USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 787 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 TYR OH : rot 16:sc= 0.965 USER MOD Set 1.2: A 70 THR OG1 : rot 68:sc= 0.966 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 25:sc= 0.979 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -173:sc= -1.01 (180deg=-1.26) USER MOD Single : A 12 SER OG : rot 34:sc= 0.131 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00248) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 23 THR OG1 : rot 166:sc= 0.0364 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl -164:sc= -0.0136 (180deg=-0.368) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= -0.0029 (180deg=-0.0029) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 158:sc= -0.107 (180deg=-0.5) USER MOD Single : A 61 MET CE :methyl -121:sc= -2.94! (180deg=-6.96!) USER MOD Single : A 77 SER OG : rot 92:sc= 0.0347 USER MOD Single : A 78 SER OG : rot 110:sc= 1.13 USER MOD Single : A 79 GLN : amide:sc= -0.169 X(o=-0.17,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 118:sc=-0.00621 USER MOD Single : A 94 LYS NZ :NH3+ 153:sc= -2.13 (180deg=-3.27!) USER MOD Single : A 98 ASN : amide:sc= -2.71! C(o=-2.7!,f=-2.5!) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 30:sc= 0.898 USER MOD Single : A 107 SER OG : rot 180:sc= -0.0159 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 61.111 -9.084 -26.666 1.00 0.00 N ATOM 2 CA GLY A 1 60.314 -10.189 -26.165 1.00 0.00 C ATOM 3 C GLY A 1 60.179 -10.168 -24.656 1.00 0.00 C ATOM 4 O GLY A 1 59.463 -9.335 -24.101 1.00 0.00 O ATOM 0 H1 GLY A 1 61.174 -9.143 -27.702 1.00 0.00 H new ATOM 0 H2 GLY A 1 60.665 -8.184 -26.397 1.00 0.00 H new ATOM 0 H3 GLY A 1 62.067 -9.132 -26.258 1.00 0.00 H new ATOM 0 HA2 GLY A 1 59.322 -10.152 -26.616 1.00 0.00 H new ATOM 0 HA3 GLY A 1 60.769 -11.130 -26.473 1.00 0.00 H new ATOM 8 N SER A 2 60.867 -11.089 -23.989 1.00 0.00 N ATOM 9 CA SER A 2 60.816 -11.177 -22.534 1.00 0.00 C ATOM 10 C SER A 2 59.430 -10.806 -22.016 1.00 0.00 C ATOM 11 O SER A 2 59.294 -9.990 -21.104 1.00 0.00 O ATOM 12 CB SER A 2 61.869 -10.260 -21.909 1.00 0.00 C ATOM 13 OG SER A 2 63.135 -10.895 -21.862 1.00 0.00 O ATOM 0 H SER A 2 61.466 -11.785 -24.433 1.00 0.00 H new ATOM 0 HA SER A 2 61.028 -12.208 -22.249 1.00 0.00 H new ATOM 0 HB2 SER A 2 61.942 -9.338 -22.487 1.00 0.00 H new ATOM 0 HB3 SER A 2 61.561 -9.981 -20.901 1.00 0.00 H new ATOM 0 HG SER A 2 63.791 -10.288 -21.460 1.00 0.00 H new ATOM 19 N SER A 3 58.403 -11.411 -22.604 1.00 0.00 N ATOM 20 CA SER A 3 57.026 -11.142 -22.206 1.00 0.00 C ATOM 21 C SER A 3 56.333 -12.422 -21.749 1.00 0.00 C ATOM 22 O SER A 3 56.853 -13.522 -21.931 1.00 0.00 O ATOM 23 CB SER A 3 56.251 -10.514 -23.365 1.00 0.00 C ATOM 24 OG SER A 3 55.172 -9.727 -22.890 1.00 0.00 O ATOM 0 H SER A 3 58.498 -12.091 -23.358 1.00 0.00 H new ATOM 0 HA SER A 3 57.045 -10.442 -21.371 1.00 0.00 H new ATOM 0 HB2 SER A 3 56.921 -9.895 -23.962 1.00 0.00 H new ATOM 0 HB3 SER A 3 55.872 -11.298 -24.021 1.00 0.00 H new ATOM 0 HG SER A 3 54.693 -9.335 -23.650 1.00 0.00 H new ATOM 30 N GLY A 4 55.154 -12.269 -21.154 1.00 0.00 N ATOM 31 CA GLY A 4 54.408 -13.420 -20.679 1.00 0.00 C ATOM 32 C GLY A 4 53.008 -13.056 -20.225 1.00 0.00 C ATOM 33 O GLY A 4 52.636 -11.883 -20.218 1.00 0.00 O ATOM 0 H GLY A 4 54.702 -11.369 -20.992 1.00 0.00 H new ATOM 0 HA2 GLY A 4 54.347 -14.163 -21.474 1.00 0.00 H new ATOM 0 HA3 GLY A 4 54.946 -13.882 -19.852 1.00 0.00 H new ATOM 37 N SER A 5 52.230 -14.064 -19.845 1.00 0.00 N ATOM 38 CA SER A 5 50.862 -13.845 -19.392 1.00 0.00 C ATOM 39 C SER A 5 50.368 -15.027 -18.563 1.00 0.00 C ATOM 40 O SER A 5 51.005 -16.080 -18.521 1.00 0.00 O ATOM 41 CB SER A 5 49.935 -13.624 -20.588 1.00 0.00 C ATOM 42 OG SER A 5 50.047 -12.300 -21.082 1.00 0.00 O ATOM 0 H SER A 5 52.524 -15.041 -19.842 1.00 0.00 H new ATOM 0 HA SER A 5 50.852 -12.954 -18.764 1.00 0.00 H new ATOM 0 HB2 SER A 5 50.181 -14.333 -21.379 1.00 0.00 H new ATOM 0 HB3 SER A 5 48.904 -13.820 -20.294 1.00 0.00 H new ATOM 0 HG SER A 5 50.924 -11.934 -20.842 1.00 0.00 H new ATOM 48 N SER A 6 49.227 -14.845 -17.905 1.00 0.00 N ATOM 49 CA SER A 6 48.649 -15.895 -17.074 1.00 0.00 C ATOM 50 C SER A 6 47.245 -15.512 -16.615 1.00 0.00 C ATOM 51 O SER A 6 46.918 -14.331 -16.500 1.00 0.00 O ATOM 52 CB SER A 6 49.540 -16.162 -15.860 1.00 0.00 C ATOM 53 OG SER A 6 49.299 -17.452 -15.325 1.00 0.00 O ATOM 0 H SER A 6 48.685 -13.981 -17.931 1.00 0.00 H new ATOM 0 HA SER A 6 48.582 -16.803 -17.673 1.00 0.00 H new ATOM 0 HB2 SER A 6 50.588 -16.074 -16.147 1.00 0.00 H new ATOM 0 HB3 SER A 6 49.355 -15.407 -15.096 1.00 0.00 H new ATOM 0 HG SER A 6 49.882 -17.599 -14.551 1.00 0.00 H new ATOM 59 N GLY A 7 46.419 -16.520 -16.353 1.00 0.00 N ATOM 60 CA GLY A 7 45.060 -16.270 -15.909 1.00 0.00 C ATOM 61 C GLY A 7 44.500 -17.411 -15.083 1.00 0.00 C ATOM 62 O GLY A 7 45.094 -18.488 -15.017 1.00 0.00 O ATOM 0 H GLY A 7 46.667 -17.506 -16.440 1.00 0.00 H new ATOM 0 HA2 GLY A 7 45.037 -15.353 -15.320 1.00 0.00 H new ATOM 0 HA3 GLY A 7 44.422 -16.107 -16.777 1.00 0.00 H new ATOM 66 N ASP A 8 43.356 -17.175 -14.451 1.00 0.00 N ATOM 67 CA ASP A 8 42.716 -18.192 -13.624 1.00 0.00 C ATOM 68 C ASP A 8 41.309 -17.760 -13.223 1.00 0.00 C ATOM 69 O ASP A 8 41.118 -16.693 -12.640 1.00 0.00 O ATOM 70 CB ASP A 8 43.555 -18.466 -12.374 1.00 0.00 C ATOM 71 CG ASP A 8 43.319 -17.440 -11.283 1.00 0.00 C ATOM 72 OD1 ASP A 8 43.326 -16.230 -11.595 1.00 0.00 O ATOM 73 OD2 ASP A 8 43.127 -17.846 -10.119 1.00 0.00 O ATOM 0 H ASP A 8 42.853 -16.289 -14.495 1.00 0.00 H new ATOM 0 HA ASP A 8 42.642 -19.108 -14.210 1.00 0.00 H new ATOM 0 HB2 ASP A 8 43.319 -19.459 -11.992 1.00 0.00 H new ATOM 0 HB3 ASP A 8 44.611 -18.470 -12.643 1.00 0.00 H new ATOM 78 N LYS A 9 40.326 -18.596 -13.541 1.00 0.00 N ATOM 79 CA LYS A 9 38.936 -18.302 -13.214 1.00 0.00 C ATOM 80 C LYS A 9 38.178 -19.578 -12.863 1.00 0.00 C ATOM 81 O LYS A 9 38.210 -20.555 -13.612 1.00 0.00 O ATOM 82 CB LYS A 9 38.253 -17.597 -14.388 1.00 0.00 C ATOM 83 CG LYS A 9 36.933 -16.942 -14.020 1.00 0.00 C ATOM 84 CD LYS A 9 37.130 -15.507 -13.563 1.00 0.00 C ATOM 85 CE LYS A 9 37.052 -14.535 -14.730 1.00 0.00 C ATOM 86 NZ LYS A 9 38.070 -14.838 -15.774 1.00 0.00 N ATOM 0 H LYS A 9 40.467 -19.483 -14.025 1.00 0.00 H new ATOM 0 HA LYS A 9 38.924 -17.643 -12.346 1.00 0.00 H new ATOM 0 HB2 LYS A 9 38.927 -16.838 -14.787 1.00 0.00 H new ATOM 0 HB3 LYS A 9 38.080 -18.321 -15.185 1.00 0.00 H new ATOM 0 HG2 LYS A 9 36.264 -16.962 -14.880 1.00 0.00 H new ATOM 0 HG3 LYS A 9 36.451 -17.514 -13.227 1.00 0.00 H new ATOM 0 HD2 LYS A 9 36.370 -15.252 -12.824 1.00 0.00 H new ATOM 0 HD3 LYS A 9 38.098 -15.410 -13.071 1.00 0.00 H new ATOM 0 HE2 LYS A 9 36.056 -14.577 -15.171 1.00 0.00 H new ATOM 0 HE3 LYS A 9 37.197 -13.518 -14.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 38.064 -14.087 -16.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 39.012 -14.890 -15.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 37.846 -15.749 -16.223 1.00 0.00 H new ATOM 100 N ILE A 10 37.496 -19.562 -11.723 1.00 0.00 N ATOM 101 CA ILE A 10 36.728 -20.717 -11.276 1.00 0.00 C ATOM 102 C ILE A 10 35.385 -20.292 -10.692 1.00 0.00 C ATOM 103 O ILE A 10 35.330 -19.535 -9.724 1.00 0.00 O ATOM 104 CB ILE A 10 37.499 -21.531 -10.220 1.00 0.00 C ATOM 105 CG1 ILE A 10 38.834 -22.013 -10.791 1.00 0.00 C ATOM 106 CG2 ILE A 10 36.663 -22.711 -9.746 1.00 0.00 C ATOM 107 CD1 ILE A 10 39.811 -22.479 -9.734 1.00 0.00 C ATOM 0 H ILE A 10 37.460 -18.762 -11.092 1.00 0.00 H new ATOM 0 HA ILE A 10 36.559 -21.342 -12.153 1.00 0.00 H new ATOM 0 HB ILE A 10 37.702 -20.887 -9.364 1.00 0.00 H new ATOM 0 HG12 ILE A 10 38.648 -22.830 -11.488 1.00 0.00 H new ATOM 0 HG13 ILE A 10 39.289 -21.204 -11.363 1.00 0.00 H new ATOM 0 HG21 ILE A 10 37.222 -23.276 -9.000 1.00 0.00 H new ATOM 0 HG22 ILE A 10 35.735 -22.346 -9.305 1.00 0.00 H new ATOM 0 HG23 ILE A 10 36.432 -23.357 -10.593 1.00 0.00 H new ATOM 0 HD11 ILE A 10 40.735 -22.806 -10.211 1.00 0.00 H new ATOM 0 HD12 ILE A 10 40.027 -21.658 -9.051 1.00 0.00 H new ATOM 0 HD13 ILE A 10 39.376 -23.309 -9.177 1.00 0.00 H new ATOM 119 N GLU A 11 34.304 -20.786 -11.288 1.00 0.00 N ATOM 120 CA GLU A 11 32.961 -20.458 -10.826 1.00 0.00 C ATOM 121 C GLU A 11 31.911 -21.251 -11.598 1.00 0.00 C ATOM 122 O GLU A 11 31.671 -20.999 -12.779 1.00 0.00 O ATOM 123 CB GLU A 11 32.697 -18.958 -10.978 1.00 0.00 C ATOM 124 CG GLU A 11 31.632 -18.428 -10.034 1.00 0.00 C ATOM 125 CD GLU A 11 31.813 -16.957 -9.716 1.00 0.00 C ATOM 126 OE1 GLU A 11 32.969 -16.532 -9.511 1.00 0.00 O ATOM 127 OE2 GLU A 11 30.798 -16.230 -9.674 1.00 0.00 O ATOM 0 H GLU A 11 34.332 -21.414 -12.091 1.00 0.00 H new ATOM 0 HA GLU A 11 32.892 -20.727 -9.772 1.00 0.00 H new ATOM 0 HB2 GLU A 11 33.626 -18.415 -10.805 1.00 0.00 H new ATOM 0 HB3 GLU A 11 32.394 -18.753 -12.005 1.00 0.00 H new ATOM 0 HG2 GLU A 11 30.649 -18.581 -10.479 1.00 0.00 H new ATOM 0 HG3 GLU A 11 31.655 -19.002 -9.107 1.00 0.00 H new ATOM 134 N SER A 12 31.288 -22.212 -10.923 1.00 0.00 N ATOM 135 CA SER A 12 30.267 -23.046 -11.545 1.00 0.00 C ATOM 136 C SER A 12 29.074 -23.231 -10.613 1.00 0.00 C ATOM 137 O SER A 12 29.230 -23.623 -9.456 1.00 0.00 O ATOM 138 CB SER A 12 30.851 -24.409 -11.922 1.00 0.00 C ATOM 139 OG SER A 12 31.453 -25.033 -10.801 1.00 0.00 O ATOM 0 H SER A 12 31.473 -22.432 -9.944 1.00 0.00 H new ATOM 0 HA SER A 12 29.924 -22.543 -12.449 1.00 0.00 H new ATOM 0 HB2 SER A 12 30.063 -25.049 -12.319 1.00 0.00 H new ATOM 0 HB3 SER A 12 31.590 -24.285 -12.714 1.00 0.00 H new ATOM 0 HG SER A 12 30.956 -24.799 -9.990 1.00 0.00 H new ATOM 145 N LYS A 13 27.881 -22.948 -11.125 1.00 0.00 N ATOM 146 CA LYS A 13 26.659 -23.083 -10.340 1.00 0.00 C ATOM 147 C LYS A 13 25.434 -23.134 -11.247 1.00 0.00 C ATOM 148 O LYS A 13 25.404 -22.504 -12.305 1.00 0.00 O ATOM 149 CB LYS A 13 26.530 -21.920 -9.355 1.00 0.00 C ATOM 150 CG LYS A 13 25.769 -22.277 -8.089 1.00 0.00 C ATOM 151 CD LYS A 13 26.215 -21.426 -6.912 1.00 0.00 C ATOM 152 CE LYS A 13 25.702 -19.999 -7.030 1.00 0.00 C ATOM 153 NZ LYS A 13 25.501 -19.370 -5.695 1.00 0.00 N ATOM 0 H LYS A 13 27.734 -22.623 -12.081 1.00 0.00 H new ATOM 0 HA LYS A 13 26.716 -24.018 -9.782 1.00 0.00 H new ATOM 0 HB2 LYS A 13 27.527 -21.572 -9.084 1.00 0.00 H new ATOM 0 HB3 LYS A 13 26.026 -21.090 -9.850 1.00 0.00 H new ATOM 0 HG2 LYS A 13 24.700 -22.139 -8.255 1.00 0.00 H new ATOM 0 HG3 LYS A 13 25.922 -23.331 -7.856 1.00 0.00 H new ATOM 0 HD2 LYS A 13 25.853 -21.868 -5.984 1.00 0.00 H new ATOM 0 HD3 LYS A 13 27.304 -21.419 -6.858 1.00 0.00 H new ATOM 0 HE2 LYS A 13 26.410 -19.405 -7.608 1.00 0.00 H new ATOM 0 HE3 LYS A 13 24.760 -19.996 -7.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 25.151 -18.398 -5.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 24.807 -19.922 -5.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 26.405 -19.350 -5.181 1.00 0.00 H new ATOM 167 N LEU A 14 24.423 -23.887 -10.826 1.00 0.00 N ATOM 168 CA LEU A 14 23.193 -24.019 -11.600 1.00 0.00 C ATOM 169 C LEU A 14 22.042 -23.284 -10.921 1.00 0.00 C ATOM 170 O LEU A 14 20.911 -23.771 -10.894 1.00 0.00 O ATOM 171 CB LEU A 14 22.836 -25.496 -11.779 1.00 0.00 C ATOM 172 CG LEU A 14 21.954 -25.832 -12.981 1.00 0.00 C ATOM 173 CD1 LEU A 14 22.742 -25.702 -14.275 1.00 0.00 C ATOM 174 CD2 LEU A 14 21.376 -27.233 -12.844 1.00 0.00 C ATOM 0 H LEU A 14 24.431 -24.415 -9.953 1.00 0.00 H new ATOM 0 HA LEU A 14 23.359 -23.571 -12.580 1.00 0.00 H new ATOM 0 HB2 LEU A 14 23.762 -26.065 -11.863 1.00 0.00 H new ATOM 0 HB3 LEU A 14 22.331 -25.839 -10.876 1.00 0.00 H new ATOM 0 HG LEU A 14 21.128 -25.122 -13.011 1.00 0.00 H new ATOM 0 HD11 LEU A 14 22.097 -25.945 -15.120 1.00 0.00 H new ATOM 0 HD12 LEU A 14 23.105 -24.680 -14.379 1.00 0.00 H new ATOM 0 HD13 LEU A 14 23.589 -26.388 -14.256 1.00 0.00 H new ATOM 0 HD21 LEU A 14 20.751 -27.455 -13.709 1.00 0.00 H new ATOM 0 HD22 LEU A 14 22.188 -27.958 -12.788 1.00 0.00 H new ATOM 0 HD23 LEU A 14 20.774 -27.291 -11.937 1.00 0.00 H new ATOM 186 N LEU A 15 22.337 -22.109 -10.376 1.00 0.00 N ATOM 187 CA LEU A 15 21.325 -21.305 -9.699 1.00 0.00 C ATOM 188 C LEU A 15 21.874 -19.927 -9.344 1.00 0.00 C ATOM 189 O LEU A 15 22.714 -19.793 -8.455 1.00 0.00 O ATOM 190 CB LEU A 15 20.843 -22.016 -8.434 1.00 0.00 C ATOM 191 CG LEU A 15 19.413 -21.703 -7.991 1.00 0.00 C ATOM 192 CD1 LEU A 15 19.070 -20.250 -8.283 1.00 0.00 C ATOM 193 CD2 LEU A 15 18.425 -22.635 -8.679 1.00 0.00 C ATOM 0 H LEU A 15 23.268 -21.692 -10.389 1.00 0.00 H new ATOM 0 HA LEU A 15 20.483 -21.177 -10.379 1.00 0.00 H new ATOM 0 HB2 LEU A 15 20.926 -23.091 -8.592 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.519 -21.761 -7.618 1.00 0.00 H new ATOM 0 HG LEU A 15 19.343 -21.862 -6.915 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.049 -20.045 -7.961 1.00 0.00 H new ATOM 0 HD12 LEU A 15 19.758 -19.598 -7.744 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.157 -20.064 -9.353 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.413 -22.398 -8.352 1.00 0.00 H new ATOM 0 HD22 LEU A 15 18.496 -22.508 -9.759 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.658 -23.668 -8.419 1.00 0.00 H new ATOM 205 N ALA A 16 21.390 -18.905 -10.043 1.00 0.00 N ATOM 206 CA ALA A 16 21.829 -17.537 -9.798 1.00 0.00 C ATOM 207 C ALA A 16 20.679 -16.675 -9.288 1.00 0.00 C ATOM 208 O ALA A 16 20.266 -15.719 -9.945 1.00 0.00 O ATOM 209 CB ALA A 16 22.418 -16.937 -11.066 1.00 0.00 C ATOM 0 H ALA A 16 20.694 -18.999 -10.783 1.00 0.00 H new ATOM 0 HA ALA A 16 22.600 -17.561 -9.028 1.00 0.00 H new ATOM 0 HB1 ALA A 16 22.742 -15.915 -10.869 1.00 0.00 H new ATOM 0 HB2 ALA A 16 23.272 -17.533 -11.388 1.00 0.00 H new ATOM 0 HB3 ALA A 16 21.662 -16.933 -11.852 1.00 0.00 H new ATOM 215 N LYS A 17 20.165 -17.018 -8.112 1.00 0.00 N ATOM 216 CA LYS A 17 19.063 -16.276 -7.512 1.00 0.00 C ATOM 217 C LYS A 17 19.197 -16.235 -5.993 1.00 0.00 C ATOM 218 O LYS A 17 19.756 -17.147 -5.384 1.00 0.00 O ATOM 219 CB LYS A 17 17.724 -16.909 -7.899 1.00 0.00 C ATOM 220 CG LYS A 17 17.163 -16.391 -9.212 1.00 0.00 C ATOM 221 CD LYS A 17 16.054 -17.287 -9.737 1.00 0.00 C ATOM 222 CE LYS A 17 15.709 -16.958 -11.181 1.00 0.00 C ATOM 223 NZ LYS A 17 16.707 -17.522 -12.132 1.00 0.00 N ATOM 0 H LYS A 17 20.495 -17.806 -7.555 1.00 0.00 H new ATOM 0 HA LYS A 17 19.098 -15.254 -7.890 1.00 0.00 H new ATOM 0 HB2 LYS A 17 17.849 -17.990 -7.968 1.00 0.00 H new ATOM 0 HB3 LYS A 17 17.000 -16.722 -7.105 1.00 0.00 H new ATOM 0 HG2 LYS A 17 16.780 -15.380 -9.071 1.00 0.00 H new ATOM 0 HG3 LYS A 17 17.962 -16.329 -9.951 1.00 0.00 H new ATOM 0 HD2 LYS A 17 16.362 -18.330 -9.664 1.00 0.00 H new ATOM 0 HD3 LYS A 17 15.167 -17.172 -9.114 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.720 -17.351 -11.417 1.00 0.00 H new ATOM 0 HE3 LYS A 17 15.660 -15.876 -11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 16.418 -17.305 -13.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 17.640 -17.102 -11.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 16.760 -18.553 -12.008 1.00 0.00 H new ATOM 237 N LYS A 18 18.681 -15.172 -5.387 1.00 0.00 N ATOM 238 CA LYS A 18 18.740 -15.012 -3.938 1.00 0.00 C ATOM 239 C LYS A 18 17.455 -15.507 -3.283 1.00 0.00 C ATOM 240 O LYS A 18 17.492 -16.296 -2.340 1.00 0.00 O ATOM 241 CB LYS A 18 18.978 -13.544 -3.576 1.00 0.00 C ATOM 242 CG LYS A 18 20.426 -13.109 -3.722 1.00 0.00 C ATOM 243 CD LYS A 18 20.550 -11.595 -3.770 1.00 0.00 C ATOM 244 CE LYS A 18 20.140 -11.045 -5.128 1.00 0.00 C ATOM 245 NZ LYS A 18 19.991 -9.564 -5.104 1.00 0.00 N ATOM 0 H LYS A 18 18.217 -14.407 -5.877 1.00 0.00 H new ATOM 0 HA LYS A 18 19.571 -15.611 -3.565 1.00 0.00 H new ATOM 0 HB2 LYS A 18 18.353 -12.916 -4.211 1.00 0.00 H new ATOM 0 HB3 LYS A 18 18.659 -13.376 -2.548 1.00 0.00 H new ATOM 0 HG2 LYS A 18 21.010 -13.497 -2.887 1.00 0.00 H new ATOM 0 HG3 LYS A 18 20.846 -13.539 -4.631 1.00 0.00 H new ATOM 0 HD2 LYS A 18 19.926 -11.153 -2.994 1.00 0.00 H new ATOM 0 HD3 LYS A 18 21.579 -11.306 -3.555 1.00 0.00 H new ATOM 0 HE2 LYS A 18 20.886 -11.323 -5.873 1.00 0.00 H new ATOM 0 HE3 LYS A 18 19.198 -11.500 -5.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 19.711 -9.228 -6.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 19.261 -9.300 -4.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 20.897 -9.128 -4.836 1.00 0.00 H new ATOM 259 N ALA A 19 16.319 -15.039 -3.791 1.00 0.00 N ATOM 260 CA ALA A 19 15.022 -15.437 -3.257 1.00 0.00 C ATOM 261 C ALA A 19 13.884 -14.857 -4.090 1.00 0.00 C ATOM 262 O ALA A 19 13.873 -13.666 -4.398 1.00 0.00 O ATOM 263 CB ALA A 19 14.892 -14.998 -1.806 1.00 0.00 C ATOM 0 H ALA A 19 16.271 -14.384 -4.571 1.00 0.00 H new ATOM 0 HA ALA A 19 14.955 -16.524 -3.304 1.00 0.00 H new ATOM 0 HB1 ALA A 19 13.919 -15.302 -1.420 1.00 0.00 H new ATOM 0 HB2 ALA A 19 15.679 -15.464 -1.213 1.00 0.00 H new ATOM 0 HB3 ALA A 19 14.985 -13.914 -1.744 1.00 0.00 H new ATOM 269 N GLU A 20 12.930 -15.709 -4.452 1.00 0.00 N ATOM 270 CA GLU A 20 11.788 -15.280 -5.252 1.00 0.00 C ATOM 271 C GLU A 20 10.644 -14.809 -4.359 1.00 0.00 C ATOM 272 O GLU A 20 10.322 -15.446 -3.355 1.00 0.00 O ATOM 273 CB GLU A 20 11.310 -16.421 -6.152 1.00 0.00 C ATOM 274 CG GLU A 20 10.064 -16.084 -6.953 1.00 0.00 C ATOM 275 CD GLU A 20 10.353 -15.156 -8.118 1.00 0.00 C ATOM 276 OE1 GLU A 20 11.362 -14.423 -8.057 1.00 0.00 O ATOM 277 OE2 GLU A 20 9.569 -15.164 -9.090 1.00 0.00 O ATOM 0 H GLU A 20 12.925 -16.699 -4.205 1.00 0.00 H new ATOM 0 HA GLU A 20 12.107 -14.445 -5.875 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.112 -16.690 -6.840 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.110 -17.298 -5.537 1.00 0.00 H new ATOM 0 HG2 GLU A 20 9.618 -17.005 -7.329 1.00 0.00 H new ATOM 0 HG3 GLU A 20 9.329 -15.619 -6.296 1.00 0.00 H new ATOM 284 N VAL A 21 10.033 -13.689 -4.730 1.00 0.00 N ATOM 285 CA VAL A 21 8.925 -13.132 -3.964 1.00 0.00 C ATOM 286 C VAL A 21 7.590 -13.697 -4.438 1.00 0.00 C ATOM 287 O VAL A 21 7.481 -14.206 -5.552 1.00 0.00 O ATOM 288 CB VAL A 21 8.886 -11.596 -4.069 1.00 0.00 C ATOM 289 CG1 VAL A 21 8.392 -11.167 -5.442 1.00 0.00 C ATOM 290 CG2 VAL A 21 8.010 -11.009 -2.972 1.00 0.00 C ATOM 0 H VAL A 21 10.287 -13.149 -5.557 1.00 0.00 H new ATOM 0 HA VAL A 21 9.087 -13.414 -2.923 1.00 0.00 H new ATOM 0 HB VAL A 21 9.899 -11.215 -3.938 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.371 -10.079 -5.497 1.00 0.00 H new ATOM 0 HG12 VAL A 21 9.062 -11.557 -6.208 1.00 0.00 H new ATOM 0 HG13 VAL A 21 7.388 -11.558 -5.606 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.994 -9.923 -3.061 1.00 0.00 H new ATOM 0 HG22 VAL A 21 6.996 -11.396 -3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.412 -11.287 -1.998 1.00 0.00 H new ATOM 300 N ASN A 22 6.577 -13.602 -3.583 1.00 0.00 N ATOM 301 CA ASN A 22 5.248 -14.104 -3.915 1.00 0.00 C ATOM 302 C ASN A 22 4.344 -12.974 -4.396 1.00 0.00 C ATOM 303 O ASN A 22 3.609 -13.124 -5.372 1.00 0.00 O ATOM 304 CB ASN A 22 4.622 -14.791 -2.699 1.00 0.00 C ATOM 305 CG ASN A 22 3.343 -15.529 -3.047 1.00 0.00 C ATOM 306 OD1 ASN A 22 3.264 -16.207 -4.072 1.00 0.00 O ATOM 307 ND2 ASN A 22 2.335 -15.399 -2.193 1.00 0.00 N ATOM 0 H ASN A 22 6.650 -13.183 -2.656 1.00 0.00 H new ATOM 0 HA ASN A 22 5.352 -14.830 -4.721 1.00 0.00 H new ATOM 0 HB2 ASN A 22 5.339 -15.493 -2.273 1.00 0.00 H new ATOM 0 HB3 ASN A 22 4.411 -14.045 -1.932 1.00 0.00 H new ATOM 0 HD21 ASN A 22 1.449 -15.872 -2.374 1.00 0.00 H new ATOM 0 HD22 ASN A 22 2.446 -14.827 -1.356 1.00 0.00 H new ATOM 314 N THR A 23 4.404 -11.840 -3.703 1.00 0.00 N ATOM 315 CA THR A 23 3.591 -10.684 -4.059 1.00 0.00 C ATOM 316 C THR A 23 4.447 -9.429 -4.190 1.00 0.00 C ATOM 317 O THR A 23 5.663 -9.474 -4.002 1.00 0.00 O ATOM 318 CB THR A 23 2.487 -10.431 -3.014 1.00 0.00 C ATOM 319 OG1 THR A 23 3.045 -10.455 -1.696 1.00 0.00 O ATOM 320 CG2 THR A 23 1.388 -11.478 -3.124 1.00 0.00 C ATOM 0 H THR A 23 5.007 -11.698 -2.893 1.00 0.00 H new ATOM 0 HA THR A 23 3.128 -10.907 -5.020 1.00 0.00 H new ATOM 0 HB THR A 23 2.053 -9.450 -3.206 1.00 0.00 H new ATOM 0 HG1 THR A 23 2.403 -10.072 -1.062 1.00 0.00 H new ATOM 0 HG21 THR A 23 0.620 -11.279 -2.377 1.00 0.00 H new ATOM 0 HG22 THR A 23 0.945 -11.437 -4.119 1.00 0.00 H new ATOM 0 HG23 THR A 23 1.811 -12.468 -2.955 1.00 0.00 H new ATOM 328 N ILE A 24 3.804 -8.312 -4.514 1.00 0.00 N ATOM 329 CA ILE A 24 4.508 -7.045 -4.669 1.00 0.00 C ATOM 330 C ILE A 24 5.179 -6.626 -3.365 1.00 0.00 C ATOM 331 O ILE A 24 4.606 -6.733 -2.281 1.00 0.00 O ATOM 332 CB ILE A 24 3.555 -5.924 -5.126 1.00 0.00 C ATOM 333 CG1 ILE A 24 2.809 -6.346 -6.394 1.00 0.00 C ATOM 334 CG2 ILE A 24 4.329 -4.636 -5.364 1.00 0.00 C ATOM 335 CD1 ILE A 24 1.862 -5.288 -6.917 1.00 0.00 C ATOM 0 H ILE A 24 2.798 -8.259 -4.674 1.00 0.00 H new ATOM 0 HA ILE A 24 5.269 -7.198 -5.434 1.00 0.00 H new ATOM 0 HB ILE A 24 2.823 -5.745 -4.339 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.535 -6.588 -7.170 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.246 -7.257 -6.189 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.642 -3.853 -5.686 1.00 0.00 H new ATOM 0 HG22 ILE A 24 4.820 -4.330 -4.440 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.080 -4.800 -6.136 1.00 0.00 H new ATOM 0 HD11 ILE A 24 1.368 -5.655 -7.817 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.113 -5.063 -6.158 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.422 -4.383 -7.154 1.00 0.00 H new ATOM 347 N PRO A 25 6.422 -6.134 -3.471 1.00 0.00 N ATOM 348 CA PRO A 25 7.198 -5.686 -2.311 1.00 0.00 C ATOM 349 C PRO A 25 6.639 -4.406 -1.699 1.00 0.00 C ATOM 350 O PRO A 25 7.155 -3.315 -1.940 1.00 0.00 O ATOM 351 CB PRO A 25 8.593 -5.438 -2.891 1.00 0.00 C ATOM 352 CG PRO A 25 8.357 -5.150 -4.333 1.00 0.00 C ATOM 353 CD PRO A 25 7.167 -5.978 -4.732 1.00 0.00 C ATOM 0 HA PRO A 25 7.182 -6.417 -1.503 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.085 -4.601 -2.395 1.00 0.00 H new ATOM 0 HB3 PRO A 25 9.236 -6.308 -2.761 1.00 0.00 H new ATOM 0 HG2 PRO A 25 8.165 -4.089 -4.493 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.231 -5.409 -4.931 1.00 0.00 H new ATOM 0 HD2 PRO A 25 6.568 -5.479 -5.494 1.00 0.00 H new ATOM 0 HD3 PRO A 25 7.468 -6.942 -5.143 1.00 0.00 H new ATOM 361 N GLY A 26 5.582 -4.547 -0.906 1.00 0.00 N ATOM 362 CA GLY A 26 4.971 -3.394 -0.271 1.00 0.00 C ATOM 363 C GLY A 26 4.098 -2.602 -1.225 1.00 0.00 C ATOM 364 O GLY A 26 3.687 -3.110 -2.269 1.00 0.00 O ATOM 0 H GLY A 26 5.137 -5.440 -0.692 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.371 -3.725 0.576 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.752 -2.745 0.126 1.00 0.00 H new ATOM 368 N PHE A 27 3.814 -1.354 -0.867 1.00 0.00 N ATOM 369 CA PHE A 27 2.982 -0.492 -1.698 1.00 0.00 C ATOM 370 C PHE A 27 2.992 0.942 -1.174 1.00 0.00 C ATOM 371 O PHE A 27 2.852 1.176 0.026 1.00 0.00 O ATOM 372 CB PHE A 27 1.546 -1.020 -1.742 1.00 0.00 C ATOM 373 CG PHE A 27 0.594 -0.109 -2.461 1.00 0.00 C ATOM 374 CD1 PHE A 27 0.764 0.169 -3.808 1.00 0.00 C ATOM 375 CD2 PHE A 27 -0.472 0.469 -1.791 1.00 0.00 C ATOM 376 CE1 PHE A 27 -0.110 1.008 -4.472 1.00 0.00 C ATOM 377 CE2 PHE A 27 -1.351 1.309 -2.451 1.00 0.00 C ATOM 378 CZ PHE A 27 -1.170 1.578 -3.793 1.00 0.00 C ATOM 0 H PHE A 27 4.148 -0.917 -0.008 1.00 0.00 H new ATOM 0 HA PHE A 27 3.394 -0.496 -2.707 1.00 0.00 H new ATOM 0 HB2 PHE A 27 1.541 -1.995 -2.229 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.192 -1.171 -0.722 1.00 0.00 H new ATOM 0 HD1 PHE A 27 1.589 -0.275 -4.345 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.618 0.261 -0.741 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.035 1.218 -5.521 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -2.178 1.754 -1.917 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.855 2.232 -4.311 1.00 0.00 H new ATOM 388 N ASP A 28 3.159 1.896 -2.083 1.00 0.00 N ATOM 389 CA ASP A 28 3.188 3.306 -1.715 1.00 0.00 C ATOM 390 C ASP A 28 1.989 4.046 -2.301 1.00 0.00 C ATOM 391 O ASP A 28 1.515 5.029 -1.733 1.00 0.00 O ATOM 392 CB ASP A 28 4.487 3.955 -2.195 1.00 0.00 C ATOM 393 CG ASP A 28 4.391 5.467 -2.258 1.00 0.00 C ATOM 394 OD1 ASP A 28 3.757 6.059 -1.359 1.00 0.00 O ATOM 395 OD2 ASP A 28 4.951 6.058 -3.205 1.00 0.00 O ATOM 0 H ASP A 28 3.276 1.718 -3.080 1.00 0.00 H new ATOM 0 HA ASP A 28 3.138 3.372 -0.628 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.299 3.673 -1.525 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.739 3.569 -3.182 1.00 0.00 H new ATOM 400 N GLY A 29 1.504 3.565 -3.442 1.00 0.00 N ATOM 401 CA GLY A 29 0.365 4.193 -4.087 1.00 0.00 C ATOM 402 C GLY A 29 -0.673 4.673 -3.092 1.00 0.00 C ATOM 403 O GLY A 29 -1.433 3.875 -2.543 1.00 0.00 O ATOM 0 H GLY A 29 1.879 2.752 -3.931 1.00 0.00 H new ATOM 0 HA2 GLY A 29 0.709 5.038 -4.684 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -0.096 3.484 -4.774 1.00 0.00 H new ATOM 407 N VAL A 30 -0.704 5.981 -2.856 1.00 0.00 N ATOM 408 CA VAL A 30 -1.656 6.566 -1.919 1.00 0.00 C ATOM 409 C VAL A 30 -3.081 6.131 -2.240 1.00 0.00 C ATOM 410 O VAL A 30 -3.480 6.082 -3.403 1.00 0.00 O ATOM 411 CB VAL A 30 -1.585 8.105 -1.935 1.00 0.00 C ATOM 412 CG1 VAL A 30 -2.561 8.695 -0.929 1.00 0.00 C ATOM 413 CG2 VAL A 30 -0.166 8.576 -1.653 1.00 0.00 C ATOM 0 H VAL A 30 -0.081 6.655 -3.301 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.385 6.207 -0.926 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.869 8.454 -2.928 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.497 9.783 -0.955 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.575 8.385 -1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.312 8.340 0.071 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.134 9.665 -1.668 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.148 8.218 -0.673 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.506 8.183 -2.416 1.00 0.00 H new ATOM 423 N VAL A 31 -3.845 5.814 -1.199 1.00 0.00 N ATOM 424 CA VAL A 31 -5.228 5.383 -1.369 1.00 0.00 C ATOM 425 C VAL A 31 -6.145 6.572 -1.631 1.00 0.00 C ATOM 426 O VAL A 31 -5.894 7.681 -1.158 1.00 0.00 O ATOM 427 CB VAL A 31 -5.735 4.621 -0.131 1.00 0.00 C ATOM 428 CG1 VAL A 31 -7.057 3.932 -0.432 1.00 0.00 C ATOM 429 CG2 VAL A 31 -4.694 3.615 0.337 1.00 0.00 C ATOM 0 H VAL A 31 -3.530 5.848 -0.230 1.00 0.00 H new ATOM 0 HA VAL A 31 -5.248 4.715 -2.230 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.902 5.338 0.673 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.400 3.399 0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.799 4.678 -0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.921 3.225 -1.250 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.068 3.085 1.213 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.494 2.900 -0.461 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.773 4.138 0.595 1.00 0.00 H new ATOM 439 N LYS A 32 -7.211 6.335 -2.388 1.00 0.00 N ATOM 440 CA LYS A 32 -8.169 7.385 -2.713 1.00 0.00 C ATOM 441 C LYS A 32 -9.416 7.273 -1.841 1.00 0.00 C ATOM 442 O LYS A 32 -9.957 8.279 -1.384 1.00 0.00 O ATOM 443 CB LYS A 32 -8.559 7.309 -4.191 1.00 0.00 C ATOM 444 CG LYS A 32 -7.370 7.205 -5.129 1.00 0.00 C ATOM 445 CD LYS A 32 -6.668 8.543 -5.290 1.00 0.00 C ATOM 446 CE LYS A 32 -5.585 8.735 -4.239 1.00 0.00 C ATOM 447 NZ LYS A 32 -5.388 10.172 -3.902 1.00 0.00 N ATOM 0 H LYS A 32 -7.433 5.424 -2.788 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.695 8.347 -2.518 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.208 6.446 -4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.140 8.194 -4.451 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.666 6.467 -4.744 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.704 6.849 -6.103 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.226 8.606 -6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.398 9.349 -5.214 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.852 8.184 -3.337 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -4.647 8.315 -4.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.642 10.261 -3.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -5.108 10.694 -4.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.276 10.566 -3.531 1.00 0.00 H new ATOM 461 N ASP A 33 -9.864 6.043 -1.613 1.00 0.00 N ATOM 462 CA ASP A 33 -11.045 5.799 -0.793 1.00 0.00 C ATOM 463 C ASP A 33 -10.977 4.424 -0.137 1.00 0.00 C ATOM 464 O ASP A 33 -10.342 3.508 -0.658 1.00 0.00 O ATOM 465 CB ASP A 33 -12.313 5.912 -1.641 1.00 0.00 C ATOM 466 CG ASP A 33 -12.301 7.132 -2.541 1.00 0.00 C ATOM 467 OD1 ASP A 33 -11.757 7.038 -3.662 1.00 0.00 O ATOM 468 OD2 ASP A 33 -12.837 8.180 -2.126 1.00 0.00 O ATOM 0 H ASP A 33 -9.427 5.200 -1.985 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.074 6.554 -0.008 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -12.420 5.015 -2.251 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -13.182 5.957 -0.985 1.00 0.00 H new ATOM 473 N ALA A 34 -11.636 4.287 1.009 1.00 0.00 N ATOM 474 CA ALA A 34 -11.651 3.024 1.735 1.00 0.00 C ATOM 475 C ALA A 34 -11.779 1.842 0.780 1.00 0.00 C ATOM 476 O ALA A 34 -11.018 0.879 0.863 1.00 0.00 O ATOM 477 CB ALA A 34 -12.786 3.011 2.749 1.00 0.00 C ATOM 0 H ALA A 34 -12.167 5.036 1.454 1.00 0.00 H new ATOM 0 HA ALA A 34 -10.703 2.928 2.265 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -12.785 2.061 3.284 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.650 3.827 3.458 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.737 3.135 2.232 1.00 0.00 H new ATOM 483 N GLU A 35 -12.748 1.924 -0.128 1.00 0.00 N ATOM 484 CA GLU A 35 -12.976 0.860 -1.098 1.00 0.00 C ATOM 485 C GLU A 35 -11.685 0.507 -1.833 1.00 0.00 C ATOM 486 O GLU A 35 -11.327 -0.664 -1.951 1.00 0.00 O ATOM 487 CB GLU A 35 -14.050 1.278 -2.104 1.00 0.00 C ATOM 488 CG GLU A 35 -15.454 1.295 -1.522 1.00 0.00 C ATOM 489 CD GLU A 35 -16.526 1.127 -2.581 1.00 0.00 C ATOM 490 OE1 GLU A 35 -16.857 -0.031 -2.912 1.00 0.00 O ATOM 491 OE2 GLU A 35 -17.034 2.153 -3.079 1.00 0.00 O ATOM 0 H GLU A 35 -13.386 2.715 -0.211 1.00 0.00 H new ATOM 0 HA GLU A 35 -13.319 -0.022 -0.557 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.812 2.271 -2.486 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.026 0.595 -2.953 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.548 0.497 -0.786 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.613 2.236 -0.995 1.00 0.00 H new ATOM 498 N GLU A 36 -10.993 1.530 -2.325 1.00 0.00 N ATOM 499 CA GLU A 36 -9.744 1.329 -3.049 1.00 0.00 C ATOM 500 C GLU A 36 -8.706 0.644 -2.164 1.00 0.00 C ATOM 501 O GLU A 36 -7.955 -0.216 -2.622 1.00 0.00 O ATOM 502 CB GLU A 36 -9.199 2.667 -3.552 1.00 0.00 C ATOM 503 CG GLU A 36 -7.930 2.535 -4.377 1.00 0.00 C ATOM 504 CD GLU A 36 -8.212 2.350 -5.856 1.00 0.00 C ATOM 505 OE1 GLU A 36 -8.572 3.345 -6.519 1.00 0.00 O ATOM 506 OE2 GLU A 36 -8.072 1.211 -6.349 1.00 0.00 O ATOM 0 H GLU A 36 -11.276 2.506 -2.235 1.00 0.00 H new ATOM 0 HA GLU A 36 -9.949 0.685 -3.904 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -9.964 3.158 -4.153 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -9.001 3.314 -2.697 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.316 3.424 -4.237 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.351 1.687 -4.012 1.00 0.00 H new ATOM 513 N ALA A 37 -8.671 1.034 -0.894 1.00 0.00 N ATOM 514 CA ALA A 37 -7.727 0.459 0.056 1.00 0.00 C ATOM 515 C ALA A 37 -7.876 -1.057 0.127 1.00 0.00 C ATOM 516 O ALA A 37 -6.886 -1.786 0.196 1.00 0.00 O ATOM 517 CB ALA A 37 -7.923 1.075 1.434 1.00 0.00 C ATOM 0 H ALA A 37 -9.286 1.746 -0.499 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.718 0.684 -0.290 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.211 0.636 2.133 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.760 2.151 1.378 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.938 0.879 1.779 1.00 0.00 H new ATOM 523 N VAL A 38 -9.119 -1.527 0.110 1.00 0.00 N ATOM 524 CA VAL A 38 -9.397 -2.957 0.172 1.00 0.00 C ATOM 525 C VAL A 38 -8.716 -3.699 -0.972 1.00 0.00 C ATOM 526 O VAL A 38 -7.956 -4.642 -0.749 1.00 0.00 O ATOM 527 CB VAL A 38 -10.911 -3.237 0.122 1.00 0.00 C ATOM 528 CG1 VAL A 38 -11.173 -4.720 -0.090 1.00 0.00 C ATOM 529 CG2 VAL A 38 -11.586 -2.745 1.393 1.00 0.00 C ATOM 0 H VAL A 38 -9.950 -0.938 0.054 1.00 0.00 H new ATOM 0 HA VAL A 38 -9.000 -3.316 1.121 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.336 -2.693 -0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.248 -4.899 -0.123 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -10.724 -5.038 -1.031 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -10.736 -5.288 0.731 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -12.655 -2.951 1.340 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.159 -3.259 2.254 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.428 -1.672 1.497 1.00 0.00 H new ATOM 539 N ARG A 39 -8.993 -3.268 -2.198 1.00 0.00 N ATOM 540 CA ARG A 39 -8.407 -3.892 -3.378 1.00 0.00 C ATOM 541 C ARG A 39 -6.888 -3.965 -3.257 1.00 0.00 C ATOM 542 O ARG A 39 -6.292 -5.030 -3.420 1.00 0.00 O ATOM 543 CB ARG A 39 -8.793 -3.114 -4.638 1.00 0.00 C ATOM 544 CG ARG A 39 -10.270 -3.208 -4.983 1.00 0.00 C ATOM 545 CD ARG A 39 -11.064 -2.079 -4.343 1.00 0.00 C ATOM 546 NE ARG A 39 -12.286 -1.781 -5.084 1.00 0.00 N ATOM 547 CZ ARG A 39 -12.308 -1.085 -6.216 1.00 0.00 C ATOM 548 NH1 ARG A 39 -11.180 -0.620 -6.733 1.00 0.00 N ATOM 549 NH2 ARG A 39 -13.460 -0.855 -6.832 1.00 0.00 N ATOM 0 H ARG A 39 -9.620 -2.489 -2.400 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.797 -4.907 -3.453 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -8.526 -2.066 -4.504 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.208 -3.487 -5.479 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -10.395 -3.174 -6.065 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -10.663 -4.167 -4.646 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -11.318 -2.350 -3.318 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -10.444 -1.184 -4.291 1.00 0.00 H new ATOM 0 HE ARG A 39 -13.171 -2.126 -4.713 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -10.292 -0.796 -6.262 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -11.199 -0.086 -7.602 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -14.330 -1.212 -6.437 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -13.476 -0.321 -7.701 1.00 0.00 H new ATOM 563 N ILE A 40 -6.267 -2.825 -2.971 1.00 0.00 N ATOM 564 CA ILE A 40 -4.818 -2.760 -2.828 1.00 0.00 C ATOM 565 C ILE A 40 -4.325 -3.741 -1.770 1.00 0.00 C ATOM 566 O ILE A 40 -3.343 -4.452 -1.977 1.00 0.00 O ATOM 567 CB ILE A 40 -4.353 -1.340 -2.453 1.00 0.00 C ATOM 568 CG1 ILE A 40 -4.846 -0.328 -3.488 1.00 0.00 C ATOM 569 CG2 ILE A 40 -2.837 -1.293 -2.339 1.00 0.00 C ATOM 570 CD1 ILE A 40 -4.728 1.110 -3.032 1.00 0.00 C ATOM 0 H ILE A 40 -6.745 -1.934 -2.834 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.393 -3.029 -3.795 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.780 -1.078 -1.485 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.277 -0.456 -4.409 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.888 -0.541 -3.725 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.523 -0.283 -2.074 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.508 -1.990 -1.568 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.391 -1.572 -3.294 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.096 1.772 -3.816 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.319 1.255 -2.128 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.683 1.341 -2.823 1.00 0.00 H new ATOM 582 N ALA A 41 -5.016 -3.774 -0.635 1.00 0.00 N ATOM 583 CA ALA A 41 -4.651 -4.670 0.455 1.00 0.00 C ATOM 584 C ALA A 41 -4.723 -6.129 0.014 1.00 0.00 C ATOM 585 O ALA A 41 -3.718 -6.839 0.023 1.00 0.00 O ATOM 586 CB ALA A 41 -5.555 -4.435 1.657 1.00 0.00 C ATOM 0 H ALA A 41 -5.831 -3.191 -0.447 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.621 -4.454 0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.271 -5.111 2.464 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.451 -3.404 1.994 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.591 -4.622 1.375 1.00 0.00 H new ATOM 592 N ARG A 42 -5.917 -6.568 -0.370 1.00 0.00 N ATOM 593 CA ARG A 42 -6.120 -7.942 -0.812 1.00 0.00 C ATOM 594 C ARG A 42 -4.970 -8.401 -1.705 1.00 0.00 C ATOM 595 O ARG A 42 -4.565 -9.562 -1.663 1.00 0.00 O ATOM 596 CB ARG A 42 -7.446 -8.068 -1.565 1.00 0.00 C ATOM 597 CG ARG A 42 -8.663 -7.751 -0.711 1.00 0.00 C ATOM 598 CD ARG A 42 -9.955 -7.954 -1.487 1.00 0.00 C ATOM 599 NE ARG A 42 -10.467 -9.315 -1.351 1.00 0.00 N ATOM 600 CZ ARG A 42 -11.465 -9.801 -2.082 1.00 0.00 C ATOM 601 NH1 ARG A 42 -12.053 -9.041 -2.995 1.00 0.00 N ATOM 602 NH2 ARG A 42 -11.874 -11.050 -1.900 1.00 0.00 N ATOM 0 H ARG A 42 -6.759 -5.992 -0.384 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.150 -8.581 0.071 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.431 -7.398 -2.425 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.539 -9.082 -1.953 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -8.664 -8.388 0.173 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.605 -6.720 -0.361 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.705 -7.247 -1.133 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.783 -7.735 -2.541 1.00 0.00 H new ATOM 0 HE ARG A 42 -10.035 -9.926 -0.657 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.740 -8.081 -3.138 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.819 -9.416 -3.555 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.423 -11.637 -1.199 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.640 -11.423 -2.461 1.00 0.00 H new ATOM 616 N GLU A 43 -4.451 -7.481 -2.512 1.00 0.00 N ATOM 617 CA GLU A 43 -3.350 -7.792 -3.415 1.00 0.00 C ATOM 618 C GLU A 43 -2.054 -8.010 -2.639 1.00 0.00 C ATOM 619 O GLU A 43 -1.395 -9.040 -2.787 1.00 0.00 O ATOM 620 CB GLU A 43 -3.163 -6.666 -4.434 1.00 0.00 C ATOM 621 CG GLU A 43 -4.005 -6.834 -5.688 1.00 0.00 C ATOM 622 CD GLU A 43 -3.344 -7.729 -6.719 1.00 0.00 C ATOM 623 OE1 GLU A 43 -3.504 -8.963 -6.621 1.00 0.00 O ATOM 624 OE2 GLU A 43 -2.668 -7.195 -7.622 1.00 0.00 O ATOM 0 H GLU A 43 -4.775 -6.515 -2.559 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.597 -8.713 -3.943 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.414 -5.716 -3.963 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.112 -6.614 -4.717 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -4.974 -7.253 -5.417 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -4.193 -5.855 -6.129 1.00 0.00 H new ATOM 631 N ILE A 44 -1.696 -7.034 -1.812 1.00 0.00 N ATOM 632 CA ILE A 44 -0.480 -7.119 -1.012 1.00 0.00 C ATOM 633 C ILE A 44 -0.464 -8.391 -0.171 1.00 0.00 C ATOM 634 O ILE A 44 0.532 -9.113 -0.136 1.00 0.00 O ATOM 635 CB ILE A 44 -0.331 -5.901 -0.082 1.00 0.00 C ATOM 636 CG1 ILE A 44 -0.263 -4.611 -0.903 1.00 0.00 C ATOM 637 CG2 ILE A 44 0.908 -6.047 0.788 1.00 0.00 C ATOM 638 CD1 ILE A 44 -0.154 -3.362 -0.058 1.00 0.00 C ATOM 0 H ILE A 44 -2.230 -6.175 -1.678 1.00 0.00 H new ATOM 0 HA ILE A 44 0.357 -7.137 -1.711 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.204 -5.850 0.569 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.594 -4.662 -1.574 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -1.153 -4.540 -1.528 1.00 0.00 H new ATOM 0 HG21 ILE A 44 0.999 -5.178 1.440 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.822 -6.948 1.395 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.792 -6.119 0.154 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -0.110 -2.487 -0.706 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.024 -3.287 0.595 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.751 -3.410 0.548 1.00 0.00 H new ATOM 650 N GLY A 45 -1.576 -8.661 0.507 1.00 0.00 N ATOM 651 CA GLY A 45 -1.669 -9.847 1.337 1.00 0.00 C ATOM 652 C GLY A 45 -1.740 -9.516 2.815 1.00 0.00 C ATOM 653 O GLY A 45 -0.737 -9.140 3.423 1.00 0.00 O ATOM 0 H GLY A 45 -2.414 -8.079 0.496 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.553 -10.417 1.053 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.805 -10.485 1.152 1.00 0.00 H new ATOM 657 N TYR A 46 -2.927 -9.654 3.394 1.00 0.00 N ATOM 658 CA TYR A 46 -3.126 -9.362 4.809 1.00 0.00 C ATOM 659 C TYR A 46 -2.242 -10.252 5.678 1.00 0.00 C ATOM 660 O TYR A 46 -1.859 -11.357 5.293 1.00 0.00 O ATOM 661 CB TYR A 46 -4.594 -9.556 5.190 1.00 0.00 C ATOM 662 CG TYR A 46 -5.518 -8.524 4.584 1.00 0.00 C ATOM 663 CD1 TYR A 46 -5.779 -7.326 5.239 1.00 0.00 C ATOM 664 CD2 TYR A 46 -6.132 -8.746 3.358 1.00 0.00 C ATOM 665 CE1 TYR A 46 -6.623 -6.381 4.690 1.00 0.00 C ATOM 666 CE2 TYR A 46 -6.976 -7.806 2.800 1.00 0.00 C ATOM 667 CZ TYR A 46 -7.219 -6.625 3.470 1.00 0.00 C ATOM 668 OH TYR A 46 -8.060 -5.686 2.919 1.00 0.00 O ATOM 0 H TYR A 46 -3.766 -9.966 2.906 1.00 0.00 H new ATOM 0 HA TYR A 46 -2.847 -8.323 4.982 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -4.915 -10.549 4.874 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -4.687 -9.522 6.276 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.314 -7.131 6.194 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.946 -9.670 2.832 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -6.815 -5.456 5.213 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -7.443 -7.994 1.845 1.00 0.00 H new ATOM 0 HH TYR A 46 -7.932 -4.826 3.372 1.00 0.00 H new ATOM 678 N PRO A 47 -1.909 -9.760 6.880 1.00 0.00 N ATOM 679 CA PRO A 47 -2.358 -8.445 7.349 1.00 0.00 C ATOM 680 C PRO A 47 -1.696 -7.301 6.589 1.00 0.00 C ATOM 681 O PRO A 47 -0.641 -7.476 5.979 1.00 0.00 O ATOM 682 CB PRO A 47 -1.931 -8.428 8.819 1.00 0.00 C ATOM 683 CG PRO A 47 -0.785 -9.377 8.892 1.00 0.00 C ATOM 684 CD PRO A 47 -1.069 -10.448 7.874 1.00 0.00 C ATOM 0 HA PRO A 47 -3.428 -8.303 7.200 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.637 -7.427 9.134 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.746 -8.741 9.472 1.00 0.00 H new ATOM 0 HG2 PRO A 47 0.155 -8.871 8.674 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.694 -9.803 9.891 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.151 -10.832 7.428 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -1.587 -11.298 8.319 1.00 0.00 H new ATOM 692 N VAL A 48 -2.322 -6.129 6.630 1.00 0.00 N ATOM 693 CA VAL A 48 -1.792 -4.955 5.946 1.00 0.00 C ATOM 694 C VAL A 48 -1.784 -3.740 6.867 1.00 0.00 C ATOM 695 O VAL A 48 -2.810 -3.376 7.439 1.00 0.00 O ATOM 696 CB VAL A 48 -2.611 -4.624 4.684 1.00 0.00 C ATOM 697 CG1 VAL A 48 -2.441 -5.714 3.636 1.00 0.00 C ATOM 698 CG2 VAL A 48 -4.079 -4.435 5.036 1.00 0.00 C ATOM 0 H VAL A 48 -3.196 -5.967 7.129 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.769 -5.193 5.654 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.239 -3.689 4.265 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.027 -5.463 2.752 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.389 -5.796 3.363 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.785 -6.665 4.041 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.643 -4.202 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.468 -5.352 5.480 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.180 -3.616 5.748 1.00 0.00 H new ATOM 708 N MET A 49 -0.618 -3.116 7.004 1.00 0.00 N ATOM 709 CA MET A 49 -0.477 -1.940 7.854 1.00 0.00 C ATOM 710 C MET A 49 -0.767 -0.664 7.069 1.00 0.00 C ATOM 711 O MET A 49 -0.352 -0.525 5.918 1.00 0.00 O ATOM 712 CB MET A 49 0.932 -1.879 8.446 1.00 0.00 C ATOM 713 CG MET A 49 1.205 -0.610 9.237 1.00 0.00 C ATOM 714 SD MET A 49 2.966 -0.269 9.418 1.00 0.00 S ATOM 715 CE MET A 49 3.560 -1.856 9.998 1.00 0.00 C ATOM 0 H MET A 49 0.242 -3.405 6.538 1.00 0.00 H new ATOM 0 HA MET A 49 -1.201 -2.019 8.665 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.082 -2.741 9.096 1.00 0.00 H new ATOM 0 HB3 MET A 49 1.660 -1.958 7.639 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.725 0.233 8.740 1.00 0.00 H new ATOM 0 HG3 MET A 49 0.753 -0.698 10.225 1.00 0.00 H new ATOM 0 HE1 MET A 49 4.557 -1.738 10.423 1.00 0.00 H new ATOM 0 HE2 MET A 49 2.883 -2.241 10.761 1.00 0.00 H new ATOM 0 HE3 MET A 49 3.602 -2.556 9.163 1.00 0.00 H new ATOM 725 N ILE A 50 -1.480 0.263 7.699 1.00 0.00 N ATOM 726 CA ILE A 50 -1.824 1.527 7.059 1.00 0.00 C ATOM 727 C ILE A 50 -1.209 2.706 7.806 1.00 0.00 C ATOM 728 O ILE A 50 -1.276 2.781 9.033 1.00 0.00 O ATOM 729 CB ILE A 50 -3.349 1.722 6.981 1.00 0.00 C ATOM 730 CG1 ILE A 50 -3.989 0.590 6.174 1.00 0.00 C ATOM 731 CG2 ILE A 50 -3.680 3.072 6.364 1.00 0.00 C ATOM 732 CD1 ILE A 50 -5.405 0.270 6.600 1.00 0.00 C ATOM 0 H ILE A 50 -1.831 0.163 8.652 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.419 1.489 6.048 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.756 1.698 7.992 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.988 0.862 5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.377 -0.307 6.273 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.762 3.195 6.316 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.252 3.866 6.975 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.264 3.124 5.358 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.795 -0.541 5.985 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.410 -0.033 7.647 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.031 1.153 6.475 1.00 0.00 H new ATOM 744 N LYS A 51 -0.612 3.627 7.057 1.00 0.00 N ATOM 745 CA LYS A 51 0.012 4.806 7.646 1.00 0.00 C ATOM 746 C LYS A 51 -0.391 6.069 6.893 1.00 0.00 C ATOM 747 O LYS A 51 -0.704 6.020 5.703 1.00 0.00 O ATOM 748 CB LYS A 51 1.535 4.659 7.639 1.00 0.00 C ATOM 749 CG LYS A 51 2.014 3.265 8.006 1.00 0.00 C ATOM 750 CD LYS A 51 3.317 2.920 7.305 1.00 0.00 C ATOM 751 CE LYS A 51 3.103 2.680 5.818 1.00 0.00 C ATOM 752 NZ LYS A 51 4.342 2.934 5.032 1.00 0.00 N ATOM 0 H LYS A 51 -0.547 3.580 6.040 1.00 0.00 H new ATOM 0 HA LYS A 51 -0.334 4.893 8.676 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.912 4.914 6.648 1.00 0.00 H new ATOM 0 HB3 LYS A 51 1.964 5.377 8.338 1.00 0.00 H new ATOM 0 HG2 LYS A 51 2.152 3.199 9.085 1.00 0.00 H new ATOM 0 HG3 LYS A 51 1.251 2.535 7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 51 4.032 3.731 7.445 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.751 2.030 7.760 1.00 0.00 H new ATOM 0 HE2 LYS A 51 2.776 1.652 5.659 1.00 0.00 H new ATOM 0 HE3 LYS A 51 2.304 3.328 5.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 4.155 2.760 4.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.640 3.922 5.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 5.097 2.298 5.359 1.00 0.00 H new ATOM 766 N ALA A 52 -0.380 7.199 7.592 1.00 0.00 N ATOM 767 CA ALA A 52 -0.741 8.475 6.988 1.00 0.00 C ATOM 768 C ALA A 52 0.422 9.052 6.188 1.00 0.00 C ATOM 769 O ALA A 52 1.457 9.410 6.750 1.00 0.00 O ATOM 770 CB ALA A 52 -1.187 9.459 8.059 1.00 0.00 C ATOM 0 H ALA A 52 -0.125 7.256 8.578 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.570 8.302 6.302 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.454 10.408 7.593 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -2.053 9.057 8.585 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.374 9.618 8.768 1.00 0.00 H new ATOM 776 N SER A 53 0.245 9.139 4.873 1.00 0.00 N ATOM 777 CA SER A 53 1.282 9.668 3.995 1.00 0.00 C ATOM 778 C SER A 53 1.863 10.961 4.560 1.00 0.00 C ATOM 779 O SER A 53 3.080 11.116 4.657 1.00 0.00 O ATOM 780 CB SER A 53 0.716 9.918 2.596 1.00 0.00 C ATOM 781 OG SER A 53 1.724 9.789 1.608 1.00 0.00 O ATOM 0 H SER A 53 -0.607 8.850 4.393 1.00 0.00 H new ATOM 0 HA SER A 53 2.081 8.929 3.929 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.088 9.211 2.394 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.282 10.917 2.549 1.00 0.00 H new ATOM 0 HG SER A 53 1.337 9.952 0.723 1.00 0.00 H new ATOM 787 N ALA A 54 0.984 11.886 4.929 1.00 0.00 N ATOM 788 CA ALA A 54 1.408 13.165 5.485 1.00 0.00 C ATOM 789 C ALA A 54 2.581 12.984 6.443 1.00 0.00 C ATOM 790 O ALA A 54 3.440 13.857 6.559 1.00 0.00 O ATOM 791 CB ALA A 54 0.245 13.844 6.194 1.00 0.00 C ATOM 0 H ALA A 54 -0.027 11.774 4.853 1.00 0.00 H new ATOM 0 HA ALA A 54 1.738 13.800 4.663 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.576 14.798 6.604 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.564 14.016 5.484 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -0.111 13.205 7.002 1.00 0.00 H new ATOM 797 N GLY A 55 2.609 11.846 7.130 1.00 0.00 N ATOM 798 CA GLY A 55 3.681 11.573 8.069 1.00 0.00 C ATOM 799 C GLY A 55 3.651 10.147 8.584 1.00 0.00 C ATOM 800 O GLY A 55 3.569 9.916 9.789 1.00 0.00 O ATOM 0 H GLY A 55 1.909 11.109 7.053 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.640 11.762 7.586 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.607 12.262 8.911 1.00 0.00 H new ATOM 804 N GLY A 56 3.717 9.187 7.666 1.00 0.00 N ATOM 805 CA GLY A 56 3.694 7.788 8.053 1.00 0.00 C ATOM 806 C GLY A 56 4.925 7.385 8.840 1.00 0.00 C ATOM 807 O GLY A 56 5.431 8.156 9.655 1.00 0.00 O ATOM 0 H GLY A 56 3.786 9.353 6.662 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.804 7.594 8.652 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.618 7.168 7.160 1.00 0.00 H new ATOM 811 N GLY A 57 5.408 6.169 8.599 1.00 0.00 N ATOM 812 CA GLY A 57 6.582 5.685 9.301 1.00 0.00 C ATOM 813 C GLY A 57 6.241 4.653 10.358 1.00 0.00 C ATOM 814 O GLY A 57 6.971 3.680 10.544 1.00 0.00 O ATOM 0 H GLY A 57 5.007 5.511 7.930 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.277 5.249 8.583 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.093 6.526 9.770 1.00 0.00 H new ATOM 818 N GLY A 58 5.128 4.866 11.053 1.00 0.00 N ATOM 819 CA GLY A 58 4.712 3.939 12.090 1.00 0.00 C ATOM 820 C GLY A 58 4.761 4.556 13.473 1.00 0.00 C ATOM 821 O GLY A 58 5.197 3.917 14.431 1.00 0.00 O ATOM 0 H GLY A 58 4.507 5.664 10.917 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.697 3.599 11.883 1.00 0.00 H new ATOM 0 HA3 GLY A 58 5.355 3.059 12.065 1.00 0.00 H new ATOM 825 N LYS A 59 4.315 5.803 13.579 1.00 0.00 N ATOM 826 CA LYS A 59 4.310 6.508 14.855 1.00 0.00 C ATOM 827 C LYS A 59 2.974 6.330 15.570 1.00 0.00 C ATOM 828 O LYS A 59 2.512 7.226 16.276 1.00 0.00 O ATOM 829 CB LYS A 59 4.590 7.997 14.640 1.00 0.00 C ATOM 830 CG LYS A 59 6.070 8.332 14.563 1.00 0.00 C ATOM 831 CD LYS A 59 6.633 8.057 13.178 1.00 0.00 C ATOM 832 CE LYS A 59 8.154 8.062 13.184 1.00 0.00 C ATOM 833 NZ LYS A 59 8.709 6.975 14.036 1.00 0.00 N ATOM 0 H LYS A 59 3.952 6.346 12.796 1.00 0.00 H new ATOM 0 HA LYS A 59 5.096 6.083 15.479 1.00 0.00 H new ATOM 0 HB2 LYS A 59 4.104 8.320 13.719 1.00 0.00 H new ATOM 0 HB3 LYS A 59 4.139 8.564 15.454 1.00 0.00 H new ATOM 0 HG2 LYS A 59 6.220 9.382 14.816 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.616 7.745 15.302 1.00 0.00 H new ATOM 0 HD2 LYS A 59 6.273 7.092 12.823 1.00 0.00 H new ATOM 0 HD3 LYS A 59 6.268 8.810 12.480 1.00 0.00 H new ATOM 0 HE2 LYS A 59 8.521 7.947 12.164 1.00 0.00 H new ATOM 0 HE3 LYS A 59 8.513 9.026 13.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.684 6.765 13.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 8.707 7.278 15.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 8.125 6.121 13.933 1.00 0.00 H new ATOM 847 N GLY A 60 2.358 5.167 15.382 1.00 0.00 N ATOM 848 CA GLY A 60 1.081 4.893 16.017 1.00 0.00 C ATOM 849 C GLY A 60 -0.037 4.703 15.011 1.00 0.00 C ATOM 850 O GLY A 60 -1.209 4.900 15.332 1.00 0.00 O ATOM 0 H GLY A 60 2.720 4.410 14.802 1.00 0.00 H new ATOM 0 HA2 GLY A 60 1.169 3.997 16.632 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.828 5.715 16.686 1.00 0.00 H new ATOM 854 N MET A 61 0.325 4.321 13.791 1.00 0.00 N ATOM 855 CA MET A 61 -0.658 4.105 12.735 1.00 0.00 C ATOM 856 C MET A 61 -1.583 2.943 13.083 1.00 0.00 C ATOM 857 O MET A 61 -1.486 2.362 14.164 1.00 0.00 O ATOM 858 CB MET A 61 0.044 3.832 11.404 1.00 0.00 C ATOM 859 CG MET A 61 0.346 2.361 11.166 1.00 0.00 C ATOM 860 SD MET A 61 1.549 1.701 12.337 1.00 0.00 S ATOM 861 CE MET A 61 0.575 0.434 13.145 1.00 0.00 C ATOM 0 H MET A 61 1.291 4.155 13.509 1.00 0.00 H new ATOM 0 HA MET A 61 -1.259 5.009 12.642 1.00 0.00 H new ATOM 0 HB2 MET A 61 -0.580 4.202 10.591 1.00 0.00 H new ATOM 0 HB3 MET A 61 0.976 4.396 11.372 1.00 0.00 H new ATOM 0 HG2 MET A 61 -0.578 1.788 11.239 1.00 0.00 H new ATOM 0 HG3 MET A 61 0.723 2.231 10.152 1.00 0.00 H new ATOM 0 HE1 MET A 61 0.528 0.638 14.215 1.00 0.00 H new ATOM 0 HE2 MET A 61 -0.433 0.431 12.731 1.00 0.00 H new ATOM 0 HE3 MET A 61 1.037 -0.540 12.981 1.00 0.00 H new ATOM 871 N ARG A 62 -2.480 2.611 12.161 1.00 0.00 N ATOM 872 CA ARG A 62 -3.424 1.520 12.371 1.00 0.00 C ATOM 873 C ARG A 62 -3.139 0.363 11.418 1.00 0.00 C ATOM 874 O ARG A 62 -2.536 0.551 10.361 1.00 0.00 O ATOM 875 CB ARG A 62 -4.859 2.013 12.177 1.00 0.00 C ATOM 876 CG ARG A 62 -5.908 1.079 12.757 1.00 0.00 C ATOM 877 CD ARG A 62 -7.299 1.690 12.684 1.00 0.00 C ATOM 878 NE ARG A 62 -7.586 2.538 13.837 1.00 0.00 N ATOM 879 CZ ARG A 62 -7.927 2.065 15.031 1.00 0.00 C ATOM 880 NH1 ARG A 62 -8.023 0.758 15.227 1.00 0.00 N ATOM 881 NH2 ARG A 62 -8.173 2.901 16.032 1.00 0.00 N ATOM 0 H ARG A 62 -2.573 3.082 11.261 1.00 0.00 H new ATOM 0 HA ARG A 62 -3.305 1.163 13.394 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.963 2.994 12.640 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.049 2.142 11.111 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.896 0.134 12.214 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.662 0.854 13.795 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.389 2.278 11.771 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.042 0.894 12.626 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.521 3.549 13.720 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.835 0.112 14.460 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.285 0.398 16.145 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -8.100 3.908 15.885 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -8.435 2.537 16.948 1.00 0.00 H new ATOM 895 N ILE A 63 -3.577 -0.832 11.799 1.00 0.00 N ATOM 896 CA ILE A 63 -3.369 -2.019 10.978 1.00 0.00 C ATOM 897 C ILE A 63 -4.678 -2.769 10.755 1.00 0.00 C ATOM 898 O ILE A 63 -5.551 -2.786 11.622 1.00 0.00 O ATOM 899 CB ILE A 63 -2.345 -2.975 11.618 1.00 0.00 C ATOM 900 CG1 ILE A 63 -1.095 -2.205 12.047 1.00 0.00 C ATOM 901 CG2 ILE A 63 -1.982 -4.088 10.648 1.00 0.00 C ATOM 902 CD1 ILE A 63 -0.125 -3.032 12.862 1.00 0.00 C ATOM 0 H ILE A 63 -4.078 -1.004 12.671 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.982 -1.675 10.019 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.793 -3.424 12.504 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.585 -1.833 11.159 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.397 -1.335 12.630 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.257 -4.755 11.115 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.879 -4.651 10.388 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.549 -3.657 9.745 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.737 -2.422 13.131 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.618 -3.383 13.769 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.206 -3.888 12.274 1.00 0.00 H new ATOM 914 N ALA A 64 -4.807 -3.389 9.586 1.00 0.00 N ATOM 915 CA ALA A 64 -6.007 -4.144 9.251 1.00 0.00 C ATOM 916 C ALA A 64 -5.662 -5.577 8.858 1.00 0.00 C ATOM 917 O ALA A 64 -4.548 -5.858 8.418 1.00 0.00 O ATOM 918 CB ALA A 64 -6.767 -3.455 8.127 1.00 0.00 C ATOM 0 H ALA A 64 -4.095 -3.383 8.856 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.643 -4.181 10.136 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.661 -4.030 7.887 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.054 -2.452 8.443 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.130 -3.389 7.245 1.00 0.00 H new ATOM 924 N TRP A 65 -6.625 -6.477 9.020 1.00 0.00 N ATOM 925 CA TRP A 65 -6.422 -7.882 8.683 1.00 0.00 C ATOM 926 C TRP A 65 -7.442 -8.346 7.649 1.00 0.00 C ATOM 927 O TRP A 65 -7.190 -9.286 6.894 1.00 0.00 O ATOM 928 CB TRP A 65 -6.520 -8.749 9.939 1.00 0.00 C ATOM 929 CG TRP A 65 -5.399 -8.521 10.907 1.00 0.00 C ATOM 930 CD1 TRP A 65 -5.216 -7.429 11.708 1.00 0.00 C ATOM 931 CD2 TRP A 65 -4.304 -9.404 11.174 1.00 0.00 C ATOM 932 NE1 TRP A 65 -4.074 -7.581 12.457 1.00 0.00 N ATOM 933 CE2 TRP A 65 -3.497 -8.784 12.149 1.00 0.00 C ATOM 934 CE3 TRP A 65 -3.928 -10.659 10.687 1.00 0.00 C ATOM 935 CZ2 TRP A 65 -2.338 -9.378 12.642 1.00 0.00 C ATOM 936 CZ3 TRP A 65 -2.778 -11.246 11.178 1.00 0.00 C ATOM 937 CH2 TRP A 65 -1.994 -10.607 12.147 1.00 0.00 C ATOM 0 H TRP A 65 -7.553 -6.260 9.382 1.00 0.00 H new ATOM 0 HA TRP A 65 -5.425 -7.987 8.255 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -7.468 -8.547 10.438 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -6.530 -9.799 9.647 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -5.873 -6.572 11.747 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -3.714 -6.907 13.133 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.526 -11.161 9.940 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -1.732 -8.886 13.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -2.478 -12.215 10.808 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -1.101 -11.093 12.511 1.00 0.00 H new ATOM 948 N ASP A 66 -8.592 -7.682 7.619 1.00 0.00 N ATOM 949 CA ASP A 66 -9.649 -8.027 6.676 1.00 0.00 C ATOM 950 C ASP A 66 -10.238 -6.772 6.037 1.00 0.00 C ATOM 951 O ASP A 66 -10.018 -5.659 6.515 1.00 0.00 O ATOM 952 CB ASP A 66 -10.751 -8.820 7.380 1.00 0.00 C ATOM 953 CG ASP A 66 -10.199 -9.807 8.390 1.00 0.00 C ATOM 954 OD1 ASP A 66 -9.315 -10.606 8.017 1.00 0.00 O ATOM 955 OD2 ASP A 66 -10.650 -9.778 9.554 1.00 0.00 O ATOM 0 H ASP A 66 -8.816 -6.902 8.237 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.214 -8.644 5.890 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -11.427 -8.129 7.884 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.340 -9.357 6.636 1.00 0.00 H new ATOM 960 N ASP A 67 -10.985 -6.961 4.955 1.00 0.00 N ATOM 961 CA ASP A 67 -11.605 -5.845 4.251 1.00 0.00 C ATOM 962 C ASP A 67 -12.289 -4.896 5.230 1.00 0.00 C ATOM 963 O ASP A 67 -12.090 -3.683 5.175 1.00 0.00 O ATOM 964 CB ASP A 67 -12.619 -6.359 3.228 1.00 0.00 C ATOM 965 CG ASP A 67 -13.769 -7.105 3.877 1.00 0.00 C ATOM 966 OD1 ASP A 67 -13.650 -8.334 4.061 1.00 0.00 O ATOM 967 OD2 ASP A 67 -14.786 -6.458 4.202 1.00 0.00 O ATOM 0 H ASP A 67 -11.176 -7.876 4.547 1.00 0.00 H new ATOM 0 HA ASP A 67 -10.820 -5.297 3.730 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -13.012 -5.518 2.656 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.115 -7.018 2.521 1.00 0.00 H new ATOM 972 N GLU A 68 -13.096 -5.458 6.125 1.00 0.00 N ATOM 973 CA GLU A 68 -13.811 -4.661 7.115 1.00 0.00 C ATOM 974 C GLU A 68 -12.847 -3.771 7.895 1.00 0.00 C ATOM 975 O GLU A 68 -13.112 -2.588 8.106 1.00 0.00 O ATOM 976 CB GLU A 68 -14.576 -5.571 8.078 1.00 0.00 C ATOM 977 CG GLU A 68 -13.679 -6.494 8.886 1.00 0.00 C ATOM 978 CD GLU A 68 -14.390 -7.758 9.329 1.00 0.00 C ATOM 979 OE1 GLU A 68 -14.424 -8.727 8.543 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.913 -7.776 10.463 1.00 0.00 O ATOM 0 H GLU A 68 -13.271 -6.461 6.185 1.00 0.00 H new ATOM 0 HA GLU A 68 -14.521 -4.024 6.588 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -15.158 -4.954 8.762 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.285 -6.173 7.510 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.808 -6.762 8.289 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.312 -5.961 9.763 1.00 0.00 H new ATOM 987 N GLU A 69 -11.729 -4.351 8.321 1.00 0.00 N ATOM 988 CA GLU A 69 -10.727 -3.611 9.079 1.00 0.00 C ATOM 989 C GLU A 69 -10.076 -2.535 8.215 1.00 0.00 C ATOM 990 O GLU A 69 -9.836 -1.416 8.670 1.00 0.00 O ATOM 991 CB GLU A 69 -9.658 -4.563 9.619 1.00 0.00 C ATOM 992 CG GLU A 69 -10.167 -5.496 10.705 1.00 0.00 C ATOM 993 CD GLU A 69 -9.058 -5.997 11.611 1.00 0.00 C ATOM 994 OE1 GLU A 69 -8.106 -5.230 11.863 1.00 0.00 O ATOM 995 OE2 GLU A 69 -9.145 -7.156 12.068 1.00 0.00 O ATOM 0 H GLU A 69 -11.495 -5.330 8.154 1.00 0.00 H new ATOM 0 HA GLU A 69 -11.228 -3.126 9.917 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.264 -5.158 8.795 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.828 -3.977 10.014 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.914 -4.976 11.305 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.666 -6.348 10.243 1.00 0.00 H new ATOM 1002 N THR A 70 -9.790 -2.882 6.964 1.00 0.00 N ATOM 1003 CA THR A 70 -9.165 -1.948 6.035 1.00 0.00 C ATOM 1004 C THR A 70 -9.982 -0.667 5.911 1.00 0.00 C ATOM 1005 O THR A 70 -9.465 0.432 6.116 1.00 0.00 O ATOM 1006 CB THR A 70 -8.997 -2.574 4.638 1.00 0.00 C ATOM 1007 OG1 THR A 70 -8.241 -3.786 4.731 1.00 0.00 O ATOM 1008 CG2 THR A 70 -8.300 -1.607 3.692 1.00 0.00 C ATOM 0 H THR A 70 -9.981 -3.803 6.571 1.00 0.00 H new ATOM 0 HA THR A 70 -8.181 -1.710 6.439 1.00 0.00 H new ATOM 0 HB THR A 70 -9.988 -2.795 4.242 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.763 -4.461 5.212 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.192 -2.071 2.712 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.893 -0.697 3.600 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.314 -1.359 4.086 1.00 0.00 H new ATOM 1016 N ARG A 71 -11.259 -0.815 5.575 1.00 0.00 N ATOM 1017 CA ARG A 71 -12.147 0.332 5.424 1.00 0.00 C ATOM 1018 C ARG A 71 -12.234 1.128 6.723 1.00 0.00 C ATOM 1019 O ARG A 71 -11.978 2.332 6.743 1.00 0.00 O ATOM 1020 CB ARG A 71 -13.542 -0.129 5.001 1.00 0.00 C ATOM 1021 CG ARG A 71 -13.548 -0.971 3.735 1.00 0.00 C ATOM 1022 CD ARG A 71 -14.905 -1.618 3.503 1.00 0.00 C ATOM 1023 NE ARG A 71 -15.163 -1.853 2.084 1.00 0.00 N ATOM 1024 CZ ARG A 71 -16.158 -2.609 1.634 1.00 0.00 C ATOM 1025 NH1 ARG A 71 -16.984 -3.201 2.487 1.00 0.00 N ATOM 1026 NH2 ARG A 71 -16.329 -2.775 0.329 1.00 0.00 N ATOM 0 H ARG A 71 -11.702 -1.717 5.402 1.00 0.00 H new ATOM 0 HA ARG A 71 -11.735 0.979 4.649 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.986 -0.705 5.812 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.174 0.746 4.848 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -13.291 -0.346 2.880 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.783 -1.744 3.807 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -14.953 -2.564 4.042 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -15.687 -0.978 3.913 1.00 0.00 H new ATOM 0 HE ARG A 71 -14.545 -1.413 1.402 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -16.856 -3.076 3.491 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -17.747 -3.781 2.139 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -15.696 -2.322 -0.330 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -17.093 -3.356 -0.015 1.00 0.00 H new ATOM 1040 N ASP A 72 -12.597 0.447 7.804 1.00 0.00 N ATOM 1041 CA ASP A 72 -12.717 1.089 9.108 1.00 0.00 C ATOM 1042 C ASP A 72 -11.417 1.787 9.492 1.00 0.00 C ATOM 1043 O ASP A 72 -11.430 2.858 10.097 1.00 0.00 O ATOM 1044 CB ASP A 72 -13.093 0.060 10.175 1.00 0.00 C ATOM 1045 CG ASP A 72 -14.588 -0.183 10.245 1.00 0.00 C ATOM 1046 OD1 ASP A 72 -15.198 -0.436 9.186 1.00 0.00 O ATOM 1047 OD2 ASP A 72 -15.148 -0.117 11.360 1.00 0.00 O ATOM 0 H ASP A 72 -12.813 -0.550 7.803 1.00 0.00 H new ATOM 0 HA ASP A 72 -13.506 1.839 9.045 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -12.585 -0.881 9.963 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -12.738 0.403 11.147 1.00 0.00 H new ATOM 1052 N GLY A 73 -10.293 1.171 9.137 1.00 0.00 N ATOM 1053 CA GLY A 73 -8.999 1.747 9.454 1.00 0.00 C ATOM 1054 C GLY A 73 -8.622 2.877 8.516 1.00 0.00 C ATOM 1055 O GLY A 73 -7.864 3.774 8.886 1.00 0.00 O ATOM 0 H GLY A 73 -10.256 0.284 8.636 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -9.011 2.118 10.479 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -8.237 0.969 9.406 1.00 0.00 H new ATOM 1059 N PHE A 74 -9.150 2.834 7.297 1.00 0.00 N ATOM 1060 CA PHE A 74 -8.863 3.860 6.302 1.00 0.00 C ATOM 1061 C PHE A 74 -9.593 5.158 6.634 1.00 0.00 C ATOM 1062 O PHE A 74 -9.090 6.251 6.370 1.00 0.00 O ATOM 1063 CB PHE A 74 -9.266 3.376 4.908 1.00 0.00 C ATOM 1064 CG PHE A 74 -9.367 4.482 3.896 1.00 0.00 C ATOM 1065 CD1 PHE A 74 -8.262 4.858 3.149 1.00 0.00 C ATOM 1066 CD2 PHE A 74 -10.567 5.144 3.691 1.00 0.00 C ATOM 1067 CE1 PHE A 74 -8.352 5.875 2.218 1.00 0.00 C ATOM 1068 CE2 PHE A 74 -10.663 6.162 2.761 1.00 0.00 C ATOM 1069 CZ PHE A 74 -9.554 6.527 2.022 1.00 0.00 C ATOM 0 H PHE A 74 -9.779 2.099 6.975 1.00 0.00 H new ATOM 0 HA PHE A 74 -7.790 4.054 6.315 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -8.537 2.643 4.562 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.226 2.865 4.973 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.320 4.351 3.296 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -11.437 4.861 4.265 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.483 6.160 1.644 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -11.604 6.671 2.612 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.627 7.320 1.293 1.00 0.00 H new ATOM 1079 N ARG A 75 -10.782 5.030 7.212 1.00 0.00 N ATOM 1080 CA ARG A 75 -11.583 6.192 7.578 1.00 0.00 C ATOM 1081 C ARG A 75 -10.959 6.934 8.756 1.00 0.00 C ATOM 1082 O ARG A 75 -10.896 8.164 8.766 1.00 0.00 O ATOM 1083 CB ARG A 75 -13.010 5.765 7.929 1.00 0.00 C ATOM 1084 CG ARG A 75 -13.735 5.068 6.790 1.00 0.00 C ATOM 1085 CD ARG A 75 -15.197 4.823 7.127 1.00 0.00 C ATOM 1086 NE ARG A 75 -15.363 3.729 8.080 1.00 0.00 N ATOM 1087 CZ ARG A 75 -16.545 3.247 8.447 1.00 0.00 C ATOM 1088 NH1 ARG A 75 -17.659 3.758 7.942 1.00 0.00 N ATOM 1089 NH2 ARG A 75 -16.614 2.250 9.320 1.00 0.00 N ATOM 0 H ARG A 75 -11.213 4.133 7.437 1.00 0.00 H new ATOM 0 HA ARG A 75 -11.613 6.865 6.721 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.979 5.098 8.791 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.580 6.645 8.227 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -13.665 5.675 5.887 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -13.246 4.118 6.574 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -15.631 5.733 7.541 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.746 4.595 6.214 1.00 0.00 H new ATOM 0 HE ARG A 75 -14.525 3.312 8.486 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.610 4.523 7.270 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -18.565 3.386 8.226 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -15.759 1.853 9.710 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -17.522 1.880 9.601 1.00 0.00 H new ATOM 1103 N LEU A 76 -10.498 6.179 9.747 1.00 0.00 N ATOM 1104 CA LEU A 76 -9.878 6.764 10.931 1.00 0.00 C ATOM 1105 C LEU A 76 -8.557 7.440 10.576 1.00 0.00 C ATOM 1106 O LEU A 76 -8.403 8.650 10.740 1.00 0.00 O ATOM 1107 CB LEU A 76 -9.645 5.689 11.993 1.00 0.00 C ATOM 1108 CG LEU A 76 -10.886 4.928 12.461 1.00 0.00 C ATOM 1109 CD1 LEU A 76 -10.490 3.744 13.330 1.00 0.00 C ATOM 1110 CD2 LEU A 76 -11.828 5.855 13.216 1.00 0.00 C ATOM 0 H LEU A 76 -10.542 5.160 9.754 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.555 7.519 11.330 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -8.928 4.968 11.600 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -9.182 6.158 12.861 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.409 4.549 11.583 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -11.386 3.214 13.654 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -9.856 3.068 12.757 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -9.944 4.100 14.203 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -12.705 5.296 13.541 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -11.315 6.264 14.086 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.139 6.669 12.562 1.00 0.00 H new ATOM 1122 N SER A 77 -7.607 6.649 10.087 1.00 0.00 N ATOM 1123 CA SER A 77 -6.298 7.170 9.710 1.00 0.00 C ATOM 1124 C SER A 77 -6.439 8.381 8.793 1.00 0.00 C ATOM 1125 O SER A 77 -5.536 9.213 8.702 1.00 0.00 O ATOM 1126 CB SER A 77 -5.473 6.084 9.017 1.00 0.00 C ATOM 1127 OG SER A 77 -5.164 5.030 9.913 1.00 0.00 O ATOM 0 H SER A 77 -7.719 5.646 9.943 1.00 0.00 H new ATOM 0 HA SER A 77 -5.783 7.482 10.619 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.027 5.691 8.164 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.551 6.516 8.627 1.00 0.00 H new ATOM 0 HG SER A 77 -5.853 4.336 9.852 1.00 0.00 H new ATOM 1133 N SER A 78 -7.578 8.472 8.114 1.00 0.00 N ATOM 1134 CA SER A 78 -7.837 9.578 7.200 1.00 0.00 C ATOM 1135 C SER A 78 -8.052 10.878 7.968 1.00 0.00 C ATOM 1136 O SER A 78 -7.356 11.867 7.740 1.00 0.00 O ATOM 1137 CB SER A 78 -9.062 9.275 6.334 1.00 0.00 C ATOM 1138 OG SER A 78 -8.727 8.413 5.261 1.00 0.00 O ATOM 0 H SER A 78 -8.336 7.793 8.180 1.00 0.00 H new ATOM 0 HA SER A 78 -6.966 9.697 6.556 1.00 0.00 H new ATOM 0 HB2 SER A 78 -9.839 8.815 6.945 1.00 0.00 H new ATOM 0 HB3 SER A 78 -9.474 10.205 5.942 1.00 0.00 H new ATOM 0 HG SER A 78 -9.126 7.531 5.413 1.00 0.00 H new ATOM 1144 N GLN A 79 -9.021 10.868 8.878 1.00 0.00 N ATOM 1145 CA GLN A 79 -9.328 12.046 9.679 1.00 0.00 C ATOM 1146 C GLN A 79 -8.070 12.595 10.345 1.00 0.00 C ATOM 1147 O GLN A 79 -7.873 13.808 10.415 1.00 0.00 O ATOM 1148 CB GLN A 79 -10.375 11.708 10.741 1.00 0.00 C ATOM 1149 CG GLN A 79 -11.616 11.032 10.179 1.00 0.00 C ATOM 1150 CD GLN A 79 -12.686 10.811 11.229 1.00 0.00 C ATOM 1151 OE1 GLN A 79 -13.853 11.147 11.023 1.00 0.00 O ATOM 1152 NE2 GLN A 79 -12.295 10.243 12.364 1.00 0.00 N ATOM 0 H GLN A 79 -9.606 10.057 9.078 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.729 12.811 9.014 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -9.924 11.056 11.489 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -10.671 12.624 11.252 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -12.024 11.642 9.373 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -11.337 10.073 9.743 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -11.318 9.980 12.493 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -12.972 10.069 13.107 1.00 0.00 H new ATOM 1161 N GLU A 80 -7.223 11.694 10.833 1.00 0.00 N ATOM 1162 CA GLU A 80 -5.985 12.089 11.494 1.00 0.00 C ATOM 1163 C GLU A 80 -5.100 12.900 10.552 1.00 0.00 C ATOM 1164 O GLU A 80 -4.919 14.104 10.735 1.00 0.00 O ATOM 1165 CB GLU A 80 -5.228 10.855 11.987 1.00 0.00 C ATOM 1166 CG GLU A 80 -5.815 10.244 13.248 1.00 0.00 C ATOM 1167 CD GLU A 80 -5.074 8.997 13.692 1.00 0.00 C ATOM 1168 OE1 GLU A 80 -3.856 9.093 13.950 1.00 0.00 O ATOM 1169 OE2 GLU A 80 -5.712 7.928 13.782 1.00 0.00 O ATOM 0 H GLU A 80 -7.372 10.686 10.783 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.243 12.713 12.349 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.223 10.103 11.198 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.189 11.127 12.175 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.790 10.982 14.050 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.862 9.997 13.074 1.00 0.00 H new ATOM 1176 N ALA A 81 -4.551 12.231 9.544 1.00 0.00 N ATOM 1177 CA ALA A 81 -3.686 12.889 8.572 1.00 0.00 C ATOM 1178 C ALA A 81 -4.313 14.184 8.066 1.00 0.00 C ATOM 1179 O ALA A 81 -3.613 15.161 7.802 1.00 0.00 O ATOM 1180 CB ALA A 81 -3.392 11.953 7.408 1.00 0.00 C ATOM 0 H ALA A 81 -4.690 11.234 9.379 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.749 13.140 9.069 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.745 12.457 6.690 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.894 11.057 7.778 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.326 11.674 6.921 1.00 0.00 H new ATOM 1186 N ALA A 82 -5.635 14.183 7.934 1.00 0.00 N ATOM 1187 CA ALA A 82 -6.356 15.358 7.462 1.00 0.00 C ATOM 1188 C ALA A 82 -6.178 16.533 8.418 1.00 0.00 C ATOM 1189 O ALA A 82 -6.145 17.689 7.997 1.00 0.00 O ATOM 1190 CB ALA A 82 -7.833 15.037 7.287 1.00 0.00 C ATOM 0 H ALA A 82 -6.228 13.381 8.147 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.941 15.644 6.496 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.359 15.924 6.934 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.947 14.234 6.559 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.253 14.723 8.243 1.00 0.00 H new ATOM 1196 N SER A 83 -6.064 16.229 9.707 1.00 0.00 N ATOM 1197 CA SER A 83 -5.894 17.260 10.724 1.00 0.00 C ATOM 1198 C SER A 83 -4.444 17.327 11.192 1.00 0.00 C ATOM 1199 O SER A 83 -3.774 18.348 11.029 1.00 0.00 O ATOM 1200 CB SER A 83 -6.814 16.988 11.915 1.00 0.00 C ATOM 1201 OG SER A 83 -6.655 17.977 12.918 1.00 0.00 O ATOM 0 H SER A 83 -6.086 15.277 10.072 1.00 0.00 H new ATOM 0 HA SER A 83 -6.159 18.220 10.281 1.00 0.00 H new ATOM 0 HB2 SER A 83 -7.851 16.968 11.580 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.594 16.005 12.331 1.00 0.00 H new ATOM 0 HG SER A 83 -7.255 17.782 13.668 1.00 0.00 H new ATOM 1207 N SER A 84 -3.965 16.232 11.773 1.00 0.00 N ATOM 1208 CA SER A 84 -2.595 16.167 12.269 1.00 0.00 C ATOM 1209 C SER A 84 -1.654 16.967 11.373 1.00 0.00 C ATOM 1210 O SER A 84 -0.928 17.844 11.842 1.00 0.00 O ATOM 1211 CB SER A 84 -2.128 14.712 12.348 1.00 0.00 C ATOM 1212 OG SER A 84 -2.132 14.105 11.067 1.00 0.00 O ATOM 0 H SER A 84 -4.505 15.378 11.912 1.00 0.00 H new ATOM 0 HA SER A 84 -2.575 16.603 13.268 1.00 0.00 H new ATOM 0 HB2 SER A 84 -1.124 14.671 12.770 1.00 0.00 H new ATOM 0 HB3 SER A 84 -2.779 14.154 13.021 1.00 0.00 H new ATOM 0 HG SER A 84 -1.219 13.844 10.826 1.00 0.00 H new ATOM 1218 N PHE A 85 -1.673 16.659 10.081 1.00 0.00 N ATOM 1219 CA PHE A 85 -0.822 17.348 9.118 1.00 0.00 C ATOM 1220 C PHE A 85 -1.641 18.296 8.248 1.00 0.00 C ATOM 1221 O PHE A 85 -1.306 19.471 8.105 1.00 0.00 O ATOM 1222 CB PHE A 85 -0.089 16.334 8.236 1.00 0.00 C ATOM 1223 CG PHE A 85 0.850 15.444 8.999 1.00 0.00 C ATOM 1224 CD1 PHE A 85 2.170 15.816 9.198 1.00 0.00 C ATOM 1225 CD2 PHE A 85 0.413 14.236 9.518 1.00 0.00 C ATOM 1226 CE1 PHE A 85 3.037 14.999 9.900 1.00 0.00 C ATOM 1227 CE2 PHE A 85 1.275 13.416 10.221 1.00 0.00 C ATOM 1228 CZ PHE A 85 2.589 13.797 10.411 1.00 0.00 C ATOM 0 H PHE A 85 -2.269 15.937 9.676 1.00 0.00 H new ATOM 0 HA PHE A 85 -0.089 17.934 9.673 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.823 15.716 7.719 1.00 0.00 H new ATOM 0 HB3 PHE A 85 0.472 16.869 7.470 1.00 0.00 H new ATOM 0 HD1 PHE A 85 2.526 16.755 8.800 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -0.613 13.932 9.371 1.00 0.00 H new ATOM 0 HE1 PHE A 85 4.063 15.301 10.048 1.00 0.00 H new ATOM 0 HE2 PHE A 85 0.921 12.478 10.622 1.00 0.00 H new ATOM 0 HZ PHE A 85 3.265 13.156 10.958 1.00 0.00 H new ATOM 1238 N GLY A 86 -2.719 17.776 7.669 1.00 0.00 N ATOM 1239 CA GLY A 86 -3.570 18.590 6.820 1.00 0.00 C ATOM 1240 C GLY A 86 -4.130 17.812 5.645 1.00 0.00 C ATOM 1241 O GLY A 86 -5.230 18.097 5.171 1.00 0.00 O ATOM 0 H GLY A 86 -3.018 16.806 7.772 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -4.393 18.990 7.412 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.000 19.442 6.449 1.00 0.00 H new ATOM 1245 N ASP A 87 -3.372 16.829 5.173 1.00 0.00 N ATOM 1246 CA ASP A 87 -3.798 16.008 4.046 1.00 0.00 C ATOM 1247 C ASP A 87 -4.339 14.665 4.526 1.00 0.00 C ATOM 1248 O ASP A 87 -3.854 14.104 5.509 1.00 0.00 O ATOM 1249 CB ASP A 87 -2.634 15.786 3.079 1.00 0.00 C ATOM 1250 CG ASP A 87 -2.483 16.921 2.085 1.00 0.00 C ATOM 1251 OD1 ASP A 87 -3.514 17.504 1.690 1.00 0.00 O ATOM 1252 OD2 ASP A 87 -1.334 17.225 1.701 1.00 0.00 O ATOM 0 H ASP A 87 -2.459 16.581 5.554 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.597 16.537 3.525 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.710 15.678 3.646 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.787 14.852 2.539 1.00 0.00 H new ATOM 1257 N ASP A 88 -5.347 14.155 3.826 1.00 0.00 N ATOM 1258 CA ASP A 88 -5.955 12.878 4.181 1.00 0.00 C ATOM 1259 C ASP A 88 -5.263 11.727 3.456 1.00 0.00 C ATOM 1260 O ASP A 88 -5.796 10.620 3.376 1.00 0.00 O ATOM 1261 CB ASP A 88 -7.446 12.886 3.842 1.00 0.00 C ATOM 1262 CG ASP A 88 -7.705 12.684 2.362 1.00 0.00 C ATOM 1263 OD1 ASP A 88 -6.892 13.168 1.546 1.00 0.00 O ATOM 1264 OD2 ASP A 88 -8.719 12.042 2.019 1.00 0.00 O ATOM 0 H ASP A 88 -5.760 14.606 3.010 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.835 12.733 5.255 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -7.948 12.100 4.406 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -7.882 13.834 4.158 1.00 0.00 H new ATOM 1269 N ARG A 89 -4.073 11.997 2.930 1.00 0.00 N ATOM 1270 CA ARG A 89 -3.309 10.985 2.210 1.00 0.00 C ATOM 1271 C ARG A 89 -2.928 9.832 3.134 1.00 0.00 C ATOM 1272 O ARG A 89 -2.367 10.043 4.210 1.00 0.00 O ATOM 1273 CB ARG A 89 -2.049 11.603 1.602 1.00 0.00 C ATOM 1274 CG ARG A 89 -2.330 12.779 0.682 1.00 0.00 C ATOM 1275 CD ARG A 89 -2.760 12.314 -0.701 1.00 0.00 C ATOM 1276 NE ARG A 89 -1.620 11.919 -1.524 1.00 0.00 N ATOM 1277 CZ ARG A 89 -0.688 12.768 -1.945 1.00 0.00 C ATOM 1278 NH1 ARG A 89 -0.761 14.051 -1.621 1.00 0.00 N ATOM 1279 NH2 ARG A 89 0.319 12.333 -2.691 1.00 0.00 N ATOM 0 H ARG A 89 -3.617 12.908 2.989 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.936 10.594 1.409 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.391 11.931 2.407 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.512 10.836 1.044 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.111 13.404 1.116 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.437 13.398 0.598 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -3.446 11.472 -0.604 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -3.307 13.115 -1.199 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.534 10.938 -1.790 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.534 14.389 -1.047 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -0.044 14.700 -1.945 1.00 0.00 H new ATOM 0 HH21 ARG A 89 0.379 11.346 -2.942 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.034 12.985 -3.014 1.00 0.00 H new ATOM 1293 N LEU A 90 -3.237 8.612 2.707 1.00 0.00 N ATOM 1294 CA LEU A 90 -2.928 7.424 3.496 1.00 0.00 C ATOM 1295 C LEU A 90 -1.954 6.516 2.753 1.00 0.00 C ATOM 1296 O LEU A 90 -1.606 6.772 1.599 1.00 0.00 O ATOM 1297 CB LEU A 90 -4.210 6.657 3.823 1.00 0.00 C ATOM 1298 CG LEU A 90 -5.134 7.304 4.856 1.00 0.00 C ATOM 1299 CD1 LEU A 90 -6.198 6.318 5.311 1.00 0.00 C ATOM 1300 CD2 LEU A 90 -4.332 7.813 6.045 1.00 0.00 C ATOM 0 H LEU A 90 -3.701 8.420 1.819 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.459 7.747 4.425 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.772 6.517 2.899 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.935 5.665 4.182 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.631 8.154 4.389 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.846 6.796 6.046 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.792 6.003 4.453 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.719 5.448 5.761 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.006 8.270 6.770 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.807 6.980 6.513 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.608 8.554 5.705 1.00 0.00 H new ATOM 1312 N LEU A 91 -1.518 5.453 3.420 1.00 0.00 N ATOM 1313 CA LEU A 91 -0.586 4.503 2.823 1.00 0.00 C ATOM 1314 C LEU A 91 -0.880 3.082 3.292 1.00 0.00 C ATOM 1315 O LEU A 91 -1.506 2.879 4.332 1.00 0.00 O ATOM 1316 CB LEU A 91 0.854 4.881 3.176 1.00 0.00 C ATOM 1317 CG LEU A 91 1.462 6.031 2.372 1.00 0.00 C ATOM 1318 CD1 LEU A 91 2.866 6.343 2.866 1.00 0.00 C ATOM 1319 CD2 LEU A 91 1.480 5.693 0.888 1.00 0.00 C ATOM 0 H LEU A 91 -1.795 5.227 4.375 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.711 4.541 1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.891 5.144 4.233 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.482 4.000 3.045 1.00 0.00 H new ATOM 0 HG LEU A 91 0.843 6.917 2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.283 7.164 2.282 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.827 6.628 3.917 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.496 5.461 2.753 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.916 6.522 0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.076 4.795 0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.461 5.519 0.542 1.00 0.00 H new ATOM 1331 N ILE A 92 -0.423 2.103 2.519 1.00 0.00 N ATOM 1332 CA ILE A 92 -0.634 0.701 2.857 1.00 0.00 C ATOM 1333 C ILE A 92 0.610 -0.130 2.562 1.00 0.00 C ATOM 1334 O ILE A 92 1.141 -0.097 1.452 1.00 0.00 O ATOM 1335 CB ILE A 92 -1.828 0.109 2.085 1.00 0.00 C ATOM 1336 CG1 ILE A 92 -3.043 1.034 2.194 1.00 0.00 C ATOM 1337 CG2 ILE A 92 -2.163 -1.279 2.610 1.00 0.00 C ATOM 1338 CD1 ILE A 92 -4.255 0.530 1.443 1.00 0.00 C ATOM 0 H ILE A 92 0.096 2.255 1.654 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.848 0.663 3.925 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.555 0.022 1.033 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.302 1.157 3.245 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.774 2.020 1.814 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.009 -1.684 2.054 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.300 -1.933 2.485 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.420 -1.216 3.667 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -5.077 1.235 1.564 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.013 0.433 0.385 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.549 -0.442 1.838 1.00 0.00 H new ATOM 1350 N GLU A 93 1.069 -0.875 3.562 1.00 0.00 N ATOM 1351 CA GLU A 93 2.250 -1.715 3.409 1.00 0.00 C ATOM 1352 C GLU A 93 2.012 -3.102 3.998 1.00 0.00 C ATOM 1353 O GLU A 93 1.155 -3.283 4.864 1.00 0.00 O ATOM 1354 CB GLU A 93 3.459 -1.063 4.083 1.00 0.00 C ATOM 1355 CG GLU A 93 4.232 -0.125 3.172 1.00 0.00 C ATOM 1356 CD GLU A 93 5.185 -0.860 2.250 1.00 0.00 C ATOM 1357 OE1 GLU A 93 5.406 -2.070 2.469 1.00 0.00 O ATOM 1358 OE2 GLU A 93 5.710 -0.227 1.311 1.00 0.00 O ATOM 0 H GLU A 93 0.641 -0.914 4.487 1.00 0.00 H new ATOM 0 HA GLU A 93 2.452 -1.822 2.343 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.121 -0.509 4.958 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.130 -1.844 4.440 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.529 0.455 2.574 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.795 0.584 3.780 1.00 0.00 H new ATOM 1365 N LYS A 94 2.777 -4.080 3.524 1.00 0.00 N ATOM 1366 CA LYS A 94 2.651 -5.451 4.003 1.00 0.00 C ATOM 1367 C LYS A 94 3.115 -5.567 5.451 1.00 0.00 C ATOM 1368 O LYS A 94 4.185 -5.075 5.812 1.00 0.00 O ATOM 1369 CB LYS A 94 3.465 -6.399 3.118 1.00 0.00 C ATOM 1370 CG LYS A 94 3.504 -7.828 3.632 1.00 0.00 C ATOM 1371 CD LYS A 94 2.162 -8.519 3.458 1.00 0.00 C ATOM 1372 CE LYS A 94 2.329 -10.017 3.256 1.00 0.00 C ATOM 1373 NZ LYS A 94 3.075 -10.649 4.379 1.00 0.00 N ATOM 0 H LYS A 94 3.491 -3.948 2.808 1.00 0.00 H new ATOM 0 HA LYS A 94 1.599 -5.731 3.954 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.044 -6.395 2.112 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.485 -6.022 3.038 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.274 -8.386 3.099 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.781 -7.829 4.686 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.541 -8.336 4.335 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.639 -8.091 2.602 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.348 -10.483 3.165 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.857 -10.200 2.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.793 -11.646 4.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.097 -10.593 4.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.857 -10.150 5.265 1.00 0.00 H new ATOM 1387 N PHE A 95 2.304 -6.219 6.277 1.00 0.00 N ATOM 1388 CA PHE A 95 2.632 -6.399 7.687 1.00 0.00 C ATOM 1389 C PHE A 95 3.112 -7.822 7.956 1.00 0.00 C ATOM 1390 O PHE A 95 2.356 -8.783 7.807 1.00 0.00 O ATOM 1391 CB PHE A 95 1.415 -6.086 8.559 1.00 0.00 C ATOM 1392 CG PHE A 95 1.664 -6.282 10.028 1.00 0.00 C ATOM 1393 CD1 PHE A 95 1.826 -7.554 10.553 1.00 0.00 C ATOM 1394 CD2 PHE A 95 1.736 -5.194 10.883 1.00 0.00 C ATOM 1395 CE1 PHE A 95 2.054 -7.737 11.903 1.00 0.00 C ATOM 1396 CE2 PHE A 95 1.964 -5.371 12.234 1.00 0.00 C ATOM 1397 CZ PHE A 95 2.125 -6.644 12.745 1.00 0.00 C ATOM 0 H PHE A 95 1.415 -6.632 5.995 1.00 0.00 H new ATOM 0 HA PHE A 95 3.438 -5.709 7.938 1.00 0.00 H new ATOM 0 HB2 PHE A 95 1.109 -5.054 8.385 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.584 -6.721 8.251 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.773 -8.412 9.899 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.612 -4.196 10.489 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.177 -8.734 12.300 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.016 -4.515 12.890 1.00 0.00 H new ATOM 0 HZ PHE A 95 2.306 -6.785 13.800 1.00 0.00 H new ATOM 1407 N ILE A 96 4.374 -7.949 8.352 1.00 0.00 N ATOM 1408 CA ILE A 96 4.956 -9.254 8.642 1.00 0.00 C ATOM 1409 C ILE A 96 5.673 -9.249 9.988 1.00 0.00 C ATOM 1410 O ILE A 96 6.702 -8.594 10.152 1.00 0.00 O ATOM 1411 CB ILE A 96 5.948 -9.685 7.546 1.00 0.00 C ATOM 1412 CG1 ILE A 96 5.409 -9.311 6.164 1.00 0.00 C ATOM 1413 CG2 ILE A 96 6.214 -11.180 7.630 1.00 0.00 C ATOM 1414 CD1 ILE A 96 6.297 -9.763 5.026 1.00 0.00 C ATOM 0 H ILE A 96 5.013 -7.164 8.479 1.00 0.00 H new ATOM 0 HA ILE A 96 4.132 -9.967 8.674 1.00 0.00 H new ATOM 0 HB ILE A 96 6.890 -9.159 7.702 1.00 0.00 H new ATOM 0 HG12 ILE A 96 4.419 -9.750 6.038 1.00 0.00 H new ATOM 0 HG13 ILE A 96 5.287 -8.229 6.111 1.00 0.00 H new ATOM 0 HG21 ILE A 96 6.917 -11.469 6.849 1.00 0.00 H new ATOM 0 HG22 ILE A 96 6.637 -11.420 8.606 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.279 -11.724 7.496 1.00 0.00 H new ATOM 0 HD11 ILE A 96 5.853 -9.464 4.077 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.280 -9.304 5.127 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.399 -10.848 5.053 1.00 0.00 H new ATOM 1426 N ASP A 97 5.123 -9.985 10.948 1.00 0.00 N ATOM 1427 CA ASP A 97 5.711 -10.068 12.280 1.00 0.00 C ATOM 1428 C ASP A 97 6.943 -10.968 12.274 1.00 0.00 C ATOM 1429 O ASP A 97 7.912 -10.715 12.988 1.00 0.00 O ATOM 1430 CB ASP A 97 4.684 -10.595 13.282 1.00 0.00 C ATOM 1431 CG ASP A 97 5.325 -11.082 14.567 1.00 0.00 C ATOM 1432 OD1 ASP A 97 5.800 -10.235 15.352 1.00 0.00 O ATOM 1433 OD2 ASP A 97 5.351 -12.311 14.788 1.00 0.00 O ATOM 0 H ASP A 97 4.271 -10.533 10.828 1.00 0.00 H new ATOM 0 HA ASP A 97 6.017 -9.065 12.579 1.00 0.00 H new ATOM 0 HB2 ASP A 97 3.968 -9.806 13.513 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.123 -11.411 12.827 1.00 0.00 H new ATOM 1438 N ASN A 98 6.897 -12.021 11.464 1.00 0.00 N ATOM 1439 CA ASN A 98 8.009 -12.960 11.367 1.00 0.00 C ATOM 1440 C ASN A 98 7.981 -13.700 10.033 1.00 0.00 C ATOM 1441 O ASN A 98 6.925 -14.082 9.528 1.00 0.00 O ATOM 1442 CB ASN A 98 7.958 -13.964 12.520 1.00 0.00 C ATOM 1443 CG ASN A 98 9.326 -14.523 12.861 1.00 0.00 C ATOM 1444 OD1 ASN A 98 10.057 -13.954 13.672 1.00 0.00 O ATOM 1445 ND2 ASN A 98 9.678 -15.643 12.241 1.00 0.00 N ATOM 0 H ASN A 98 6.102 -12.245 10.866 1.00 0.00 H new ATOM 0 HA ASN A 98 8.938 -12.392 11.429 1.00 0.00 H new ATOM 0 HB2 ASN A 98 7.536 -13.480 13.401 1.00 0.00 H new ATOM 0 HB3 ASN A 98 7.289 -14.783 12.256 1.00 0.00 H new ATOM 0 HD21 ASN A 98 10.587 -16.066 12.430 1.00 0.00 H new ATOM 0 HD22 ASN A 98 9.040 -16.080 11.576 1.00 0.00 H new ATOM 1452 N PRO A 99 9.169 -13.908 9.447 1.00 0.00 N ATOM 1453 CA PRO A 99 9.309 -14.604 8.164 1.00 0.00 C ATOM 1454 C PRO A 99 8.993 -16.092 8.275 1.00 0.00 C ATOM 1455 O PRO A 99 8.734 -16.601 9.365 1.00 0.00 O ATOM 1456 CB PRO A 99 10.782 -14.395 7.805 1.00 0.00 C ATOM 1457 CG PRO A 99 11.464 -14.186 9.113 1.00 0.00 C ATOM 1458 CD PRO A 99 10.469 -13.480 9.991 1.00 0.00 C ATOM 0 HA PRO A 99 8.616 -14.221 7.415 1.00 0.00 H new ATOM 0 HB2 PRO A 99 11.188 -15.260 7.280 1.00 0.00 H new ATOM 0 HB3 PRO A 99 10.911 -13.534 7.149 1.00 0.00 H new ATOM 0 HG2 PRO A 99 11.766 -15.137 9.552 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.368 -13.590 8.991 1.00 0.00 H new ATOM 0 HD2 PRO A 99 10.581 -13.767 11.037 1.00 0.00 H new ATOM 0 HD3 PRO A 99 10.588 -12.398 9.943 1.00 0.00 H new ATOM 1466 N ARG A 100 9.016 -16.783 7.140 1.00 0.00 N ATOM 1467 CA ARG A 100 8.731 -18.212 7.110 1.00 0.00 C ATOM 1468 C ARG A 100 9.098 -18.812 5.756 1.00 0.00 C ATOM 1469 O ARG A 100 8.923 -18.176 4.716 1.00 0.00 O ATOM 1470 CB ARG A 100 7.252 -18.466 7.408 1.00 0.00 C ATOM 1471 CG ARG A 100 6.918 -19.931 7.632 1.00 0.00 C ATOM 1472 CD ARG A 100 5.415 -20.162 7.663 1.00 0.00 C ATOM 1473 NE ARG A 100 4.831 -20.141 6.325 1.00 0.00 N ATOM 1474 CZ ARG A 100 3.529 -20.265 6.090 1.00 0.00 C ATOM 1475 NH1 ARG A 100 2.681 -20.416 7.098 1.00 0.00 N ATOM 1476 NH2 ARG A 100 3.074 -20.236 4.844 1.00 0.00 N ATOM 0 H ARG A 100 9.229 -16.376 6.229 1.00 0.00 H new ATOM 0 HA ARG A 100 9.337 -18.693 7.878 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.966 -17.898 8.293 1.00 0.00 H new ATOM 0 HB3 ARG A 100 6.653 -18.088 6.579 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.363 -20.532 6.839 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.358 -20.266 8.571 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.205 -21.122 8.135 1.00 0.00 H new ATOM 0 HD3 ARG A 100 4.943 -19.395 8.277 1.00 0.00 H new ATOM 0 HE ARG A 100 5.456 -20.025 5.528 1.00 0.00 H new ATOM 0 HH11 ARG A 100 3.027 -20.437 8.057 1.00 0.00 H new ATOM 0 HH12 ARG A 100 1.682 -20.511 6.914 1.00 0.00 H new ATOM 0 HH21 ARG A 100 3.724 -20.119 4.066 1.00 0.00 H new ATOM 0 HH22 ARG A 100 2.075 -20.331 4.664 1.00 0.00 H new ATOM 1490 N HIS A 101 9.608 -20.039 5.776 1.00 0.00 N ATOM 1491 CA HIS A 101 9.999 -20.725 4.550 1.00 0.00 C ATOM 1492 C HIS A 101 8.933 -20.560 3.471 1.00 0.00 C ATOM 1493 O HIS A 101 7.832 -20.079 3.741 1.00 0.00 O ATOM 1494 CB HIS A 101 10.238 -22.210 4.824 1.00 0.00 C ATOM 1495 CG HIS A 101 11.550 -22.492 5.490 1.00 0.00 C ATOM 1496 ND1 HIS A 101 12.739 -22.590 4.800 1.00 0.00 N ATOM 1497 CD2 HIS A 101 11.855 -22.697 6.793 1.00 0.00 C ATOM 1498 CE1 HIS A 101 13.719 -22.844 5.648 1.00 0.00 C ATOM 1499 NE2 HIS A 101 13.209 -22.913 6.865 1.00 0.00 N ATOM 0 H HIS A 101 9.760 -20.579 6.628 1.00 0.00 H new ATOM 0 HA HIS A 101 10.926 -20.276 4.192 1.00 0.00 H new ATOM 0 HB2 HIS A 101 9.432 -22.590 5.452 1.00 0.00 H new ATOM 0 HB3 HIS A 101 10.193 -22.757 3.882 1.00 0.00 H new ATOM 0 HD2 HIS A 101 11.162 -22.692 7.622 1.00 0.00 H new ATOM 0 HE1 HIS A 101 14.760 -22.973 5.391 1.00 0.00 H new ATOM 0 HE2 HIS A 101 13.736 -23.097 7.719 1.00 0.00 H new ATOM 1508 N ILE A 102 9.268 -20.961 2.249 1.00 0.00 N ATOM 1509 CA ILE A 102 8.339 -20.858 1.131 1.00 0.00 C ATOM 1510 C ILE A 102 7.244 -21.914 1.226 1.00 0.00 C ATOM 1511 O ILE A 102 7.403 -22.929 1.905 1.00 0.00 O ATOM 1512 CB ILE A 102 9.064 -21.007 -0.220 1.00 0.00 C ATOM 1513 CG1 ILE A 102 9.723 -22.384 -0.320 1.00 0.00 C ATOM 1514 CG2 ILE A 102 10.099 -19.905 -0.389 1.00 0.00 C ATOM 1515 CD1 ILE A 102 8.798 -23.460 -0.844 1.00 0.00 C ATOM 0 H ILE A 102 10.175 -21.360 2.008 1.00 0.00 H new ATOM 0 HA ILE A 102 7.890 -19.866 1.186 1.00 0.00 H new ATOM 0 HB ILE A 102 8.331 -20.917 -1.022 1.00 0.00 H new ATOM 0 HG12 ILE A 102 10.593 -22.315 -0.973 1.00 0.00 H new ATOM 0 HG13 ILE A 102 10.086 -22.676 0.665 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.603 -20.023 -1.348 1.00 0.00 H new ATOM 0 HG22 ILE A 102 9.605 -18.934 -0.356 1.00 0.00 H new ATOM 0 HG23 ILE A 102 10.831 -19.967 0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.332 -24.409 -0.888 1.00 0.00 H new ATOM 0 HD12 ILE A 102 7.940 -23.557 -0.179 1.00 0.00 H new ATOM 0 HD13 ILE A 102 8.455 -23.190 -1.843 1.00 0.00 H new ATOM 1527 N SER A 103 6.132 -21.671 0.540 1.00 0.00 N ATOM 1528 CA SER A 103 5.009 -22.601 0.548 1.00 0.00 C ATOM 1529 C SER A 103 4.162 -22.442 -0.711 1.00 0.00 C ATOM 1530 O SER A 103 4.238 -21.425 -1.399 1.00 0.00 O ATOM 1531 CB SER A 103 4.143 -22.376 1.790 1.00 0.00 C ATOM 1532 OG SER A 103 3.339 -23.511 2.062 1.00 0.00 O ATOM 0 H SER A 103 5.985 -20.837 -0.029 1.00 0.00 H new ATOM 0 HA SER A 103 5.409 -23.615 0.570 1.00 0.00 H new ATOM 0 HB2 SER A 103 4.780 -22.164 2.648 1.00 0.00 H new ATOM 0 HB3 SER A 103 3.507 -21.503 1.641 1.00 0.00 H new ATOM 0 HG SER A 103 2.796 -23.344 2.861 1.00 0.00 H new ATOM 1538 N GLY A 104 3.355 -23.457 -1.006 1.00 0.00 N ATOM 1539 CA GLY A 104 2.506 -23.411 -2.182 1.00 0.00 C ATOM 1540 C GLY A 104 1.032 -23.379 -1.831 1.00 0.00 C ATOM 1541 O GLY A 104 0.595 -23.962 -0.839 1.00 0.00 O ATOM 0 H GLY A 104 3.274 -24.310 -0.452 1.00 0.00 H new ATOM 0 HA2 GLY A 104 2.755 -22.529 -2.772 1.00 0.00 H new ATOM 0 HA3 GLY A 104 2.709 -24.281 -2.807 1.00 0.00 H new ATOM 1545 N PRO A 105 0.238 -22.682 -2.658 1.00 0.00 N ATOM 1546 CA PRO A 105 -1.208 -22.558 -2.449 1.00 0.00 C ATOM 1547 C PRO A 105 -1.943 -23.871 -2.693 1.00 0.00 C ATOM 1548 O PRO A 105 -1.644 -24.594 -3.643 1.00 0.00 O ATOM 1549 CB PRO A 105 -1.627 -21.511 -3.484 1.00 0.00 C ATOM 1550 CG PRO A 105 -0.594 -21.600 -4.554 1.00 0.00 C ATOM 1551 CD PRO A 105 0.691 -21.961 -3.859 1.00 0.00 C ATOM 0 HA PRO A 105 -1.450 -22.283 -1.422 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.622 -21.719 -3.877 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -1.659 -20.513 -3.047 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.863 -22.354 -5.294 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.498 -20.652 -5.084 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.326 -22.586 -4.487 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.271 -21.075 -3.601 1.00 0.00 H new ATOM 1559 N SER A 106 -2.906 -24.174 -1.828 1.00 0.00 N ATOM 1560 CA SER A 106 -3.683 -25.403 -1.948 1.00 0.00 C ATOM 1561 C SER A 106 -5.134 -25.170 -1.539 1.00 0.00 C ATOM 1562 O SER A 106 -5.441 -25.024 -0.356 1.00 0.00 O ATOM 1563 CB SER A 106 -3.068 -26.505 -1.084 1.00 0.00 C ATOM 1564 OG SER A 106 -3.098 -26.155 0.289 1.00 0.00 O ATOM 0 H SER A 106 -3.167 -23.586 -1.037 1.00 0.00 H new ATOM 0 HA SER A 106 -3.664 -25.716 -2.992 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.612 -27.437 -1.237 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.038 -26.683 -1.395 1.00 0.00 H new ATOM 0 HG SER A 106 -3.869 -25.575 0.462 1.00 0.00 H new ATOM 1570 N SER A 107 -6.022 -25.137 -2.527 1.00 0.00 N ATOM 1571 CA SER A 107 -7.441 -24.919 -2.271 1.00 0.00 C ATOM 1572 C SER A 107 -8.272 -25.244 -3.509 1.00 0.00 C ATOM 1573 O SER A 107 -7.761 -25.257 -4.628 1.00 0.00 O ATOM 1574 CB SER A 107 -7.687 -23.471 -1.844 1.00 0.00 C ATOM 1575 OG SER A 107 -9.053 -23.256 -1.531 1.00 0.00 O ATOM 0 H SER A 107 -5.784 -25.258 -3.511 1.00 0.00 H new ATOM 0 HA SER A 107 -7.746 -25.585 -1.464 1.00 0.00 H new ATOM 0 HB2 SER A 107 -7.070 -23.235 -0.977 1.00 0.00 H new ATOM 0 HB3 SER A 107 -7.384 -22.796 -2.644 1.00 0.00 H new ATOM 0 HG SER A 107 -9.184 -22.323 -1.259 1.00 0.00 H new ATOM 1581 N GLY A 108 -9.559 -25.506 -3.299 1.00 0.00 N ATOM 1582 CA GLY A 108 -10.441 -25.827 -4.405 1.00 0.00 C ATOM 1583 C GLY A 108 -9.816 -26.807 -5.379 1.00 0.00 C ATOM 1584 O GLY A 108 -9.790 -28.011 -5.127 1.00 0.00 O ATOM 0 H GLY A 108 -10.006 -25.501 -2.382 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -11.368 -26.247 -4.016 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -10.704 -24.911 -4.934 1.00 0.00 H new TER 1588 GLY A 108