USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 776 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 3 THR OG1 : rot 66:sc= 0.949 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.128 X(o=-0.13,f=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.401 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 1.24 K(o=1.2,f=-0.033) USER MOD Single : A 33 SER OG : rot 75:sc= -1.51 USER MOD Single : A 35 MET CE :methyl -149:sc= -0.758 (180deg=-3.7!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -110:sc= -0.671 (180deg=-2.4!) USER MOD Single : A 39 SER OG : rot -54:sc= 0.0759 USER MOD Single : A 40 SER OG : rot 180:sc= -1.1 USER MOD Single : A 41 SER OG : rot -17:sc= 0.205 USER MOD Single : A 42 GLN : amide:sc= -3.61 K(o=-3.6,f=-1.5) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.628 X(o=-0.63,f=-0.38) USER MOD Single : A 54 GLN : amide:sc= -0.584 X(o=-0.58,f=-0.98) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -1.2 K(o=-1.2,f=-0.077) USER MOD Single : A 72 SER OG : rot -47:sc= 0.189 USER MOD Single : A 78 THR OG1 : rot -72:sc= 0.0707 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -90:sc= 1.26 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -48:sc= 0.617 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -3.52 K(o=-3.5,f=-5.2!) USER MOD Single : A 105 MET CE :methyl 172:sc= -0.703 (180deg=-0.948) USER MOD Single : A 107 GLN : amide:sc= -6.42 K(o=-6.4,f=-7.8!) USER MOD Single : A 108 SER OG : rot -53:sc= 0.795 USER MOD ----------------------------------------------------------------- ATOM 31 N THR A 3 1.512 -5.372 -2.066 1.00 0.00 N ATOM 32 CA THR A 3 0.182 -5.966 -2.082 1.00 0.00 C ATOM 33 C THR A 3 -0.868 -4.978 -1.587 1.00 0.00 C ATOM 34 O THR A 3 -1.599 -5.258 -0.637 1.00 0.00 O ATOM 35 CB THR A 3 0.123 -7.237 -1.213 1.00 0.00 C ATOM 36 OG1 THR A 3 0.206 -6.887 0.173 1.00 0.00 O ATOM 37 CG2 THR A 3 1.256 -8.188 -1.570 1.00 0.00 C ATOM 0 HA THR A 3 -0.032 -6.232 -3.117 1.00 0.00 H new ATOM 0 HB THR A 3 -0.826 -7.738 -1.404 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.589 -6.374 0.429 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.195 -9.078 -0.944 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.173 -8.475 -2.618 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.213 -7.693 -1.404 1.00 0.00 H new ATOM 45 N ASP A 4 -0.937 -3.821 -2.237 1.00 0.00 N ATOM 46 CA ASP A 4 -1.900 -2.791 -1.864 1.00 0.00 C ATOM 47 C ASP A 4 -3.304 -3.164 -2.330 1.00 0.00 C ATOM 48 O ASP A 4 -4.240 -3.214 -1.532 1.00 0.00 O ATOM 49 CB ASP A 4 -1.493 -1.442 -2.460 1.00 0.00 C ATOM 50 CG ASP A 4 -2.470 -0.337 -2.113 1.00 0.00 C ATOM 51 OD1 ASP A 4 -3.033 -0.371 -0.998 1.00 0.00 O ATOM 52 OD2 ASP A 4 -2.672 0.562 -2.955 1.00 0.00 O ATOM 0 H ASP A 4 -0.338 -3.573 -3.024 1.00 0.00 H new ATOM 0 HA ASP A 4 -1.907 -2.712 -0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -0.501 -1.173 -2.098 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -1.423 -1.533 -3.544 1.00 0.00 H new ATOM 57 N ILE A 5 -3.442 -3.424 -3.625 1.00 0.00 N ATOM 58 CA ILE A 5 -4.731 -3.792 -4.197 1.00 0.00 C ATOM 59 C ILE A 5 -5.024 -5.274 -3.984 1.00 0.00 C ATOM 60 O ILE A 5 -6.137 -5.740 -4.229 1.00 0.00 O ATOM 61 CB ILE A 5 -4.788 -3.481 -5.704 1.00 0.00 C ATOM 62 CG1 ILE A 5 -6.181 -2.979 -6.091 1.00 0.00 C ATOM 63 CG2 ILE A 5 -4.420 -4.715 -6.514 1.00 0.00 C ATOM 64 CD1 ILE A 5 -6.315 -1.473 -6.043 1.00 0.00 C ATOM 0 H ILE A 5 -2.677 -3.387 -4.298 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.486 -3.197 -3.683 1.00 0.00 H new ATOM 0 HB ILE A 5 -4.065 -2.696 -5.926 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -6.416 -3.325 -7.098 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.917 -3.423 -5.421 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.465 -4.479 -7.577 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.410 -5.032 -6.255 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.121 -5.519 -6.291 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.328 -1.189 -6.329 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.111 -1.122 -5.031 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.603 -1.022 -6.734 1.00 0.00 H new ATOM 76 N LEU A 6 -4.017 -6.010 -3.525 1.00 0.00 N ATOM 77 CA LEU A 6 -4.166 -7.440 -3.276 1.00 0.00 C ATOM 78 C LEU A 6 -3.837 -7.777 -1.826 1.00 0.00 C ATOM 79 O LEU A 6 -3.575 -6.888 -1.015 1.00 0.00 O ATOM 80 CB LEU A 6 -3.261 -8.238 -4.216 1.00 0.00 C ATOM 81 CG LEU A 6 -3.971 -9.132 -5.233 1.00 0.00 C ATOM 82 CD1 LEU A 6 -4.356 -8.333 -6.469 1.00 0.00 C ATOM 83 CD2 LEU A 6 -3.089 -10.312 -5.612 1.00 0.00 C ATOM 0 H LEU A 6 -3.089 -5.640 -3.318 1.00 0.00 H new ATOM 0 HA LEU A 6 -5.205 -7.711 -3.465 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -2.627 -7.537 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.603 -8.862 -3.611 1.00 0.00 H new ATOM 0 HG LEU A 6 -4.883 -9.517 -4.776 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -4.860 -8.986 -7.182 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.025 -7.521 -6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -3.459 -7.919 -6.928 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -3.610 -10.938 -6.337 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -2.160 -9.946 -6.050 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.864 -10.899 -4.721 1.00 0.00 H new ATOM 95 N SER A 7 -3.850 -9.067 -1.506 1.00 0.00 N ATOM 96 CA SER A 7 -3.555 -9.523 -0.152 1.00 0.00 C ATOM 97 C SER A 7 -2.130 -10.059 -0.059 1.00 0.00 C ATOM 98 O SER A 7 -1.656 -10.789 -0.929 1.00 0.00 O ATOM 99 CB SER A 7 -4.548 -10.606 0.272 1.00 0.00 C ATOM 100 OG SER A 7 -5.200 -10.254 1.481 1.00 0.00 O ATOM 0 H SER A 7 -4.062 -9.815 -2.166 1.00 0.00 H new ATOM 0 HA SER A 7 -3.649 -8.671 0.521 1.00 0.00 H new ATOM 0 HB2 SER A 7 -5.288 -10.754 -0.515 1.00 0.00 H new ATOM 0 HB3 SER A 7 -4.025 -11.554 0.400 1.00 0.00 H new ATOM 0 HG SER A 7 -5.831 -10.961 1.730 1.00 0.00 H new ATOM 106 N PRO A 8 -1.429 -9.688 1.023 1.00 0.00 N ATOM 107 CA PRO A 8 -0.048 -10.120 1.258 1.00 0.00 C ATOM 108 C PRO A 8 0.047 -11.607 1.585 1.00 0.00 C ATOM 109 O PRO A 8 1.122 -12.201 1.509 1.00 0.00 O ATOM 110 CB PRO A 8 0.387 -9.279 2.461 1.00 0.00 C ATOM 111 CG PRO A 8 -0.880 -8.947 3.169 1.00 0.00 C ATOM 112 CD PRO A 8 -1.931 -8.819 2.101 1.00 0.00 C ATOM 0 HA PRO A 8 0.578 -9.983 0.376 1.00 0.00 H new ATOM 0 HB2 PRO A 8 1.068 -9.834 3.107 1.00 0.00 H new ATOM 0 HB3 PRO A 8 0.912 -8.377 2.145 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -1.143 -9.727 3.884 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.781 -8.019 3.732 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.908 -9.145 2.458 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.041 -7.787 1.767 1.00 0.00 H new ATOM 120 N SER A 9 -1.085 -12.201 1.947 1.00 0.00 N ATOM 121 CA SER A 9 -1.129 -13.618 2.289 1.00 0.00 C ATOM 122 C SER A 9 -1.557 -14.454 1.087 1.00 0.00 C ATOM 123 O SER A 9 -2.135 -15.530 1.239 1.00 0.00 O ATOM 124 CB SER A 9 -2.089 -13.854 3.457 1.00 0.00 C ATOM 125 OG SER A 9 -1.599 -13.261 4.647 1.00 0.00 O ATOM 0 H SER A 9 -1.984 -11.723 2.011 1.00 0.00 H new ATOM 0 HA SER A 9 -0.126 -13.926 2.585 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.068 -13.439 3.217 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.225 -14.925 3.610 1.00 0.00 H new ATOM 0 HG SER A 9 -2.231 -13.424 5.378 1.00 0.00 H new ATOM 131 N ASP A 10 -1.269 -13.951 -0.108 1.00 0.00 N ATOM 132 CA ASP A 10 -1.623 -14.650 -1.338 1.00 0.00 C ATOM 133 C ASP A 10 -0.419 -14.758 -2.268 1.00 0.00 C ATOM 134 O ASP A 10 -0.250 -15.757 -2.968 1.00 0.00 O ATOM 135 CB ASP A 10 -2.769 -13.928 -2.049 1.00 0.00 C ATOM 136 CG ASP A 10 -3.978 -13.739 -1.154 1.00 0.00 C ATOM 137 OD1 ASP A 10 -4.067 -14.438 -0.123 1.00 0.00 O ATOM 138 OD2 ASP A 10 -4.836 -12.894 -1.486 1.00 0.00 O ATOM 0 H ASP A 10 -0.791 -13.061 -0.251 1.00 0.00 H new ATOM 0 HA ASP A 10 -1.947 -15.657 -1.074 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -2.422 -12.955 -2.396 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -3.060 -14.496 -2.933 1.00 0.00 H new ATOM 143 N ILE A 11 0.415 -13.723 -2.270 1.00 0.00 N ATOM 144 CA ILE A 11 1.603 -13.702 -3.114 1.00 0.00 C ATOM 145 C ILE A 11 2.662 -14.671 -2.597 1.00 0.00 C ATOM 146 O ILE A 11 3.490 -15.167 -3.360 1.00 0.00 O ATOM 147 CB ILE A 11 2.212 -12.290 -3.194 1.00 0.00 C ATOM 148 CG1 ILE A 11 1.297 -11.362 -3.997 1.00 0.00 C ATOM 149 CG2 ILE A 11 3.598 -12.345 -3.818 1.00 0.00 C ATOM 150 CD1 ILE A 11 0.118 -10.842 -3.205 1.00 0.00 C ATOM 0 H ILE A 11 0.290 -12.889 -1.697 1.00 0.00 H new ATOM 0 HA ILE A 11 1.287 -14.010 -4.111 1.00 0.00 H new ATOM 0 HB ILE A 11 2.306 -11.893 -2.183 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.880 -10.517 -4.362 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.929 -11.897 -4.872 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.015 -11.339 -3.867 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.246 -12.977 -3.210 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.528 -12.759 -4.824 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.486 -10.191 -3.837 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -0.488 -11.680 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.478 -10.279 -2.344 1.00 0.00 H new ATOM 162 N ALA A 12 2.627 -14.937 -1.295 1.00 0.00 N ATOM 163 CA ALA A 12 3.581 -15.849 -0.677 1.00 0.00 C ATOM 164 C ALA A 12 3.344 -17.285 -1.135 1.00 0.00 C ATOM 165 O ALA A 12 4.285 -18.066 -1.269 1.00 0.00 O ATOM 166 CB ALA A 12 3.493 -15.756 0.839 1.00 0.00 C ATOM 0 H ALA A 12 1.949 -14.534 -0.649 1.00 0.00 H new ATOM 0 HA ALA A 12 4.583 -15.556 -0.991 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.211 -16.442 1.288 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.719 -14.737 1.155 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.486 -16.021 1.162 1.00 0.00 H new ATOM 172 N ALA A 13 2.081 -17.624 -1.374 1.00 0.00 N ATOM 173 CA ALA A 13 1.722 -18.965 -1.818 1.00 0.00 C ATOM 174 C ALA A 13 2.362 -19.287 -3.164 1.00 0.00 C ATOM 175 O ALA A 13 2.646 -20.446 -3.466 1.00 0.00 O ATOM 176 CB ALA A 13 0.209 -19.105 -1.904 1.00 0.00 C ATOM 0 H ALA A 13 1.290 -16.989 -1.268 1.00 0.00 H new ATOM 0 HA ALA A 13 2.101 -19.677 -1.085 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.045 -20.111 -2.237 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.229 -18.926 -0.922 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.184 -18.378 -2.615 1.00 0.00 H new ATOM 182 N ALA A 14 2.586 -18.254 -3.970 1.00 0.00 N ATOM 183 CA ALA A 14 3.193 -18.428 -5.284 1.00 0.00 C ATOM 184 C ALA A 14 4.714 -18.466 -5.184 1.00 0.00 C ATOM 185 O ALA A 14 5.364 -19.326 -5.780 1.00 0.00 O ATOM 186 CB ALA A 14 2.751 -17.313 -6.221 1.00 0.00 C ATOM 0 H ALA A 14 2.356 -17.288 -3.736 1.00 0.00 H new ATOM 0 HA ALA A 14 2.857 -19.383 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.212 -17.455 -7.199 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.666 -17.333 -6.325 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.058 -16.351 -5.812 1.00 0.00 H new ATOM 192 N LEU A 15 5.277 -17.528 -4.429 1.00 0.00 N ATOM 193 CA LEU A 15 6.723 -17.454 -4.252 1.00 0.00 C ATOM 194 C LEU A 15 7.271 -18.765 -3.698 1.00 0.00 C ATOM 195 O LEU A 15 8.448 -19.081 -3.874 1.00 0.00 O ATOM 196 CB LEU A 15 7.083 -16.301 -3.315 1.00 0.00 C ATOM 197 CG LEU A 15 6.799 -14.894 -3.842 1.00 0.00 C ATOM 198 CD1 LEU A 15 7.201 -13.847 -2.814 1.00 0.00 C ATOM 199 CD2 LEU A 15 7.529 -14.660 -5.157 1.00 0.00 C ATOM 0 H LEU A 15 4.754 -16.809 -3.930 1.00 0.00 H new ATOM 0 HA LEU A 15 7.175 -17.276 -5.228 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.537 -16.434 -2.381 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.144 -16.371 -3.077 1.00 0.00 H new ATOM 0 HG LEU A 15 5.728 -14.804 -4.022 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.991 -12.852 -3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.634 -14.002 -1.896 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.266 -13.936 -2.601 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.316 -13.654 -5.518 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.602 -14.770 -5.002 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.193 -15.389 -5.895 1.00 0.00 H new ATOM 211 N ARG A 16 6.411 -19.525 -3.029 1.00 0.00 N ATOM 212 CA ARG A 16 6.809 -20.803 -2.450 1.00 0.00 C ATOM 213 C ARG A 16 6.506 -21.952 -3.408 1.00 0.00 C ATOM 214 O ARG A 16 7.382 -22.758 -3.721 1.00 0.00 O ATOM 215 CB ARG A 16 6.089 -21.031 -1.120 1.00 0.00 C ATOM 216 CG ARG A 16 6.840 -21.949 -0.170 1.00 0.00 C ATOM 217 CD ARG A 16 6.565 -23.413 -0.476 1.00 0.00 C ATOM 218 NE ARG A 16 5.189 -23.788 -0.162 1.00 0.00 N ATOM 219 CZ ARG A 16 4.616 -24.906 -0.593 1.00 0.00 C ATOM 220 NH1 ARG A 16 5.296 -25.755 -1.351 1.00 0.00 N ATOM 221 NH2 ARG A 16 3.359 -25.178 -0.265 1.00 0.00 N ATOM 0 H ARG A 16 5.433 -19.278 -2.874 1.00 0.00 H new ATOM 0 HA ARG A 16 7.884 -20.774 -2.273 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.931 -20.069 -0.633 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.104 -21.454 -1.318 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.910 -21.755 -0.245 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.548 -21.730 0.857 1.00 0.00 H new ATOM 0 HD2 ARG A 16 6.762 -23.606 -1.531 1.00 0.00 H new ATOM 0 HD3 ARG A 16 7.251 -24.038 0.096 1.00 0.00 H new ATOM 0 HE ARG A 16 4.638 -23.157 0.420 1.00 0.00 H new ATOM 0 HH11 ARG A 16 6.262 -25.551 -1.605 1.00 0.00 H new ATOM 0 HH12 ARG A 16 4.853 -26.613 -1.680 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.832 -24.528 0.319 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.920 -26.037 -0.597 1.00 0.00 H new ATOM 235 N ASP A 17 5.262 -22.019 -3.868 1.00 0.00 N ATOM 236 CA ASP A 17 4.844 -23.068 -4.790 1.00 0.00 C ATOM 237 C ASP A 17 5.662 -23.019 -6.077 1.00 0.00 C ATOM 238 O ASP A 17 5.725 -23.997 -6.822 1.00 0.00 O ATOM 239 CB ASP A 17 3.355 -22.931 -5.112 1.00 0.00 C ATOM 240 CG ASP A 17 2.738 -24.238 -5.567 1.00 0.00 C ATOM 241 OD1 ASP A 17 2.997 -25.274 -4.919 1.00 0.00 O ATOM 242 OD2 ASP A 17 1.996 -24.227 -6.572 1.00 0.00 O ATOM 0 H ASP A 17 4.525 -21.359 -3.618 1.00 0.00 H new ATOM 0 HA ASP A 17 5.016 -24.030 -4.308 1.00 0.00 H new ATOM 0 HB2 ASP A 17 2.827 -22.572 -4.229 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.222 -22.180 -5.890 1.00 0.00 H new ATOM 247 N CYS A 18 6.285 -21.874 -6.332 1.00 0.00 N ATOM 248 CA CYS A 18 7.098 -21.695 -7.530 1.00 0.00 C ATOM 249 C CYS A 18 8.509 -21.244 -7.168 1.00 0.00 C ATOM 250 O CYS A 18 9.192 -20.609 -7.970 1.00 0.00 O ATOM 251 CB CYS A 18 6.448 -20.675 -8.466 1.00 0.00 C ATOM 252 SG CYS A 18 4.686 -20.960 -8.759 1.00 0.00 S ATOM 0 H CYS A 18 6.243 -21.055 -5.725 1.00 0.00 H new ATOM 0 HA CYS A 18 7.163 -22.656 -8.041 1.00 0.00 H new ATOM 0 HB2 CYS A 18 6.579 -19.678 -8.046 1.00 0.00 H new ATOM 0 HB3 CYS A 18 6.971 -20.690 -9.422 1.00 0.00 H new ATOM 0 HG CYS A 18 4.226 -20.046 -9.560 1.00 0.00 H new ATOM 258 N GLN A 19 8.937 -21.576 -5.954 1.00 0.00 N ATOM 259 CA GLN A 19 10.266 -21.203 -5.485 1.00 0.00 C ATOM 260 C GLN A 19 11.348 -21.875 -6.323 1.00 0.00 C ATOM 261 O GLN A 19 12.479 -21.396 -6.395 1.00 0.00 O ATOM 262 CB GLN A 19 10.436 -21.582 -4.013 1.00 0.00 C ATOM 263 CG GLN A 19 11.364 -20.652 -3.248 1.00 0.00 C ATOM 264 CD GLN A 19 11.399 -20.954 -1.763 1.00 0.00 C ATOM 265 OE1 GLN A 19 12.341 -21.572 -1.266 1.00 0.00 O ATOM 266 NE2 GLN A 19 10.370 -20.520 -1.045 1.00 0.00 N ATOM 0 H GLN A 19 8.383 -22.102 -5.278 1.00 0.00 H new ATOM 0 HA GLN A 19 10.370 -20.123 -5.589 1.00 0.00 H new ATOM 0 HB2 GLN A 19 9.458 -21.583 -3.531 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.823 -22.599 -3.951 1.00 0.00 H new ATOM 0 HG2 GLN A 19 12.372 -20.735 -3.655 1.00 0.00 H new ATOM 0 HG3 GLN A 19 11.043 -19.621 -3.398 1.00 0.00 H new ATOM 0 HE21 GLN A 19 9.610 -20.012 -1.498 1.00 0.00 H new ATOM 0 HE22 GLN A 19 10.339 -20.695 -0.041 1.00 0.00 H new ATOM 275 N ALA A 20 10.993 -22.990 -6.955 1.00 0.00 N ATOM 276 CA ALA A 20 11.934 -23.727 -7.789 1.00 0.00 C ATOM 277 C ALA A 20 12.305 -22.930 -9.035 1.00 0.00 C ATOM 278 O ALA A 20 11.602 -22.005 -9.441 1.00 0.00 O ATOM 279 CB ALA A 20 11.347 -25.076 -8.179 1.00 0.00 C ATOM 0 H ALA A 20 10.061 -23.402 -6.905 1.00 0.00 H new ATOM 0 HA ALA A 20 12.843 -23.891 -7.211 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.060 -25.617 -8.802 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.138 -25.656 -7.280 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.422 -24.923 -8.735 1.00 0.00 H new ATOM 285 N PRO A 21 13.437 -23.294 -9.656 1.00 0.00 N ATOM 286 CA PRO A 21 13.927 -22.624 -10.864 1.00 0.00 C ATOM 287 C PRO A 21 13.052 -22.909 -12.080 1.00 0.00 C ATOM 288 O PRO A 21 12.653 -24.050 -12.316 1.00 0.00 O ATOM 289 CB PRO A 21 15.323 -23.221 -11.059 1.00 0.00 C ATOM 290 CG PRO A 21 15.263 -24.551 -10.390 1.00 0.00 C ATOM 291 CD PRO A 21 14.324 -24.388 -9.227 1.00 0.00 C ATOM 0 HA PRO A 21 13.923 -21.539 -10.758 1.00 0.00 H new ATOM 0 HB2 PRO A 21 15.567 -23.321 -12.117 1.00 0.00 H new ATOM 0 HB3 PRO A 21 16.090 -22.588 -10.613 1.00 0.00 H new ATOM 0 HG2 PRO A 21 14.904 -25.317 -11.077 1.00 0.00 H new ATOM 0 HG3 PRO A 21 16.251 -24.863 -10.053 1.00 0.00 H new ATOM 0 HD2 PRO A 21 13.766 -25.303 -9.029 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.859 -24.136 -8.311 1.00 0.00 H new ATOM 299 N ASP A 22 12.759 -21.866 -12.849 1.00 0.00 N ATOM 300 CA ASP A 22 11.932 -22.005 -14.043 1.00 0.00 C ATOM 301 C ASP A 22 10.531 -22.489 -13.680 1.00 0.00 C ATOM 302 O ASP A 22 9.801 -23.000 -14.529 1.00 0.00 O ATOM 303 CB ASP A 22 12.581 -22.977 -15.029 1.00 0.00 C ATOM 304 CG ASP A 22 11.950 -22.913 -16.406 1.00 0.00 C ATOM 305 OD1 ASP A 22 11.172 -21.970 -16.658 1.00 0.00 O ATOM 306 OD2 ASP A 22 12.233 -23.807 -17.231 1.00 0.00 O ATOM 0 H ASP A 22 13.081 -20.915 -12.667 1.00 0.00 H new ATOM 0 HA ASP A 22 11.848 -21.025 -14.513 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.645 -22.752 -15.109 1.00 0.00 H new ATOM 0 HB3 ASP A 22 12.498 -23.992 -14.641 1.00 0.00 H new ATOM 311 N SER A 23 10.163 -22.326 -12.413 1.00 0.00 N ATOM 312 CA SER A 23 8.852 -22.750 -11.937 1.00 0.00 C ATOM 313 C SER A 23 7.941 -21.548 -11.710 1.00 0.00 C ATOM 314 O SER A 23 6.719 -21.683 -11.649 1.00 0.00 O ATOM 315 CB SER A 23 8.992 -23.551 -10.641 1.00 0.00 C ATOM 316 OG SER A 23 7.795 -24.248 -10.341 1.00 0.00 O ATOM 0 H SER A 23 10.755 -21.903 -11.698 1.00 0.00 H new ATOM 0 HA SER A 23 8.403 -23.384 -12.701 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.815 -24.259 -10.735 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.241 -22.879 -9.820 1.00 0.00 H new ATOM 0 HG SER A 23 7.910 -24.753 -9.509 1.00 0.00 H new ATOM 322 N PHE A 24 8.546 -20.371 -11.584 1.00 0.00 N ATOM 323 CA PHE A 24 7.790 -19.143 -11.363 1.00 0.00 C ATOM 324 C PHE A 24 7.550 -18.408 -12.677 1.00 0.00 C ATOM 325 O PHE A 24 8.403 -18.405 -13.565 1.00 0.00 O ATOM 326 CB PHE A 24 8.533 -18.232 -10.383 1.00 0.00 C ATOM 327 CG PHE A 24 7.930 -16.862 -10.264 1.00 0.00 C ATOM 328 CD1 PHE A 24 6.595 -16.706 -9.925 1.00 0.00 C ATOM 329 CD2 PHE A 24 8.697 -15.731 -10.490 1.00 0.00 C ATOM 330 CE1 PHE A 24 6.037 -15.446 -9.814 1.00 0.00 C ATOM 331 CE2 PHE A 24 8.144 -14.469 -10.380 1.00 0.00 C ATOM 332 CZ PHE A 24 6.812 -14.326 -10.043 1.00 0.00 C ATOM 0 H PHE A 24 9.557 -20.242 -11.631 1.00 0.00 H new ATOM 0 HA PHE A 24 6.823 -19.412 -10.937 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.544 -18.702 -9.400 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.571 -18.137 -10.703 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.984 -17.578 -9.746 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.739 -15.836 -10.755 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.996 -15.338 -9.548 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.753 -13.595 -10.557 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.378 -13.341 -9.959 1.00 0.00 H new ATOM 342 N SER A 25 6.382 -17.784 -12.795 1.00 0.00 N ATOM 343 CA SER A 25 6.026 -17.048 -14.002 1.00 0.00 C ATOM 344 C SER A 25 4.932 -16.025 -13.712 1.00 0.00 C ATOM 345 O SER A 25 4.192 -16.130 -12.735 1.00 0.00 O ATOM 346 CB SER A 25 5.561 -18.013 -15.095 1.00 0.00 C ATOM 347 OG SER A 25 6.008 -19.332 -14.834 1.00 0.00 O ATOM 0 H SER A 25 5.666 -17.774 -12.069 1.00 0.00 H new ATOM 0 HA SER A 25 6.913 -16.517 -14.349 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.473 -18.000 -15.157 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.940 -17.682 -16.062 1.00 0.00 H new ATOM 0 HG SER A 25 5.697 -19.930 -15.546 1.00 0.00 H new ATOM 353 N PRO A 26 4.828 -15.009 -14.582 1.00 0.00 N ATOM 354 CA PRO A 26 3.827 -13.947 -14.442 1.00 0.00 C ATOM 355 C PRO A 26 2.411 -14.446 -14.704 1.00 0.00 C ATOM 356 O PRO A 26 1.459 -14.018 -14.050 1.00 0.00 O ATOM 357 CB PRO A 26 4.240 -12.928 -15.507 1.00 0.00 C ATOM 358 CG PRO A 26 4.979 -13.725 -16.527 1.00 0.00 C ATOM 359 CD PRO A 26 5.677 -14.821 -15.770 1.00 0.00 C ATOM 0 HA PRO A 26 3.802 -13.542 -13.431 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.370 -12.436 -15.943 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.870 -12.146 -15.083 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.296 -14.137 -17.270 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.696 -13.103 -17.064 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.749 -15.734 -16.361 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.693 -14.537 -15.497 1.00 0.00 H new ATOM 367 N LYS A 27 2.277 -15.355 -15.664 1.00 0.00 N ATOM 368 CA LYS A 27 0.976 -15.915 -16.012 1.00 0.00 C ATOM 369 C LYS A 27 0.713 -17.203 -15.237 1.00 0.00 C ATOM 370 O LYS A 27 0.045 -18.111 -15.731 1.00 0.00 O ATOM 371 CB LYS A 27 0.901 -16.188 -17.516 1.00 0.00 C ATOM 372 CG LYS A 27 1.848 -17.279 -17.984 1.00 0.00 C ATOM 373 CD LYS A 27 1.549 -17.703 -19.412 1.00 0.00 C ATOM 374 CE LYS A 27 1.865 -16.591 -20.401 1.00 0.00 C ATOM 375 NZ LYS A 27 2.126 -17.122 -21.768 1.00 0.00 N ATOM 0 H LYS A 27 3.054 -15.720 -16.215 1.00 0.00 H new ATOM 0 HA LYS A 27 0.211 -15.187 -15.742 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.120 -16.469 -17.775 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.125 -15.268 -18.055 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.876 -16.923 -17.917 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.766 -18.142 -17.323 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.134 -18.589 -19.660 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.498 -17.980 -19.498 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.032 -15.889 -20.437 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.736 -16.034 -20.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.337 -16.333 -22.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.937 -17.772 -21.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.286 -17.632 -22.109 1.00 0.00 H new ATOM 389 N LYS A 28 1.241 -17.274 -14.020 1.00 0.00 N ATOM 390 CA LYS A 28 1.062 -18.448 -13.175 1.00 0.00 C ATOM 391 C LYS A 28 0.680 -18.044 -11.755 1.00 0.00 C ATOM 392 O LYS A 28 -0.167 -18.677 -11.125 1.00 0.00 O ATOM 393 CB LYS A 28 2.343 -19.285 -13.151 1.00 0.00 C ATOM 394 CG LYS A 28 2.384 -20.365 -14.219 1.00 0.00 C ATOM 395 CD LYS A 28 1.427 -21.501 -13.900 1.00 0.00 C ATOM 396 CE LYS A 28 1.984 -22.411 -12.816 1.00 0.00 C ATOM 397 NZ LYS A 28 2.802 -23.517 -13.387 1.00 0.00 N ATOM 0 H LYS A 28 1.797 -16.531 -13.597 1.00 0.00 H new ATOM 0 HA LYS A 28 0.252 -19.046 -13.594 1.00 0.00 H new ATOM 0 HB2 LYS A 28 3.201 -18.625 -13.280 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.444 -19.751 -12.171 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.127 -19.932 -15.186 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.398 -20.755 -14.304 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.470 -21.092 -13.577 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.237 -22.082 -14.802 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.594 -21.825 -12.128 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.162 -22.830 -12.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.164 -24.115 -12.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.213 -24.091 -14.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.601 -23.118 -13.920 1.00 0.00 H new ATOM 411 N PHE A 29 1.310 -16.985 -11.257 1.00 0.00 N ATOM 412 CA PHE A 29 1.036 -16.495 -9.911 1.00 0.00 C ATOM 413 C PHE A 29 -0.209 -15.613 -9.896 1.00 0.00 C ATOM 414 O PHE A 29 -0.837 -15.423 -8.854 1.00 0.00 O ATOM 415 CB PHE A 29 2.236 -15.712 -9.375 1.00 0.00 C ATOM 416 CG PHE A 29 2.240 -14.267 -9.785 1.00 0.00 C ATOM 417 CD1 PHE A 29 2.426 -13.910 -11.111 1.00 0.00 C ATOM 418 CD2 PHE A 29 2.058 -13.266 -8.845 1.00 0.00 C ATOM 419 CE1 PHE A 29 2.431 -12.581 -11.491 1.00 0.00 C ATOM 420 CE2 PHE A 29 2.061 -11.935 -9.219 1.00 0.00 C ATOM 421 CZ PHE A 29 2.247 -11.592 -10.544 1.00 0.00 C ATOM 0 H PHE A 29 2.014 -16.450 -11.765 1.00 0.00 H new ATOM 0 HA PHE A 29 0.857 -17.357 -9.268 1.00 0.00 H new ATOM 0 HB2 PHE A 29 2.243 -15.773 -8.287 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.154 -16.184 -9.726 1.00 0.00 H new ATOM 0 HD1 PHE A 29 2.569 -14.679 -11.856 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.912 -13.528 -7.808 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.579 -12.316 -12.527 1.00 0.00 H new ATOM 0 HE2 PHE A 29 1.918 -11.164 -8.476 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.249 -10.553 -10.839 1.00 0.00 H new ATOM 431 N PHE A 30 -0.560 -15.075 -11.060 1.00 0.00 N ATOM 432 CA PHE A 30 -1.728 -14.211 -11.182 1.00 0.00 C ATOM 433 C PHE A 30 -2.966 -14.884 -10.595 1.00 0.00 C ATOM 434 O PHE A 30 -3.846 -14.219 -10.051 1.00 0.00 O ATOM 435 CB PHE A 30 -1.975 -13.855 -12.649 1.00 0.00 C ATOM 436 CG PHE A 30 -2.605 -14.967 -13.438 1.00 0.00 C ATOM 437 CD1 PHE A 30 -1.911 -16.142 -13.680 1.00 0.00 C ATOM 438 CD2 PHE A 30 -3.890 -14.837 -13.939 1.00 0.00 C ATOM 439 CE1 PHE A 30 -2.488 -17.168 -14.405 1.00 0.00 C ATOM 440 CE2 PHE A 30 -4.472 -15.859 -14.664 1.00 0.00 C ATOM 441 CZ PHE A 30 -3.770 -17.025 -14.899 1.00 0.00 C ATOM 0 H PHE A 30 -0.052 -15.222 -11.932 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.532 -13.297 -10.622 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.618 -12.976 -12.698 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -1.027 -13.583 -13.113 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -0.908 -16.257 -13.298 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -4.443 -13.927 -13.761 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.937 -18.080 -14.585 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -5.476 -15.746 -15.047 1.00 0.00 H new ATOM 0 HZ PHE A 30 -4.223 -17.824 -15.468 1.00 0.00 H new ATOM 451 N GLN A 31 -3.024 -16.207 -10.711 1.00 0.00 N ATOM 452 CA GLN A 31 -4.153 -16.970 -10.194 1.00 0.00 C ATOM 453 C GLN A 31 -3.975 -17.268 -8.709 1.00 0.00 C ATOM 454 O GLN A 31 -4.949 -17.345 -7.960 1.00 0.00 O ATOM 455 CB GLN A 31 -4.313 -18.277 -10.973 1.00 0.00 C ATOM 456 CG GLN A 31 -3.365 -19.375 -10.518 1.00 0.00 C ATOM 457 CD GLN A 31 -3.139 -20.429 -11.585 1.00 0.00 C ATOM 458 OE1 GLN A 31 -4.087 -21.026 -12.095 1.00 0.00 O ATOM 459 NE2 GLN A 31 -1.878 -20.663 -11.927 1.00 0.00 N ATOM 0 H GLN A 31 -2.302 -16.772 -11.158 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.053 -16.368 -10.320 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.340 -18.629 -10.870 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.148 -18.082 -12.033 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -2.408 -18.932 -10.241 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -3.767 -19.850 -9.623 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -1.123 -20.144 -11.478 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -1.664 -21.361 -12.639 1.00 0.00 H new ATOM 468 N ILE A 32 -2.725 -17.434 -8.290 1.00 0.00 N ATOM 469 CA ILE A 32 -2.419 -17.723 -6.895 1.00 0.00 C ATOM 470 C ILE A 32 -2.621 -16.490 -6.021 1.00 0.00 C ATOM 471 O ILE A 32 -3.436 -16.496 -5.099 1.00 0.00 O ATOM 472 CB ILE A 32 -0.973 -18.226 -6.727 1.00 0.00 C ATOM 473 CG1 ILE A 32 -0.768 -19.525 -7.509 1.00 0.00 C ATOM 474 CG2 ILE A 32 -0.651 -18.432 -5.254 1.00 0.00 C ATOM 475 CD1 ILE A 32 0.635 -19.689 -8.050 1.00 0.00 C ATOM 0 H ILE A 32 -1.908 -17.373 -8.897 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.106 -18.507 -6.578 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.293 -17.473 -7.125 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.000 -20.370 -6.861 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.475 -19.556 -8.338 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.374 -18.788 -5.152 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.762 -17.487 -4.722 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.334 -19.169 -4.832 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.708 -20.631 -8.593 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.864 -18.863 -8.724 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.346 -19.691 -7.224 1.00 0.00 H new ATOM 487 N SER A 33 -1.874 -15.431 -6.319 1.00 0.00 N ATOM 488 CA SER A 33 -1.969 -14.190 -5.560 1.00 0.00 C ATOM 489 C SER A 33 -3.386 -13.628 -5.614 1.00 0.00 C ATOM 490 O SER A 33 -3.955 -13.250 -4.590 1.00 0.00 O ATOM 491 CB SER A 33 -0.978 -13.159 -6.103 1.00 0.00 C ATOM 492 OG SER A 33 0.334 -13.692 -6.158 1.00 0.00 O ATOM 0 H SER A 33 -1.196 -15.408 -7.081 1.00 0.00 H new ATOM 0 HA SER A 33 -1.723 -14.408 -4.521 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.287 -12.842 -7.099 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.987 -12.272 -5.469 1.00 0.00 H new ATOM 0 HG SER A 33 0.403 -14.314 -6.912 1.00 0.00 H new ATOM 498 N GLY A 34 -3.950 -13.575 -6.816 1.00 0.00 N ATOM 499 CA GLY A 34 -5.296 -13.058 -6.983 1.00 0.00 C ATOM 500 C GLY A 34 -5.349 -11.873 -7.927 1.00 0.00 C ATOM 501 O GLY A 34 -6.282 -11.072 -7.876 1.00 0.00 O ATOM 0 H GLY A 34 -3.499 -13.881 -7.678 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.942 -13.850 -7.362 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.692 -12.762 -6.011 1.00 0.00 H new ATOM 505 N MET A 35 -4.344 -11.760 -8.790 1.00 0.00 N ATOM 506 CA MET A 35 -4.281 -10.664 -9.749 1.00 0.00 C ATOM 507 C MET A 35 -5.339 -10.830 -10.835 1.00 0.00 C ATOM 508 O MET A 35 -5.776 -9.853 -11.443 1.00 0.00 O ATOM 509 CB MET A 35 -2.890 -10.593 -10.383 1.00 0.00 C ATOM 510 CG MET A 35 -1.849 -9.935 -9.491 1.00 0.00 C ATOM 511 SD MET A 35 -0.735 -8.853 -10.407 1.00 0.00 S ATOM 512 CE MET A 35 -0.352 -9.881 -11.822 1.00 0.00 C ATOM 0 H MET A 35 -3.563 -12.414 -8.844 1.00 0.00 H new ATOM 0 HA MET A 35 -4.477 -9.735 -9.214 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.560 -11.602 -10.629 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.955 -10.041 -11.321 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.353 -9.359 -8.715 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.267 -10.707 -8.987 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.657 -9.659 -12.171 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.414 -10.931 -11.536 1.00 0.00 H new ATOM 0 HE3 MET A 35 -1.065 -9.680 -12.622 1.00 0.00 H new ATOM 522 N SER A 36 -5.747 -12.072 -11.073 1.00 0.00 N ATOM 523 CA SER A 36 -6.752 -12.365 -12.088 1.00 0.00 C ATOM 524 C SER A 36 -8.006 -11.525 -11.871 1.00 0.00 C ATOM 525 O SER A 36 -8.682 -11.137 -12.824 1.00 0.00 O ATOM 526 CB SER A 36 -7.111 -13.852 -12.067 1.00 0.00 C ATOM 527 OG SER A 36 -8.434 -14.065 -12.526 1.00 0.00 O ATOM 0 H SER A 36 -5.397 -12.892 -10.577 1.00 0.00 H new ATOM 0 HA SER A 36 -6.332 -12.113 -13.062 1.00 0.00 H new ATOM 0 HB2 SER A 36 -6.412 -14.407 -12.693 1.00 0.00 H new ATOM 0 HB3 SER A 36 -7.008 -14.240 -11.054 1.00 0.00 H new ATOM 0 HG SER A 36 -8.638 -15.023 -12.504 1.00 0.00 H new ATOM 533 N LYS A 37 -8.313 -11.247 -10.608 1.00 0.00 N ATOM 534 CA LYS A 37 -9.484 -10.451 -10.262 1.00 0.00 C ATOM 535 C LYS A 37 -9.400 -9.060 -10.881 1.00 0.00 C ATOM 536 O LYS A 37 -10.412 -8.484 -11.280 1.00 0.00 O ATOM 537 CB LYS A 37 -9.618 -10.337 -8.742 1.00 0.00 C ATOM 538 CG LYS A 37 -9.464 -11.663 -8.016 1.00 0.00 C ATOM 539 CD LYS A 37 -10.416 -12.713 -8.564 1.00 0.00 C ATOM 540 CE LYS A 37 -10.301 -14.023 -7.800 1.00 0.00 C ATOM 541 NZ LYS A 37 -10.858 -15.167 -8.574 1.00 0.00 N ATOM 0 H LYS A 37 -7.766 -11.562 -9.807 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.364 -10.954 -10.662 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -8.867 -9.640 -8.371 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.593 -9.912 -8.503 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.437 -12.015 -8.114 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.652 -11.520 -6.952 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.440 -12.344 -8.504 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.201 -12.886 -9.619 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.254 -14.217 -7.568 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.828 -13.937 -6.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.761 -16.041 -8.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.864 -14.994 -8.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.339 -15.266 -9.470 1.00 0.00 H new ATOM 555 N LYS A 38 -8.186 -8.525 -10.959 1.00 0.00 N ATOM 556 CA LYS A 38 -7.968 -7.202 -11.532 1.00 0.00 C ATOM 557 C LYS A 38 -8.638 -7.083 -12.897 1.00 0.00 C ATOM 558 O LYS A 38 -9.023 -8.085 -13.499 1.00 0.00 O ATOM 559 CB LYS A 38 -6.469 -6.920 -11.661 1.00 0.00 C ATOM 560 CG LYS A 38 -5.714 -7.031 -10.348 1.00 0.00 C ATOM 561 CD LYS A 38 -6.392 -6.234 -9.246 1.00 0.00 C ATOM 562 CE LYS A 38 -7.314 -7.110 -8.411 1.00 0.00 C ATOM 563 NZ LYS A 38 -7.431 -6.615 -7.012 1.00 0.00 N ATOM 0 H LYS A 38 -7.338 -8.988 -10.632 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.414 -6.466 -10.863 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.037 -7.617 -12.379 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.330 -5.918 -12.067 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.648 -8.078 -10.053 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.694 -6.672 -10.483 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.636 -5.784 -8.603 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.964 -5.417 -9.686 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.302 -7.139 -8.870 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.936 -8.132 -8.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.948 -7.275 -6.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.991 -5.675 -6.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.435 -6.549 -6.750 1.00 0.00 H new ATOM 577 N SER A 39 -8.772 -5.852 -13.381 1.00 0.00 N ATOM 578 CA SER A 39 -9.397 -5.603 -14.674 1.00 0.00 C ATOM 579 C SER A 39 -8.711 -4.447 -15.395 1.00 0.00 C ATOM 580 O SER A 39 -9.371 -3.566 -15.947 1.00 0.00 O ATOM 581 CB SER A 39 -10.885 -5.296 -14.494 1.00 0.00 C ATOM 582 OG SER A 39 -11.583 -5.418 -15.721 1.00 0.00 O ATOM 0 H SER A 39 -8.456 -5.012 -12.897 1.00 0.00 H new ATOM 0 HA SER A 39 -9.290 -6.502 -15.281 1.00 0.00 H new ATOM 0 HB2 SER A 39 -11.314 -5.977 -13.759 1.00 0.00 H new ATOM 0 HB3 SER A 39 -11.006 -4.286 -14.102 1.00 0.00 H new ATOM 0 HG SER A 39 -11.155 -4.854 -16.398 1.00 0.00 H new ATOM 588 N SER A 40 -7.382 -4.457 -15.387 1.00 0.00 N ATOM 589 CA SER A 40 -6.605 -3.408 -16.036 1.00 0.00 C ATOM 590 C SER A 40 -6.865 -2.055 -15.381 1.00 0.00 C ATOM 591 O SER A 40 -6.514 -1.010 -15.929 1.00 0.00 O ATOM 592 CB SER A 40 -6.946 -3.340 -17.526 1.00 0.00 C ATOM 593 OG SER A 40 -7.568 -4.536 -17.962 1.00 0.00 O ATOM 0 H SER A 40 -6.821 -5.181 -14.938 1.00 0.00 H new ATOM 0 HA SER A 40 -5.548 -3.650 -15.923 1.00 0.00 H new ATOM 0 HB2 SER A 40 -7.607 -2.494 -17.713 1.00 0.00 H new ATOM 0 HB3 SER A 40 -6.037 -3.168 -18.103 1.00 0.00 H new ATOM 0 HG SER A 40 -7.777 -4.467 -18.917 1.00 0.00 H new ATOM 599 N SER A 41 -7.482 -2.083 -14.204 1.00 0.00 N ATOM 600 CA SER A 41 -7.794 -0.860 -13.475 1.00 0.00 C ATOM 601 C SER A 41 -6.919 -0.731 -12.231 1.00 0.00 C ATOM 602 O SER A 41 -6.837 0.337 -11.625 1.00 0.00 O ATOM 603 CB SER A 41 -9.271 -0.839 -13.077 1.00 0.00 C ATOM 604 OG SER A 41 -9.565 0.285 -12.266 1.00 0.00 O ATOM 0 H SER A 41 -7.776 -2.940 -13.735 1.00 0.00 H new ATOM 0 HA SER A 41 -7.591 -0.014 -14.132 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.892 -0.817 -13.973 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.519 -1.754 -12.539 1.00 0.00 H new ATOM 0 HG SER A 41 -8.732 0.660 -11.912 1.00 0.00 H new ATOM 610 N GLN A 42 -6.267 -1.828 -11.858 1.00 0.00 N ATOM 611 CA GLN A 42 -5.399 -1.839 -10.687 1.00 0.00 C ATOM 612 C GLN A 42 -4.017 -2.379 -11.039 1.00 0.00 C ATOM 613 O GLN A 42 -3.127 -2.439 -10.189 1.00 0.00 O ATOM 614 CB GLN A 42 -6.021 -2.682 -9.573 1.00 0.00 C ATOM 615 CG GLN A 42 -7.464 -2.316 -9.266 1.00 0.00 C ATOM 616 CD GLN A 42 -8.434 -3.428 -9.613 1.00 0.00 C ATOM 617 OE1 GLN A 42 -9.200 -3.887 -8.765 1.00 0.00 O ATOM 618 NE2 GLN A 42 -8.408 -3.868 -10.866 1.00 0.00 N ATOM 0 H GLN A 42 -6.324 -2.720 -12.350 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.289 -0.812 -10.337 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.974 -3.734 -9.855 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.426 -2.568 -8.667 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.557 -2.076 -8.207 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.733 -1.418 -9.821 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.757 -3.459 -11.537 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -9.039 -4.615 -11.158 1.00 0.00 H new ATOM 627 N LEU A 43 -3.843 -2.772 -12.296 1.00 0.00 N ATOM 628 CA LEU A 43 -2.569 -3.309 -12.760 1.00 0.00 C ATOM 629 C LEU A 43 -1.436 -2.320 -12.505 1.00 0.00 C ATOM 630 O LEU A 43 -0.336 -2.707 -12.109 1.00 0.00 O ATOM 631 CB LEU A 43 -2.645 -3.639 -14.252 1.00 0.00 C ATOM 632 CG LEU A 43 -3.270 -4.988 -14.609 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.219 -6.088 -14.579 1.00 0.00 C ATOM 634 CD2 LEU A 43 -4.413 -5.315 -13.659 1.00 0.00 C ATOM 0 H LEU A 43 -4.568 -2.729 -13.012 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.363 -4.222 -12.201 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.215 -2.854 -14.749 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.636 -3.609 -14.662 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.672 -4.924 -15.620 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.682 -7.041 -14.836 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.434 -5.861 -15.300 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.787 -6.152 -13.580 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.846 -6.279 -13.928 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.036 -5.360 -12.637 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.178 -4.541 -13.730 1.00 0.00 H new ATOM 646 N LYS A 44 -1.713 -1.040 -12.731 1.00 0.00 N ATOM 647 CA LYS A 44 -0.719 0.007 -12.522 1.00 0.00 C ATOM 648 C LYS A 44 -0.882 0.645 -11.146 1.00 0.00 C ATOM 649 O LYS A 44 -0.015 1.391 -10.692 1.00 0.00 O ATOM 650 CB LYS A 44 -0.839 1.077 -13.609 1.00 0.00 C ATOM 651 CG LYS A 44 -2.229 1.679 -13.719 1.00 0.00 C ATOM 652 CD LYS A 44 -2.478 2.710 -12.631 1.00 0.00 C ATOM 653 CE LYS A 44 -2.897 4.049 -13.218 1.00 0.00 C ATOM 654 NZ LYS A 44 -2.769 5.154 -12.227 1.00 0.00 N ATOM 0 H LYS A 44 -2.618 -0.702 -13.059 1.00 0.00 H new ATOM 0 HA LYS A 44 0.269 -0.449 -12.577 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.123 1.873 -13.404 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -0.564 0.640 -14.569 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.348 2.145 -14.697 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.976 0.888 -13.650 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.254 2.348 -11.956 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -1.574 2.839 -12.037 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.283 4.271 -14.091 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.929 3.988 -13.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.064 6.050 -12.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.374 4.955 -11.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -1.779 5.230 -11.917 1.00 0.00 H new ATOM 668 N GLU A 45 -1.997 0.344 -10.487 1.00 0.00 N ATOM 669 CA GLU A 45 -2.271 0.889 -9.163 1.00 0.00 C ATOM 670 C GLU A 45 -1.129 0.577 -8.199 1.00 0.00 C ATOM 671 O GLU A 45 -0.673 1.448 -7.458 1.00 0.00 O ATOM 672 CB GLU A 45 -3.583 0.323 -8.616 1.00 0.00 C ATOM 673 CG GLU A 45 -4.780 1.230 -8.846 1.00 0.00 C ATOM 674 CD GLU A 45 -4.630 2.577 -8.167 1.00 0.00 C ATOM 675 OE1 GLU A 45 -4.511 2.604 -6.924 1.00 0.00 O ATOM 676 OE2 GLU A 45 -4.633 3.604 -8.877 1.00 0.00 O ATOM 0 H GLU A 45 -2.724 -0.274 -10.848 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.361 1.971 -9.255 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.775 -0.643 -9.083 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.474 0.144 -7.546 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.917 1.380 -9.917 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.680 0.739 -8.476 1.00 0.00 H new ATOM 683 N ILE A 46 -0.674 -0.671 -8.215 1.00 0.00 N ATOM 684 CA ILE A 46 0.414 -1.098 -7.344 1.00 0.00 C ATOM 685 C ILE A 46 1.771 -0.787 -7.966 1.00 0.00 C ATOM 686 O ILE A 46 2.768 -0.628 -7.261 1.00 0.00 O ATOM 687 CB ILE A 46 0.335 -2.606 -7.042 1.00 0.00 C ATOM 688 CG1 ILE A 46 -1.118 -3.025 -6.804 1.00 0.00 C ATOM 689 CG2 ILE A 46 1.195 -2.951 -5.835 1.00 0.00 C ATOM 690 CD1 ILE A 46 -1.755 -3.702 -7.997 1.00 0.00 C ATOM 0 H ILE A 46 -1.042 -1.404 -8.821 1.00 0.00 H new ATOM 0 HA ILE A 46 0.308 -0.543 -6.412 1.00 0.00 H new ATOM 0 HB ILE A 46 0.716 -3.154 -7.904 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.157 -3.700 -5.949 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.703 -2.144 -6.541 1.00 0.00 H new ATOM 0 HG21 ILE A 46 1.128 -4.020 -5.635 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.232 -2.684 -6.039 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.842 -2.396 -4.966 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.783 -3.971 -7.756 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.748 -3.021 -8.848 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.193 -4.602 -8.247 1.00 0.00 H new ATOM 702 N PHE A 47 1.802 -0.699 -9.292 1.00 0.00 N ATOM 703 CA PHE A 47 3.037 -0.405 -10.010 1.00 0.00 C ATOM 704 C PHE A 47 4.224 -1.110 -9.361 1.00 0.00 C ATOM 705 O PHE A 47 5.309 -0.541 -9.244 1.00 0.00 O ATOM 706 CB PHE A 47 3.283 1.104 -10.048 1.00 0.00 C ATOM 707 CG PHE A 47 3.198 1.759 -8.699 1.00 0.00 C ATOM 708 CD1 PHE A 47 4.324 1.878 -7.899 1.00 0.00 C ATOM 709 CD2 PHE A 47 1.993 2.257 -8.230 1.00 0.00 C ATOM 710 CE1 PHE A 47 4.248 2.479 -6.657 1.00 0.00 C ATOM 711 CE2 PHE A 47 1.911 2.860 -6.989 1.00 0.00 C ATOM 712 CZ PHE A 47 3.040 2.972 -6.202 1.00 0.00 C ATOM 0 H PHE A 47 0.986 -0.827 -9.891 1.00 0.00 H new ATOM 0 HA PHE A 47 2.932 -0.774 -11.030 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.269 1.293 -10.473 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.554 1.566 -10.714 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.271 1.497 -8.250 1.00 0.00 H new ATOM 0 HD2 PHE A 47 1.107 2.173 -8.842 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.132 2.563 -6.042 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.965 3.243 -6.635 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.979 3.444 -5.233 1.00 0.00 H new ATOM 722 N ARG A 48 4.009 -2.352 -8.940 1.00 0.00 N ATOM 723 CA ARG A 48 5.061 -3.135 -8.301 1.00 0.00 C ATOM 724 C ARG A 48 5.052 -4.574 -8.809 1.00 0.00 C ATOM 725 O ARG A 48 5.837 -5.407 -8.355 1.00 0.00 O ATOM 726 CB ARG A 48 4.886 -3.118 -6.782 1.00 0.00 C ATOM 727 CG ARG A 48 4.097 -4.301 -6.246 1.00 0.00 C ATOM 728 CD ARG A 48 3.918 -4.215 -4.738 1.00 0.00 C ATOM 729 NE ARG A 48 3.926 -2.834 -4.264 1.00 0.00 N ATOM 730 CZ ARG A 48 5.021 -2.203 -3.856 1.00 0.00 C ATOM 731 NH1 ARG A 48 6.191 -2.826 -3.864 1.00 0.00 N ATOM 732 NH2 ARG A 48 4.947 -0.946 -3.438 1.00 0.00 N ATOM 0 H ARG A 48 3.117 -2.838 -9.030 1.00 0.00 H new ATOM 0 HA ARG A 48 6.021 -2.684 -8.555 1.00 0.00 H new ATOM 0 HB2 ARG A 48 5.869 -3.105 -6.312 1.00 0.00 H new ATOM 0 HB3 ARG A 48 4.382 -2.195 -6.493 1.00 0.00 H new ATOM 0 HG2 ARG A 48 3.120 -4.336 -6.728 1.00 0.00 H new ATOM 0 HG3 ARG A 48 4.611 -5.228 -6.500 1.00 0.00 H new ATOM 0 HD2 ARG A 48 2.978 -4.689 -4.457 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.715 -4.772 -4.246 1.00 0.00 H new ATOM 0 HE ARG A 48 3.042 -2.326 -4.245 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.252 -3.793 -4.184 1.00 0.00 H new ATOM 0 HH12 ARG A 48 7.030 -2.339 -3.550 1.00 0.00 H new ATOM 0 HH21 ARG A 48 4.048 -0.463 -3.430 1.00 0.00 H new ATOM 0 HH22 ARG A 48 5.789 -0.462 -3.125 1.00 0.00 H new ATOM 746 N ILE A 49 4.160 -4.858 -9.752 1.00 0.00 N ATOM 747 CA ILE A 49 4.050 -6.195 -10.322 1.00 0.00 C ATOM 748 C ILE A 49 4.417 -6.194 -11.802 1.00 0.00 C ATOM 749 O ILE A 49 4.567 -7.251 -12.416 1.00 0.00 O ATOM 750 CB ILE A 49 2.628 -6.762 -10.157 1.00 0.00 C ATOM 751 CG1 ILE A 49 1.608 -5.843 -10.833 1.00 0.00 C ATOM 752 CG2 ILE A 49 2.295 -6.938 -8.683 1.00 0.00 C ATOM 753 CD1 ILE A 49 1.081 -4.754 -9.926 1.00 0.00 C ATOM 0 H ILE A 49 3.503 -4.180 -10.138 1.00 0.00 H new ATOM 0 HA ILE A 49 4.750 -6.829 -9.777 1.00 0.00 H new ATOM 0 HB ILE A 49 2.584 -7.739 -10.638 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.068 -5.384 -11.708 1.00 0.00 H new ATOM 0 HG13 ILE A 49 0.771 -6.443 -11.191 1.00 0.00 H new ATOM 0 HG21 ILE A 49 1.287 -7.340 -8.583 1.00 0.00 H new ATOM 0 HG22 ILE A 49 3.007 -7.628 -8.229 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.353 -5.973 -8.179 1.00 0.00 H new ATOM 0 HD11 ILE A 49 0.363 -4.142 -10.472 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.591 -5.205 -9.063 1.00 0.00 H new ATOM 0 HD13 ILE A 49 1.908 -4.130 -9.589 1.00 0.00 H new ATOM 765 N LEU A 50 4.562 -5.002 -12.369 1.00 0.00 N ATOM 766 CA LEU A 50 4.914 -4.862 -13.778 1.00 0.00 C ATOM 767 C LEU A 50 6.409 -4.607 -13.943 1.00 0.00 C ATOM 768 O LEU A 50 7.139 -5.449 -14.466 1.00 0.00 O ATOM 769 CB LEU A 50 4.117 -3.721 -14.412 1.00 0.00 C ATOM 770 CG LEU A 50 2.655 -3.603 -13.980 1.00 0.00 C ATOM 771 CD1 LEU A 50 2.124 -2.208 -14.271 1.00 0.00 C ATOM 772 CD2 LEU A 50 1.805 -4.655 -14.678 1.00 0.00 C ATOM 0 H LEU A 50 4.441 -4.118 -11.875 1.00 0.00 H new ATOM 0 HA LEU A 50 4.666 -5.795 -14.284 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.620 -2.782 -14.182 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.146 -3.842 -15.495 1.00 0.00 H new ATOM 0 HG LEU A 50 2.599 -3.775 -12.905 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.082 -2.142 -13.957 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.715 -1.473 -13.725 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.194 -2.008 -15.340 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.768 -4.556 -14.358 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.867 -4.515 -15.757 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.171 -5.649 -14.419 1.00 0.00 H new ATOM 784 N ASP A 51 6.857 -3.440 -13.493 1.00 0.00 N ATOM 785 CA ASP A 51 8.266 -3.075 -13.588 1.00 0.00 C ATOM 786 C ASP A 51 8.698 -2.256 -12.375 1.00 0.00 C ATOM 787 O ASP A 51 7.918 -2.043 -11.448 1.00 0.00 O ATOM 788 CB ASP A 51 8.524 -2.284 -14.871 1.00 0.00 C ATOM 789 CG ASP A 51 9.902 -2.547 -15.446 1.00 0.00 C ATOM 790 OD1 ASP A 51 10.659 -3.331 -14.836 1.00 0.00 O ATOM 791 OD2 ASP A 51 10.224 -1.969 -16.505 1.00 0.00 O ATOM 0 H ASP A 51 6.266 -2.731 -13.059 1.00 0.00 H new ATOM 0 HA ASP A 51 8.853 -3.993 -13.612 1.00 0.00 H new ATOM 0 HB2 ASP A 51 7.768 -2.544 -15.613 1.00 0.00 H new ATOM 0 HB3 ASP A 51 8.416 -1.219 -14.666 1.00 0.00 H new ATOM 796 N ASN A 52 9.947 -1.801 -12.389 1.00 0.00 N ATOM 797 CA ASN A 52 10.483 -1.008 -11.289 1.00 0.00 C ATOM 798 C ASN A 52 11.068 0.305 -11.801 1.00 0.00 C ATOM 799 O ASN A 52 11.627 1.089 -11.033 1.00 0.00 O ATOM 800 CB ASN A 52 11.556 -1.798 -10.537 1.00 0.00 C ATOM 801 CG ASN A 52 12.028 -1.086 -9.285 1.00 0.00 C ATOM 802 OD1 ASN A 52 13.227 -0.904 -9.076 1.00 0.00 O ATOM 803 ND2 ASN A 52 11.084 -0.680 -8.444 1.00 0.00 N ATOM 0 H ASN A 52 10.606 -1.968 -13.149 1.00 0.00 H new ATOM 0 HA ASN A 52 9.665 -0.780 -10.606 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.160 -2.777 -10.267 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.407 -1.969 -11.197 1.00 0.00 H new ATOM 0 HD21 ASN A 52 11.341 -0.196 -7.584 1.00 0.00 H new ATOM 0 HD22 ASN A 52 10.102 -0.852 -8.658 1.00 0.00 H new ATOM 810 N ASP A 53 10.936 0.538 -13.102 1.00 0.00 N ATOM 811 CA ASP A 53 11.449 1.757 -13.717 1.00 0.00 C ATOM 812 C ASP A 53 10.311 2.708 -14.071 1.00 0.00 C ATOM 813 O ASP A 53 10.326 3.878 -13.689 1.00 0.00 O ATOM 814 CB ASP A 53 12.258 1.419 -14.971 1.00 0.00 C ATOM 815 CG ASP A 53 13.292 2.479 -15.296 1.00 0.00 C ATOM 816 OD1 ASP A 53 13.032 3.667 -15.013 1.00 0.00 O ATOM 817 OD2 ASP A 53 14.361 2.121 -15.834 1.00 0.00 O ATOM 0 H ASP A 53 10.478 -0.101 -13.752 1.00 0.00 H new ATOM 0 HA ASP A 53 12.100 2.252 -12.997 1.00 0.00 H new ATOM 0 HB2 ASP A 53 12.757 0.460 -14.831 1.00 0.00 H new ATOM 0 HB3 ASP A 53 11.580 1.305 -15.817 1.00 0.00 H new ATOM 822 N GLN A 54 9.327 2.198 -14.805 1.00 0.00 N ATOM 823 CA GLN A 54 8.182 3.004 -15.212 1.00 0.00 C ATOM 824 C GLN A 54 8.619 4.157 -16.109 1.00 0.00 C ATOM 825 O GLN A 54 8.139 5.281 -15.970 1.00 0.00 O ATOM 826 CB GLN A 54 7.451 3.547 -13.983 1.00 0.00 C ATOM 827 CG GLN A 54 5.938 3.423 -14.071 1.00 0.00 C ATOM 828 CD GLN A 54 5.473 1.981 -14.120 1.00 0.00 C ATOM 829 OE1 GLN A 54 5.396 1.378 -15.190 1.00 0.00 O ATOM 830 NE2 GLN A 54 5.159 1.421 -12.958 1.00 0.00 N ATOM 0 H GLN A 54 9.300 1.231 -15.130 1.00 0.00 H new ATOM 0 HA GLN A 54 7.503 2.366 -15.777 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.800 3.015 -13.098 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.714 4.596 -13.848 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.486 3.918 -13.211 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.586 3.945 -14.961 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.238 1.959 -12.095 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.839 0.453 -12.928 1.00 0.00 H new ATOM 839 N SER A 55 9.534 3.870 -17.030 1.00 0.00 N ATOM 840 CA SER A 55 10.040 4.884 -17.947 1.00 0.00 C ATOM 841 C SER A 55 9.522 4.643 -19.362 1.00 0.00 C ATOM 842 O SER A 55 9.583 5.526 -20.216 1.00 0.00 O ATOM 843 CB SER A 55 11.570 4.887 -17.946 1.00 0.00 C ATOM 844 OG SER A 55 12.079 6.004 -18.652 1.00 0.00 O ATOM 0 H SER A 55 9.940 2.943 -17.161 1.00 0.00 H new ATOM 0 HA SER A 55 9.682 5.856 -17.607 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.936 4.904 -16.919 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.939 3.967 -18.400 1.00 0.00 H new ATOM 0 HG SER A 55 13.059 5.983 -18.635 1.00 0.00 H new ATOM 850 N GLY A 56 9.012 3.439 -19.602 1.00 0.00 N ATOM 851 CA GLY A 56 8.491 3.102 -20.914 1.00 0.00 C ATOM 852 C GLY A 56 8.206 1.620 -21.061 1.00 0.00 C ATOM 853 O GLY A 56 7.054 1.192 -20.984 1.00 0.00 O ATOM 0 H GLY A 56 8.950 2.691 -18.911 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.575 3.665 -21.093 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.208 3.408 -21.676 1.00 0.00 H new ATOM 857 N PHE A 57 9.257 0.836 -21.276 1.00 0.00 N ATOM 858 CA PHE A 57 9.114 -0.607 -21.437 1.00 0.00 C ATOM 859 C PHE A 57 9.980 -1.356 -20.429 1.00 0.00 C ATOM 860 O PHE A 57 10.885 -0.780 -19.825 1.00 0.00 O ATOM 861 CB PHE A 57 9.493 -1.022 -22.860 1.00 0.00 C ATOM 862 CG PHE A 57 8.739 -0.276 -23.924 1.00 0.00 C ATOM 863 CD1 PHE A 57 9.133 0.995 -24.309 1.00 0.00 C ATOM 864 CD2 PHE A 57 7.636 -0.847 -24.538 1.00 0.00 C ATOM 865 CE1 PHE A 57 8.441 1.684 -25.288 1.00 0.00 C ATOM 866 CE2 PHE A 57 6.941 -0.164 -25.518 1.00 0.00 C ATOM 867 CZ PHE A 57 7.343 1.104 -25.892 1.00 0.00 C ATOM 0 H PHE A 57 10.217 1.175 -21.343 1.00 0.00 H new ATOM 0 HA PHE A 57 8.071 -0.866 -21.255 1.00 0.00 H new ATOM 0 HB2 PHE A 57 10.562 -0.862 -23.004 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.311 -2.090 -22.979 1.00 0.00 H new ATOM 0 HD1 PHE A 57 9.991 1.453 -23.839 1.00 0.00 H new ATOM 0 HD2 PHE A 57 7.316 -1.837 -24.248 1.00 0.00 H new ATOM 0 HE1 PHE A 57 8.759 2.674 -25.580 1.00 0.00 H new ATOM 0 HE2 PHE A 57 6.084 -0.621 -25.991 1.00 0.00 H new ATOM 0 HZ PHE A 57 6.799 1.641 -26.655 1.00 0.00 H new ATOM 877 N ILE A 58 9.694 -2.641 -20.252 1.00 0.00 N ATOM 878 CA ILE A 58 10.446 -3.469 -19.318 1.00 0.00 C ATOM 879 C ILE A 58 11.594 -4.186 -20.020 1.00 0.00 C ATOM 880 O ILE A 58 11.546 -4.421 -21.227 1.00 0.00 O ATOM 881 CB ILE A 58 9.542 -4.514 -18.638 1.00 0.00 C ATOM 882 CG1 ILE A 58 8.242 -3.863 -18.162 1.00 0.00 C ATOM 883 CG2 ILE A 58 10.271 -5.167 -17.473 1.00 0.00 C ATOM 884 CD1 ILE A 58 7.250 -4.848 -17.582 1.00 0.00 C ATOM 0 H ILE A 58 8.947 -3.131 -20.743 1.00 0.00 H new ATOM 0 HA ILE A 58 10.849 -2.800 -18.558 1.00 0.00 H new ATOM 0 HB ILE A 58 9.294 -5.287 -19.366 1.00 0.00 H new ATOM 0 HG12 ILE A 58 8.476 -3.110 -17.410 1.00 0.00 H new ATOM 0 HG13 ILE A 58 7.778 -3.343 -19.000 1.00 0.00 H new ATOM 0 HG21 ILE A 58 9.619 -5.903 -17.003 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.172 -5.661 -17.838 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.545 -4.406 -16.743 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.352 -4.317 -17.265 1.00 0.00 H new ATOM 0 HD12 ILE A 58 6.986 -5.587 -18.339 1.00 0.00 H new ATOM 0 HD13 ILE A 58 7.696 -5.351 -16.724 1.00 0.00 H new ATOM 896 N GLU A 59 12.625 -4.533 -19.255 1.00 0.00 N ATOM 897 CA GLU A 59 13.785 -5.224 -19.804 1.00 0.00 C ATOM 898 C GLU A 59 14.272 -6.312 -18.851 1.00 0.00 C ATOM 899 O GLU A 59 13.954 -6.297 -17.662 1.00 0.00 O ATOM 900 CB GLU A 59 14.915 -4.231 -20.081 1.00 0.00 C ATOM 901 CG GLU A 59 15.892 -4.701 -21.145 1.00 0.00 C ATOM 902 CD GLU A 59 16.782 -3.585 -21.655 1.00 0.00 C ATOM 903 OE1 GLU A 59 17.824 -3.318 -21.019 1.00 0.00 O ATOM 904 OE2 GLU A 59 16.438 -2.977 -22.690 1.00 0.00 O ATOM 0 H GLU A 59 12.680 -4.347 -18.254 1.00 0.00 H new ATOM 0 HA GLU A 59 13.486 -5.693 -20.741 1.00 0.00 H new ATOM 0 HB2 GLU A 59 14.483 -3.280 -20.391 1.00 0.00 H new ATOM 0 HB3 GLU A 59 15.460 -4.047 -19.155 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.513 -5.498 -20.736 1.00 0.00 H new ATOM 0 HG3 GLU A 59 15.336 -5.127 -21.980 1.00 0.00 H new ATOM 911 N GLU A 60 15.044 -7.255 -19.383 1.00 0.00 N ATOM 912 CA GLU A 60 15.573 -8.351 -18.580 1.00 0.00 C ATOM 913 C GLU A 60 16.406 -7.820 -17.416 1.00 0.00 C ATOM 914 O GLU A 60 16.589 -8.502 -16.408 1.00 0.00 O ATOM 915 CB GLU A 60 16.422 -9.283 -19.446 1.00 0.00 C ATOM 916 CG GLU A 60 17.451 -8.556 -20.295 1.00 0.00 C ATOM 917 CD GLU A 60 18.472 -9.496 -20.907 1.00 0.00 C ATOM 918 OE1 GLU A 60 19.504 -9.756 -20.254 1.00 0.00 O ATOM 919 OE2 GLU A 60 18.239 -9.972 -22.037 1.00 0.00 O ATOM 0 H GLU A 60 15.317 -7.282 -20.366 1.00 0.00 H new ATOM 0 HA GLU A 60 14.730 -8.911 -18.175 1.00 0.00 H new ATOM 0 HB2 GLU A 60 16.934 -9.997 -18.802 1.00 0.00 H new ATOM 0 HB3 GLU A 60 15.765 -9.857 -20.099 1.00 0.00 H new ATOM 0 HG2 GLU A 60 16.941 -8.012 -21.090 1.00 0.00 H new ATOM 0 HG3 GLU A 60 17.965 -7.816 -19.682 1.00 0.00 H new ATOM 926 N ASP A 61 16.909 -6.600 -17.565 1.00 0.00 N ATOM 927 CA ASP A 61 17.722 -5.976 -16.528 1.00 0.00 C ATOM 928 C ASP A 61 16.847 -5.445 -15.397 1.00 0.00 C ATOM 929 O ASP A 61 17.352 -4.951 -14.389 1.00 0.00 O ATOM 930 CB ASP A 61 18.559 -4.840 -17.119 1.00 0.00 C ATOM 931 CG ASP A 61 19.539 -4.262 -16.119 1.00 0.00 C ATOM 932 OD1 ASP A 61 20.417 -5.014 -15.646 1.00 0.00 O ATOM 933 OD2 ASP A 61 19.429 -3.057 -15.808 1.00 0.00 O ATOM 0 H ASP A 61 16.768 -6.023 -18.394 1.00 0.00 H new ATOM 0 HA ASP A 61 18.390 -6.734 -16.120 1.00 0.00 H new ATOM 0 HB2 ASP A 61 19.105 -5.209 -17.987 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.896 -4.050 -17.472 1.00 0.00 H new ATOM 938 N GLU A 62 15.534 -5.549 -15.573 1.00 0.00 N ATOM 939 CA GLU A 62 14.589 -5.076 -14.568 1.00 0.00 C ATOM 940 C GLU A 62 13.639 -6.194 -14.146 1.00 0.00 C ATOM 941 O GLU A 62 12.519 -5.937 -13.701 1.00 0.00 O ATOM 942 CB GLU A 62 13.789 -3.888 -15.106 1.00 0.00 C ATOM 943 CG GLU A 62 14.549 -2.573 -15.061 1.00 0.00 C ATOM 944 CD GLU A 62 15.092 -2.259 -13.681 1.00 0.00 C ATOM 945 OE1 GLU A 62 14.543 -2.788 -12.692 1.00 0.00 O ATOM 946 OE2 GLU A 62 16.067 -1.483 -13.589 1.00 0.00 O ATOM 0 H GLU A 62 15.100 -5.956 -16.402 1.00 0.00 H new ATOM 0 HA GLU A 62 15.157 -4.756 -13.695 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.496 -4.094 -16.136 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.871 -3.787 -14.528 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.374 -2.610 -15.772 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.890 -1.766 -15.380 1.00 0.00 H new ATOM 953 N LEU A 63 14.093 -7.434 -14.290 1.00 0.00 N ATOM 954 CA LEU A 63 13.285 -8.592 -13.925 1.00 0.00 C ATOM 955 C LEU A 63 13.846 -9.279 -12.685 1.00 0.00 C ATOM 956 O LEU A 63 13.108 -9.611 -11.757 1.00 0.00 O ATOM 957 CB LEU A 63 13.224 -9.583 -15.088 1.00 0.00 C ATOM 958 CG LEU A 63 12.707 -9.029 -16.416 1.00 0.00 C ATOM 959 CD1 LEU A 63 12.574 -10.143 -17.444 1.00 0.00 C ATOM 960 CD2 LEU A 63 11.374 -8.324 -16.217 1.00 0.00 C ATOM 0 H LEU A 63 15.017 -7.663 -14.657 1.00 0.00 H new ATOM 0 HA LEU A 63 12.277 -8.244 -13.699 1.00 0.00 H new ATOM 0 HB2 LEU A 63 14.224 -9.984 -15.250 1.00 0.00 H new ATOM 0 HB3 LEU A 63 12.589 -10.419 -14.794 1.00 0.00 H new ATOM 0 HG LEU A 63 13.428 -8.302 -16.789 1.00 0.00 H new ATOM 0 HD11 LEU A 63 12.205 -9.730 -18.383 1.00 0.00 H new ATOM 0 HD12 LEU A 63 13.548 -10.604 -17.609 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.874 -10.894 -17.078 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.021 -7.936 -17.173 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.645 -9.030 -15.821 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.500 -7.500 -15.515 1.00 0.00 H new ATOM 972 N LYS A 64 15.158 -9.489 -12.674 1.00 0.00 N ATOM 973 CA LYS A 64 15.821 -10.133 -11.547 1.00 0.00 C ATOM 974 C LYS A 64 15.604 -9.341 -10.262 1.00 0.00 C ATOM 975 O LYS A 64 15.184 -8.184 -10.298 1.00 0.00 O ATOM 976 CB LYS A 64 17.320 -10.275 -11.823 1.00 0.00 C ATOM 977 CG LYS A 64 17.633 -10.986 -13.129 1.00 0.00 C ATOM 978 CD LYS A 64 19.033 -10.659 -13.619 1.00 0.00 C ATOM 979 CE LYS A 64 19.102 -9.264 -14.222 1.00 0.00 C ATOM 980 NZ LYS A 64 20.505 -8.778 -14.336 1.00 0.00 N ATOM 0 H LYS A 64 15.784 -9.222 -13.434 1.00 0.00 H new ATOM 0 HA LYS A 64 15.385 -11.124 -11.420 1.00 0.00 H new ATOM 0 HB2 LYS A 64 17.773 -9.284 -11.841 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.782 -10.822 -11.001 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.537 -12.063 -12.990 1.00 0.00 H new ATOM 0 HG3 LYS A 64 16.904 -10.696 -13.886 1.00 0.00 H new ATOM 0 HD2 LYS A 64 19.736 -10.733 -12.790 1.00 0.00 H new ATOM 0 HD3 LYS A 64 19.340 -11.394 -14.363 1.00 0.00 H new ATOM 0 HE2 LYS A 64 18.639 -9.272 -15.209 1.00 0.00 H new ATOM 0 HE3 LYS A 64 18.527 -8.573 -13.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 20.509 -7.824 -14.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 20.939 -8.746 -13.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 21.047 -9.423 -14.945 1.00 0.00 H new ATOM 994 N TYR A 65 15.893 -9.969 -9.128 1.00 0.00 N ATOM 995 CA TYR A 65 15.728 -9.323 -7.832 1.00 0.00 C ATOM 996 C TYR A 65 14.298 -8.824 -7.650 1.00 0.00 C ATOM 997 O TYR A 65 14.044 -7.896 -6.882 1.00 0.00 O ATOM 998 CB TYR A 65 16.708 -8.157 -7.691 1.00 0.00 C ATOM 999 CG TYR A 65 18.106 -8.479 -8.171 1.00 0.00 C ATOM 1000 CD1 TYR A 65 18.446 -8.362 -9.513 1.00 0.00 C ATOM 1001 CD2 TYR A 65 19.086 -8.901 -7.281 1.00 0.00 C ATOM 1002 CE1 TYR A 65 19.721 -8.656 -9.955 1.00 0.00 C ATOM 1003 CE2 TYR A 65 20.364 -9.196 -7.714 1.00 0.00 C ATOM 1004 CZ TYR A 65 20.677 -9.073 -9.052 1.00 0.00 C ATOM 1005 OH TYR A 65 21.948 -9.366 -9.488 1.00 0.00 O ATOM 0 H TYR A 65 16.243 -10.926 -9.080 1.00 0.00 H new ATOM 0 HA TYR A 65 15.938 -10.061 -7.058 1.00 0.00 H new ATOM 0 HB2 TYR A 65 16.328 -7.304 -8.253 1.00 0.00 H new ATOM 0 HB3 TYR A 65 16.753 -7.855 -6.644 1.00 0.00 H new ATOM 0 HD1 TYR A 65 17.700 -8.036 -10.223 1.00 0.00 H new ATOM 0 HD2 TYR A 65 18.844 -9.000 -6.233 1.00 0.00 H new ATOM 0 HE1 TYR A 65 19.968 -8.560 -11.002 1.00 0.00 H new ATOM 0 HE2 TYR A 65 21.114 -9.521 -7.009 1.00 0.00 H new ATOM 0 HH TYR A 65 22.499 -9.644 -8.727 1.00 0.00 H new ATOM 1015 N PHE A 66 13.366 -9.448 -8.362 1.00 0.00 N ATOM 1016 CA PHE A 66 11.960 -9.069 -8.281 1.00 0.00 C ATOM 1017 C PHE A 66 11.287 -9.728 -7.080 1.00 0.00 C ATOM 1018 O PHE A 66 10.615 -9.065 -6.290 1.00 0.00 O ATOM 1019 CB PHE A 66 11.229 -9.460 -9.567 1.00 0.00 C ATOM 1020 CG PHE A 66 9.735 -9.342 -9.467 1.00 0.00 C ATOM 1021 CD1 PHE A 66 8.973 -10.405 -9.009 1.00 0.00 C ATOM 1022 CD2 PHE A 66 9.093 -8.169 -9.831 1.00 0.00 C ATOM 1023 CE1 PHE A 66 7.598 -10.299 -8.917 1.00 0.00 C ATOM 1024 CE2 PHE A 66 7.718 -8.058 -9.741 1.00 0.00 C ATOM 1025 CZ PHE A 66 6.970 -9.125 -9.282 1.00 0.00 C ATOM 0 H PHE A 66 13.559 -10.219 -9.002 1.00 0.00 H new ATOM 0 HA PHE A 66 11.908 -7.987 -8.156 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.582 -8.828 -10.382 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.488 -10.487 -9.825 1.00 0.00 H new ATOM 0 HD1 PHE A 66 9.459 -11.326 -8.721 1.00 0.00 H new ATOM 0 HD2 PHE A 66 9.674 -7.332 -10.189 1.00 0.00 H new ATOM 0 HE1 PHE A 66 7.015 -11.135 -8.560 1.00 0.00 H new ATOM 0 HE2 PHE A 66 7.229 -7.139 -10.029 1.00 0.00 H new ATOM 0 HZ PHE A 66 5.896 -9.041 -9.209 1.00 0.00 H new ATOM 1035 N LEU A 67 11.473 -11.037 -6.951 1.00 0.00 N ATOM 1036 CA LEU A 67 10.884 -11.788 -5.847 1.00 0.00 C ATOM 1037 C LEU A 67 11.215 -11.137 -4.508 1.00 0.00 C ATOM 1038 O LEU A 67 10.438 -11.222 -3.558 1.00 0.00 O ATOM 1039 CB LEU A 67 11.385 -13.233 -5.863 1.00 0.00 C ATOM 1040 CG LEU A 67 11.421 -13.916 -7.231 1.00 0.00 C ATOM 1041 CD1 LEU A 67 11.822 -15.376 -7.088 1.00 0.00 C ATOM 1042 CD2 LEU A 67 10.071 -13.797 -7.922 1.00 0.00 C ATOM 0 H LEU A 67 12.027 -11.600 -7.596 1.00 0.00 H new ATOM 0 HA LEU A 67 9.801 -11.784 -5.974 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.391 -13.252 -5.443 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.752 -13.823 -5.201 1.00 0.00 H new ATOM 0 HG LEU A 67 12.167 -13.414 -7.847 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.842 -15.846 -8.071 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.812 -15.439 -6.635 1.00 0.00 H new ATOM 0 HD13 LEU A 67 11.100 -15.891 -6.455 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.115 -14.289 -8.894 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.305 -14.273 -7.309 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.824 -12.744 -8.059 1.00 0.00 H new ATOM 1054 N GLN A 68 12.372 -10.486 -4.443 1.00 0.00 N ATOM 1055 CA GLN A 68 12.805 -9.820 -3.220 1.00 0.00 C ATOM 1056 C GLN A 68 11.761 -8.813 -2.750 1.00 0.00 C ATOM 1057 O GLN A 68 11.675 -8.502 -1.562 1.00 0.00 O ATOM 1058 CB GLN A 68 14.145 -9.116 -3.444 1.00 0.00 C ATOM 1059 CG GLN A 68 15.114 -9.270 -2.283 1.00 0.00 C ATOM 1060 CD GLN A 68 16.537 -8.906 -2.660 1.00 0.00 C ATOM 1061 OE1 GLN A 68 17.194 -8.126 -1.969 1.00 0.00 O ATOM 1062 NE2 GLN A 68 17.022 -9.471 -3.759 1.00 0.00 N ATOM 0 H GLN A 68 13.026 -10.406 -5.222 1.00 0.00 H new ATOM 0 HA GLN A 68 12.926 -10.579 -2.447 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.608 -9.512 -4.348 1.00 0.00 H new ATOM 0 HB3 GLN A 68 13.964 -8.055 -3.617 1.00 0.00 H new ATOM 0 HG2 GLN A 68 14.788 -8.639 -1.456 1.00 0.00 H new ATOM 0 HG3 GLN A 68 15.088 -10.300 -1.927 1.00 0.00 H new ATOM 0 HE21 GLN A 68 16.442 -10.112 -4.301 1.00 0.00 H new ATOM 0 HE22 GLN A 68 17.974 -9.265 -4.061 1.00 0.00 H new ATOM 1071 N ARG A 69 10.970 -8.306 -3.690 1.00 0.00 N ATOM 1072 CA ARG A 69 9.932 -7.333 -3.372 1.00 0.00 C ATOM 1073 C ARG A 69 8.941 -7.904 -2.362 1.00 0.00 C ATOM 1074 O ARG A 69 8.780 -7.370 -1.265 1.00 0.00 O ATOM 1075 CB ARG A 69 9.194 -6.909 -4.643 1.00 0.00 C ATOM 1076 CG ARG A 69 9.949 -5.884 -5.474 1.00 0.00 C ATOM 1077 CD ARG A 69 9.618 -4.464 -5.042 1.00 0.00 C ATOM 1078 NE ARG A 69 10.309 -4.091 -3.811 1.00 0.00 N ATOM 1079 CZ ARG A 69 11.576 -3.692 -3.771 1.00 0.00 C ATOM 1080 NH1 ARG A 69 12.285 -3.614 -4.889 1.00 0.00 N ATOM 1081 NH2 ARG A 69 12.135 -3.369 -2.612 1.00 0.00 N ATOM 0 H ARG A 69 11.028 -8.553 -4.678 1.00 0.00 H new ATOM 0 HA ARG A 69 10.412 -6.460 -2.930 1.00 0.00 H new ATOM 0 HB2 ARG A 69 9.005 -7.791 -5.254 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.223 -6.497 -4.369 1.00 0.00 H new ATOM 0 HG2 ARG A 69 11.021 -6.054 -5.377 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.699 -6.013 -6.527 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.893 -3.770 -5.836 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.542 -4.371 -4.896 1.00 0.00 H new ATOM 0 HE ARG A 69 9.791 -4.139 -2.934 1.00 0.00 H new ATOM 0 HH11 ARG A 69 11.858 -3.860 -5.782 1.00 0.00 H new ATOM 0 HH12 ARG A 69 13.257 -3.307 -4.856 1.00 0.00 H new ATOM 0 HH21 ARG A 69 11.592 -3.427 -1.750 1.00 0.00 H new ATOM 0 HH22 ARG A 69 13.108 -3.063 -2.583 1.00 0.00 H new ATOM 1095 N PHE A 70 8.280 -8.993 -2.741 1.00 0.00 N ATOM 1096 CA PHE A 70 7.303 -9.636 -1.870 1.00 0.00 C ATOM 1097 C PHE A 70 7.987 -10.603 -0.908 1.00 0.00 C ATOM 1098 O PHE A 70 7.861 -10.475 0.310 1.00 0.00 O ATOM 1099 CB PHE A 70 6.258 -10.381 -2.702 1.00 0.00 C ATOM 1100 CG PHE A 70 5.596 -9.522 -3.742 1.00 0.00 C ATOM 1101 CD1 PHE A 70 6.211 -9.289 -4.961 1.00 0.00 C ATOM 1102 CD2 PHE A 70 4.358 -8.948 -3.499 1.00 0.00 C ATOM 1103 CE1 PHE A 70 5.604 -8.499 -5.919 1.00 0.00 C ATOM 1104 CE2 PHE A 70 3.746 -8.157 -4.453 1.00 0.00 C ATOM 1105 CZ PHE A 70 4.370 -7.933 -5.665 1.00 0.00 C ATOM 0 H PHE A 70 8.403 -9.449 -3.645 1.00 0.00 H new ATOM 0 HA PHE A 70 6.807 -8.860 -1.287 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.734 -11.230 -3.193 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.495 -10.784 -2.036 1.00 0.00 H new ATOM 0 HD1 PHE A 70 7.176 -9.730 -5.165 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.866 -9.121 -2.553 1.00 0.00 H new ATOM 0 HE1 PHE A 70 6.094 -8.324 -6.865 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.782 -7.715 -4.251 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.894 -7.316 -6.413 1.00 0.00 H new ATOM 1115 N GLU A 71 8.711 -11.570 -1.464 1.00 0.00 N ATOM 1116 CA GLU A 71 9.413 -12.559 -0.655 1.00 0.00 C ATOM 1117 C GLU A 71 10.217 -11.884 0.452 1.00 0.00 C ATOM 1118 O GLU A 71 10.215 -12.335 1.598 1.00 0.00 O ATOM 1119 CB GLU A 71 10.341 -13.402 -1.533 1.00 0.00 C ATOM 1120 CG GLU A 71 11.095 -14.475 -0.766 1.00 0.00 C ATOM 1121 CD GLU A 71 11.758 -15.488 -1.679 1.00 0.00 C ATOM 1122 OE1 GLU A 71 11.319 -15.614 -2.842 1.00 0.00 O ATOM 1123 OE2 GLU A 71 12.714 -16.155 -1.232 1.00 0.00 O ATOM 0 H GLU A 71 8.826 -11.689 -2.470 1.00 0.00 H new ATOM 0 HA GLU A 71 8.669 -13.210 -0.195 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.753 -13.875 -2.320 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.059 -12.745 -2.023 1.00 0.00 H new ATOM 0 HG2 GLU A 71 11.853 -14.004 -0.141 1.00 0.00 H new ATOM 0 HG3 GLU A 71 10.406 -14.991 -0.097 1.00 0.00 H new ATOM 1130 N SER A 72 10.905 -10.802 0.101 1.00 0.00 N ATOM 1131 CA SER A 72 11.717 -10.068 1.064 1.00 0.00 C ATOM 1132 C SER A 72 12.831 -10.950 1.620 1.00 0.00 C ATOM 1133 O SER A 72 13.421 -10.645 2.655 1.00 0.00 O ATOM 1134 CB SER A 72 10.845 -9.547 2.208 1.00 0.00 C ATOM 1135 OG SER A 72 11.501 -8.512 2.920 1.00 0.00 O ATOM 0 H SER A 72 10.916 -10.415 -0.843 1.00 0.00 H new ATOM 0 HA SER A 72 12.170 -9.222 0.548 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.901 -9.176 1.810 1.00 0.00 H new ATOM 0 HB3 SER A 72 10.605 -10.365 2.888 1.00 0.00 H new ATOM 0 HG SER A 72 12.422 -8.784 3.118 1.00 0.00 H new ATOM 1141 N GLY A 73 13.114 -12.046 0.922 1.00 0.00 N ATOM 1142 CA GLY A 73 14.156 -12.956 1.360 1.00 0.00 C ATOM 1143 C GLY A 73 15.057 -13.396 0.224 1.00 0.00 C ATOM 1144 O GLY A 73 16.263 -13.559 0.406 1.00 0.00 O ATOM 0 H GLY A 73 12.640 -12.320 0.061 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.757 -12.472 2.130 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.699 -13.833 1.818 1.00 0.00 H new ATOM 1148 N ALA A 74 14.471 -13.590 -0.953 1.00 0.00 N ATOM 1149 CA ALA A 74 15.229 -14.013 -2.124 1.00 0.00 C ATOM 1150 C ALA A 74 16.388 -13.062 -2.401 1.00 0.00 C ATOM 1151 O ALA A 74 16.556 -12.055 -1.712 1.00 0.00 O ATOM 1152 CB ALA A 74 14.317 -14.104 -3.339 1.00 0.00 C ATOM 0 H ALA A 74 13.473 -13.461 -1.121 1.00 0.00 H new ATOM 0 HA ALA A 74 15.644 -15.000 -1.920 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.897 -14.421 -4.206 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.526 -14.829 -3.147 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.874 -13.128 -3.536 1.00 0.00 H new ATOM 1158 N ARG A 75 17.187 -13.388 -3.412 1.00 0.00 N ATOM 1159 CA ARG A 75 18.332 -12.563 -3.778 1.00 0.00 C ATOM 1160 C ARG A 75 18.316 -12.242 -5.269 1.00 0.00 C ATOM 1161 O ARG A 75 18.131 -11.090 -5.665 1.00 0.00 O ATOM 1162 CB ARG A 75 19.636 -13.273 -3.412 1.00 0.00 C ATOM 1163 CG ARG A 75 19.502 -14.784 -3.319 1.00 0.00 C ATOM 1164 CD ARG A 75 20.828 -15.479 -3.587 1.00 0.00 C ATOM 1165 NE ARG A 75 20.953 -16.727 -2.838 1.00 0.00 N ATOM 1166 CZ ARG A 75 20.259 -17.825 -3.118 1.00 0.00 C ATOM 1167 NH1 ARG A 75 19.396 -17.829 -4.124 1.00 0.00 N ATOM 1168 NH2 ARG A 75 20.429 -18.921 -2.390 1.00 0.00 N ATOM 0 H ARG A 75 17.062 -14.218 -3.992 1.00 0.00 H new ATOM 0 HA ARG A 75 18.267 -11.628 -3.222 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.394 -13.029 -4.157 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.993 -12.889 -2.456 1.00 0.00 H new ATOM 0 HG2 ARG A 75 19.140 -15.058 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 75 18.758 -15.129 -4.037 1.00 0.00 H new ATOM 0 HD2 ARG A 75 20.920 -15.685 -4.653 1.00 0.00 H new ATOM 0 HD3 ARG A 75 21.648 -14.812 -3.319 1.00 0.00 H new ATOM 0 HE ARG A 75 21.609 -16.757 -2.057 1.00 0.00 H new ATOM 0 HH11 ARG A 75 19.263 -16.988 -4.685 1.00 0.00 H new ATOM 0 HH12 ARG A 75 18.865 -18.673 -4.337 1.00 0.00 H new ATOM 0 HH21 ARG A 75 21.092 -18.921 -1.615 1.00 0.00 H new ATOM 0 HH22 ARG A 75 19.896 -19.764 -2.605 1.00 0.00 H new ATOM 1182 N VAL A 76 18.511 -13.267 -6.093 1.00 0.00 N ATOM 1183 CA VAL A 76 18.518 -13.094 -7.540 1.00 0.00 C ATOM 1184 C VAL A 76 17.741 -14.209 -8.231 1.00 0.00 C ATOM 1185 O VAL A 76 17.504 -15.268 -7.649 1.00 0.00 O ATOM 1186 CB VAL A 76 19.955 -13.065 -8.095 1.00 0.00 C ATOM 1187 CG1 VAL A 76 19.977 -12.459 -9.490 1.00 0.00 C ATOM 1188 CG2 VAL A 76 20.872 -12.297 -7.156 1.00 0.00 C ATOM 0 H VAL A 76 18.666 -14.226 -5.782 1.00 0.00 H new ATOM 0 HA VAL A 76 18.037 -12.138 -7.746 1.00 0.00 H new ATOM 0 HB VAL A 76 20.320 -14.090 -8.165 1.00 0.00 H new ATOM 0 HG11 VAL A 76 21.000 -12.447 -9.865 1.00 0.00 H new ATOM 0 HG12 VAL A 76 19.353 -13.056 -10.156 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.593 -11.440 -9.450 1.00 0.00 H new ATOM 0 HG21 VAL A 76 21.883 -12.286 -7.563 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.512 -11.274 -7.052 1.00 0.00 H new ATOM 0 HG23 VAL A 76 20.879 -12.780 -6.179 1.00 0.00 H new ATOM 1198 N LEU A 77 17.346 -13.964 -9.475 1.00 0.00 N ATOM 1199 CA LEU A 77 16.595 -14.948 -10.247 1.00 0.00 C ATOM 1200 C LEU A 77 17.490 -15.633 -11.275 1.00 0.00 C ATOM 1201 O LEU A 77 18.695 -15.382 -11.331 1.00 0.00 O ATOM 1202 CB LEU A 77 15.412 -14.279 -10.950 1.00 0.00 C ATOM 1203 CG LEU A 77 14.167 -14.045 -10.093 1.00 0.00 C ATOM 1204 CD1 LEU A 77 13.566 -12.679 -10.385 1.00 0.00 C ATOM 1205 CD2 LEU A 77 13.141 -15.144 -10.332 1.00 0.00 C ATOM 0 H LEU A 77 17.533 -13.093 -9.971 1.00 0.00 H new ATOM 0 HA LEU A 77 16.220 -15.704 -9.557 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.744 -13.318 -11.342 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.130 -14.892 -11.806 1.00 0.00 H new ATOM 0 HG LEU A 77 14.461 -14.072 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.681 -12.531 -9.766 1.00 0.00 H new ATOM 0 HD12 LEU A 77 14.299 -11.904 -10.162 1.00 0.00 H new ATOM 0 HD13 LEU A 77 13.286 -12.622 -11.437 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.262 -14.962 -9.714 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.851 -15.149 -11.383 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.574 -16.109 -10.070 1.00 0.00 H new ATOM 1217 N THR A 78 16.894 -16.498 -12.089 1.00 0.00 N ATOM 1218 CA THR A 78 17.636 -17.218 -13.116 1.00 0.00 C ATOM 1219 C THR A 78 17.354 -16.647 -14.501 1.00 0.00 C ATOM 1220 O THR A 78 16.631 -15.661 -14.641 1.00 0.00 O ATOM 1221 CB THR A 78 17.289 -18.719 -13.112 1.00 0.00 C ATOM 1222 OG1 THR A 78 15.884 -18.897 -13.323 1.00 0.00 O ATOM 1223 CG2 THR A 78 17.696 -19.364 -11.796 1.00 0.00 C ATOM 0 H THR A 78 15.898 -16.717 -12.057 1.00 0.00 H new ATOM 0 HA THR A 78 18.694 -17.096 -12.884 1.00 0.00 H new ATOM 0 HB THR A 78 17.841 -19.200 -13.920 1.00 0.00 H new ATOM 0 HG1 THR A 78 15.396 -18.630 -12.516 1.00 0.00 H new ATOM 0 HG21 THR A 78 17.441 -20.424 -11.816 1.00 0.00 H new ATOM 0 HG22 THR A 78 18.771 -19.252 -11.653 1.00 0.00 H new ATOM 0 HG23 THR A 78 17.168 -18.879 -10.975 1.00 0.00 H new ATOM 1231 N ALA A 79 17.929 -17.273 -15.523 1.00 0.00 N ATOM 1232 CA ALA A 79 17.737 -16.828 -16.897 1.00 0.00 C ATOM 1233 C ALA A 79 16.455 -17.405 -17.487 1.00 0.00 C ATOM 1234 O ALA A 79 16.157 -17.204 -18.664 1.00 0.00 O ATOM 1235 CB ALA A 79 18.936 -17.217 -17.750 1.00 0.00 C ATOM 0 H ALA A 79 18.532 -18.090 -15.425 1.00 0.00 H new ATOM 0 HA ALA A 79 17.646 -15.742 -16.892 1.00 0.00 H new ATOM 0 HB1 ALA A 79 18.779 -16.878 -18.774 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.835 -16.751 -17.347 1.00 0.00 H new ATOM 0 HB3 ALA A 79 19.053 -18.301 -17.740 1.00 0.00 H new ATOM 1241 N SER A 80 15.701 -18.124 -16.662 1.00 0.00 N ATOM 1242 CA SER A 80 14.453 -18.735 -17.104 1.00 0.00 C ATOM 1243 C SER A 80 13.251 -17.970 -16.558 1.00 0.00 C ATOM 1244 O SER A 80 12.407 -17.496 -17.319 1.00 0.00 O ATOM 1245 CB SER A 80 14.389 -20.196 -16.654 1.00 0.00 C ATOM 1246 OG SER A 80 14.978 -21.053 -17.618 1.00 0.00 O ATOM 0 H SER A 80 15.932 -18.298 -15.684 1.00 0.00 H new ATOM 0 HA SER A 80 14.423 -18.696 -18.193 1.00 0.00 H new ATOM 0 HB2 SER A 80 14.904 -20.309 -15.700 1.00 0.00 H new ATOM 0 HB3 SER A 80 13.350 -20.485 -16.492 1.00 0.00 H new ATOM 0 HG SER A 80 14.926 -21.981 -17.306 1.00 0.00 H new ATOM 1252 N GLU A 81 13.181 -17.855 -15.236 1.00 0.00 N ATOM 1253 CA GLU A 81 12.082 -17.149 -14.588 1.00 0.00 C ATOM 1254 C GLU A 81 11.931 -15.740 -15.156 1.00 0.00 C ATOM 1255 O GLU A 81 10.825 -15.302 -15.477 1.00 0.00 O ATOM 1256 CB GLU A 81 12.311 -17.079 -13.077 1.00 0.00 C ATOM 1257 CG GLU A 81 12.023 -18.385 -12.357 1.00 0.00 C ATOM 1258 CD GLU A 81 12.661 -18.447 -10.983 1.00 0.00 C ATOM 1259 OE1 GLU A 81 13.887 -18.229 -10.887 1.00 0.00 O ATOM 1260 OE2 GLU A 81 11.934 -18.714 -10.003 1.00 0.00 O ATOM 0 H GLU A 81 13.872 -18.241 -14.593 1.00 0.00 H new ATOM 0 HA GLU A 81 11.163 -17.702 -14.784 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.345 -16.790 -12.888 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.679 -16.296 -12.658 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.945 -18.511 -12.259 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.388 -19.216 -12.961 1.00 0.00 H new ATOM 1267 N THR A 82 13.051 -15.034 -15.278 1.00 0.00 N ATOM 1268 CA THR A 82 13.044 -13.675 -15.805 1.00 0.00 C ATOM 1269 C THR A 82 12.746 -13.667 -17.300 1.00 0.00 C ATOM 1270 O THR A 82 11.927 -12.881 -17.777 1.00 0.00 O ATOM 1271 CB THR A 82 14.391 -12.970 -15.557 1.00 0.00 C ATOM 1272 OG1 THR A 82 15.469 -13.803 -16.000 1.00 0.00 O ATOM 1273 CG2 THR A 82 14.568 -12.645 -14.082 1.00 0.00 C ATOM 0 H THR A 82 13.974 -15.381 -15.019 1.00 0.00 H new ATOM 0 HA THR A 82 12.257 -13.135 -15.278 1.00 0.00 H new ATOM 0 HB THR A 82 14.397 -12.038 -16.121 1.00 0.00 H new ATOM 0 HG1 THR A 82 15.762 -14.379 -15.263 1.00 0.00 H new ATOM 0 HG21 THR A 82 15.526 -12.148 -13.931 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.763 -11.987 -13.755 1.00 0.00 H new ATOM 0 HG23 THR A 82 14.542 -13.567 -13.501 1.00 0.00 H new ATOM 1281 N LYS A 83 13.416 -14.547 -18.037 1.00 0.00 N ATOM 1282 CA LYS A 83 13.223 -14.643 -19.479 1.00 0.00 C ATOM 1283 C LYS A 83 11.751 -14.858 -19.817 1.00 0.00 C ATOM 1284 O LYS A 83 11.306 -14.551 -20.923 1.00 0.00 O ATOM 1285 CB LYS A 83 14.062 -15.788 -20.052 1.00 0.00 C ATOM 1286 CG LYS A 83 13.813 -16.044 -21.528 1.00 0.00 C ATOM 1287 CD LYS A 83 14.222 -14.852 -22.377 1.00 0.00 C ATOM 1288 CE LYS A 83 13.852 -15.056 -23.838 1.00 0.00 C ATOM 1289 NZ LYS A 83 14.893 -15.830 -24.571 1.00 0.00 N ATOM 0 H LYS A 83 14.098 -15.204 -17.659 1.00 0.00 H new ATOM 0 HA LYS A 83 13.548 -13.704 -19.927 1.00 0.00 H new ATOM 0 HB2 LYS A 83 15.118 -15.563 -19.904 1.00 0.00 H new ATOM 0 HB3 LYS A 83 13.849 -16.699 -19.493 1.00 0.00 H new ATOM 0 HG2 LYS A 83 14.370 -16.926 -21.844 1.00 0.00 H new ATOM 0 HG3 LYS A 83 12.757 -16.260 -21.688 1.00 0.00 H new ATOM 0 HD2 LYS A 83 13.737 -13.952 -22.000 1.00 0.00 H new ATOM 0 HD3 LYS A 83 15.297 -14.695 -22.291 1.00 0.00 H new ATOM 0 HE2 LYS A 83 12.898 -15.580 -23.901 1.00 0.00 H new ATOM 0 HE3 LYS A 83 13.716 -14.086 -24.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 14.604 -15.948 -25.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 15.798 -15.318 -24.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 15.005 -16.765 -24.130 1.00 0.00 H new ATOM 1303 N THR A 84 10.999 -15.388 -18.857 1.00 0.00 N ATOM 1304 CA THR A 84 9.578 -15.644 -19.053 1.00 0.00 C ATOM 1305 C THR A 84 8.727 -14.620 -18.309 1.00 0.00 C ATOM 1306 O THR A 84 7.581 -14.893 -17.952 1.00 0.00 O ATOM 1307 CB THR A 84 9.191 -17.057 -18.580 1.00 0.00 C ATOM 1308 OG1 THR A 84 7.864 -17.373 -19.014 1.00 0.00 O ATOM 1309 CG2 THR A 84 9.273 -17.162 -17.064 1.00 0.00 C ATOM 0 H THR A 84 11.351 -15.648 -17.936 1.00 0.00 H new ATOM 0 HA THR A 84 9.387 -15.563 -20.123 1.00 0.00 H new ATOM 0 HB THR A 84 9.894 -17.767 -19.016 1.00 0.00 H new ATOM 0 HG1 THR A 84 7.265 -16.626 -18.805 1.00 0.00 H new ATOM 0 HG21 THR A 84 8.995 -18.169 -16.753 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.292 -16.950 -16.739 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.591 -16.442 -16.612 1.00 0.00 H new ATOM 1317 N PHE A 85 9.295 -13.441 -18.079 1.00 0.00 N ATOM 1318 CA PHE A 85 8.588 -12.376 -17.377 1.00 0.00 C ATOM 1319 C PHE A 85 8.090 -11.317 -18.356 1.00 0.00 C ATOM 1320 O PHE A 85 6.984 -10.794 -18.213 1.00 0.00 O ATOM 1321 CB PHE A 85 9.501 -11.732 -16.332 1.00 0.00 C ATOM 1322 CG PHE A 85 8.841 -11.542 -14.996 1.00 0.00 C ATOM 1323 CD1 PHE A 85 8.324 -12.625 -14.303 1.00 0.00 C ATOM 1324 CD2 PHE A 85 8.739 -10.281 -14.432 1.00 0.00 C ATOM 1325 CE1 PHE A 85 7.716 -12.453 -13.074 1.00 0.00 C ATOM 1326 CE2 PHE A 85 8.132 -10.102 -13.203 1.00 0.00 C ATOM 1327 CZ PHE A 85 7.621 -11.190 -12.523 1.00 0.00 C ATOM 0 H PHE A 85 10.243 -13.199 -18.368 1.00 0.00 H new ATOM 0 HA PHE A 85 7.726 -12.815 -16.875 1.00 0.00 H new ATOM 0 HB2 PHE A 85 10.389 -12.352 -16.205 1.00 0.00 H new ATOM 0 HB3 PHE A 85 9.838 -10.764 -16.703 1.00 0.00 H new ATOM 0 HD1 PHE A 85 8.397 -13.615 -14.728 1.00 0.00 H new ATOM 0 HD2 PHE A 85 9.139 -9.427 -14.959 1.00 0.00 H new ATOM 0 HE1 PHE A 85 7.316 -13.305 -12.545 1.00 0.00 H new ATOM 0 HE2 PHE A 85 8.058 -9.113 -12.775 1.00 0.00 H new ATOM 0 HZ PHE A 85 7.148 -11.053 -11.562 1.00 0.00 H new ATOM 1337 N LEU A 86 8.914 -11.004 -19.349 1.00 0.00 N ATOM 1338 CA LEU A 86 8.559 -10.006 -20.353 1.00 0.00 C ATOM 1339 C LEU A 86 8.447 -10.640 -21.736 1.00 0.00 C ATOM 1340 O LEU A 86 7.821 -10.082 -22.636 1.00 0.00 O ATOM 1341 CB LEU A 86 9.600 -8.885 -20.376 1.00 0.00 C ATOM 1342 CG LEU A 86 11.063 -9.328 -20.401 1.00 0.00 C ATOM 1343 CD1 LEU A 86 11.419 -9.918 -21.756 1.00 0.00 C ATOM 1344 CD2 LEU A 86 11.980 -8.159 -20.069 1.00 0.00 C ATOM 0 H LEU A 86 9.833 -11.426 -19.481 1.00 0.00 H new ATOM 0 HA LEU A 86 7.589 -9.587 -20.086 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.415 -8.262 -21.251 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.447 -8.256 -19.499 1.00 0.00 H new ATOM 0 HG LEU A 86 11.202 -10.100 -19.644 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.464 -10.228 -21.755 1.00 0.00 H new ATOM 0 HD12 LEU A 86 10.785 -10.782 -21.955 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.264 -9.168 -22.532 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.017 -8.493 -20.091 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.838 -7.365 -20.803 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.742 -7.781 -19.075 1.00 0.00 H new ATOM 1356 N ALA A 87 9.057 -11.810 -21.895 1.00 0.00 N ATOM 1357 CA ALA A 87 9.022 -12.522 -23.167 1.00 0.00 C ATOM 1358 C ALA A 87 7.760 -13.369 -23.287 1.00 0.00 C ATOM 1359 O ALA A 87 7.398 -13.809 -24.378 1.00 0.00 O ATOM 1360 CB ALA A 87 10.261 -13.393 -23.318 1.00 0.00 C ATOM 0 H ALA A 87 9.581 -12.285 -21.160 1.00 0.00 H new ATOM 0 HA ALA A 87 9.010 -11.784 -23.969 1.00 0.00 H new ATOM 0 HB1 ALA A 87 10.222 -13.919 -24.272 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.152 -12.767 -23.285 1.00 0.00 H new ATOM 0 HB3 ALA A 87 10.297 -14.118 -22.505 1.00 0.00 H new ATOM 1366 N ALA A 88 7.094 -13.594 -22.159 1.00 0.00 N ATOM 1367 CA ALA A 88 5.871 -14.387 -22.139 1.00 0.00 C ATOM 1368 C ALA A 88 4.791 -13.753 -23.010 1.00 0.00 C ATOM 1369 O ALA A 88 4.130 -14.437 -23.790 1.00 0.00 O ATOM 1370 CB ALA A 88 5.372 -14.551 -20.712 1.00 0.00 C ATOM 0 H ALA A 88 7.381 -13.238 -21.247 1.00 0.00 H new ATOM 0 HA ALA A 88 6.099 -15.371 -22.548 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.458 -15.145 -20.712 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.133 -15.055 -20.116 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.167 -13.570 -20.283 1.00 0.00 H new ATOM 1376 N ALA A 89 4.619 -12.443 -22.871 1.00 0.00 N ATOM 1377 CA ALA A 89 3.620 -11.717 -23.646 1.00 0.00 C ATOM 1378 C ALA A 89 3.749 -12.027 -25.134 1.00 0.00 C ATOM 1379 O ALA A 89 2.963 -12.797 -25.687 1.00 0.00 O ATOM 1380 CB ALA A 89 3.749 -10.221 -23.404 1.00 0.00 C ATOM 0 H ALA A 89 5.158 -11.862 -22.229 1.00 0.00 H new ATOM 0 HA ALA A 89 2.633 -12.043 -23.317 1.00 0.00 H new ATOM 0 HB1 ALA A 89 2.997 -9.692 -23.989 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.600 -10.010 -22.345 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.743 -9.888 -23.704 1.00 0.00 H new ATOM 1386 N ASP A 90 4.743 -11.424 -25.775 1.00 0.00 N ATOM 1387 CA ASP A 90 4.974 -11.636 -27.200 1.00 0.00 C ATOM 1388 C ASP A 90 6.176 -10.829 -27.681 1.00 0.00 C ATOM 1389 O ASP A 90 6.855 -10.174 -26.889 1.00 0.00 O ATOM 1390 CB ASP A 90 3.731 -11.250 -28.003 1.00 0.00 C ATOM 1391 CG ASP A 90 3.046 -12.452 -28.622 1.00 0.00 C ATOM 1392 OD1 ASP A 90 3.756 -13.392 -29.036 1.00 0.00 O ATOM 1393 OD2 ASP A 90 1.799 -12.453 -28.692 1.00 0.00 O ATOM 0 H ASP A 90 5.402 -10.784 -25.331 1.00 0.00 H new ATOM 0 HA ASP A 90 5.183 -12.694 -27.356 1.00 0.00 H new ATOM 0 HB2 ASP A 90 3.028 -10.730 -27.352 1.00 0.00 H new ATOM 0 HB3 ASP A 90 4.013 -10.551 -28.790 1.00 0.00 H new ATOM 1453 N LYS A 96 9.601 -6.094 -25.617 1.00 0.00 N ATOM 1454 CA LYS A 96 9.571 -5.049 -24.600 1.00 0.00 C ATOM 1455 C LYS A 96 8.139 -4.745 -24.174 1.00 0.00 C ATOM 1456 O LYS A 96 7.410 -4.041 -24.874 1.00 0.00 O ATOM 1457 CB LYS A 96 10.240 -3.777 -25.127 1.00 0.00 C ATOM 1458 CG LYS A 96 10.266 -3.687 -26.642 1.00 0.00 C ATOM 1459 CD LYS A 96 8.875 -3.469 -27.213 1.00 0.00 C ATOM 1460 CE LYS A 96 8.916 -3.261 -28.719 1.00 0.00 C ATOM 1461 NZ LYS A 96 8.853 -1.818 -29.081 1.00 0.00 N ATOM 0 HA LYS A 96 10.121 -5.407 -23.730 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.715 -2.909 -24.729 1.00 0.00 H new ATOM 0 HB3 LYS A 96 11.262 -3.732 -24.751 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.918 -2.868 -26.947 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.690 -4.603 -27.054 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.246 -4.329 -26.981 1.00 0.00 H new ATOM 0 HD3 LYS A 96 8.417 -2.602 -26.737 1.00 0.00 H new ATOM 0 HE2 LYS A 96 9.831 -3.697 -29.121 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.082 -3.788 -29.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.883 -1.718 -30.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.968 -1.408 -28.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 9.663 -1.319 -28.661 1.00 0.00 H new ATOM 1475 N ILE A 97 7.742 -5.277 -23.023 1.00 0.00 N ATOM 1476 CA ILE A 97 6.398 -5.059 -22.504 1.00 0.00 C ATOM 1477 C ILE A 97 6.283 -3.696 -21.831 1.00 0.00 C ATOM 1478 O ILE A 97 7.232 -3.215 -21.213 1.00 0.00 O ATOM 1479 CB ILE A 97 6.000 -6.153 -21.495 1.00 0.00 C ATOM 1480 CG1 ILE A 97 6.015 -7.527 -22.167 1.00 0.00 C ATOM 1481 CG2 ILE A 97 4.627 -5.859 -20.909 1.00 0.00 C ATOM 1482 CD1 ILE A 97 5.507 -8.640 -21.278 1.00 0.00 C ATOM 0 H ILE A 97 8.332 -5.862 -22.432 1.00 0.00 H new ATOM 0 HA ILE A 97 5.720 -5.099 -23.357 1.00 0.00 H new ATOM 0 HB ILE A 97 6.727 -6.159 -20.683 1.00 0.00 H new ATOM 0 HG12 ILE A 97 5.406 -7.487 -23.070 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.033 -7.759 -22.479 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.360 -6.641 -20.198 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.648 -4.896 -20.399 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.888 -5.829 -21.710 1.00 0.00 H new ATOM 0 HD11 ILE A 97 5.546 -9.585 -21.820 1.00 0.00 H new ATOM 0 HD12 ILE A 97 6.130 -8.707 -20.386 1.00 0.00 H new ATOM 0 HD13 ILE A 97 4.478 -8.432 -20.986 1.00 0.00 H new ATOM 1494 N GLY A 98 5.112 -3.078 -21.953 1.00 0.00 N ATOM 1495 CA GLY A 98 4.893 -1.777 -21.350 1.00 0.00 C ATOM 1496 C GLY A 98 3.636 -1.734 -20.504 1.00 0.00 C ATOM 1497 O GLY A 98 3.670 -2.042 -19.314 1.00 0.00 O ATOM 0 H GLY A 98 4.311 -3.456 -22.459 1.00 0.00 H new ATOM 0 HA2 GLY A 98 5.752 -1.517 -20.732 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.825 -1.023 -22.134 1.00 0.00 H new ATOM 1501 N ALA A 99 2.523 -1.348 -21.121 1.00 0.00 N ATOM 1502 CA ALA A 99 1.249 -1.266 -20.417 1.00 0.00 C ATOM 1503 C ALA A 99 0.096 -1.698 -21.316 1.00 0.00 C ATOM 1504 O ALA A 99 -1.071 -1.479 -20.992 1.00 0.00 O ATOM 1505 CB ALA A 99 1.020 0.148 -19.903 1.00 0.00 C ATOM 0 H ALA A 99 2.478 -1.087 -22.106 1.00 0.00 H new ATOM 0 HA ALA A 99 1.287 -1.948 -19.567 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.065 0.195 -19.379 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.823 0.421 -19.218 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.008 0.843 -20.743 1.00 0.00 H new ATOM 1511 N GLU A 100 0.431 -2.311 -22.447 1.00 0.00 N ATOM 1512 CA GLU A 100 -0.578 -2.772 -23.393 1.00 0.00 C ATOM 1513 C GLU A 100 -0.407 -4.258 -23.691 1.00 0.00 C ATOM 1514 O GLU A 100 -1.280 -4.886 -24.289 1.00 0.00 O ATOM 1515 CB GLU A 100 -0.496 -1.967 -24.693 1.00 0.00 C ATOM 1516 CG GLU A 100 0.886 -1.973 -25.325 1.00 0.00 C ATOM 1517 CD GLU A 100 1.794 -0.901 -24.754 1.00 0.00 C ATOM 1518 OE1 GLU A 100 1.400 0.284 -24.775 1.00 0.00 O ATOM 1519 OE2 GLU A 100 2.898 -1.248 -24.285 1.00 0.00 O ATOM 0 H GLU A 100 1.393 -2.500 -22.730 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.558 -2.621 -22.941 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.215 -2.370 -25.406 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.790 -0.937 -24.492 1.00 0.00 H new ATOM 0 HG2 GLU A 100 1.345 -2.950 -25.176 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.790 -1.827 -26.401 1.00 0.00 H new ATOM 1526 N GLU A 101 0.725 -4.813 -23.270 1.00 0.00 N ATOM 1527 CA GLU A 101 1.012 -6.226 -23.492 1.00 0.00 C ATOM 1528 C GLU A 101 0.949 -7.007 -22.183 1.00 0.00 C ATOM 1529 O GLU A 101 0.660 -8.204 -22.174 1.00 0.00 O ATOM 1530 CB GLU A 101 2.391 -6.394 -24.134 1.00 0.00 C ATOM 1531 CG GLU A 101 2.492 -5.794 -25.526 1.00 0.00 C ATOM 1532 CD GLU A 101 3.894 -5.879 -26.098 1.00 0.00 C ATOM 1533 OE1 GLU A 101 4.848 -6.045 -25.309 1.00 0.00 O ATOM 1534 OE2 GLU A 101 4.036 -5.780 -27.335 1.00 0.00 O ATOM 0 H GLU A 101 1.458 -4.306 -22.774 1.00 0.00 H new ATOM 0 HA GLU A 101 0.254 -6.623 -24.167 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.140 -5.930 -23.492 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.631 -7.456 -24.187 1.00 0.00 H new ATOM 0 HG2 GLU A 101 1.800 -6.311 -26.191 1.00 0.00 H new ATOM 0 HG3 GLU A 101 2.181 -4.750 -25.491 1.00 0.00 H new ATOM 1541 N PHE A 102 1.223 -6.321 -21.078 1.00 0.00 N ATOM 1542 CA PHE A 102 1.200 -6.949 -19.762 1.00 0.00 C ATOM 1543 C PHE A 102 -0.233 -7.237 -19.323 1.00 0.00 C ATOM 1544 O PHE A 102 -0.505 -8.258 -18.692 1.00 0.00 O ATOM 1545 CB PHE A 102 1.891 -6.053 -18.733 1.00 0.00 C ATOM 1546 CG PHE A 102 2.195 -6.751 -17.438 1.00 0.00 C ATOM 1547 CD1 PHE A 102 1.173 -7.135 -16.586 1.00 0.00 C ATOM 1548 CD2 PHE A 102 3.504 -7.022 -17.073 1.00 0.00 C ATOM 1549 CE1 PHE A 102 1.449 -7.778 -15.394 1.00 0.00 C ATOM 1550 CE2 PHE A 102 3.787 -7.665 -15.883 1.00 0.00 C ATOM 1551 CZ PHE A 102 2.758 -8.042 -15.042 1.00 0.00 C ATOM 0 H PHE A 102 1.464 -5.330 -21.068 1.00 0.00 H new ATOM 0 HA PHE A 102 1.738 -7.894 -19.828 1.00 0.00 H new ATOM 0 HB2 PHE A 102 2.820 -5.674 -19.159 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.257 -5.190 -18.531 1.00 0.00 H new ATOM 0 HD1 PHE A 102 0.148 -6.930 -16.856 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.312 -6.727 -17.726 1.00 0.00 H new ATOM 0 HE1 PHE A 102 0.643 -8.073 -14.739 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.811 -7.873 -15.611 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.977 -8.543 -14.110 1.00 0.00 H new ATOM 1561 N GLN A 103 -1.143 -6.329 -19.660 1.00 0.00 N ATOM 1562 CA GLN A 103 -2.547 -6.484 -19.298 1.00 0.00 C ATOM 1563 C GLN A 103 -3.157 -7.697 -19.993 1.00 0.00 C ATOM 1564 O GLN A 103 -4.003 -8.388 -19.427 1.00 0.00 O ATOM 1565 CB GLN A 103 -3.332 -5.224 -19.665 1.00 0.00 C ATOM 1566 CG GLN A 103 -3.192 -4.103 -18.648 1.00 0.00 C ATOM 1567 CD GLN A 103 -1.753 -3.866 -18.234 1.00 0.00 C ATOM 1568 OE1 GLN A 103 -1.404 -3.991 -17.060 1.00 0.00 O ATOM 1569 NE2 GLN A 103 -0.908 -3.523 -19.199 1.00 0.00 N ATOM 0 H GLN A 103 -0.933 -5.479 -20.183 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.604 -6.638 -18.220 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.994 -4.866 -20.637 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -4.386 -5.480 -19.769 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -3.601 -3.184 -19.068 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -3.785 -4.342 -17.765 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -1.240 -3.431 -20.159 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.073 -3.352 -18.980 1.00 0.00 H new ATOM 1578 N GLU A 104 -2.720 -7.950 -21.223 1.00 0.00 N ATOM 1579 CA GLU A 104 -3.225 -9.080 -21.995 1.00 0.00 C ATOM 1580 C GLU A 104 -2.616 -10.390 -21.504 1.00 0.00 C ATOM 1581 O GLU A 104 -3.077 -11.473 -21.861 1.00 0.00 O ATOM 1582 CB GLU A 104 -2.919 -8.888 -23.482 1.00 0.00 C ATOM 1583 CG GLU A 104 -3.905 -7.977 -24.194 1.00 0.00 C ATOM 1584 CD GLU A 104 -5.140 -8.715 -24.672 1.00 0.00 C ATOM 1585 OE1 GLU A 104 -5.058 -9.945 -24.871 1.00 0.00 O ATOM 1586 OE2 GLU A 104 -6.190 -8.061 -24.846 1.00 0.00 O ATOM 0 H GLU A 104 -2.018 -7.389 -21.706 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.305 -9.127 -21.857 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.915 -8.476 -23.587 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -2.917 -9.861 -23.973 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -4.204 -7.174 -23.520 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -3.412 -7.510 -25.047 1.00 0.00 H new ATOM 1593 N MET A 105 -1.577 -10.281 -20.683 1.00 0.00 N ATOM 1594 CA MET A 105 -0.904 -11.457 -20.142 1.00 0.00 C ATOM 1595 C MET A 105 -1.579 -11.926 -18.856 1.00 0.00 C ATOM 1596 O MET A 105 -1.516 -13.104 -18.504 1.00 0.00 O ATOM 1597 CB MET A 105 0.571 -11.150 -19.875 1.00 0.00 C ATOM 1598 CG MET A 105 1.207 -12.071 -18.847 1.00 0.00 C ATOM 1599 SD MET A 105 2.987 -12.243 -19.077 1.00 0.00 S ATOM 1600 CE MET A 105 3.457 -10.539 -19.367 1.00 0.00 C ATOM 0 H MET A 105 -1.183 -9.391 -20.378 1.00 0.00 H new ATOM 0 HA MET A 105 -0.973 -12.256 -20.880 1.00 0.00 H new ATOM 0 HB2 MET A 105 1.125 -11.226 -20.811 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.663 -10.119 -19.533 1.00 0.00 H new ATOM 0 HG2 MET A 105 1.009 -11.685 -17.847 1.00 0.00 H new ATOM 0 HG3 MET A 105 0.740 -13.054 -18.907 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.544 -10.460 -19.386 1.00 0.00 H new ATOM 0 HE2 MET A 105 3.052 -10.208 -20.323 1.00 0.00 H new ATOM 0 HE3 MET A 105 3.061 -9.911 -18.568 1.00 0.00 H new ATOM 1610 N VAL A 106 -2.223 -10.996 -18.159 1.00 0.00 N ATOM 1611 CA VAL A 106 -2.910 -11.314 -16.913 1.00 0.00 C ATOM 1612 C VAL A 106 -4.423 -11.218 -17.079 1.00 0.00 C ATOM 1613 O VAL A 106 -5.141 -12.199 -16.887 1.00 0.00 O ATOM 1614 CB VAL A 106 -2.469 -10.376 -15.773 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -3.214 -10.709 -14.489 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -0.965 -10.463 -15.564 1.00 0.00 C ATOM 0 H VAL A 106 -2.283 -10.016 -18.436 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.640 -12.338 -16.656 1.00 0.00 H new ATOM 0 HB VAL A 106 -2.716 -9.352 -16.053 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -2.889 -10.036 -13.695 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.286 -10.591 -14.649 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.001 -11.739 -14.202 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -0.671 -9.794 -14.755 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.692 -11.486 -15.306 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.453 -10.171 -16.481 1.00 0.00 H new ATOM 1626 N GLN A 107 -4.899 -10.030 -17.436 1.00 0.00 N ATOM 1627 CA GLN A 107 -6.327 -9.806 -17.627 1.00 0.00 C ATOM 1628 C GLN A 107 -6.900 -10.788 -18.644 1.00 0.00 C ATOM 1629 O GLN A 107 -7.989 -11.331 -18.451 1.00 0.00 O ATOM 1630 CB GLN A 107 -6.582 -8.370 -18.088 1.00 0.00 C ATOM 1631 CG GLN A 107 -5.845 -7.327 -17.264 1.00 0.00 C ATOM 1632 CD GLN A 107 -5.680 -7.738 -15.815 1.00 0.00 C ATOM 1633 OE1 GLN A 107 -4.579 -8.070 -15.373 1.00 0.00 O ATOM 1634 NE2 GLN A 107 -6.775 -7.718 -15.065 1.00 0.00 N ATOM 0 H GLN A 107 -4.317 -9.208 -17.599 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.826 -9.967 -16.671 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -6.283 -8.274 -19.132 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -7.652 -8.167 -18.043 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -4.862 -7.151 -17.702 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.388 -6.383 -17.310 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -7.667 -7.436 -15.472 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -6.725 -7.984 -14.082 1.00 0.00 H new ATOM 1643 N SER A 108 -6.161 -11.012 -19.725 1.00 0.00 N ATOM 1644 CA SER A 108 -6.598 -11.926 -20.774 1.00 0.00 C ATOM 1645 C SER A 108 -5.498 -12.925 -21.117 1.00 0.00 C ATOM 1646 O SER A 108 -5.225 -13.185 -22.288 1.00 0.00 O ATOM 1647 CB SER A 108 -7.001 -11.144 -22.026 1.00 0.00 C ATOM 1648 OG SER A 108 -7.469 -12.014 -23.042 1.00 0.00 O ATOM 0 H SER A 108 -5.257 -10.573 -19.898 1.00 0.00 H new ATOM 0 HA SER A 108 -7.463 -12.477 -20.404 1.00 0.00 H new ATOM 0 HB2 SER A 108 -7.779 -10.423 -21.774 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.147 -10.576 -22.394 1.00 0.00 H new ATOM 0 HG SER A 108 -6.802 -12.713 -23.207 1.00 0.00 H new