -1.340 1.00 0.00 H new ATOM 0 HA LYS A 38 4.022 -10.621 -1.713 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.533 -8.938 0.744 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.321 -10.503 0.727 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.198 -9.699 -0.482 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.327 -8.314 -1.111 1.00 0.00 H new ATOM 0 HD2 LYS A 38 6.392 -7.156 0.550 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.144 -7.818 1.588 1.00 0.00 H new ATOM 0 HE2 LYS A 38 7.012 -8.518 2.777 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.824 -9.907 1.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.095 -9.108 1.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.411 -8.918 0.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.593 -7.573 1.202 1.00 0.00 H new ATOM 518 N VAL A 39 1.046 -10.111 -0.438 1.00 0.00 N ATOM 519 CA VAL A 39 -0.217 -10.760 -0.134 1.00 0.00 C ATOM 520 C VAL A 39 -0.543 -11.772 -1.234 1.00 0.00 C ATOM 521 O VAL A 39 -0.649 -12.969 -0.969 1.00 0.00 O ATOM 522 CB VAL A 39 -1.313 -9.709 0.056 1.00 0.00 C ATOM 523 CG1 VAL A 39 -2.688 -10.369 0.188 1.00 0.00 C ATOM 524 CG2 VAL A 39 -1.015 -8.818 1.263 1.00 0.00 C ATOM 0 H VAL A 39 1.048 -9.099 -0.308 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.148 -11.311 0.804 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.328 -9.076 -0.832 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.449 -9.600 0.322 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.905 -10.941 -0.714 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.690 -11.036 1.050 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.809 -8.080 1.375 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.959 -9.431 2.163 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.064 -8.307 1.112 1.00 0.00 H new ATOM 534 N GLN A 40 -0.693 -11.255 -2.444 1.00 0.00 N ATOM 535 CA GLN A 40 -1.005 -12.098 -3.585 1.00 0.00 C ATOM 536 C GLN A 40 -0.262 -13.431 -3.479 1.00 0.00 C ATOM 537 O GLN A 40 -0.862 -14.495 -3.626 1.00 0.00 O ATOM 538 CB GLN A 40 -0.672 -11.388 -4.899 1.00 0.00 C ATOM 539 CG GLN A 40 -1.558 -10.157 -5.097 1.00 0.00 C ATOM 540 CD GLN A 40 -2.768 -10.487 -5.974 1.00 0.00 C ATOM 541 OE1 GLN A 40 -3.673 -11.206 -5.584 1.00 0.00 O ATOM 542 NE2 GLN A 40 -2.732 -9.923 -7.178 1.00 0.00 N ATOM 0 H GLN A 40 -0.604 -10.262 -2.659 1.00 0.00 H new ATOM 0 HA GLN A 40 -2.076 -12.300 -3.580 1.00 0.00 H new ATOM 0 HB2 GLN A 40 0.376 -11.090 -4.900 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -0.808 -12.076 -5.733 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -1.896 -9.788 -4.129 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -0.978 -9.357 -5.558 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -1.944 -9.331 -7.441 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -3.493 -10.082 -7.839 1.00 0.00 H new ATOM 551 N GLY A 41 1.035 -13.331 -3.224 1.00 0.00 N ATOM 552 CA GLY A 41 1.866 -14.516 -3.096 1.00 0.00 C ATOM 553 C GLY A 41 1.263 -15.504 -2.096 1.00 0.00 C ATOM 554 O GLY A 41 1.197 -16.702 -2.365 1.00 0.00 O ATOM 0 H GLY A 41 1.530 -12.448 -3.103 1.00 0.00 H new ATOM 0 HA2 GLY A 41 1.972 -14.997 -4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 41 2.866 -14.230 -2.771 1.00 0.00 H new ATOM 558 N LEU A 42 0.838 -14.964 -0.963 1.00 0.00 N ATOM 559 CA LEU A 42 0.242 -15.783 0.078 1.00 0.00 C ATOM 560 C LEU A 42 -1.042 -16.423 -0.454 1.00 0.00 C ATOM 561 O LEU A 42 -1.188 -17.644 -0.427 1.00 0.00 O ATOM 562 CB LEU A 42 0.037 -14.963 1.354 1.00 0.00 C ATOM 563 CG LEU A 42 1.298 -14.350 1.967 1.00 0.00 C ATOM 564 CD1 LEU A 42 0.950 -13.158 2.860 1.00 0.00 C ATOM 565 CD2 LEU A 42 2.114 -15.407 2.714 1.00 0.00 C ATOM 0 H LEU A 42 0.895 -13.970 -0.744 1.00 0.00 H new ATOM 0 HA LEU A 42 0.914 -16.596 0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.665 -14.158 1.136 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -0.433 -15.602 2.102 1.00 0.00 H new ATOM 0 HG LEU A 42 1.923 -13.974 1.157 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.864 -12.741 3.283 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.443 -12.396 2.268 1.00 0.00 H new ATOM 0 HD13 LEU A 42 0.294 -13.487 3.666 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.005 -14.945 3.140 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.510 -15.835 3.514 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.410 -16.195 2.021 1.00 0.00 H new ATOM 577 N GLU A 43 -1.939 -15.570 -0.925 1.00 0.00 N ATOM 578 CA GLU A 43 -3.206 -16.037 -1.462 1.00 0.00 C ATOM 579 C GLU A 43 -2.966 -17.066 -2.569 1.00 0.00 C ATOM 580 O GLU A 43 -3.756 -17.993 -2.741 1.00 0.00 O ATOM 581 CB GLU A 43 -4.048 -14.867 -1.975 1.00 0.00 C ATOM 582 CG GLU A 43 -4.935 -15.301 -3.144 1.00 0.00 C ATOM 583 CD GLU A 43 -4.262 -14.999 -4.484 1.00 0.00 C ATOM 584 OE1 GLU A 43 -3.013 -15.013 -4.508 1.00 0.00 O ATOM 585 OE2 GLU A 43 -5.013 -14.760 -5.455 1.00 0.00 O ATOM 0 H GLU A 43 -1.814 -14.558 -0.946 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.764 -16.519 -0.659 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -4.669 -14.479 -1.167 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.394 -14.055 -2.292 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.144 -16.368 -3.070 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.893 -14.784 -3.090 1.00 0.00 H new ATOM 592 N GLN A 44 -1.872 -16.868 -3.290 1.00 0.00 N ATOM 593 CA GLN A 44 -1.519 -17.768 -4.375 1.00 0.00 C ATOM 594 C GLN A 44 -1.244 -19.171 -3.832 1.00 0.00 C ATOM 595 O GLN A 44 -1.431 -20.161 -4.538 1.00 0.00 O ATOM 596 CB GLN A 44 -0.316 -17.237 -5.157 1.00 0.00 C ATOM 597 CG GLN A 44 -0.747 -16.178 -6.174 1.00 0.00 C ATOM 598 CD GLN A 44 0.209 -16.144 -7.368 1.00 0.00 C ATOM 599 OE1 GLN A 44 1.213 -16.836 -7.413 1.00 0.00 O ATOM 600 NE2 GLN A 44 -0.158 -15.302 -8.331 1.00 0.00 N ATOM 0 H GLN A 44 -1.219 -16.098 -3.144 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.362 -17.825 -5.063 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.411 -16.809 -4.467 1.00 0.00 H new ATOM 0 HB3 GLN A 44 0.180 -18.060 -5.672 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.759 -16.391 -6.519 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -0.773 -15.199 -5.696 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.011 -14.752 -8.230 1.00 0.00 H new ATOM 0 HE22 GLN A 44 0.414 -15.207 -9.170 1.00 0.00 H new ATOM 609 N ALA A 45 -0.804 -19.213 -2.583 1.00 0.00 N ATOM 610 CA ALA A 45 -0.501 -20.479 -1.937 1.00 0.00 C ATOM 611 C ALA A 45 -1.792 -21.082 -1.378 1.00 0.00 C ATOM 612 O ALA A 45 -2.006 -22.290 -1.469 1.00 0.00 O ATOM 613 CB ALA A 45 0.557 -20.260 -0.855 1.00 0.00 C ATOM 0 H ALA A 45 -0.650 -18.390 -2.001 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.089 -21.188 -2.655 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.784 -21.210 -0.371 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.463 -19.858 -1.308 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.179 -19.556 -0.114 1.00 0.00 H new ATOM 619 N VAL A 46 -2.616 -20.214 -0.811 1.00 0.00 N ATOM 620 CA VAL A 46 -3.879 -20.646 -0.237 1.00 0.00 C ATOM 621 C VAL A 46 -4.791 -21.161 -1.352 1.00 0.00 C ATOM 622 O VAL A 46 -5.326 -22.265 -1.262 1.00 0.00 O ATOM 623 CB VAL A 46 -4.505 -19.506 0.568 1.00 0.00 C ATOM 624 CG1 VAL A 46 -3.426 -18.608 1.177 1.00 0.00 C ATOM 625 CG2 VAL A 46 -5.474 -18.693 -0.293 1.00 0.00 C ATOM 0 H VAL A 46 -2.434 -19.213 -0.737 1.00 0.00 H new ATOM 0 HA VAL A 46 -3.720 -21.469 0.460 1.00 0.00 H new ATOM 0 HB VAL A 46 -5.074 -19.947 1.386 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -3.898 -17.806 1.744 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -2.794 -19.198 1.840 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -2.817 -18.180 0.381 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -5.905 -17.889 0.304 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -4.938 -18.268 -1.141 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.271 -19.342 -0.656 1.00 0.00 H new ATOM 635 N ASP A 47 -4.942 -20.337 -2.379 1.00 0.00 N ATOM 636 CA ASP A 47 -5.780 -20.695 -3.510 1.00 0.00 C ATOM 637 C ASP A 47 -5.286 -22.014 -4.107 1.00 0.00 C ATOM 638 O ASP A 47 -6.044 -22.722 -4.770 1.00 0.00 O ATOM 639 CB ASP A 47 -5.716 -19.627 -4.604 1.00 0.00 C ATOM 640 CG ASP A 47 -6.975 -19.506 -5.464 1.00 0.00 C ATOM 641 OD1 ASP A 47 -8.008 -19.083 -4.901 1.00 0.00 O ATOM 642 OD2 ASP A 47 -6.876 -19.838 -6.665 1.00 0.00 O ATOM 0 H ASP A 47 -4.497 -19.422 -2.451 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.806 -20.785 -3.154 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.519 -18.662 -4.137 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.869 -19.845 -5.255 1.00 0.00 H new ATOM 647 N SER A 48 -4.019 -22.306 -3.851 1.00 0.00 N ATOM 648 CA SER A 48 -3.416 -23.527 -4.356 1.00 0.00 C ATOM 649 C SER A 48 -2.808 -24.326 -3.201 1.00 0.00 C ATOM 650 O SER A 48 -1.798 -25.006 -3.376 1.00 0.00 O ATOM 651 CB SER A 48 -2.349 -23.220 -5.409 1.00 0.00 C ATOM 652 OG SER A 48 -1.805 -24.407 -5.979 1.00 0.00 O ATOM 0 H SER A 48 -3.394 -21.718 -3.300 1.00 0.00 H new ATOM 0 HA SER A 48 -4.195 -24.123 -4.831 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.784 -22.606 -6.197 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.549 -22.636 -4.955 1.00 0.00 H new ATOM 0 HG SER A 48 -1.486 -24.997 -5.264 1.00 0.00 H new ATOM 658 N PHE A 49 -3.449 -24.217 -2.047 1.00 0.00 N ATOM 659 CA PHE A 49 -2.984 -24.921 -0.863 1.00 0.00 C ATOM 660 C PHE A 49 -3.777 -26.210 -0.645 1.00 0.00 C ATOM 661 O PHE A 49 -4.803 -26.429 -1.288 1.00 0.00 O ATOM 662 CB PHE A 49 -3.210 -23.989 0.329 1.00 0.00 C ATOM 663 CG PHE A 49 -3.380 -24.717 1.664 1.00 0.00 C ATOM 664 CD1 PHE A 49 -2.288 -25.174 2.333 1.00 0.00 C ATOM 665 CD2 PHE A 49 -4.623 -24.907 2.181 1.00 0.00 C ATOM 666 CE1 PHE A 49 -2.446 -25.849 3.572 1.00 0.00 C ATOM 667 CE2 PHE A 49 -4.781 -25.582 3.420 1.00 0.00 C ATOM 668 CZ PHE A 49 -3.689 -26.039 4.090 1.00 0.00 C ATOM 0 H PHE A 49 -4.286 -23.652 -1.906 1.00 0.00 H new ATOM 0 HA PHE A 49 -1.933 -25.188 -0.977 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.367 -23.303 0.406 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -4.097 -23.384 0.141 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.301 -25.024 1.922 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.490 -24.544 1.649 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -1.579 -26.212 4.103 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -5.768 -25.733 3.831 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.809 -26.552 5.033 1.00 0.00 H new ATOM 678 N GLU A 50 -3.272 -27.031 0.264 1.00 0.00 N ATOM 679 CA GLU A 50 -3.921 -28.294 0.575 1.00 0.00 C ATOM 680 C GLU A 50 -3.647 -28.688 2.028 1.00 0.00 C ATOM 681 O GLU A 50 -2.494 -28.732 2.455 1.00 0.00 O ATOM 682 CB GLU A 50 -3.469 -29.394 -0.387 1.00 0.00 C ATOM 683 CG GLU A 50 -4.505 -30.518 -0.460 1.00 0.00 C ATOM 684 CD GLU A 50 -4.809 -30.889 -1.913 1.00 0.00 C ATOM 685 OE1 GLU A 50 -5.304 -29.997 -2.635 1.00 0.00 O ATOM 686 OE2 GLU A 50 -4.538 -32.057 -2.269 1.00 0.00 O ATOM 0 H GLU A 50 -2.421 -26.847 0.795 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.997 -28.168 0.450 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -3.314 -28.972 -1.380 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.511 -29.798 -0.059 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.135 -31.394 0.073 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.422 -30.205 0.039 1.00 0.00 H new ATOM 693 N GLY A 51 -4.725 -28.964 2.746 1.00 0.00 N ATOM 694 CA GLY A 51 -4.615 -29.353 4.142 1.00 0.00 C ATOM 695 C GLY A 51 -5.867 -28.952 4.923 1.00 0.00 C ATOM 696 O GLY A 51 -6.945 -28.814 4.347 1.00 0.00 O ATOM 0 H GLY A 51 -5.679 -28.926 2.388 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.468 -30.431 4.212 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.738 -28.882 4.587 1.00 0.00 H new ATOM 700 N LYS A 52 -5.684 -28.776 6.224 1.00 0.00 N ATOM 701 CA LYS A 52 -6.786 -28.393 7.090 1.00 0.00 C ATOM 702 C LYS A 52 -6.344 -27.236 7.988 1.00 0.00 C ATOM 703 O LYS A 52 -5.330 -26.593 7.724 1.00 0.00 O ATOM 704 CB LYS A 52 -7.306 -29.607 7.863 1.00 0.00 C ATOM 705 CG LYS A 52 -6.209 -30.209 8.743 1.00 0.00 C ATOM 706 CD LYS A 52 -5.910 -31.654 8.336 1.00 0.00 C ATOM 707 CE LYS A 52 -6.485 -32.640 9.356 1.00 0.00 C ATOM 708 NZ LYS A 52 -6.462 -34.017 8.814 1.00 0.00 N ATOM 0 H LYS A 52 -4.789 -28.892 6.699 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.629 -28.035 6.499 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -8.153 -29.312 8.483 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -7.669 -30.360 7.163 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -5.302 -29.609 8.661 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -6.518 -30.178 9.788 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -6.334 -31.854 7.352 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -4.833 -31.797 8.254 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -5.907 -32.596 10.279 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -7.508 -32.358 9.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -6.855 -34.674 9.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -7.033 -34.058 7.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -5.482 -34.288 8.597 1.00 0.00 H new ATOM 722 N LYS A 53 -7.128 -27.006 9.031 1.00 0.00 N ATOM 723 CA LYS A 53 -6.831 -25.937 9.970 1.00 0.00 C ATOM 724 C LYS A 53 -5.777 -26.420 10.968 1.00 0.00 C ATOM 725 O LYS A 53 -5.421 -25.698 11.898 1.00 0.00 O ATOM 726 CB LYS A 53 -8.116 -25.431 10.629 1.00 0.00 C ATOM 727 CG LYS A 53 -8.949 -24.607 9.645 1.00 0.00 C ATOM 728 CD LYS A 53 -10.052 -23.836 10.372 1.00 0.00 C ATOM 729 CE LYS A 53 -11.322 -23.763 9.522 1.00 0.00 C ATOM 730 NZ LYS A 53 -12.506 -24.141 10.325 1.00 0.00 N ATOM 0 H LYS A 53 -7.969 -27.542 9.247 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.408 -25.078 9.449 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -8.702 -26.277 10.988 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -7.868 -24.823 11.499 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.303 -23.909 9.112 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -9.392 -25.265 8.898 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -10.274 -24.321 11.323 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -9.705 -22.828 10.602 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -11.448 -22.753 9.131 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -11.230 -24.428 8.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -13.359 -24.086 9.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -12.391 -25.113 10.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -12.601 -23.490 11.131 1.00 0.00 H new ATOM 744 N THR A 54 -5.306 -27.637 10.740 1.00 0.00 N ATOM 745 CA THR A 54 -4.299 -28.224 11.608 1.00 0.00 C ATOM 746 C THR A 54 -2.946 -28.278 10.895 1.00 0.00 C ATOM 747 O THR A 54 -1.899 -28.258 11.541 1.00 0.00 O ATOM 748 CB THR A 54 -4.804 -29.596 12.057 1.00 0.00 C ATOM 749 OG1 THR A 54 -4.722 -29.548 13.479 1.00 0.00 O ATOM 750 CG2 THR A 54 -3.850 -30.728 11.667 1.00 0.00 C ATOM 0 H THR A 54 -5.603 -28.233 9.967 1.00 0.00 H new ATOM 0 HA THR A 54 -4.138 -27.614 12.497 1.00 0.00 H new ATOM 0 HB THR A 54 -5.785 -29.782 11.621 1.00 0.00 H new ATOM 0 HG1 THR A 54 -5.033 -30.399 13.853 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.256 -31.680 12.009 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.736 -30.751 10.583 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.878 -30.560 12.130 1.00 0.00 H new ATOM 758 N ASP A 55 -3.012 -28.344 9.574 1.00 0.00 N ATOM 759 CA ASP A 55 -1.805 -28.401 8.766 1.00 0.00 C ATOM 760 C ASP A 55 -0.873 -27.257 9.169 1.00 0.00 C ATOM 761 O ASP A 55 -1.286 -26.099 9.210 1.00 0.00 O ATOM 762 CB ASP A 55 -2.130 -28.245 7.279 1.00 0.00 C ATOM 763 CG ASP A 55 -0.913 -28.192 6.354 1.00 0.00 C ATOM 764 OD1 ASP A 55 0.214 -28.202 6.896 1.00 0.00 O ATOM 765 OD2 ASP A 55 -1.136 -28.142 5.125 1.00 0.00 O ATOM 0 H ASP A 55 -3.882 -28.359 9.042 1.00 0.00 H new ATOM 0 HA ASP A 55 -1.333 -29.369 8.932 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -2.765 -29.076 6.972 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.711 -27.333 7.143 1.00 0.00 H new ATOM 770 N LYS A 56 0.368 -27.622 9.458 1.00 0.00 N ATOM 771 CA LYS A 56 1.363 -26.640 9.856 1.00 0.00 C ATOM 772 C LYS A 56 1.472 -25.563 8.776 1.00 0.00 C ATOM 773 O LYS A 56 1.720 -24.397 9.079 1.00 0.00 O ATOM 774 CB LYS A 56 2.693 -27.325 10.178 1.00 0.00 C ATOM 775 CG LYS A 56 3.811 -26.296 10.356 1.00 0.00 C ATOM 776 CD LYS A 56 3.617 -25.494 11.645 1.00 0.00 C ATOM 777 CE LYS A 56 4.378 -26.133 12.808 1.00 0.00 C ATOM 778 NZ LYS A 56 5.622 -25.381 13.088 1.00 0.00 N ATOM 0 H LYS A 56 0.707 -28.583 9.424 1.00 0.00 H new ATOM 0 HA LYS A 56 1.058 -26.140 10.775 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.590 -27.917 11.088 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.954 -28.016 9.376 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.776 -26.802 10.380 1.00 0.00 H new ATOM 0 HG3 LYS A 56 3.827 -25.620 9.501 1.00 0.00 H new ATOM 0 HD2 LYS A 56 3.964 -24.471 11.497 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.556 -25.439 11.887 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.748 -26.150 13.697 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.618 -27.169 12.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.127 -25.828 13.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.229 -25.387 12.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.386 -24.399 13.338 1.00 0.00 H new ATOM 792 N LYS A 57 1.280 -25.991 7.536 1.00 0.00 N ATOM 793 CA LYS A 57 1.354 -25.078 6.409 1.00 0.00 C ATOM 794 C LYS A 57 0.306 -23.976 6.581 1.00 0.00 C ATOM 795 O LYS A 57 0.633 -22.791 6.544 1.00 0.00 O ATOM 796 CB LYS A 57 1.230 -25.843 5.090 1.00 0.00 C ATOM 797 CG LYS A 57 0.782 -24.917 3.958 1.00 0.00 C ATOM 798 CD LYS A 57 1.851 -23.865 3.654 1.00 0.00 C ATOM 799 CE LYS A 57 2.333 -23.978 2.206 1.00 0.00 C ATOM 800 NZ LYS A 57 3.419 -23.006 1.945 1.00 0.00 N ATOM 0 H LYS A 57 1.073 -26.959 7.288 1.00 0.00 H new ATOM 0 HA LYS A 57 2.328 -24.590 6.378 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.189 -26.295 4.836 1.00 0.00 H new ATOM 0 HB3 LYS A 57 0.514 -26.657 5.204 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.579 -25.504 3.062 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -0.150 -24.424 4.234 1.00 0.00 H new ATOM 0 HD2 LYS A 57 1.446 -22.868 3.830 1.00 0.00 H new ATOM 0 HD3 LYS A 57 2.694 -23.991 4.333 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.688 -24.990 2.012 1.00 0.00 H new ATOM 0 HE3 LYS A 57 1.502 -23.796 1.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.735 -23.095 0.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.068 -22.041 2.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.218 -23.198 2.583 1.00 0.00 H new ATOM 814 N TYR A 58 -0.934 -24.407 6.766 1.00 0.00 N ATOM 815 CA TYR A 58 -2.032 -23.472 6.944 1.00 0.00 C ATOM 816 C TYR A 58 -1.659 -22.371 7.938 1.00 0.00 C ATOM 817 O TYR A 58 -1.829 -21.187 7.651 1.00 0.00 O ATOM 818 CB TYR A 58 -3.192 -24.289 7.518 1.00 0.00 C ATOM 819 CG TYR A 58 -4.395 -23.446 7.946 1.00 0.00 C ATOM 820 CD1 TYR A 58 -5.064 -22.676 7.016 1.00 0.00 C ATOM 821 CD2 TYR A 58 -4.810 -23.454 9.262 1.00 0.00 C ATOM 822 CE1 TYR A 58 -6.196 -21.883 7.419 1.00 0.00 C ATOM 823 CE2 TYR A 58 -5.942 -22.661 9.664 1.00 0.00 C ATOM 824 CZ TYR A 58 -6.579 -21.914 8.723 1.00 0.00 C ATOM 825 OH TYR A 58 -7.649 -21.165 9.103 1.00 0.00 O ATOM 0 H TYR A 58 -1.202 -25.391 6.796 1.00 0.00 H new ATOM 0 HA TYR A 58 -2.285 -22.993 5.998 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -3.517 -25.014 6.772 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -2.834 -24.855 8.378 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -4.738 -22.668 5.986 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -4.286 -24.055 9.990 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -6.729 -21.277 6.701 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -6.278 -22.659 10.690 1.00 0.00 H new ATOM 0 HH TYR A 58 -7.809 -21.286 10.062 1.00 0.00 H new ATOM 835 N LEU A 59 -1.157 -22.800 9.087 1.00 0.00 N ATOM 836 CA LEU A 59 -0.759 -21.864 10.125 1.00 0.00 C ATOM 837 C LEU A 59 0.212 -20.839 9.536 1.00 0.00 C ATOM 838 O LEU A 59 0.003 -19.634 9.669 1.00 0.00 O ATOM 839 CB LEU A 59 -0.200 -22.614 11.336 1.00 0.00 C ATOM 840 CG LEU A 59 -1.228 -23.331 12.214 1.00 0.00 C ATOM 841 CD1 LEU A 59 -1.839 -24.526 11.480 1.00 0.00 C ATOM 842 CD2 LEU A 59 -0.616 -23.735 13.557 1.00 0.00 C ATOM 0 H LEU A 59 -1.017 -23.783 9.322 1.00 0.00 H new ATOM 0 HA LEU A 59 -1.624 -21.311 10.492 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.522 -23.350 10.981 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.347 -21.905 11.957 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.040 -22.635 12.426 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.566 -25.017 12.127 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.335 -24.181 10.573 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.052 -25.232 11.217 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.368 -24.243 14.161 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.226 -24.406 13.386 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.269 -22.845 14.081 1.00 0.00 H new ATOM 854 N MET A 60 1.252 -21.354 8.897 1.00 0.00 N ATOM 855 CA MET A 60 2.255 -20.498 8.288 1.00 0.00 C ATOM 856 C MET A 60 1.601 -19.401 7.446 1.00 0.00 C ATOM 857 O MET A 60 1.948 -18.227 7.569 1.00 0.00 O ATOM 858 CB MET A 60 3.176 -21.340 7.402 1.00 0.00 C ATOM 859 CG MET A 60 4.502 -21.629 8.109 1.00 0.00 C ATOM 860 SD MET A 60 5.399 -22.896 7.229 1.00 0.00 S ATOM 861 CE MET A 60 5.371 -22.209 5.582 1.00 0.00 C ATOM 0 H MET A 60 1.422 -22.354 8.788 1.00 0.00 H new ATOM 0 HA MET A 60 2.833 -20.025 9.082 1.00 0.00 H new ATOM 0 HB2 MET A 60 2.683 -22.278 7.147 1.00 0.00 H new ATOM 0 HB3 MET A 60 3.366 -20.815 6.466 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.100 -20.720 8.164 1.00 0.00 H new ATOM 0 HG3 MET A 60 4.315 -21.949 9.134 1.00 0.00 H new ATOM 0 HE1 MET A 60 6.139 -22.688 4.975 1.00 0.00 H new ATOM 0 HE2 MET A 60 4.393 -22.382 5.132 1.00 0.00 H new ATOM 0 HE3 MET A 60 5.563 -21.137 5.631 1.00 0.00 H new ATOM 871 N ILE A 61 0.664 -19.821 6.608 1.00 0.00 N ATOM 872 CA ILE A 61 -0.042 -18.889 5.745 1.00 0.00 C ATOM 873 C ILE A 61 -0.891 -17.950 6.604 1.00 0.00 C ATOM 874 O ILE A 61 -0.898 -16.739 6.386 1.00 0.00 O ATOM 875 CB ILE A 61 -0.843 -19.644 4.683 1.00 0.00 C ATOM 876 CG1 ILE A 61 0.049 -20.624 3.917 1.00 0.00 C ATOM 877 CG2 ILE A 61 -1.563 -18.672 3.746 1.00 0.00 C ATOM 878 CD1 ILE A 61 -0.792 -21.650 3.155 1.00 0.00 C ATOM 0 H ILE A 61 0.377 -20.795 6.508 1.00 0.00 H new ATOM 0 HA ILE A 61 0.665 -18.268 5.195 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.609 -20.233 5.187 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.681 -20.076 3.219 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.713 -21.137 4.613 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.125 -19.234 3.000 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.247 -18.050 4.323 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.830 -18.038 3.246 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.134 -22.334 2.619 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.405 -22.213 3.859 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.437 -21.135 2.443 1.00 0.00 H new ATOM 890 N GLU A 62 -1.588 -18.544 7.562 1.00 0.00 N ATOM 891 CA GLU A 62 -2.439 -17.775 8.454 1.00 0.00 C ATOM 892 C GLU A 62 -1.639 -16.650 9.113 1.00 0.00 C ATOM 893 O GLU A 62 -2.011 -15.481 9.019 1.00 0.00 O ATOM 894 CB GLU A 62 -3.086 -18.678 9.507 1.00 0.00 C ATOM 895 CG GLU A 62 -4.219 -17.949 10.233 1.00 0.00 C ATOM 896 CD GLU A 62 -3.673 -16.814 11.102 1.00 0.00 C ATOM 897 OE1 GLU A 62 -2.634 -17.050 11.756 1.00 0.00 O ATOM 898 OE2 GLU A 62 -4.307 -15.737 11.093 1.00 0.00 O ATOM 0 H GLU A 62 -1.581 -19.548 7.740 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.239 -17.327 7.865 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.474 -19.578 9.030 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.334 -18.998 10.228 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.923 -17.547 9.504 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.771 -18.654 10.854 1.00 0.00 H new ATOM 905 N GLU A 63 -0.554 -17.042 9.766 1.00 0.00 N ATOM 906 CA GLU A 63 0.302 -16.081 10.440 1.00 0.00 C ATOM 907 C GLU A 63 0.870 -15.078 9.433 1.00 0.00 C ATOM 908 O GLU A 63 1.012 -13.896 9.742 1.00 0.00 O ATOM 909 CB GLU A 63 1.424 -16.787 11.203 1.00 0.00 C ATOM 910 CG GLU A 63 2.727 -16.769 10.402 1.00 0.00 C ATOM 911 CD GLU A 63 3.844 -17.496 11.155 1.00 0.00 C ATOM 912 OE1 GLU A 63 3.604 -18.660 11.540 1.00 0.00 O ATOM 913 OE2 GLU A 63 4.912 -16.869 11.329 1.00 0.00 O ATOM 0 H GLU A 63 -0.249 -18.012 9.842 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.299 -15.535 11.167 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.578 -16.299 12.165 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.135 -17.817 11.411 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.569 -17.242 9.433 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.025 -15.739 10.209 1.00 0.00 H new ATOM 920 N TYR A 64 1.179 -15.587 8.250 1.00 0.00 N ATOM 921 CA TYR A 64 1.728 -14.751 7.196 1.00 0.00 C ATOM 922 C TYR A 64 0.740 -13.654 6.795 1.00 0.00 C ATOM 923 O TYR A 64 1.046 -12.468 6.903 1.00 0.00 O ATOM 924 CB TYR A 64 1.958 -15.677 6.000 1.00 0.00 C ATOM 925 CG TYR A 64 3.380 -16.233 5.907 1.00 0.00 C ATOM 926 CD1 TYR A 64 4.462 -15.392 6.072 1.00 0.00 C ATOM 927 CD2 TYR A 64 3.581 -17.575 5.659 1.00 0.00 C ATOM 928 CE1 TYR A 64 5.801 -15.916 5.985 1.00 0.00 C ATOM 929 CE2 TYR A 64 4.920 -18.099 5.572 1.00 0.00 C ATOM 930 CZ TYR A 64 5.964 -17.243 5.739 1.00 0.00 C ATOM 931 OH TYR A 64 7.228 -17.738 5.657 1.00 0.00 O ATOM 0 H TYR A 64 1.060 -16.568 7.998 1.00 0.00 H new ATOM 0 HA TYR A 64 2.644 -14.265 7.530 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.257 -16.509 6.058 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.731 -15.133 5.083 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.305 -14.341 6.266 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.734 -18.233 5.530 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.656 -15.269 6.112 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.091 -19.148 5.379 1.00 0.00 H new ATOM 0 HH TYR A 64 7.191 -18.701 5.478 1.00 0.00 H new ATOM 941 N LEU A 65 -0.426 -14.090 6.341 1.00 0.00 N ATOM 942 CA LEU A 65 -1.462 -13.161 5.923 1.00 0.00 C ATOM 943 C LEU A 65 -1.474 -11.959 6.870 1.00 0.00 C ATOM 944 O LEU A 65 -1.628 -10.820 6.431 1.00 0.00 O ATOM 945 CB LEU A 65 -2.811 -13.874 5.817 1.00 0.00 C ATOM 946 CG LEU A 65 -2.869 -15.060 4.852 1.00 0.00 C ATOM 947 CD1 LEU A 65 -3.841 -16.129 5.355 1.00 0.00 C ATOM 948 CD2 LEU A 65 -3.209 -14.597 3.434 1.00 0.00 C ATOM 0 H LEU A 65 -0.676 -15.075 6.253 1.00 0.00 H new ATOM 0 HA LEU A 65 -1.251 -12.779 4.924 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.093 -14.225 6.810 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.562 -13.145 5.511 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.880 -15.517 4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.863 -16.961 4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.514 -16.488 6.331 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.840 -15.701 5.442 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -3.244 -15.459 2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -4.179 -14.101 3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.446 -13.901 3.086 1.00 0.00 H new ATOM 960 N THR A 66 -1.310 -12.253 8.151 1.00 0.00 N ATOM 961 CA THR A 66 -1.300 -11.211 9.163 1.00 0.00 C ATOM 962 C THR A 66 -0.106 -10.277 8.956 1.00 0.00 C ATOM 963 O THR A 66 -0.266 -9.058 8.918 1.00 0.00 O ATOM 964 CB THR A 66 -1.313 -11.886 10.536 1.00 0.00 C ATOM 965 OG1 THR A 66 -2.583 -12.528 10.596 1.00 0.00 O ATOM 966 CG2 THR A 66 -1.351 -10.875 11.685 1.00 0.00 C ATOM 0 H THR A 66 -1.183 -13.199 8.512 1.00 0.00 H new ATOM 0 HA THR A 66 -2.184 -10.578 9.087 1.00 0.00 H new ATOM 0 HB THR A 66 -0.431 -12.518 10.638 1.00 0.00 H new ATOM 0 HG1 THR A 66 -2.675 -12.992 11.454 1.00 0.00 H new ATOM 0 HG21 THR A 66 -1.359 -11.406 12.637 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.471 -10.234 11.635 1.00 0.00 H new ATOM 0 HG23 THR A 66 -2.250 -10.264 11.603 1.00 0.00 H new ATOM 974 N LYS A 67 1.064 -10.885 8.826 1.00 0.00 N ATOM 975 CA LYS A 67 2.285 -10.123 8.624 1.00 0.00 C ATOM 976 C LYS A 67 1.994 -8.938 7.700 1.00 0.00 C ATOM 977 O LYS A 67 2.518 -7.844 7.904 1.00 0.00 O ATOM 978 CB LYS A 67 3.407 -11.033 8.121 1.00 0.00 C ATOM 979 CG LYS A 67 4.119 -11.721 9.288 1.00 0.00 C ATOM 980 CD LYS A 67 4.623 -13.107 8.883 1.00 0.00 C ATOM 981 CE LYS A 67 5.955 -13.427 9.563 1.00 0.00 C ATOM 982 NZ LYS A 67 6.896 -14.040 8.599 1.00 0.00 N ATOM 0 H LYS A 67 1.192 -11.896 8.857 1.00 0.00 H new ATOM 0 HA LYS A 67 2.639 -9.712 9.570 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.996 -11.785 7.447 1.00 0.00 H new ATOM 0 HB3 LYS A 67 4.125 -10.448 7.546 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.957 -11.108 9.619 1.00 0.00 H new ATOM 0 HG3 LYS A 67 3.436 -11.811 10.133 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.883 -13.860 9.153 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.743 -13.152 7.801 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.389 -12.515 9.973 1.00 0.00 H new ATOM 0 HE3 LYS A 67 5.789 -14.106 10.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.536 -14.687 9.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.362 -14.571 7.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.452 -13.294 8.135 1.00 0.00 H new ATOM 996 N GLU A 68 1.159 -9.197 6.704 1.00 0.00 N ATOM 997 CA GLU A 68 0.792 -8.165 5.748 1.00 0.00 C ATOM 998 C GLU A 68 -0.341 -7.303 6.307 1.00 0.00 C ATOM 999 O GLU A 68 -0.345 -6.086 6.131 1.00 0.00 O ATOM 1000 CB GLU A 68 0.402 -8.779 4.402 1.00 0.00 C ATOM 1001 CG GLU A 68 1.544 -9.623 3.833 1.00 0.00 C ATOM 1002 CD GLU A 68 1.613 -10.988 4.521 1.00 0.00 C ATOM 1003 OE1 GLU A 68 0.526 -11.532 4.813 1.00 0.00 O ATOM 1004 OE2 GLU A 68 2.751 -11.457 4.739 1.00 0.00 O ATOM 0 H GLU A 68 0.726 -10.106 6.538 1.00 0.00 H new ATOM 0 HA GLU A 68 1.659 -7.526 5.581 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -0.487 -9.398 4.525 1.00 0.00 H new ATOM 0 HB3 GLU A 68 0.144 -7.988 3.698 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.401 -9.759 2.761 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.490 -9.097 3.964 1.00 0.00 H new ATOM 1011 N LEU A 69 -1.277 -7.968 6.969 1.00 0.00 N ATOM 1012 CA LEU A 69 -2.413 -7.278 7.555 1.00 0.00 C ATOM 1013 C LEU A 69 -1.918 -6.315 8.636 1.00 0.00 C ATOM 1014 O LEU A 69 -2.348 -5.164 8.691 1.00 0.00 O ATOM 1015 CB LEU A 69 -3.451 -8.284 8.056 1.00 0.00 C ATOM 1016 CG LEU A 69 -4.897 -8.025 7.629 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -5.453 -9.206 6.831 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -5.773 -7.686 8.837 1.00 0.00 C ATOM 0 H LEU A 69 -1.271 -8.978 7.112 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.923 -6.677 6.802 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.163 -9.276 7.709 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.413 -8.303 9.145 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.908 -7.157 6.969 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.482 -8.996 6.540 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.847 -9.359 5.938 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.426 -10.106 7.446 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.796 -7.506 8.506 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.760 -8.518 9.541 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.388 -6.791 9.326 1.00 0.00 H new ATOM 1030 N LEU A 70 -1.021 -6.822 9.468 1.00 0.00 N ATOM 1031 CA LEU A 70 -0.462 -6.021 10.545 1.00 0.00 C ATOM 1032 C LEU A 70 0.514 -4.999 9.960 1.00 0.00 C ATOM 1033 O LEU A 70 0.637 -3.888 10.474 1.00 0.00 O ATOM 1034 CB LEU A 70 0.157 -6.920 11.616 1.00 0.00 C ATOM 1035 CG LEU A 70 1.683 -6.886 11.720 1.00 0.00 C ATOM 1036 CD1 LEU A 70 2.332 -7.493 10.475 1.00 0.00 C ATOM 1037 CD2 LEU A 70 2.183 -5.465 11.992 1.00 0.00 C ATOM 0 H LEU A 70 -0.667 -7.777 9.419 1.00 0.00 H new ATOM 0 HA LEU A 70 -1.248 -5.459 11.050 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -0.260 -6.639 12.583 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.151 -7.947 11.422 1.00 0.00 H new ATOM 0 HG LEU A 70 1.980 -7.500 12.570 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.417 -7.456 10.575 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.013 -8.530 10.367 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.030 -6.927 9.594 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.271 -5.469 12.061 1.00 0.00 H new ATOM 0 HD22 LEU A 70 1.874 -4.809 11.179 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.761 -5.104 12.930 1.00 0.00 H new ATOM 1049 N ALA A 71 1.185 -5.410 8.894 1.00 0.00 N ATOM 1050 CA ALA A 71 2.147 -4.544 8.234 1.00 0.00 C ATOM 1051 C ALA A 71 1.401 -3.429 7.498 1.00 0.00 C ATOM 1052 O ALA A 71 2.021 -2.507 6.970 1.00 0.00 O ATOM 1053 CB ALA A 71 3.024 -5.376 7.297 1.00 0.00 C ATOM 0 H ALA A 71 1.081 -6.332 8.471 1.00 0.00 H new ATOM 0 HA ALA A 71 2.805 -4.074 8.965 1.00 0.00 H new ATOM 0 HB1 ALA A 71 3.746 -4.726 6.802 1.00 0.00 H new ATOM 0 HB2 ALA A 71 3.554 -6.135 7.873 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.398 -5.861 6.548 1.00 0.00 H new ATOM 1059 N LEU A 72 0.082 -3.551 7.486 1.00 0.00 N ATOM 1060 CA LEU A 72 -0.754 -2.565 6.823 1.00 0.00 C ATOM 1061 C LEU A 72 -1.240 -1.540 7.850 1.00 0.00 C ATOM 1062 O LEU A 72 -1.630 -0.431 7.490 1.00 0.00 O ATOM 1063 CB LEU A 72 -1.887 -3.251 6.056 1.00 0.00 C ATOM 1064 CG LEU A 72 -1.526 -3.796 4.673 1.00 0.00 C ATOM 1065 CD1 LEU A 72 -2.499 -4.897 4.247 1.00 0.00 C ATOM 1066 CD2 LEU A 72 -1.450 -2.668 3.642 1.00 0.00 C ATOM 0 H LEU A 72 -0.428 -4.317 7.925 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.178 -2.019 6.075 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.263 -4.075 6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.705 -2.540 5.942 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.535 -4.246 4.731 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.220 -5.267 3.260 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.460 -5.715 4.966 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.511 -4.494 4.210 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.192 -3.083 2.668 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.416 -2.167 3.579 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.688 -1.950 3.944 1.00 0.00 H new ATOM 1078 N ASP A 73 -1.200 -1.949 9.110 1.00 0.00 N ATOM 1079 CA ASP A 73 -1.631 -1.081 10.193 1.00 0.00 C ATOM 1080 C ASP A 73 -0.497 -0.118 10.551 1.00 0.00 C ATOM 1081 O ASP A 73 -0.743 0.978 11.051 1.00 0.00 O ATOM 1082 CB ASP A 73 -1.977 -1.890 11.444 1.00 0.00 C ATOM 1083 CG ASP A 73 -3.121 -1.322 12.286 1.00 0.00 C ATOM 1084 OD1 ASP A 73 -2.891 -0.268 12.918 1.00 0.00 O ATOM 1085 OD2 ASP A 73 -4.199 -1.954 12.279 1.00 0.00 O ATOM 0 H ASP A 73 -0.876 -2.870 9.405 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.516 -0.539 9.859 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.237 -2.904 11.142 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -1.087 -1.962 12.069 1.00 0.00 H new ATOM 1090 N SER A 74 0.721 -0.563 10.281 1.00 0.00 N ATOM 1091 CA SER A 74 1.894 0.245 10.568 1.00 0.00 C ATOM 1092 C SER A 74 1.921 1.472 9.655 1.00 0.00 C ATOM 1093 O SER A 74 2.680 2.411 9.892 1.00 0.00 O ATOM 1094 CB SER A 74 3.179 -0.569 10.402 1.00 0.00 C ATOM 1095 OG SER A 74 4.245 -0.051 11.192 1.00 0.00 O ATOM 0 H SER A 74 0.921 -1.473 9.866 1.00 0.00 H new ATOM 0 HA SER A 74 1.836 0.574 11.606 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.990 -1.605 10.682 1.00 0.00 H new ATOM 0 HB3 SER A 74 3.474 -0.571 9.353 1.00 0.00 H new ATOM 0 HG SER A 74 5.047 -0.599 11.059 1.00 0.00 H new ATOM 1101 N VAL A 75 1.083 1.425 8.629 1.00 0.00 N ATOM 1102 CA VAL A 75 1.002 2.521 7.679 1.00 0.00 C ATOM 1103 C VAL A 75 0.133 3.635 8.265 1.00 0.00 C ATOM 1104 O VAL A 75 -0.974 3.380 8.738 1.00 0.00 O ATOM 1105 CB VAL A 75 0.488 2.008 6.332 1.00 0.00 C ATOM 1106 CG1 VAL A 75 0.172 3.170 5.388 1.00 0.00 C ATOM 1107 CG2 VAL A 75 1.489 1.042 5.695 1.00 0.00 C ATOM 0 H VAL A 75 0.455 0.645 8.435 1.00 0.00 H new ATOM 0 HA VAL A 75 1.991 2.942 7.496 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.437 1.461 6.513 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.191 2.778 4.438 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.593 3.805 5.835 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.075 3.756 5.217 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.099 0.692 4.739 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.438 1.554 5.535 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.644 0.190 6.357 1.00 0.00 H new ATOM 1117 N ASP A 76 0.666 4.847 8.215 1.00 0.00 N ATOM 1118 CA ASP A 76 -0.047 6.001 8.736 1.00 0.00 C ATOM 1119 C ASP A 76 -0.269 7.009 7.607 1.00 0.00 C ATOM 1120 O ASP A 76 0.684 7.595 7.097 1.00 0.00 O ATOM 1121 CB ASP A 76 0.757 6.694 9.838 1.00 0.00 C ATOM 1122 CG ASP A 76 0.070 7.903 10.476 1.00 0.00 C ATOM 1123 OD1 ASP A 76 -1.123 8.109 10.163 1.00 0.00 O ATOM 1124 OD2 ASP A 76 0.753 8.594 11.262 1.00 0.00 O ATOM 0 H ASP A 76 1.584 5.055 7.821 1.00 0.00 H new ATOM 0 HA ASP A 76 -0.996 5.655 9.146 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.977 5.966 10.619 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.712 7.015 9.423 1.00 0.00 H new ATOM 1129 N PRO A 77 -1.567 7.185 7.240 1.00 0.00 N ATOM 1130 CA PRO A 77 -1.927 8.112 6.181 1.00 0.00 C ATOM 1131 C PRO A 77 -1.831 9.561 6.665 1.00 0.00 C ATOM 1132 O PRO A 77 -1.449 10.449 5.905 1.00 0.00 O ATOM 1133 CB PRO A 77 -3.335 7.714 5.772 1.00 0.00 C ATOM 1134 CG PRO A 77 -3.887 6.888 6.922 1.00 0.00 C ATOM 1135 CD PRO A 77 -2.722 6.508 7.822 1.00 0.00 C ATOM 0 HA PRO A 77 -1.250 8.061 5.328 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -3.953 8.594 5.592 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -3.324 7.137 4.847 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -4.630 7.458 7.479 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -4.386 5.995 6.546 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.894 6.830 8.849 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -2.577 5.428 7.847 1.00 0.00 H new ATOM 1143 N GLU A 78 -2.186 9.754 7.927 1.00 0.00 N ATOM 1144 CA GLU A 78 -2.145 11.079 8.521 1.00 0.00 C ATOM 1145 C GLU A 78 -3.262 11.953 7.947 1.00 0.00 C ATOM 1146 O GLU A 78 -3.302 13.157 8.195 1.00 0.00 O ATOM 1147 CB GLU A 78 -0.776 11.731 8.313 1.00 0.00 C ATOM 1148 CG GLU A 78 0.350 10.798 8.763 1.00 0.00 C ATOM 1149 CD GLU A 78 1.582 11.595 9.195 1.00 0.00 C ATOM 1150 OE1 GLU A 78 1.565 12.088 10.344 1.00 0.00 O ATOM 1151 OE2 GLU A 78 2.514 11.693 8.368 1.00 0.00 O ATOM 0 H GLU A 78 -2.503 9.015 8.554 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.304 10.980 9.595 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.645 11.983 7.261 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.725 12.665 8.873 1.00 0.00 H new ATOM 0 HG2 GLU A 78 0.005 10.178 9.591 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.616 10.124 7.949 1.00 0.00 H new ATOM 1158 N GLY A 79 -4.140 11.313 7.190 1.00 0.00 N ATOM 1159 CA GLY A 79 -5.255 12.017 6.578 1.00 0.00 C ATOM 1160 C GLY A 79 -5.062 12.139 5.065 1.00 0.00 C ATOM 1161 O GLY A 79 -5.020 13.245 4.528 1.00 0.00 O ATOM 0 H GLY A 79 -4.103 10.314 6.986 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.184 11.487 6.788 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.348 13.010 7.018 1.00 0.00 H new ATOM 1165 N ARG A 80 -4.950 10.987 4.420 1.00 0.00 N ATOM 1166 CA ARG A 80 -4.763 10.951 2.980 1.00 0.00 C ATOM 1167 C ARG A 80 -5.578 9.810 2.367 1.00 0.00 C ATOM 1168 O ARG A 80 -5.199 8.645 2.473 1.00 0.00 O ATOM 1169 CB ARG A 80 -3.288 10.764 2.621 1.00 0.00 C ATOM 1170 CG ARG A 80 -2.493 12.044 2.887 1.00 0.00 C ATOM 1171 CD ARG A 80 -1.157 11.729 3.564 1.00 0.00 C ATOM 1172 NE ARG A 80 -0.038 12.214 2.726 1.00 0.00 N ATOM 1173 CZ ARG A 80 1.242 11.860 2.904 1.00 0.00 C ATOM 1174 NH1 ARG A 80 1.573 11.016 3.891 1.00 0.00 N ATOM 1175 NH2 ARG A 80 2.191 12.349 2.095 1.00 0.00 N ATOM 0 H ARG A 80 -4.985 10.072 4.869 1.00 0.00 H new ATOM 0 HA ARG A 80 -5.106 11.904 2.577 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -2.869 9.944 3.204 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.198 10.487 1.571 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -2.314 12.567 1.948 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -3.076 12.714 3.519 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.118 12.200 4.546 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.065 10.655 3.722 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.255 12.858 1.965 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.850 10.643 4.507 1.00 0.00 H new ATOM 0 HH12 ARG A 80 2.547 10.747 4.026 1.00 0.00 H new ATOM 0 HH21 ARG A 80 1.939 12.991 1.343 1.00 0.00 H new ATOM 0 HH22 ARG A 80 3.165 12.079 2.231 1.00 0.00 H new ATOM 1189 N ALA A 81 -6.683 10.185 1.740 1.00 0.00 N ATOM 1190 CA ALA A 81 -7.555 9.208 1.110 1.00 0.00 C ATOM 1191 C ALA A 81 -6.709 8.217 0.309 1.00 0.00 C ATOM 1192 O ALA A 81 -6.792 7.009 0.523 1.00 0.00 O ATOM 1193 CB ALA A 81 -8.587 9.929 0.241 1.00 0.00 C ATOM 0 H ALA A 81 -6.995 11.152 1.655 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.102 8.641 1.863 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.241 9.196 -0.231 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -9.182 10.599 0.862 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.075 10.507 -0.528 1.00 0.00 H new ATOM 1199 N ASP A 82 -5.913 8.766 -0.597 1.00 0.00 N ATOM 1200 CA ASP A 82 -5.051 7.945 -1.432 1.00 0.00 C ATOM 1201 C ASP A 82 -4.444 6.825 -0.584 1.00 0.00 C ATOM 1202 O ASP A 82 -4.676 5.646 -0.848 1.00 0.00 O ATOM 1203 CB ASP A 82 -3.904 8.770 -2.018 1.00 0.00 C ATOM 1204 CG ASP A 82 -4.014 9.057 -3.516 1.00 0.00 C ATOM 1205 OD1 ASP A 82 -4.007 8.071 -4.285 1.00 0.00 O ATOM 1206 OD2 ASP A 82 -4.102 10.256 -3.860 1.00 0.00 O ATOM 0 H ASP A 82 -5.847 9.769 -0.771 1.00 0.00 H new ATOM 0 HA ASP A 82 -5.654 7.539 -2.244 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -3.850 9.719 -1.485 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -2.967 8.245 -1.832 1.00 0.00 H new ATOM 1211 N VAL A 83 -3.678 7.233 0.417 1.00 0.00 N ATOM 1212 CA VAL A 83 -3.035 6.279 1.305 1.00 0.00 C ATOM 1213 C VAL A 83 -4.105 5.431 1.995 1.00 0.00 C ATOM 1214 O VAL A 83 -4.088 4.204 1.898 1.00 0.00 O ATOM 1215 CB VAL A 83 -2.126 7.014 2.292 1.00 0.00 C ATOM 1216 CG1 VAL A 83 -1.356 6.024 3.169 1.00 0.00 C ATOM 1217 CG2 VAL A 83 -1.170 7.957 1.560 1.00 0.00 C ATOM 0 H VAL A 83 -3.488 8.212 0.633 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.397 5.600 0.740 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.758 7.618 2.943 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.717 6.572 3.862 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.061 5.412 3.732 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.741 5.382 2.539 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.535 8.467 2.285 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.548 7.383 0.873 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.745 8.694 0.999 1.00 0.00 H new ATOM 1227 N ARG A 84 -5.011 6.117 2.676 1.00 0.00 N ATOM 1228 CA ARG A 84 -6.087 5.441 3.382 1.00 0.00 C ATOM 1229 C ARG A 84 -6.681 4.334 2.509 1.00 0.00 C ATOM 1230 O ARG A 84 -6.516 3.151 2.803 1.00 0.00 O ATOM 1231 CB ARG A 84 -7.193 6.424 3.770 1.00 0.00 C ATOM 1232 CG ARG A 84 -6.764 7.292 4.955 1.00 0.00 C ATOM 1233 CD ARG A 84 -7.647 8.536 5.070 1.00 0.00 C ATOM 1234 NE ARG A 84 -7.700 8.990 6.478 1.00 0.00 N ATOM 1235 CZ ARG A 84 -8.548 8.501 7.394 1.00 0.00 C ATOM 1236 NH1 ARG A 84 -9.418 7.540 7.055 1.00 0.00 N ATOM 1237 NH2 ARG A 84 -8.525 8.972 8.648 1.00 0.00 N ATOM 0 H ARG A 84 -5.022 7.134 2.754 1.00 0.00 H new ATOM 0 HA ARG A 84 -5.667 5.007 4.290 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -7.435 7.059 2.918 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -8.099 5.875 4.026 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -6.824 6.712 5.876 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.723 7.590 4.834 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -7.253 9.331 4.437 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -8.652 8.313 4.713 1.00 0.00 H new ATOM 0 HE ARG A 84 -7.051 9.721 6.769 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -9.435 7.181 6.100 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -10.063 7.168 7.751 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.862 9.703 8.906 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -9.170 8.600 9.345 1.00 0.00 H new ATOM 1251 N GLN A 85 -7.359 4.757 1.452 1.00 0.00 N ATOM 1252 CA GLN A 85 -7.979 3.815 0.535 1.00 0.00 C ATOM 1253 C GLN A 85 -7.073 2.599 0.330 1.00 0.00 C ATOM 1254 O GLN A 85 -7.474 1.469 0.602 1.00 0.00 O ATOM 1255 CB GLN A 85 -8.306 4.486 -0.801 1.00 0.00 C ATOM 1256 CG GLN A 85 -8.898 3.480 -1.789 1.00 0.00 C ATOM 1257 CD GLN A 85 -10.191 4.014 -2.408 1.00 0.00 C ATOM 1258 OE1 GLN A 85 -11.290 3.640 -2.033 1.00 0.00 O ATOM 1259 NE2 GLN A 85 -9.999 4.908 -3.374 1.00 0.00 N ATOM 0 H GLN A 85 -7.493 5.739 1.210 1.00 0.00 H new ATOM 0 HA GLN A 85 -8.917 3.475 0.973 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -9.012 5.301 -0.640 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -7.402 4.926 -1.222 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -8.174 3.269 -2.576 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -9.097 2.538 -1.278 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -9.051 5.177 -3.639 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -10.799 5.325 -3.850 1.00 0.00 H new ATOM 1268 N ALA A 86 -5.868 2.873 -0.148 1.00 0.00 N ATOM 1269 CA ALA A 86 -4.902 1.816 -0.393 1.00 0.00 C ATOM 1270 C ALA A 86 -4.693 1.014 0.894 1.00 0.00 C ATOM 1271 O ALA A 86 -4.616 -0.213 0.859 1.00 0.00 O ATOM 1272 CB ALA A 86 -3.600 2.424 -0.918 1.00 0.00 C ATOM 0 H ALA A 86 -5.539 3.812 -0.372 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.271 1.129 -1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.876 1.630 -1.102 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.797 2.958 -1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.199 3.118 -0.179 1.00 0.00 H new ATOM 1278 N ARG A 87 -4.607 1.740 1.998 1.00 0.00 N ATOM 1279 CA ARG A 87 -4.409 1.112 3.294 1.00 0.00 C ATOM 1280 C ARG A 87 -5.545 0.130 3.587 1.00 0.00 C ATOM 1281 O ARG A 87 -5.333 -0.894 4.234 1.00 0.00 O ATOM 1282 CB ARG A 87 -4.347 2.157 4.409 1.00 0.00 C ATOM 1283 CG ARG A 87 -3.557 1.633 5.609 1.00 0.00 C ATOM 1284 CD ARG A 87 -3.050 2.786 6.478 1.00 0.00 C ATOM 1285 NE ARG A 87 -3.702 2.743 7.806 1.00 0.00 N ATOM 1286 CZ ARG A 87 -4.935 3.207 8.052 1.00 0.00 C ATOM 1287 NH1 ARG A 87 -5.657 3.750 7.063 1.00 0.00 N ATOM 1288 NH2 ARG A 87 -5.447 3.127 9.288 1.00 0.00 N ATOM 0 H ARG A 87 -4.671 2.758 2.023 1.00 0.00 H new ATOM 0 HA ARG A 87 -3.460 0.576 3.261 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.882 3.068 4.033 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -5.357 2.421 4.722 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -4.189 0.974 6.205 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -2.713 1.037 5.261 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.968 2.718 6.592 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.260 3.739 5.991 1.00 0.00 H new ATOM 0 HE ARG A 87 -3.181 2.335 8.582 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.268 3.811 6.122 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -6.595 4.103 7.251 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -4.898 2.713 10.042 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -6.385 3.480 9.475 1.00 0.00 H new ATOM 1302 N ARG A 88 -6.725 0.476 3.095 1.00 0.00 N ATOM 1303 CA ARG A 88 -7.895 -0.362 3.296 1.00 0.00 C ATOM 1304 C ARG A 88 -7.992 -1.413 2.188 1.00 0.00 C ATOM 1305 O ARG A 88 -8.100 -2.606 2.467 1.00 0.00 O ATOM 1306 CB ARG A 88 -9.176 0.474 3.310 1.00 0.00 C ATOM 1307 CG ARG A 88 -8.867 1.947 3.588 1.00 0.00 C ATOM 1308 CD ARG A 88 -10.074 2.652 4.211 1.00 0.00 C ATOM 1309 NE ARG A 88 -9.637 3.488 5.352 1.00 0.00 N ATOM 1310 CZ ARG A 88 -9.175 2.998 6.510 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -9.087 1.673 6.688 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -8.802 3.832 7.490 1.00 0.00 N ATOM 0 H ARG A 88 -6.896 1.326 2.557 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.787 -0.856 4.262 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -9.686 0.380 2.351 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.856 0.091 4.071 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -8.011 2.023 4.259 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -8.589 2.446 2.659 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -10.569 3.272 3.464 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -10.803 1.915 4.548 1.00 0.00 H new ATOM 0 HE ARG A 88 -9.691 4.501 5.250 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -9.372 1.038 5.942 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -8.735 1.299 7.569 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -8.870 4.841 7.355 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -8.450 3.458 8.371 1.00 0.00 H new ATOM 1326 N ASP A 89 -7.948 -0.932 0.955 1.00 0.00 N ATOM 1327 CA ASP A 89 -8.029 -1.815 -0.196 1.00 0.00 C ATOM 1328 C ASP A 89 -7.167 -3.053 0.055 1.00 0.00 C ATOM 1329 O ASP A 89 -7.665 -4.178 0.019 1.00 0.00 O ATOM 1330 CB ASP A 89 -7.508 -1.124 -1.458 1.00 0.00 C ATOM 1331 CG ASP A 89 -8.405 -1.265 -2.690 1.00 0.00 C ATOM 1332 OD1 ASP A 89 -9.199 -2.230 -2.706 1.00 0.00 O ATOM 1333 OD2 ASP A 89 -8.276 -0.405 -3.587 1.00 0.00 O ATOM 0 H ASP A 89 -7.857 0.058 0.727 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.075 -2.087 -0.339 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -7.374 -0.064 -1.244 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -6.524 -1.528 -1.695 1.00 0.00 H new ATOM 1338 N GLY A 90 -5.890 -2.805 0.304 1.00 0.00 N ATOM 1339 CA GLY A 90 -4.954 -3.887 0.561 1.00 0.00 C ATOM 1340 C GLY A 90 -5.444 -4.775 1.706 1.00 0.00 C ATOM 1341 O GLY A 90 -5.612 -5.981 1.533 1.00 0.00 O ATOM 0 H GLY A 90 -5.481 -1.871 0.333 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -4.829 -4.486 -0.341 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -3.976 -3.475 0.808 1.00 0.00 H new ATOM 1345 N VAL A 91 -5.659 -4.144 2.851 1.00 0.00 N ATOM 1346 CA VAL A 91 -6.126 -4.863 4.025 1.00 0.00 C ATOM 1347 C VAL A 91 -7.360 -5.688 3.655 1.00 0.00 C ATOM 1348 O VAL A 91 -7.499 -6.831 4.087 1.00 0.00 O ATOM 1349 CB VAL A 91 -6.384 -3.882 5.170 1.00 0.00 C ATOM 1350 CG1 VAL A 91 -7.206 -4.540 6.281 1.00 0.00 C ATOM 1351 CG2 VAL A 91 -5.071 -3.320 5.719 1.00 0.00 C ATOM 0 H VAL A 91 -5.519 -3.143 2.991 1.00 0.00 H new ATOM 0 HA VAL A 91 -5.364 -5.558 4.376 1.00 0.00 H new ATOM 0 HB VAL A 91 -6.964 -3.049 4.772 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.375 -3.821 7.083 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.165 -4.868 5.879 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -6.664 -5.400 6.674 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.284 -2.626 6.532 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.453 -4.137 6.092 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.539 -2.797 4.925 1.00 0.00 H new ATOM 1361 N ARG A 92 -8.224 -5.077 2.858 1.00 0.00 N ATOM 1362 CA ARG A 92 -9.442 -5.741 2.425 1.00 0.00 C ATOM 1363 C ARG A 92 -9.103 -6.996 1.618 1.00 0.00 C ATOM 1364 O ARG A 92 -9.846 -7.977 1.648 1.00 0.00 O ATOM 1365 CB ARG A 92 -10.302 -4.810 1.569 1.00 0.00 C ATOM 1366 CG ARG A 92 -11.656 -4.550 2.233 1.00 0.00 C ATOM 1367 CD ARG A 92 -12.799 -4.716 1.230 1.00 0.00 C ATOM 1368 NE ARG A 92 -14.092 -4.807 1.946 1.00 0.00 N ATOM 1369 CZ ARG A 92 -14.540 -5.916 2.549 1.00 0.00 C ATOM 1370 NH1 ARG A 92 -13.803 -7.035 2.526 1.00 0.00 N ATOM 1371 NH2 ARG A 92 -15.725 -5.906 3.175 1.00 0.00 N ATOM 0 H ARG A 92 -8.105 -4.129 2.501 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.004 -6.018 3.317 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.780 -3.865 1.416 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.455 -5.253 0.585 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.795 -5.239 3.066 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.674 -3.542 2.647 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -12.814 -3.872 0.541 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.641 -5.613 0.632 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.678 -3.973 1.982 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.901 -7.042 2.049 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.144 -7.880 2.985 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -16.286 -5.054 3.192 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.066 -6.750 3.634 1.00 0.00 H new ATOM 1385 N LYS A 93 -7.982 -6.925 0.916 1.00 0.00 N ATOM 1386 CA LYS A 93 -7.536 -8.044 0.103 1.00 0.00 C ATOM 1387 C LYS A 93 -7.017 -9.157 1.015 1.00 0.00 C ATOM 1388 O LYS A 93 -7.487 -10.292 0.945 1.00 0.00 O ATOM 1389 CB LYS A 93 -6.517 -7.577 -0.938 1.00 0.00 C ATOM 1390 CG LYS A 93 -5.815 -8.769 -1.592 1.00 0.00 C ATOM 1391 CD LYS A 93 -6.106 -8.821 -3.093 1.00 0.00 C ATOM 1392 CE LYS A 93 -6.334 -10.261 -3.558 1.00 0.00 C ATOM 1393 NZ LYS A 93 -7.570 -10.355 -4.367 1.00 0.00 N ATOM 0 H LYS A 93 -7.369 -6.110 0.893 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.369 -8.459 -0.464 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.018 -6.982 -1.701 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -5.778 -6.930 -0.464 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.740 -8.697 -1.429 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.147 -9.694 -1.121 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -6.986 -8.219 -3.317 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.273 -8.385 -3.644 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -5.481 -10.599 -4.146 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -6.407 -10.921 -2.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -7.710 -11.339 -4.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -8.384 -10.052 -3.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -7.486 -9.740 -5.202 1.00 0.00 H new ATOM 1407 N VAL A 94 -6.055 -8.794 1.850 1.00 0.00 N ATOM 1408 CA VAL A 94 -5.467 -9.748 2.775 1.00 0.00 C ATOM 1409 C VAL A 94 -6.575 -10.383 3.618 1.00 0.00 C ATOM 1410 O VAL A 94 -6.580 -11.594 3.831 1.00 0.00 O ATOM 1411 CB VAL A 94 -4.391 -9.063 3.620 1.00 0.00 C ATOM 1412 CG1 VAL A 94 -3.552 -10.092 4.379 1.00 0.00 C ATOM 1413 CG2 VAL A 94 -3.506 -8.163 2.755 1.00 0.00 C ATOM 0 H VAL A 94 -5.668 -7.852 1.906 1.00 0.00 H new ATOM 0 HA VAL A 94 -4.971 -10.552 2.231 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.892 -8.433 4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -2.795 -9.578 4.972 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.197 -10.672 5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.065 -10.760 3.668 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.750 -7.688 3.380 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -3.018 -8.763 1.987 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.119 -7.396 2.282 1.00 0.00 H new ATOM 1423 N GLN A 95 -7.485 -9.536 4.076 1.00 0.00 N ATOM 1424 CA GLN A 95 -8.595 -10.000 4.892 1.00 0.00 C ATOM 1425 C GLN A 95 -9.330 -11.142 4.188 1.00 0.00 C ATOM 1426 O GLN A 95 -9.464 -12.233 4.741 1.00 0.00 O ATOM 1427 CB GLN A 95 -9.552 -8.852 5.219 1.00 0.00 C ATOM 1428 CG GLN A 95 -8.882 -7.824 6.133 1.00 0.00 C ATOM 1429 CD GLN A 95 -9.503 -7.847 7.532 1.00 0.00 C ATOM 1430 OE1 GLN A 95 -10.413 -8.607 7.823 1.00 0.00 O ATOM 1431 NE2 GLN A 95 -8.963 -6.975 8.378 1.00 0.00 N ATOM 0 H GLN A 95 -7.477 -8.532 3.898 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.196 -10.377 5.834 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.874 -8.369 4.297 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.446 -9.246 5.702 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -7.815 -8.034 6.201 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.984 -6.828 5.702 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.204 -6.368 8.069 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -9.308 -6.913 9.336 1.00 0.00 H new ATOM 1440 N THR A 96 -9.787 -10.853 2.978 1.00 0.00 N ATOM 1441 CA THR A 96 -10.505 -11.842 2.193 1.00 0.00 C ATOM 1442 C THR A 96 -9.695 -13.137 2.098 1.00 0.00 C ATOM 1443 O THR A 96 -10.224 -14.223 2.332 1.00 0.00 O ATOM 1444 CB THR A 96 -10.824 -11.224 0.830 1.00 0.00 C ATOM 1445 OG1 THR A 96 -11.831 -10.257 1.115 1.00 0.00 O ATOM 1446 CG2 THR A 96 -11.512 -12.211 -0.115 1.00 0.00 C ATOM 0 H THR A 96 -9.674 -9.947 2.522 1.00 0.00 H new ATOM 0 HA THR A 96 -11.446 -12.117 2.669 1.00 0.00 H new ATOM 0 HB THR A 96 -9.903 -10.864 0.371 1.00 0.00 H new ATOM 0 HG1 THR A 96 -11.409 -9.398 1.328 1.00 0.00 H new ATOM 0 HG21 THR A 96 -11.716 -11.721 -1.067 1.00 0.00 H new ATOM 0 HG22 THR A 96 -10.862 -13.070 -0.281 1.00 0.00 H new ATOM 0 HG23 THR A 96 -12.450 -12.546 0.329 1.00 0.00 H new ATOM 1454 N ILE A 97 -8.426 -12.980 1.753 1.00 0.00 N ATOM 1455 CA ILE A 97 -7.538 -14.123 1.625 1.00 0.00 C ATOM 1456 C ILE A 97 -7.553 -14.924 2.928 1.00 0.00 C ATOM 1457 O ILE A 97 -7.759 -16.137 2.913 1.00 0.00 O ATOM 1458 CB ILE A 97 -6.141 -13.671 1.197 1.00 0.00 C ATOM 1459 CG1 ILE A 97 -6.194 -12.900 -0.124 1.00 0.00 C ATOM 1460 CG2 ILE A 97 -5.177 -14.857 1.130 1.00 0.00 C ATOM 1461 CD1 ILE A 97 -4.867 -12.190 -0.398 1.00 0.00 C ATOM 0 H ILE A 97 -7.991 -12.078 1.558 1.00 0.00 H new ATOM 0 HA ILE A 97 -7.887 -14.790 0.837 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.757 -12.987 1.954 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -6.419 -13.586 -0.941 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -7.002 -12.169 -0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -4.191 -14.508 0.823 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -5.107 -15.325 2.112 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -5.545 -15.585 0.407 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -4.932 -11.650 -1.342 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -4.657 -11.487 0.408 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -4.065 -12.926 -0.455 1.00 0.00 H new ATOM 1473 N LEU A 98 -7.332 -14.214 4.024 1.00 0.00 N ATOM 1474 CA LEU A 98 -7.317 -14.844 5.334 1.00 0.00 C ATOM 1475 C LEU A 98 -8.537 -15.758 5.469 1.00 0.00 C ATOM 1476 O LEU A 98 -8.439 -16.853 6.021 1.00 0.00 O ATOM 1477 CB LEU A 98 -7.215 -13.787 6.435 1.00 0.00 C ATOM 1478 CG LEU A 98 -5.936 -13.815 7.275 1.00 0.00 C ATOM 1479 CD1 LEU A 98 -5.864 -12.602 8.205 1.00 0.00 C ATOM 1480 CD2 LEU A 98 -5.813 -15.133 8.042 1.00 0.00 C ATOM 0 H LEU A 98 -7.162 -13.208 4.032 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.434 -15.473 5.445 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.303 -12.803 5.975 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.068 -13.904 7.104 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.082 -13.754 6.600 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.946 -12.646 8.790 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.872 -11.688 7.612 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.723 -12.607 8.876 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.896 -15.127 8.631 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.670 -15.249 8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.786 -15.963 7.336 1.00 0.00 H new ATOM 1492 N GLU A 99 -9.659 -15.274 4.956 1.00 0.00 N ATOM 1493 CA GLU A 99 -10.896 -16.033 5.013 1.00 0.00 C ATOM 1494 C GLU A 99 -10.871 -17.167 3.986 1.00 0.00 C ATOM 1495 O GLU A 99 -11.544 -18.181 4.158 1.00 0.00 O ATOM 1496 CB GLU A 99 -12.108 -15.124 4.796 1.00 0.00 C ATOM 1497 CG GLU A 99 -13.075 -15.210 5.978 1.00 0.00 C ATOM 1498 CD GLU A 99 -14.129 -16.295 5.747 1.00 0.00 C ATOM 1499 OE1 GLU A 99 -13.807 -17.468 6.033 1.00 0.00 O ATOM 1500 OE2 GLU A 99 -15.232 -15.926 5.290 1.00 0.00 O ATOM 0 H GLU A 99 -9.737 -14.365 4.499 1.00 0.00 H new ATOM 0 HA GLU A 99 -10.985 -16.471 6.007 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -11.776 -14.094 4.667 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.623 -15.410 3.879 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -12.520 -15.426 6.891 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.565 -14.247 6.122 1.00 0.00 H new ATOM 1507 N LYS A 100 -10.086 -16.957 2.939 1.00 0.00 N ATOM 1508 CA LYS A 100 -9.964 -17.948 1.884 1.00 0.00 C ATOM 1509 C LYS A 100 -9.190 -19.157 2.413 1.00 0.00 C ATOM 1510 O LYS A 100 -9.747 -20.246 2.544 1.00 0.00 O ATOM 1511 CB LYS A 100 -9.347 -17.324 0.630 1.00 0.00 C ATOM 1512 CG LYS A 100 -9.165 -18.371 -0.471 1.00 0.00 C ATOM 1513 CD LYS A 100 -9.193 -17.721 -1.855 1.00 0.00 C ATOM 1514 CE LYS A 100 -7.820 -17.154 -2.223 1.00 0.00 C ATOM 1515 NZ LYS A 100 -7.830 -16.628 -3.606 1.00 0.00 N ATOM 0 H LYS A 100 -9.528 -16.115 2.799 1.00 0.00 H new ATOM 0 HA LYS A 100 -10.949 -18.306 1.582 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -9.986 -16.518 0.268 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.383 -16.880 0.877 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.218 -18.892 -0.329 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -9.955 -19.119 -0.401 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -9.498 -18.456 -2.600 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -9.936 -16.924 -1.871 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -7.550 -16.359 -1.527 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -7.062 -17.931 -2.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -6.916 -16.828 -4.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -8.592 -17.085 -4.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -7.988 -15.600 -3.585 1.00 0.00 H new ATOM 1529 N LEU A 101 -7.918 -18.925 2.703 1.00 0.00 N ATOM 1530 CA LEU A 101 -7.062 -19.981 3.215 1.00 0.00 C ATOM 1531 C LEU A 101 -7.869 -20.871 4.163 1.00 0.00 C ATOM 1532 O LEU A 101 -7.821 -22.096 4.062 1.00 0.00 O ATOM 1533 CB LEU A 101 -5.802 -19.390 3.849 1.00 0.00 C ATOM 1534 CG LEU A 101 -4.896 -20.377 4.587 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -4.030 -21.167 3.604 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -4.054 -19.663 5.647 1.00 0.00 C ATOM 0 H LEU A 101 -7.460 -18.020 2.593 1.00 0.00 H new ATOM 0 HA LEU A 101 -6.712 -20.616 2.401 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.218 -18.907 3.066 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.103 -18.611 4.549 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.528 -21.095 5.109 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -3.395 -21.861 4.155 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -4.671 -21.725 2.921 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.406 -20.479 3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.419 -20.388 6.156 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.431 -18.908 5.168 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.712 -19.184 6.372 1.00 0.00 H new ATOM 1548 N GLU A 102 -8.591 -20.219 5.063 1.00 0.00 N ATOM 1549 CA GLU A 102 -9.407 -20.936 6.029 1.00 0.00 C ATOM 1550 C GLU A 102 -10.239 -22.010 5.327 1.00 0.00 C ATOM 1551 O GLU A 102 -10.023 -23.203 5.536 1.00 0.00 O ATOM 1552 CB GLU A 102 -10.302 -19.973 6.812 1.00 0.00 C ATOM 1553 CG GLU A 102 -11.553 -20.686 7.330 1.00 0.00 C ATOM 1554 CD GLU A 102 -11.976 -20.130 8.691 1.00 0.00 C ATOM 1555 OE1 GLU A 102 -11.189 -20.306 9.646 1.00 0.00 O ATOM 1556 OE2 GLU A 102 -13.078 -19.542 8.746 1.00 0.00 O ATOM 0 H GLU A 102 -8.628 -19.203 5.144 1.00 0.00 H new ATOM 0 HA GLU A 102 -8.745 -21.426 6.743 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -9.745 -19.553 7.650 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -10.593 -19.139 6.173 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -12.367 -20.566 6.615 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -11.358 -21.755 7.414 1.00 0.00 H new ATOM 1563 N GLN A 103 -11.174 -21.549 4.509 1.00 0.00 N ATOM 1564 CA GLN A 103 -12.040 -22.456 3.775 1.00 0.00 C ATOM 1565 C GLN A 103 -11.204 -23.428 2.939 1.00 0.00 C ATOM 1566 O GLN A 103 -11.597 -24.576 2.739 1.00 0.00 O ATOM 1567 CB GLN A 103 -13.025 -21.683 2.896 1.00 0.00 C ATOM 1568 CG GLN A 103 -13.994 -20.863 3.749 1.00 0.00 C ATOM 1569 CD GLN A 103 -15.417 -20.944 3.192 1.00 0.00 C ATOM 1570 OE1 GLN A 103 -16.158 -21.880 3.446 1.00 0.00 O ATOM 1571 NE2 GLN A 103 -15.757 -19.915 2.422 1.00 0.00 N ATOM 0 H GLN A 103 -11.351 -20.559 4.338 1.00 0.00 H new ATOM 0 HA GLN A 103 -12.622 -23.033 4.494 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.477 -21.022 2.224 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -13.585 -22.379 2.271 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -13.980 -21.229 4.776 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -13.669 -19.823 3.777 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -15.088 -19.164 2.250 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -16.686 -19.876 2.004 1.00 0.00 H new ATOM 1580 N LYS A 104 -10.067 -22.932 2.474 1.00 0.00 N ATOM 1581 CA LYS A 104 -9.173 -23.742 1.664 1.00 0.00 C ATOM 1582 C LYS A 104 -8.698 -24.944 2.484 1.00 0.00 C ATOM 1583 O LYS A 104 -8.507 -26.032 1.942 1.00 0.00 O ATOM 1584 CB LYS A 104 -8.032 -22.887 1.108 1.00 0.00 C ATOM 1585 CG LYS A 104 -8.563 -21.574 0.529 1.00 0.00 C ATOM 1586 CD LYS A 104 -8.344 -21.515 -0.985 1.00 0.00 C ATOM 1587 CE LYS A 104 -8.920 -22.755 -1.671 1.00 0.00 C ATOM 1588 NZ LYS A 104 -8.922 -22.580 -3.141 1.00 0.00 N ATOM 0 H LYS A 104 -9.744 -21.979 2.643 1.00 0.00 H new ATOM 0 HA LYS A 104 -9.698 -24.136 0.794 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.313 -22.675 1.899 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -7.501 -23.441 0.334 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -9.626 -21.478 0.750 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -8.061 -20.732 1.006 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -8.815 -20.619 -1.390 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.278 -21.439 -1.199 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -8.331 -23.632 -1.404 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -9.936 -22.934 -1.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -9.508 -23.320 -3.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -9.311 -21.645 -3.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -7.949 -22.652 -3.501 1.00 0.00 H new ATOM 1602 N ALA A 105 -8.522 -24.706 3.775 1.00 0.00 N ATOM 1603 CA ALA A 105 -8.073 -25.756 4.674 1.00 0.00 C ATOM 1604 C ALA A 105 -9.289 -26.413 5.331 1.00 0.00 C ATOM 1605 O ALA A 105 -9.292 -26.655 6.537 1.00 0.00 O ATOM 1606 CB ALA A 105 -7.102 -25.169 5.701 1.00 0.00 C ATOM 0 H ALA A 105 -8.682 -23.802 4.220 1.00 0.00 H new ATOM 0 HA ALA A 105 -7.537 -26.529 4.123 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -6.765 -25.957 6.375 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.242 -24.741 5.186 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.606 -24.391 6.275 1.00 0.00 H new ATOM 1612 N SER A 106 -10.292 -26.683 4.509 1.00 0.00 N ATOM 1613 CA SER A 106 -11.511 -27.308 4.995 1.00 0.00 C ATOM 1614 C SER A 106 -12.031 -28.312 3.964 1.00 0.00 C ATOM 1615 O SER A 106 -13.163 -28.782 4.067 1.00 0.00 O ATOM 1616 CB SER A 106 -12.582 -26.260 5.302 1.00 0.00 C ATOM 1617 OG SER A 106 -12.520 -25.815 6.655 1.00 0.00 O ATOM 0 H SER A 106 -10.286 -26.481 3.509 1.00 0.00 H new ATOM 0 HA SER A 106 -11.280 -27.834 5.921 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.458 -25.408 4.634 1.00 0.00 H new ATOM 0 HB3 SER A 106 -13.568 -26.680 5.103 1.00 0.00 H new ATOM 0 HG SER A 106 -13.218 -25.145 6.811 1.00 0.00 H new ATOM 1623 N GLY A 107 -11.180 -28.610 2.993 1.00 0.00 N ATOM 1624 CA GLY A 107 -11.540 -29.550 1.945 1.00 0.00 C ATOM 1625 C GLY A 107 -10.355 -29.812 1.013 1.00 0.00 C ATOM 1626 O GLY A 107 -9.334 -29.130 1.094 1.00 0.00 O ATOM 0 H GLY A 107 -10.242 -28.217 2.910 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -11.871 -30.488 2.391 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.379 -29.156 1.371 1.00 0.00 H new ATOM 1630 N PRO A 108 -10.534 -30.828 0.128 1.00 0.00 N ATOM 1631 CA PRO A 108 -9.492 -31.189 -0.818 1.00 0.00 C ATOM 1632 C PRO A 108 -9.405 -30.168 -1.954 1.00 0.00 C ATOM 1633 O PRO A 108 -8.323 -29.672 -2.267 1.00 0.00 O ATOM 1634 CB PRO A 108 -9.862 -32.583 -1.299 1.00 0.00 C ATOM 1635 CG PRO A 108 -11.334 -32.762 -0.963 1.00 0.00 C ATOM 1636 CD PRO A 108 -11.729 -31.657 0.003 1.00 0.00 C ATOM 0 HA PRO A 108 -8.498 -31.188 -0.370 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -9.691 -32.685 -2.371 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -9.254 -33.341 -0.805 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -11.941 -32.713 -1.867 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -11.507 -33.741 -0.515 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -12.572 -31.081 -0.378 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -12.031 -32.064 0.968 1.00 0.00 H new ATOM 1644 N SER A 109 -10.558 -29.884 -2.542 1.00 0.00 N ATOM 1645 CA SER A 109 -10.626 -28.931 -3.636 1.00 0.00 C ATOM 1646 C SER A 109 -12.082 -28.716 -4.053 1.00 0.00 C ATOM 1647 O SER A 109 -12.859 -29.667 -4.123 1.00 0.00 O ATOM 1648 CB SER A 109 -9.796 -29.405 -4.831 1.00 0.00 C ATOM 1649 OG SER A 109 -10.112 -30.743 -5.204 1.00 0.00 O ATOM 0 H SER A 109 -11.453 -30.298 -2.281 1.00 0.00 H new ATOM 0 HA SER A 109 -10.210 -27.984 -3.291 1.00 0.00 H new ATOM 0 HB2 SER A 109 -9.970 -28.742 -5.679 1.00 0.00 H new ATOM 0 HB3 SER A 109 -8.736 -29.338 -4.586 1.00 0.00 H new ATOM 0 HG SER A 109 -9.562 -31.007 -5.971 1.00 0.00 H new ATOM 1655 N SER A 110 -12.408 -27.460 -4.320 1.00 0.00 N ATOM 1656 CA SER A 110 -13.758 -27.108 -4.729 1.00 0.00 C ATOM 1657 C SER A 110 -13.712 -26.220 -5.974 1.00 0.00 C ATOM 1658 O SER A 110 -13.556 -25.004 -5.868 1.00 0.00 O ATOM 1659 CB SER A 110 -14.508 -26.400 -3.599 1.00 0.00 C ATOM 1660 OG SER A 110 -15.916 -26.390 -3.817 1.00 0.00 O ATOM 0 H SER A 110 -11.761 -26.673 -4.261 1.00 0.00 H new ATOM 0 HA SER A 110 -14.295 -28.027 -4.965 1.00 0.00 H new ATOM 0 HB2 SER A 110 -14.291 -26.896 -2.653 1.00 0.00 H new ATOM 0 HB3 SER A 110 -14.147 -25.375 -3.511 1.00 0.00 H new ATOM 0 HG SER A 110 -16.359 -25.931 -3.073 1.00 0.00 H new ATOM 1666 N GLY A 111 -13.853 -26.861 -7.125 1.00 0.00 N ATOM 1667 CA GLY A 111 -13.830 -26.144 -8.388 1.00 0.00 C ATOM 1668 C GLY A 111 -12.785 -25.027 -8.366 1.00 0.00 C ATOM 1669 O GLY A 111 -11.820 -25.059 -9.128 1.00 0.00 O ATOM 0 H GLY A 111 -13.984 -27.869 -7.209 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -13.609 -26.837 -9.200 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -14.815 -25.722 -8.588 1.00 0.00 H new TER 1673 GLY A 111