USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1063 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 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 103 HIS : no HE2:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 6 LYS NZ :NH3+ 152:sc= -0.136 (180deg=-0.968) USER MOD Single : A 7 TYR OH : rot -116:sc= -3.37! USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -19:sc= 0.143 USER MOD Single : A 29 LYS NZ :NH3+ -176:sc= -0.76 (180deg=-0.781) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.0179 USER MOD Single : A 36 SER OG : rot 112:sc= -0.705 USER MOD Single : A 38 SER OG : rot -153:sc= 0.228 USER MOD Single : A 47 THR OG1 : rot 180:sc= -2.13 USER MOD Single : A 49 GLN : amide:sc= -0.0934 X(o=-0.093,f=0) USER MOD Single : A 54 TYR OH : rot 79:sc= 1.34 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.365 K(o=-0.36,f=-2.5) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -4.48 K(o=-4.5,f=-5.7!) USER MOD Single : A 68 CYS SG : rot 175:sc= -1.23 USER MOD Single : A 69 THR OG1 : rot -140:sc= -0.378 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -144:sc= 1.18 (180deg=0.0818) USER MOD Single : A 84 MET CE :methyl -172:sc= -5.04! (180deg=-5.19!) USER MOD Single : A 93 GLN : amide:sc= -3.37! C(o=-3.4!,f=-6.1!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.287 K(o=-0.29,f=-1.8!) USER MOD Single : A 101 SER OG : rot -75:sc= 1.26 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -3.25 K(o=-3.3,f=-2.5) USER MOD Single : A 108 SER OG : rot -7:sc= 1 USER MOD Single : A 111 THR OG1 : rot -150:sc=-0.000446 USER MOD Single : A 119 SER OG : rot 136:sc= 0.645 USER MOD Single : A 124 THR OG1 : rot -120:sc= -0.329 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.0014 USER MOD Single : A 130 THR OG1 : rot 127:sc= 0.209 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.203 K(o=-0.2,f=-2.5!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -4.353 12.279 3.240 1.00 0.00 N ATOM 22 CA LEU A 4 -4.298 11.427 2.057 1.00 0.00 C ATOM 23 C LEU A 4 -5.030 12.073 0.883 1.00 0.00 C ATOM 24 O LEU A 4 -4.738 11.783 -0.277 1.00 0.00 O ATOM 25 CB LEU A 4 -4.907 10.056 2.362 1.00 0.00 C ATOM 26 CG LEU A 4 -3.935 9.034 2.951 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.630 7.699 3.168 1.00 0.00 C ATOM 28 CD2 LEU A 4 -2.725 8.866 2.043 1.00 0.00 C ATOM 0 HA LEU A 4 -3.251 11.299 1.781 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -5.736 10.190 3.058 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.326 9.648 1.442 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.592 9.402 3.918 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -3.922 6.984 3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.464 7.831 3.857 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.003 7.324 2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -2.043 8.135 2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -3.051 8.520 1.062 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.213 9.823 1.939 1.00 0.00 H new ATOM 40 N ASP A 5 -5.980 12.951 1.192 1.00 0.00 N ATOM 41 CA ASP A 5 -6.750 13.639 0.163 1.00 0.00 C ATOM 42 C ASP A 5 -5.835 14.442 -0.756 1.00 0.00 C ATOM 43 O ASP A 5 -6.017 14.454 -1.973 1.00 0.00 O ATOM 44 CB ASP A 5 -7.787 14.562 0.804 1.00 0.00 C ATOM 45 CG ASP A 5 -9.127 13.882 0.997 1.00 0.00 C ATOM 46 OD1 ASP A 5 -9.165 12.820 1.655 1.00 0.00 O ATOM 47 OD2 ASP A 5 -10.140 14.410 0.493 1.00 0.00 O ATOM 0 H ASP A 5 -6.234 13.202 2.147 1.00 0.00 H new ATOM 0 HA ASP A 5 -7.264 12.886 -0.435 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -7.415 14.906 1.769 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.918 15.446 0.179 1.00 0.00 H new ATOM 52 N LYS A 6 -4.850 15.111 -0.165 1.00 0.00 N ATOM 53 CA LYS A 6 -3.906 15.917 -0.934 1.00 0.00 C ATOM 54 C LYS A 6 -2.876 15.033 -1.633 1.00 0.00 C ATOM 55 O LYS A 6 -2.344 15.394 -2.682 1.00 0.00 O ATOM 56 CB LYS A 6 -3.201 16.924 -0.025 1.00 0.00 C ATOM 57 CG LYS A 6 -2.346 16.279 1.053 1.00 0.00 C ATOM 58 CD LYS A 6 -1.068 17.064 1.297 1.00 0.00 C ATOM 59 CE LYS A 6 0.004 16.711 0.278 1.00 0.00 C ATOM 60 NZ LYS A 6 0.022 17.667 -0.864 1.00 0.00 N ATOM 0 H LYS A 6 -4.684 15.112 0.841 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.467 16.459 -1.695 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.573 17.573 -0.635 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.950 17.559 0.449 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.916 16.213 1.980 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.097 15.259 0.759 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -1.281 18.132 1.248 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -0.699 16.858 2.302 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.980 16.708 0.764 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.169 15.702 -0.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.981 17.714 -1.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.642 17.345 -1.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.261 18.611 -0.531 1.00 0.00 H new ATOM 74 N TYR A 7 -2.599 13.872 -1.044 1.00 0.00 N ATOM 75 CA TYR A 7 -1.634 12.939 -1.610 1.00 0.00 C ATOM 76 C TYR A 7 -2.110 12.420 -2.964 1.00 0.00 C ATOM 77 O TYR A 7 -1.304 12.109 -3.840 1.00 0.00 O ATOM 78 CB TYR A 7 -1.405 11.767 -0.653 1.00 0.00 C ATOM 79 CG TYR A 7 -0.249 11.982 0.295 1.00 0.00 C ATOM 80 CD1 TYR A 7 -0.440 12.602 1.523 1.00 0.00 C ATOM 81 CD2 TYR A 7 1.034 11.565 -0.036 1.00 0.00 C ATOM 82 CE1 TYR A 7 0.615 12.802 2.393 1.00 0.00 C ATOM 83 CE2 TYR A 7 2.094 11.762 0.828 1.00 0.00 C ATOM 84 CZ TYR A 7 1.880 12.380 2.041 1.00 0.00 C ATOM 85 OH TYR A 7 2.931 12.579 2.904 1.00 0.00 O ATOM 0 H TYR A 7 -3.030 13.557 -0.175 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.693 13.470 -1.755 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.313 11.598 -0.074 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -1.225 10.863 -1.235 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -1.429 12.933 1.803 1.00 0.00 H new ATOM 0 HD2 TYR A 7 1.206 11.079 -0.985 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.450 13.286 3.344 1.00 0.00 H new ATOM 0 HE2 TYR A 7 3.086 11.433 0.554 1.00 0.00 H new ATOM 0 HH TYR A 7 3.581 13.187 2.493 1.00 0.00 H new ATOM 135 N ILE A 11 -9.398 10.605 -3.650 1.00 0.00 N ATOM 136 CA ILE A 11 -9.884 9.233 -3.577 1.00 0.00 C ATOM 137 C ILE A 11 -11.158 9.148 -2.743 1.00 0.00 C ATOM 138 O ILE A 11 -11.114 9.221 -1.515 1.00 0.00 O ATOM 139 CB ILE A 11 -8.824 8.289 -2.975 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.450 8.567 -3.590 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.224 6.838 -3.190 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.372 8.251 -5.068 1.00 0.00 C ATOM 0 HA ILE A 11 -10.098 8.918 -4.598 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.763 8.473 -1.902 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.199 9.617 -3.438 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.699 7.980 -3.061 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.466 6.184 -2.760 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.183 6.649 -2.707 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.311 6.639 -4.258 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.370 8.473 -5.435 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.591 7.195 -5.226 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.099 8.857 -5.609 1.00 0.00 H new ATOM 154 N GLU A 12 -12.293 8.997 -3.418 1.00 0.00 N ATOM 155 CA GLU A 12 -13.583 8.907 -2.742 1.00 0.00 C ATOM 156 C GLU A 12 -13.648 7.678 -1.840 1.00 0.00 C ATOM 157 O GLU A 12 -13.757 7.798 -0.621 1.00 0.00 O ATOM 158 CB GLU A 12 -14.715 8.860 -3.768 1.00 0.00 C ATOM 159 CG GLU A 12 -15.989 9.546 -3.300 1.00 0.00 C ATOM 160 CD GLU A 12 -15.983 11.037 -3.578 1.00 0.00 C ATOM 161 OE1 GLU A 12 -15.947 11.418 -4.767 1.00 0.00 O ATOM 162 OE2 GLU A 12 -16.015 11.822 -2.608 1.00 0.00 O ATOM 0 H GLU A 12 -12.346 8.934 -4.435 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.699 9.794 -2.120 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.377 9.330 -4.691 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -14.938 7.819 -4.003 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.846 9.091 -3.796 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.115 9.380 -2.230 1.00 0.00 H new ATOM 169 N LYS A 13 -13.588 6.499 -2.448 1.00 0.00 N ATOM 170 CA LYS A 13 -13.646 5.245 -1.697 1.00 0.00 C ATOM 171 C LYS A 13 -12.730 4.195 -2.316 1.00 0.00 C ATOM 172 O LYS A 13 -12.263 4.351 -3.443 1.00 0.00 O ATOM 173 CB LYS A 13 -15.082 4.718 -1.654 1.00 0.00 C ATOM 174 CG LYS A 13 -16.095 5.741 -1.166 1.00 0.00 C ATOM 175 CD LYS A 13 -17.520 5.287 -1.437 1.00 0.00 C ATOM 176 CE LYS A 13 -18.394 6.439 -1.909 1.00 0.00 C ATOM 177 NZ LYS A 13 -19.222 6.060 -3.088 1.00 0.00 N ATOM 0 H LYS A 13 -13.499 6.382 -3.457 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.306 5.445 -0.681 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.367 4.385 -2.652 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.119 3.844 -1.004 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.962 5.905 -0.097 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.916 6.696 -1.660 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.515 4.501 -2.192 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.944 4.856 -0.530 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -19.045 6.758 -1.095 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.764 7.291 -2.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.803 6.872 -3.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.600 5.780 -3.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -19.841 5.264 -2.836 1.00 0.00 H new ATOM 191 N LEU A 14 -12.482 3.125 -1.569 1.00 0.00 N ATOM 192 CA LEU A 14 -11.624 2.044 -2.039 1.00 0.00 C ATOM 193 C LEU A 14 -12.445 0.798 -2.356 1.00 0.00 C ATOM 194 O LEU A 14 -13.603 0.689 -1.957 1.00 0.00 O ATOM 195 CB LEU A 14 -10.559 1.716 -0.991 1.00 0.00 C ATOM 196 CG LEU A 14 -9.536 2.825 -0.740 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.016 2.757 0.688 1.00 0.00 C ATOM 198 CD2 LEU A 14 -8.387 2.722 -1.732 1.00 0.00 C ATOM 0 H LEU A 14 -12.864 2.983 -0.634 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.132 2.375 -2.953 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.057 1.482 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.028 0.817 -1.303 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.028 3.787 -0.881 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.289 3.553 0.849 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.846 2.878 1.384 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.539 1.791 0.856 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -7.668 3.518 -1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.896 1.755 -1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.773 2.819 -2.747 1.00 0.00 H new ATOM 210 N ARG A 15 -11.833 -0.142 -3.070 1.00 0.00 N ATOM 211 CA ARG A 15 -12.494 -1.380 -3.436 1.00 0.00 C ATOM 212 C ARG A 15 -12.000 -2.523 -2.572 1.00 0.00 C ATOM 213 O ARG A 15 -10.910 -3.059 -2.773 1.00 0.00 O ATOM 214 CB ARG A 15 -12.263 -1.715 -4.902 1.00 0.00 C ATOM 215 CG ARG A 15 -12.412 -0.526 -5.837 1.00 0.00 C ATOM 216 CD ARG A 15 -12.257 -0.940 -7.290 1.00 0.00 C ATOM 217 NE ARG A 15 -13.213 -1.978 -7.669 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.077 -2.757 -8.740 1.00 0.00 C ATOM 219 NH1 ARG A 15 -12.027 -2.619 -9.541 1.00 0.00 N ATOM 220 NH2 ARG A 15 -13.993 -3.676 -9.012 1.00 0.00 N ATOM 0 H ARG A 15 -10.873 -0.064 -3.406 1.00 0.00 H new ATOM 0 HA ARG A 15 -13.563 -1.242 -3.274 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -11.262 -2.131 -5.016 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -12.967 -2.491 -5.202 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -13.389 -0.066 -5.690 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -11.665 0.228 -5.590 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -12.394 -0.069 -7.931 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -11.243 -1.303 -7.457 1.00 0.00 H new ATOM 0 HE ARG A 15 -14.033 -2.114 -7.078 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.319 -1.913 -9.337 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -11.928 -3.219 -10.360 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.802 -3.786 -8.401 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -13.889 -4.273 -9.833 1.00 0.00 H new ATOM 234 N ARG A 16 -12.821 -2.878 -1.614 1.00 0.00 N ATOM 235 CA ARG A 16 -12.516 -3.958 -0.682 1.00 0.00 C ATOM 236 C ARG A 16 -13.042 -5.295 -1.198 1.00 0.00 C ATOM 237 O ARG A 16 -13.633 -6.070 -0.445 1.00 0.00 O ATOM 238 CB ARG A 16 -13.121 -3.657 0.690 1.00 0.00 C ATOM 239 CG ARG A 16 -12.727 -4.660 1.764 1.00 0.00 C ATOM 240 CD ARG A 16 -12.194 -3.968 3.008 1.00 0.00 C ATOM 241 NE ARG A 16 -12.009 -4.901 4.118 1.00 0.00 N ATOM 242 CZ ARG A 16 -13.001 -5.337 4.892 1.00 0.00 C ATOM 243 NH1 ARG A 16 -14.245 -4.928 4.681 1.00 0.00 N ATOM 244 NH2 ARG A 16 -12.745 -6.184 5.879 1.00 0.00 N ATOM 0 H ARG A 16 -13.723 -2.431 -1.451 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.432 -4.028 -0.591 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -12.810 -2.661 1.004 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -14.207 -3.639 0.603 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.591 -5.269 2.028 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -11.968 -5.336 1.370 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.243 -3.488 2.776 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -12.885 -3.180 3.308 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.066 -5.237 4.311 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -14.446 -4.276 3.923 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -15.001 -5.265 5.277 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -11.790 -6.501 6.044 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -13.503 -6.519 6.473 1.00 0.00 H new ATOM 258 N GLY A 17 -12.825 -5.561 -2.483 1.00 0.00 N ATOM 259 CA GLY A 17 -13.289 -6.805 -3.069 1.00 0.00 C ATOM 260 C GLY A 17 -14.791 -6.970 -2.956 1.00 0.00 C ATOM 261 O GLY A 17 -15.319 -7.165 -1.862 1.00 0.00 O ATOM 0 H GLY A 17 -12.337 -4.938 -3.127 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.000 -6.839 -4.119 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -12.796 -7.642 -2.576 1.00 0.00 H new ATOM 265 N ASP A 18 -15.480 -6.904 -4.094 1.00 0.00 N ATOM 266 CA ASP A 18 -16.927 -7.054 -4.138 1.00 0.00 C ATOM 267 C ASP A 18 -17.639 -5.879 -3.474 1.00 0.00 C ATOM 268 O ASP A 18 -18.501 -5.240 -4.079 1.00 0.00 O ATOM 269 CB ASP A 18 -17.313 -8.365 -3.478 1.00 0.00 C ATOM 270 CG ASP A 18 -18.615 -8.929 -4.012 1.00 0.00 C ATOM 271 OD1 ASP A 18 -19.671 -8.301 -3.787 1.00 0.00 O ATOM 272 OD2 ASP A 18 -18.578 -9.998 -4.657 1.00 0.00 O ATOM 0 H ASP A 18 -15.050 -6.746 -5.005 1.00 0.00 H new ATOM 0 HA ASP A 18 -17.244 -7.065 -5.181 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.516 -9.093 -3.632 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.402 -8.213 -2.402 1.00 0.00 H new ATOM 277 N GLY A 19 -17.273 -5.596 -2.234 1.00 0.00 N ATOM 278 CA GLY A 19 -17.882 -4.498 -1.508 1.00 0.00 C ATOM 279 C GLY A 19 -16.907 -3.365 -1.254 1.00 0.00 C ATOM 280 O GLY A 19 -15.717 -3.600 -1.041 1.00 0.00 O ATOM 0 H GLY A 19 -16.561 -6.109 -1.714 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.735 -4.121 -2.072 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.267 -4.864 -0.556 1.00 0.00 H new ATOM 284 N GLU A 20 -17.409 -2.136 -1.277 1.00 0.00 N ATOM 285 CA GLU A 20 -16.569 -0.966 -1.049 1.00 0.00 C ATOM 286 C GLU A 20 -16.657 -0.507 0.401 1.00 0.00 C ATOM 287 O GLU A 20 -17.673 -0.711 1.068 1.00 0.00 O ATOM 288 CB GLU A 20 -16.983 0.175 -1.979 1.00 0.00 C ATOM 289 CG GLU A 20 -16.220 0.192 -3.292 1.00 0.00 C ATOM 290 CD GLU A 20 -16.083 1.589 -3.869 1.00 0.00 C ATOM 291 OE1 GLU A 20 -17.056 2.076 -4.481 1.00 0.00 O ATOM 292 OE2 GLU A 20 -15.003 2.194 -3.708 1.00 0.00 O ATOM 0 H GLU A 20 -18.391 -1.924 -1.451 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.537 -1.246 -1.263 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -18.050 0.094 -2.189 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.830 1.125 -1.467 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -15.228 -0.232 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.730 -0.447 -4.013 1.00 0.00 H new ATOM 299 N VAL A 21 -15.588 0.116 0.885 1.00 0.00 N ATOM 300 CA VAL A 21 -15.549 0.606 2.258 1.00 0.00 C ATOM 301 C VAL A 21 -15.266 2.103 2.298 1.00 0.00 C ATOM 302 O VAL A 21 -14.358 2.592 1.626 1.00 0.00 O ATOM 303 CB VAL A 21 -14.480 -0.130 3.089 1.00 0.00 C ATOM 304 CG1 VAL A 21 -14.840 -1.599 3.240 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.109 0.029 2.454 1.00 0.00 C ATOM 0 H VAL A 21 -14.739 0.293 0.348 1.00 0.00 H new ATOM 0 HA VAL A 21 -16.530 0.412 2.691 1.00 0.00 H new ATOM 0 HB VAL A 21 -14.447 0.315 4.083 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -14.074 -2.103 3.830 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -15.802 -1.688 3.744 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -14.902 -2.061 2.255 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.367 -0.497 3.054 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.124 -0.389 1.447 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.852 1.087 2.404 1.00 0.00 H new ATOM 315 N GLU A 22 -16.048 2.826 3.092 1.00 0.00 N ATOM 316 CA GLU A 22 -15.881 4.268 3.221 1.00 0.00 C ATOM 317 C GLU A 22 -14.492 4.609 3.749 1.00 0.00 C ATOM 318 O GLU A 22 -13.934 3.883 4.571 1.00 0.00 O ATOM 319 CB GLU A 22 -16.949 4.846 4.152 1.00 0.00 C ATOM 320 CG GLU A 22 -18.365 4.698 3.620 1.00 0.00 C ATOM 321 CD GLU A 22 -19.137 3.591 4.313 1.00 0.00 C ATOM 322 OE1 GLU A 22 -18.496 2.635 4.797 1.00 0.00 O ATOM 323 OE2 GLU A 22 -20.381 3.682 4.372 1.00 0.00 O ATOM 0 H GLU A 22 -16.804 2.437 3.656 1.00 0.00 H new ATOM 0 HA GLU A 22 -15.994 4.711 2.232 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -16.880 4.352 5.121 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.741 5.903 4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -18.897 5.641 3.747 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -18.327 4.495 2.550 1.00 0.00 H new ATOM 330 N VAL A 23 -13.941 5.721 3.274 1.00 0.00 N ATOM 331 CA VAL A 23 -12.618 6.162 3.699 1.00 0.00 C ATOM 332 C VAL A 23 -12.551 6.313 5.219 1.00 0.00 C ATOM 333 O VAL A 23 -11.488 6.168 5.821 1.00 0.00 O ATOM 334 CB VAL A 23 -12.236 7.501 3.034 1.00 0.00 C ATOM 335 CG1 VAL A 23 -10.921 8.028 3.588 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.158 7.341 1.522 1.00 0.00 C ATOM 0 H VAL A 23 -14.391 6.334 2.594 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.908 5.397 3.386 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.013 8.230 3.264 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.674 8.972 3.103 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.016 8.186 4.662 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.129 7.304 3.396 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -11.888 8.295 1.069 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.404 6.594 1.274 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.127 7.019 1.140 1.00 0.00 H new ATOM 346 N LYS A 24 -13.696 6.604 5.828 1.00 0.00 N ATOM 347 CA LYS A 24 -13.778 6.775 7.276 1.00 0.00 C ATOM 348 C LYS A 24 -13.164 5.584 8.011 1.00 0.00 C ATOM 349 O LYS A 24 -12.680 5.720 9.135 1.00 0.00 O ATOM 350 CB LYS A 24 -15.235 6.956 7.706 1.00 0.00 C ATOM 351 CG LYS A 24 -15.422 7.992 8.803 1.00 0.00 C ATOM 352 CD LYS A 24 -15.602 9.388 8.228 1.00 0.00 C ATOM 353 CE LYS A 24 -14.264 10.052 7.947 1.00 0.00 C ATOM 354 NZ LYS A 24 -14.367 11.538 7.963 1.00 0.00 N ATOM 0 H LYS A 24 -14.583 6.727 5.340 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.211 7.668 7.539 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.828 7.247 6.839 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.625 5.999 8.052 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.292 7.731 9.406 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -14.558 7.980 9.467 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.182 9.331 7.307 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.173 9.999 8.927 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -13.536 9.731 8.692 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.893 9.724 6.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.434 11.953 7.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.043 11.847 7.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.697 11.853 8.898 1.00 0.00 H new ATOM 368 N SER A 25 -13.190 4.419 7.372 1.00 0.00 N ATOM 369 CA SER A 25 -12.636 3.206 7.968 1.00 0.00 C ATOM 370 C SER A 25 -11.143 3.363 8.257 1.00 0.00 C ATOM 371 O SER A 25 -10.574 2.608 9.044 1.00 0.00 O ATOM 372 CB SER A 25 -12.864 2.009 7.043 1.00 0.00 C ATOM 373 OG SER A 25 -12.357 0.817 7.618 1.00 0.00 O ATOM 0 H SER A 25 -13.588 4.288 6.442 1.00 0.00 H new ATOM 0 HA SER A 25 -13.150 3.033 8.913 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.930 1.896 6.845 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.379 2.189 6.084 1.00 0.00 H new ATOM 0 HG SER A 25 -11.715 1.041 8.323 1.00 0.00 H new ATOM 379 N LEU A 26 -10.517 4.351 7.623 1.00 0.00 N ATOM 380 CA LEU A 26 -9.097 4.608 7.820 1.00 0.00 C ATOM 381 C LEU A 26 -8.900 5.904 8.598 1.00 0.00 C ATOM 382 O LEU A 26 -8.100 6.759 8.220 1.00 0.00 O ATOM 383 CB LEU A 26 -8.369 4.686 6.472 1.00 0.00 C ATOM 384 CG LEU A 26 -8.836 3.687 5.407 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.788 3.546 4.314 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.139 2.331 6.031 1.00 0.00 C ATOM 0 H LEU A 26 -10.973 4.986 6.968 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.674 3.783 8.393 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.486 5.694 6.074 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.304 4.533 6.645 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.754 4.070 4.961 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.136 2.833 3.566 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.622 4.514 3.842 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.854 3.189 4.749 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.468 1.639 5.256 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.240 1.941 6.507 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.926 2.441 6.777 1.00 0.00 H new ATOM 398 N ALA A 27 -9.647 6.040 9.687 1.00 0.00 N ATOM 399 CA ALA A 27 -9.581 7.212 10.528 1.00 0.00 C ATOM 400 C ALA A 27 -8.748 6.952 11.763 1.00 0.00 C ATOM 401 O ALA A 27 -9.256 6.626 12.835 1.00 0.00 O ATOM 402 CB ALA A 27 -10.963 7.644 10.920 1.00 0.00 C ATOM 0 H ALA A 27 -10.313 5.336 10.005 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.104 8.010 9.959 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -10.902 8.528 11.554 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.539 7.879 10.025 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.454 6.839 11.467 1.00 0.00 H new ATOM 408 N GLY A 28 -7.467 7.113 11.581 1.00 0.00 N ATOM 409 CA GLY A 28 -6.511 6.914 12.656 1.00 0.00 C ATOM 410 C GLY A 28 -5.861 5.544 12.630 1.00 0.00 C ATOM 411 O GLY A 28 -5.866 4.828 13.631 1.00 0.00 O ATOM 0 H GLY A 28 -7.049 7.384 10.691 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -5.736 7.678 12.591 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.015 7.052 13.612 1.00 0.00 H new ATOM 415 N LYS A 29 -5.294 5.184 11.484 1.00 0.00 N ATOM 416 CA LYS A 29 -4.628 3.899 11.326 1.00 0.00 C ATOM 417 C LYS A 29 -3.444 4.021 10.371 1.00 0.00 C ATOM 418 O LYS A 29 -3.265 5.051 9.721 1.00 0.00 O ATOM 419 CB LYS A 29 -5.621 2.855 10.815 1.00 0.00 C ATOM 420 CG LYS A 29 -6.048 3.059 9.367 1.00 0.00 C ATOM 421 CD LYS A 29 -6.143 1.737 8.619 1.00 0.00 C ATOM 422 CE LYS A 29 -7.102 0.774 9.303 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.362 1.447 9.723 1.00 0.00 N ATOM 0 H LYS A 29 -5.283 5.768 10.648 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.250 3.580 12.297 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.175 1.865 10.915 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.507 2.871 11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -7.014 3.563 9.340 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.333 3.711 8.865 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.477 1.919 7.598 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.154 1.283 8.555 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.338 -0.046 8.625 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.616 0.337 10.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.958 0.773 10.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.136 2.256 10.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.873 1.783 8.882 1.00 0.00 H new ATOM 437 N LEU A 30 -2.639 2.967 10.284 1.00 0.00 N ATOM 438 CA LEU A 30 -1.482 2.968 9.399 1.00 0.00 C ATOM 439 C LEU A 30 -1.818 2.272 8.087 1.00 0.00 C ATOM 440 O LEU A 30 -1.723 1.051 7.980 1.00 0.00 O ATOM 441 CB LEU A 30 -0.294 2.278 10.073 1.00 0.00 C ATOM 442 CG LEU A 30 1.029 2.376 9.312 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.550 3.805 9.330 1.00 0.00 C ATOM 444 CD2 LEU A 30 2.056 1.425 9.907 1.00 0.00 C ATOM 0 H LEU A 30 -2.767 2.105 10.814 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.210 4.002 9.187 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.158 2.709 11.065 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.537 1.225 10.214 1.00 0.00 H new ATOM 0 HG LEU A 30 0.853 2.088 8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.492 3.856 8.784 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.821 4.464 8.858 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.711 4.121 10.361 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.992 1.507 9.354 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.228 1.683 10.952 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.685 0.402 9.842 1.00 0.00 H new ATOM 456 N VAL A 31 -2.221 3.052 7.092 1.00 0.00 N ATOM 457 CA VAL A 31 -2.581 2.497 5.794 1.00 0.00 C ATOM 458 C VAL A 31 -1.356 2.328 4.905 1.00 0.00 C ATOM 459 O VAL A 31 -0.690 3.302 4.552 1.00 0.00 O ATOM 460 CB VAL A 31 -3.615 3.378 5.065 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.237 2.617 3.902 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.689 3.857 6.031 1.00 0.00 C ATOM 0 H VAL A 31 -2.306 4.066 7.158 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.023 1.520 5.986 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.102 4.253 4.667 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.965 3.253 3.398 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.457 2.329 3.197 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.735 1.723 4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.409 4.477 5.497 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.201 2.996 6.462 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.228 4.441 6.827 1.00 0.00 H new ATOM 472 N PHE A 32 -1.066 1.082 4.547 1.00 0.00 N ATOM 473 CA PHE A 32 0.076 0.772 3.697 1.00 0.00 C ATOM 474 C PHE A 32 -0.327 0.807 2.225 1.00 0.00 C ATOM 475 O PHE A 32 -1.481 0.551 1.883 1.00 0.00 O ATOM 476 CB PHE A 32 0.644 -0.601 4.066 1.00 0.00 C ATOM 477 CG PHE A 32 1.505 -0.583 5.298 1.00 0.00 C ATOM 478 CD1 PHE A 32 2.709 0.102 5.306 1.00 0.00 C ATOM 479 CD2 PHE A 32 1.109 -1.251 6.446 1.00 0.00 C ATOM 480 CE1 PHE A 32 3.503 0.121 6.438 1.00 0.00 C ATOM 481 CE2 PHE A 32 1.899 -1.236 7.579 1.00 0.00 C ATOM 482 CZ PHE A 32 3.097 -0.549 7.575 1.00 0.00 C ATOM 0 H PHE A 32 -1.609 0.268 4.834 1.00 0.00 H new ATOM 0 HA PHE A 32 0.847 1.525 3.856 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.181 -1.297 4.219 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.230 -0.980 3.229 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.031 0.627 4.419 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.173 -1.789 6.455 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.439 0.659 6.433 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.580 -1.761 8.467 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.716 -0.536 8.460 1.00 0.00 H new ATOM 492 N PHE A 33 0.626 1.131 1.355 1.00 0.00 N ATOM 493 CA PHE A 33 0.361 1.207 -0.077 1.00 0.00 C ATOM 494 C PHE A 33 1.539 0.671 -0.884 1.00 0.00 C ATOM 495 O PHE A 33 2.581 1.320 -0.986 1.00 0.00 O ATOM 496 CB PHE A 33 0.070 2.651 -0.491 1.00 0.00 C ATOM 497 CG PHE A 33 -1.077 3.277 0.251 1.00 0.00 C ATOM 498 CD1 PHE A 33 -0.911 3.745 1.543 1.00 0.00 C ATOM 499 CD2 PHE A 33 -2.321 3.400 -0.349 1.00 0.00 C ATOM 500 CE1 PHE A 33 -1.964 4.324 2.225 1.00 0.00 C ATOM 501 CE2 PHE A 33 -3.377 3.977 0.329 1.00 0.00 C ATOM 502 CZ PHE A 33 -3.199 4.440 1.618 1.00 0.00 C ATOM 0 H PHE A 33 1.588 1.345 1.618 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.513 0.589 -0.285 1.00 0.00 H new ATOM 0 HB2 PHE A 33 0.965 3.252 -0.331 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -0.144 2.676 -1.559 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.052 3.657 2.023 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.466 3.041 -1.357 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.821 4.686 3.233 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.342 4.066 -0.149 1.00 0.00 H new ATOM 0 HZ PHE A 33 -4.023 4.892 2.150 1.00 0.00 H new ATOM 512 N TYR A 34 1.367 -0.513 -1.459 1.00 0.00 N ATOM 513 CA TYR A 34 2.414 -1.132 -2.262 1.00 0.00 C ATOM 514 C TYR A 34 2.127 -0.969 -3.753 1.00 0.00 C ATOM 515 O TYR A 34 1.067 -1.364 -4.238 1.00 0.00 O ATOM 516 CB TYR A 34 2.553 -2.617 -1.908 1.00 0.00 C ATOM 517 CG TYR A 34 1.418 -3.479 -2.416 1.00 0.00 C ATOM 518 CD1 TYR A 34 0.182 -3.482 -1.781 1.00 0.00 C ATOM 519 CD2 TYR A 34 1.585 -4.293 -3.529 1.00 0.00 C ATOM 520 CE1 TYR A 34 -0.855 -4.269 -2.242 1.00 0.00 C ATOM 521 CE2 TYR A 34 0.553 -5.084 -3.997 1.00 0.00 C ATOM 522 CZ TYR A 34 -0.665 -5.069 -3.350 1.00 0.00 C ATOM 523 OH TYR A 34 -1.698 -5.855 -3.811 1.00 0.00 O ATOM 0 H TYR A 34 0.512 -1.064 -1.384 1.00 0.00 H new ATOM 0 HA TYR A 34 3.354 -0.628 -2.038 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.491 -2.991 -2.317 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.615 -2.718 -0.824 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.030 -2.858 -0.912 1.00 0.00 H new ATOM 0 HD2 TYR A 34 2.538 -4.308 -4.037 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -1.810 -4.258 -1.738 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.699 -5.710 -4.865 1.00 0.00 H new ATOM 0 HH TYR A 34 -1.401 -6.356 -4.599 1.00 0.00 H new ATOM 533 N PHE A 35 3.079 -0.383 -4.473 1.00 0.00 N ATOM 534 CA PHE A 35 2.930 -0.164 -5.910 1.00 0.00 C ATOM 535 C PHE A 35 3.581 -1.296 -6.699 1.00 0.00 C ATOM 536 O PHE A 35 4.733 -1.652 -6.449 1.00 0.00 O ATOM 537 CB PHE A 35 3.550 1.180 -6.316 1.00 0.00 C ATOM 538 CG PHE A 35 3.282 2.305 -5.350 1.00 0.00 C ATOM 539 CD1 PHE A 35 2.208 2.257 -4.475 1.00 0.00 C ATOM 540 CD2 PHE A 35 4.110 3.414 -5.324 1.00 0.00 C ATOM 541 CE1 PHE A 35 1.967 3.294 -3.594 1.00 0.00 C ATOM 542 CE2 PHE A 35 3.874 4.454 -4.445 1.00 0.00 C ATOM 543 CZ PHE A 35 2.800 4.393 -3.580 1.00 0.00 C ATOM 0 H PHE A 35 3.962 -0.051 -4.086 1.00 0.00 H new ATOM 0 HA PHE A 35 1.865 -0.146 -6.140 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.628 1.053 -6.418 1.00 0.00 H new ATOM 0 HB3 PHE A 35 3.168 1.461 -7.297 1.00 0.00 H new ATOM 0 HD1 PHE A 35 1.552 1.399 -4.482 1.00 0.00 H new ATOM 0 HD2 PHE A 35 4.951 3.467 -5.999 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.127 3.244 -2.917 1.00 0.00 H new ATOM 0 HE2 PHE A 35 4.529 5.313 -4.435 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.612 5.205 -2.893 1.00 0.00 H new ATOM 553 N SER A 36 2.843 -1.866 -7.652 1.00 0.00 N ATOM 554 CA SER A 36 3.369 -2.959 -8.463 1.00 0.00 C ATOM 555 C SER A 36 2.396 -3.344 -9.572 1.00 0.00 C ATOM 556 O SER A 36 1.226 -2.960 -9.552 1.00 0.00 O ATOM 557 CB SER A 36 3.665 -4.178 -7.585 1.00 0.00 C ATOM 558 OG SER A 36 3.250 -3.961 -6.246 1.00 0.00 O ATOM 0 H SER A 36 1.887 -1.590 -7.878 1.00 0.00 H new ATOM 0 HA SER A 36 4.294 -2.615 -8.925 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.155 -5.052 -7.989 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.733 -4.394 -7.607 1.00 0.00 H new ATOM 0 HG SER A 36 2.495 -4.550 -6.038 1.00 0.00 H new ATOM 564 N ALA A 37 2.890 -4.115 -10.536 1.00 0.00 N ATOM 565 CA ALA A 37 2.076 -4.567 -11.652 1.00 0.00 C ATOM 566 C ALA A 37 2.246 -6.068 -11.855 1.00 0.00 C ATOM 567 O ALA A 37 3.127 -6.680 -11.257 1.00 0.00 O ATOM 568 CB ALA A 37 2.455 -3.804 -12.916 1.00 0.00 C ATOM 0 H ALA A 37 3.857 -4.440 -10.563 1.00 0.00 H new ATOM 0 HA ALA A 37 1.027 -4.370 -11.430 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.840 -4.149 -13.747 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.290 -2.738 -12.761 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.506 -3.979 -13.145 1.00 0.00 H new ATOM 574 N SER A 38 1.399 -6.661 -12.689 1.00 0.00 N ATOM 575 CA SER A 38 1.471 -8.095 -12.953 1.00 0.00 C ATOM 576 C SER A 38 2.557 -8.420 -13.976 1.00 0.00 C ATOM 577 O SER A 38 3.253 -9.428 -13.853 1.00 0.00 O ATOM 578 CB SER A 38 0.119 -8.613 -13.445 1.00 0.00 C ATOM 579 OG SER A 38 -0.355 -7.845 -14.538 1.00 0.00 O ATOM 0 H SER A 38 0.657 -6.174 -13.192 1.00 0.00 H new ATOM 0 HA SER A 38 1.727 -8.592 -12.017 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.213 -9.657 -13.744 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.605 -8.578 -12.631 1.00 0.00 H new ATOM 0 HG SER A 38 -1.334 -7.884 -14.565 1.00 0.00 H new ATOM 585 N TRP A 39 2.697 -7.570 -14.991 1.00 0.00 N ATOM 586 CA TRP A 39 3.697 -7.787 -16.030 1.00 0.00 C ATOM 587 C TRP A 39 5.032 -7.131 -15.676 1.00 0.00 C ATOM 588 O TRP A 39 5.979 -7.181 -16.461 1.00 0.00 O ATOM 589 CB TRP A 39 3.191 -7.257 -17.376 1.00 0.00 C ATOM 590 CG TRP A 39 3.044 -5.764 -17.423 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.188 -4.888 -16.385 1.00 0.00 C ATOM 592 CD2 TRP A 39 2.723 -4.974 -18.573 1.00 0.00 C ATOM 593 NE1 TRP A 39 2.977 -3.603 -16.820 1.00 0.00 N ATOM 594 CE2 TRP A 39 2.689 -3.629 -18.160 1.00 0.00 C ATOM 595 CE3 TRP A 39 2.460 -5.272 -19.913 1.00 0.00 C ATOM 596 CZ2 TRP A 39 2.404 -2.586 -19.037 1.00 0.00 C ATOM 597 CZ3 TRP A 39 2.178 -4.237 -20.784 1.00 0.00 C ATOM 598 CH2 TRP A 39 2.152 -2.908 -20.344 1.00 0.00 C ATOM 0 H TRP A 39 2.133 -6.729 -15.115 1.00 0.00 H new ATOM 0 HA TRP A 39 3.863 -8.862 -16.106 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.880 -7.570 -18.161 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.227 -7.715 -17.597 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.432 -5.166 -15.370 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.026 -2.765 -16.240 1.00 0.00 H new ATOM 0 HE3 TRP A 39 2.477 -6.294 -20.262 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 2.382 -1.560 -18.699 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 1.974 -4.457 -21.822 1.00 0.00 H new ATOM 0 HH2 TRP A 39 1.929 -2.121 -21.049 1.00 0.00 H new ATOM 609 N CYS A 40 5.114 -6.521 -14.492 1.00 0.00 N ATOM 610 CA CYS A 40 6.345 -5.869 -14.056 1.00 0.00 C ATOM 611 C CYS A 40 7.540 -6.821 -14.169 1.00 0.00 C ATOM 612 O CYS A 40 7.374 -8.041 -14.153 1.00 0.00 O ATOM 613 CB CYS A 40 6.192 -5.349 -12.621 1.00 0.00 C ATOM 614 SG CYS A 40 6.228 -6.627 -11.317 1.00 0.00 S ATOM 0 H CYS A 40 4.346 -6.466 -13.823 1.00 0.00 H new ATOM 0 HA CYS A 40 6.535 -5.020 -14.712 1.00 0.00 H new ATOM 0 HB2 CYS A 40 6.989 -4.632 -12.425 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.250 -4.806 -12.548 1.00 0.00 H new ATOM 619 N PRO A 41 8.764 -6.275 -14.311 1.00 0.00 N ATOM 620 CA PRO A 41 9.979 -7.086 -14.454 1.00 0.00 C ATOM 621 C PRO A 41 10.189 -8.065 -13.297 1.00 0.00 C ATOM 622 O PRO A 41 10.398 -9.256 -13.526 1.00 0.00 O ATOM 623 CB PRO A 41 11.112 -6.054 -14.511 1.00 0.00 C ATOM 624 CG PRO A 41 10.455 -4.777 -14.911 1.00 0.00 C ATOM 625 CD PRO A 41 9.053 -4.832 -14.365 1.00 0.00 C ATOM 0 HA PRO A 41 9.927 -7.721 -15.339 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.606 -5.957 -13.544 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.876 -6.347 -15.231 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.995 -3.920 -14.509 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.446 -4.668 -15.995 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.987 -4.372 -13.379 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.350 -4.305 -15.010 1.00 0.00 H new ATOM 633 N PRO A 42 10.133 -7.593 -12.037 1.00 0.00 N ATOM 634 CA PRO A 42 10.314 -8.458 -10.870 1.00 0.00 C ATOM 635 C PRO A 42 9.092 -9.338 -10.637 1.00 0.00 C ATOM 636 O PRO A 42 9.133 -10.550 -10.849 1.00 0.00 O ATOM 637 CB PRO A 42 10.505 -7.475 -9.701 1.00 0.00 C ATOM 638 CG PRO A 42 10.605 -6.117 -10.324 1.00 0.00 C ATOM 639 CD PRO A 42 9.882 -6.204 -11.636 1.00 0.00 C ATOM 0 HA PRO A 42 11.154 -9.142 -10.991 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.667 -7.526 -9.006 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.405 -7.712 -9.133 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.156 -5.360 -9.681 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.647 -5.832 -10.472 1.00 0.00 H new ATOM 0 HD2 PRO A 42 8.817 -5.997 -11.528 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.273 -5.493 -12.364 1.00 0.00 H new ATOM 647 N CYS A 43 7.999 -8.705 -10.221 1.00 0.00 N ATOM 648 CA CYS A 43 6.733 -9.410 -9.979 1.00 0.00 C ATOM 649 C CYS A 43 6.968 -10.724 -9.237 1.00 0.00 C ATOM 650 O CYS A 43 6.283 -11.718 -9.477 1.00 0.00 O ATOM 651 CB CYS A 43 6.055 -9.691 -11.316 1.00 0.00 C ATOM 652 SG CYS A 43 5.295 -8.240 -12.128 1.00 0.00 S ATOM 0 H CYS A 43 7.959 -7.702 -10.042 1.00 0.00 H new ATOM 0 HA CYS A 43 6.096 -8.780 -9.359 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.791 -10.122 -11.994 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.284 -10.446 -11.162 1.00 0.00 H new ATOM 657 N ARG A 44 7.949 -10.718 -8.343 1.00 0.00 N ATOM 658 CA ARG A 44 8.291 -11.911 -7.568 1.00 0.00 C ATOM 659 C ARG A 44 7.213 -12.232 -6.532 1.00 0.00 C ATOM 660 O ARG A 44 7.488 -12.278 -5.331 1.00 0.00 O ATOM 661 CB ARG A 44 9.645 -11.733 -6.872 1.00 0.00 C ATOM 662 CG ARG A 44 10.130 -12.986 -6.160 1.00 0.00 C ATOM 663 CD ARG A 44 11.592 -13.271 -6.464 1.00 0.00 C ATOM 664 NE ARG A 44 12.489 -12.508 -5.600 1.00 0.00 N ATOM 665 CZ ARG A 44 12.776 -12.848 -4.346 1.00 0.00 C ATOM 666 NH1 ARG A 44 12.239 -13.934 -3.804 1.00 0.00 N ATOM 667 NH2 ARG A 44 13.603 -12.098 -3.629 1.00 0.00 N ATOM 0 H ARG A 44 8.524 -9.902 -8.134 1.00 0.00 H new ATOM 0 HA ARG A 44 8.355 -12.747 -8.265 1.00 0.00 H new ATOM 0 HB2 ARG A 44 10.388 -11.434 -7.611 1.00 0.00 H new ATOM 0 HB3 ARG A 44 9.569 -10.920 -6.150 1.00 0.00 H new ATOM 0 HG2 ARG A 44 9.997 -12.869 -5.084 1.00 0.00 H new ATOM 0 HG3 ARG A 44 9.522 -13.837 -6.465 1.00 0.00 H new ATOM 0 HD2 ARG A 44 11.787 -14.336 -6.339 1.00 0.00 H new ATOM 0 HD3 ARG A 44 11.800 -13.029 -7.506 1.00 0.00 H new ATOM 0 HE ARG A 44 12.921 -11.666 -5.980 1.00 0.00 H new ATOM 0 HH11 ARG A 44 11.602 -14.514 -4.349 1.00 0.00 H new ATOM 0 HH12 ARG A 44 12.464 -14.188 -2.842 1.00 0.00 H new ATOM 0 HH21 ARG A 44 14.018 -11.261 -4.039 1.00 0.00 H new ATOM 0 HH22 ARG A 44 13.823 -12.358 -2.668 1.00 0.00 H new ATOM 681 N GLY A 45 5.992 -12.468 -7.008 1.00 0.00 N ATOM 682 CA GLY A 45 4.882 -12.798 -6.125 1.00 0.00 C ATOM 683 C GLY A 45 4.880 -12.016 -4.823 1.00 0.00 C ATOM 684 O GLY A 45 4.554 -12.562 -3.770 1.00 0.00 O ATOM 0 H GLY A 45 5.749 -12.436 -7.998 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.945 -12.613 -6.650 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.915 -13.864 -5.898 1.00 0.00 H new ATOM 688 N PHE A 46 5.234 -10.736 -4.889 1.00 0.00 N ATOM 689 CA PHE A 46 5.257 -9.896 -3.697 1.00 0.00 C ATOM 690 C PHE A 46 3.852 -9.406 -3.360 1.00 0.00 C ATOM 691 O PHE A 46 3.344 -8.472 -3.981 1.00 0.00 O ATOM 692 CB PHE A 46 6.197 -8.702 -3.889 1.00 0.00 C ATOM 693 CG PHE A 46 6.354 -7.844 -2.660 1.00 0.00 C ATOM 694 CD1 PHE A 46 6.105 -8.357 -1.394 1.00 0.00 C ATOM 695 CD2 PHE A 46 6.752 -6.521 -2.773 1.00 0.00 C ATOM 696 CE1 PHE A 46 6.249 -7.568 -0.269 1.00 0.00 C ATOM 697 CE2 PHE A 46 6.897 -5.727 -1.650 1.00 0.00 C ATOM 698 CZ PHE A 46 6.646 -6.250 -0.397 1.00 0.00 C ATOM 0 H PHE A 46 5.507 -10.261 -5.749 1.00 0.00 H new ATOM 0 HA PHE A 46 5.628 -10.499 -2.868 1.00 0.00 H new ATOM 0 HB2 PHE A 46 7.178 -9.069 -4.191 1.00 0.00 H new ATOM 0 HB3 PHE A 46 5.822 -8.085 -4.705 1.00 0.00 H new ATOM 0 HD1 PHE A 46 5.795 -9.386 -1.287 1.00 0.00 H new ATOM 0 HD2 PHE A 46 6.951 -6.105 -3.750 1.00 0.00 H new ATOM 0 HE1 PHE A 46 6.052 -7.980 0.709 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.207 -4.697 -1.753 1.00 0.00 H new ATOM 0 HZ PHE A 46 6.760 -5.631 0.481 1.00 0.00 H new ATOM 708 N THR A 47 3.227 -10.050 -2.379 1.00 0.00 N ATOM 709 CA THR A 47 1.875 -9.691 -1.961 1.00 0.00 C ATOM 710 C THR A 47 1.372 -10.638 -0.872 1.00 0.00 C ATOM 711 O THR A 47 1.020 -10.201 0.224 1.00 0.00 O ATOM 712 CB THR A 47 0.921 -9.718 -3.158 1.00 0.00 C ATOM 713 OG1 THR A 47 1.459 -10.496 -4.212 1.00 0.00 O ATOM 714 CG2 THR A 47 0.617 -8.344 -3.712 1.00 0.00 C ATOM 0 H THR A 47 3.636 -10.825 -1.857 1.00 0.00 H new ATOM 0 HA THR A 47 1.905 -8.680 -1.554 1.00 0.00 H new ATOM 0 HB THR A 47 -0.004 -10.153 -2.779 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.834 -10.502 -4.966 1.00 0.00 H new ATOM 0 HG21 THR A 47 -0.064 -8.435 -4.558 1.00 0.00 H new ATOM 0 HG22 THR A 47 0.153 -7.734 -2.937 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.542 -7.871 -4.041 1.00 0.00 H new ATOM 722 N PRO A 48 1.328 -11.954 -1.158 1.00 0.00 N ATOM 723 CA PRO A 48 0.861 -12.962 -0.197 1.00 0.00 C ATOM 724 C PRO A 48 1.567 -12.873 1.155 1.00 0.00 C ATOM 725 O PRO A 48 1.095 -13.436 2.143 1.00 0.00 O ATOM 726 CB PRO A 48 1.179 -14.303 -0.879 1.00 0.00 C ATOM 727 CG PRO A 48 2.074 -13.969 -2.026 1.00 0.00 C ATOM 728 CD PRO A 48 1.718 -12.571 -2.435 1.00 0.00 C ATOM 0 HA PRO A 48 -0.196 -12.825 0.031 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.668 -14.988 -0.187 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.268 -14.793 -1.223 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.122 -14.035 -1.735 1.00 0.00 H new ATOM 0 HG3 PRO A 48 1.928 -14.666 -2.851 1.00 0.00 H new ATOM 0 HD2 PRO A 48 2.562 -12.055 -2.894 1.00 0.00 H new ATOM 0 HD3 PRO A 48 0.903 -12.555 -3.159 1.00 0.00 H new ATOM 736 N GLN A 49 2.691 -12.161 1.207 1.00 0.00 N ATOM 737 CA GLN A 49 3.431 -12.009 2.453 1.00 0.00 C ATOM 738 C GLN A 49 2.715 -11.020 3.363 1.00 0.00 C ATOM 739 O GLN A 49 2.609 -11.233 4.571 1.00 0.00 O ATOM 740 CB GLN A 49 4.869 -11.549 2.180 1.00 0.00 C ATOM 741 CG GLN A 49 5.890 -12.671 2.269 1.00 0.00 C ATOM 742 CD GLN A 49 5.818 -13.621 1.091 1.00 0.00 C ATOM 743 OE1 GLN A 49 6.596 -13.513 0.143 1.00 0.00 O ATOM 744 NE2 GLN A 49 4.879 -14.560 1.143 1.00 0.00 N ATOM 0 H GLN A 49 3.105 -11.684 0.406 1.00 0.00 H new ATOM 0 HA GLN A 49 3.478 -12.977 2.952 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.917 -11.102 1.187 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.135 -10.769 2.894 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.891 -12.243 2.325 1.00 0.00 H new ATOM 0 HG3 GLN A 49 5.731 -13.230 3.191 1.00 0.00 H new ATOM 0 HE21 GLN A 49 4.255 -14.613 1.948 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.782 -15.227 0.378 1.00 0.00 H new ATOM 753 N LEU A 50 2.212 -9.943 2.769 1.00 0.00 N ATOM 754 CA LEU A 50 1.491 -8.922 3.508 1.00 0.00 C ATOM 755 C LEU A 50 0.274 -9.513 4.211 1.00 0.00 C ATOM 756 O LEU A 50 0.051 -9.282 5.399 1.00 0.00 O ATOM 757 CB LEU A 50 1.022 -7.850 2.535 1.00 0.00 C ATOM 758 CG LEU A 50 1.108 -6.406 3.027 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.777 -6.302 4.512 1.00 0.00 C ATOM 760 CD2 LEU A 50 2.482 -5.843 2.733 1.00 0.00 C ATOM 0 H LEU A 50 2.293 -9.757 1.769 1.00 0.00 H new ATOM 0 HA LEU A 50 2.158 -8.499 4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.610 -7.936 1.621 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.014 -8.060 2.268 1.00 0.00 H new ATOM 0 HG LEU A 50 0.365 -5.815 2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.848 -5.261 4.829 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.236 -6.666 4.685 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.482 -6.904 5.085 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.537 -4.813 3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.237 -6.442 3.242 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.663 -5.868 1.658 1.00 0.00 H new ATOM 772 N ILE A 51 -0.513 -10.272 3.456 1.00 0.00 N ATOM 773 CA ILE A 51 -1.718 -10.895 3.993 1.00 0.00 C ATOM 774 C ILE A 51 -1.371 -11.840 5.140 1.00 0.00 C ATOM 775 O ILE A 51 -2.136 -11.976 6.093 1.00 0.00 O ATOM 776 CB ILE A 51 -2.506 -11.654 2.891 1.00 0.00 C ATOM 777 CG1 ILE A 51 -3.536 -10.718 2.237 1.00 0.00 C ATOM 778 CG2 ILE A 51 -3.191 -12.897 3.453 1.00 0.00 C ATOM 779 CD1 ILE A 51 -4.811 -10.553 3.038 1.00 0.00 C ATOM 0 H ILE A 51 -0.339 -10.471 2.471 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.357 -10.098 4.375 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.796 -11.983 2.133 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.081 -9.738 2.091 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -3.787 -11.103 1.249 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.734 -13.405 2.656 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.440 -13.570 3.867 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.889 -12.605 4.238 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -5.487 -9.879 2.512 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.291 -11.524 3.162 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -4.574 -10.137 4.017 1.00 0.00 H new ATOM 791 N GLU A 52 -0.216 -12.487 5.047 1.00 0.00 N ATOM 792 CA GLU A 52 0.217 -13.411 6.087 1.00 0.00 C ATOM 793 C GLU A 52 0.620 -12.651 7.345 1.00 0.00 C ATOM 794 O GLU A 52 0.149 -12.952 8.440 1.00 0.00 O ATOM 795 CB GLU A 52 1.385 -14.264 5.591 1.00 0.00 C ATOM 796 CG GLU A 52 1.019 -15.190 4.442 1.00 0.00 C ATOM 797 CD GLU A 52 0.640 -16.580 4.913 1.00 0.00 C ATOM 798 OE1 GLU A 52 0.266 -16.727 6.096 1.00 0.00 O ATOM 799 OE2 GLU A 52 0.718 -17.525 4.099 1.00 0.00 O ATOM 0 H GLU A 52 0.434 -12.390 4.267 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.618 -14.068 6.330 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.194 -13.607 5.273 1.00 0.00 H new ATOM 0 HB3 GLU A 52 1.766 -14.861 6.420 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.187 -14.760 3.884 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.862 -15.260 3.754 1.00 0.00 H new ATOM 806 N PHE A 53 1.484 -11.657 7.179 1.00 0.00 N ATOM 807 CA PHE A 53 1.935 -10.846 8.302 1.00 0.00 C ATOM 808 C PHE A 53 0.775 -10.018 8.848 1.00 0.00 C ATOM 809 O PHE A 53 0.714 -9.726 10.043 1.00 0.00 O ATOM 810 CB PHE A 53 3.089 -9.933 7.870 1.00 0.00 C ATOM 811 CG PHE A 53 3.410 -8.842 8.855 1.00 0.00 C ATOM 812 CD1 PHE A 53 3.972 -9.142 10.086 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.147 -7.517 8.548 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.268 -8.139 10.991 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.440 -6.510 9.449 1.00 0.00 C ATOM 816 CZ PHE A 53 4.001 -6.822 10.671 1.00 0.00 C ATOM 0 H PHE A 53 1.886 -11.394 6.279 1.00 0.00 H new ATOM 0 HA PHE A 53 2.295 -11.506 9.091 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.980 -10.541 7.714 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.840 -9.480 6.910 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.181 -10.170 10.341 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.708 -7.268 7.593 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.707 -8.385 11.946 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.230 -5.481 9.197 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.231 -6.037 11.376 1.00 0.00 H new ATOM 826 N TYR A 54 -0.139 -9.642 7.960 1.00 0.00 N ATOM 827 CA TYR A 54 -1.297 -8.845 8.341 1.00 0.00 C ATOM 828 C TYR A 54 -2.399 -9.713 8.949 1.00 0.00 C ATOM 829 O TYR A 54 -2.832 -9.477 10.071 1.00 0.00 O ATOM 830 CB TYR A 54 -1.839 -8.089 7.126 1.00 0.00 C ATOM 831 CG TYR A 54 -3.102 -7.302 7.404 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.282 -6.640 8.612 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.114 -7.221 6.455 1.00 0.00 C ATOM 834 CE1 TYR A 54 -4.435 -5.922 8.867 1.00 0.00 C ATOM 835 CE2 TYR A 54 -5.269 -6.504 6.702 1.00 0.00 C ATOM 836 CZ TYR A 54 -5.424 -5.857 7.910 1.00 0.00 C ATOM 837 OH TYR A 54 -6.573 -5.142 8.160 1.00 0.00 O ATOM 0 H TYR A 54 -0.099 -9.878 6.968 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.975 -8.130 9.098 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.070 -7.407 6.763 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.036 -8.802 6.325 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -2.508 -6.687 9.364 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.996 -7.727 5.508 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -4.560 -5.414 9.812 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.046 -6.451 5.954 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.398 -4.186 8.032 1.00 0.00 H new ATOM 847 N ASP A 55 -2.860 -10.709 8.201 1.00 0.00 N ATOM 848 CA ASP A 55 -3.927 -11.588 8.674 1.00 0.00 C ATOM 849 C ASP A 55 -3.565 -12.279 9.988 1.00 0.00 C ATOM 850 O ASP A 55 -4.447 -12.665 10.756 1.00 0.00 O ATOM 851 CB ASP A 55 -4.257 -12.641 7.614 1.00 0.00 C ATOM 852 CG ASP A 55 -5.574 -13.341 7.884 1.00 0.00 C ATOM 853 OD1 ASP A 55 -6.574 -12.641 8.152 1.00 0.00 O ATOM 854 OD2 ASP A 55 -5.606 -14.588 7.829 1.00 0.00 O ATOM 0 H ASP A 55 -2.514 -10.929 7.267 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.800 -10.962 8.856 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.296 -12.166 6.634 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.457 -13.380 7.579 1.00 0.00 H new ATOM 859 N LYS A 56 -2.273 -12.461 10.234 1.00 0.00 N ATOM 860 CA LYS A 56 -1.817 -13.137 11.441 1.00 0.00 C ATOM 861 C LYS A 56 -1.554 -12.176 12.602 1.00 0.00 C ATOM 862 O LYS A 56 -1.408 -12.612 13.744 1.00 0.00 O ATOM 863 CB LYS A 56 -0.548 -13.936 11.145 1.00 0.00 C ATOM 864 CG LYS A 56 -0.725 -14.980 10.054 1.00 0.00 C ATOM 865 CD LYS A 56 -1.524 -16.174 10.551 1.00 0.00 C ATOM 866 CE LYS A 56 -2.482 -16.685 9.487 1.00 0.00 C ATOM 867 NZ LYS A 56 -2.579 -18.171 9.493 1.00 0.00 N ATOM 0 H LYS A 56 -1.524 -12.150 9.615 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.623 -13.803 11.749 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.244 -13.247 10.852 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.219 -14.430 12.059 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.231 -14.532 9.199 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.253 -15.314 9.706 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.843 -16.973 10.843 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.085 -15.892 11.442 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.470 -16.256 9.653 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.148 -16.347 8.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.242 -18.479 8.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.641 -18.581 9.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -2.922 -18.493 10.421 1.00 0.00 H new ATOM 881 N PHE A 57 -1.466 -10.879 12.320 1.00 0.00 N ATOM 882 CA PHE A 57 -1.187 -9.902 13.370 1.00 0.00 C ATOM 883 C PHE A 57 -2.080 -8.660 13.272 1.00 0.00 C ATOM 884 O PHE A 57 -1.913 -7.712 14.039 1.00 0.00 O ATOM 885 CB PHE A 57 0.289 -9.499 13.321 1.00 0.00 C ATOM 886 CG PHE A 57 1.118 -10.125 14.406 1.00 0.00 C ATOM 887 CD1 PHE A 57 1.079 -9.628 15.699 1.00 0.00 C ATOM 888 CD2 PHE A 57 1.936 -11.209 14.133 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.841 -10.201 16.699 1.00 0.00 C ATOM 890 CE2 PHE A 57 2.700 -11.787 15.129 1.00 0.00 C ATOM 891 CZ PHE A 57 2.652 -11.282 16.414 1.00 0.00 C ATOM 0 H PHE A 57 -1.582 -10.483 11.387 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.411 -10.377 14.325 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.702 -9.779 12.352 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.364 -8.414 13.398 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.446 -8.783 15.928 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.977 -11.607 13.130 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.802 -9.804 17.703 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.334 -12.632 14.903 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.248 -11.732 17.194 1.00 0.00 H new ATOM 901 N HIS A 58 -3.011 -8.657 12.322 1.00 0.00 N ATOM 902 CA HIS A 58 -3.904 -7.518 12.126 1.00 0.00 C ATOM 903 C HIS A 58 -4.575 -7.085 13.428 1.00 0.00 C ATOM 904 O HIS A 58 -5.006 -5.941 13.559 1.00 0.00 O ATOM 905 CB HIS A 58 -4.978 -7.852 11.086 1.00 0.00 C ATOM 906 CG HIS A 58 -5.917 -8.938 11.518 1.00 0.00 C ATOM 907 ND1 HIS A 58 -5.535 -10.256 11.654 1.00 0.00 N ATOM 908 CD2 HIS A 58 -7.230 -8.894 11.846 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.571 -10.975 12.046 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.612 -10.173 12.170 1.00 0.00 N ATOM 0 H HIS A 58 -3.167 -9.430 11.676 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.291 -6.690 11.769 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.553 -6.952 10.868 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.492 -8.152 10.158 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -7.860 -8.017 11.852 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -6.567 -12.039 12.233 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -8.548 -10.457 12.459 1.00 0.00 H new ATOM 919 N GLU A 59 -4.680 -8.003 14.382 1.00 0.00 N ATOM 920 CA GLU A 59 -5.317 -7.699 15.659 1.00 0.00 C ATOM 921 C GLU A 59 -4.508 -6.687 16.465 1.00 0.00 C ATOM 922 O GLU A 59 -5.059 -5.718 16.987 1.00 0.00 O ATOM 923 CB GLU A 59 -5.509 -8.980 16.473 1.00 0.00 C ATOM 924 CG GLU A 59 -6.148 -10.112 15.686 1.00 0.00 C ATOM 925 CD GLU A 59 -5.487 -11.451 15.950 1.00 0.00 C ATOM 926 OE1 GLU A 59 -4.883 -11.611 17.031 1.00 0.00 O ATOM 927 OE2 GLU A 59 -5.577 -12.341 15.078 1.00 0.00 O ATOM 0 H GLU A 59 -4.335 -8.959 14.297 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.290 -7.257 15.445 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -4.540 -9.311 16.848 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -6.128 -8.759 17.342 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.205 -10.176 15.942 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.091 -9.887 14.621 1.00 0.00 H new ATOM 934 N SER A 60 -3.206 -6.920 16.574 1.00 0.00 N ATOM 935 CA SER A 60 -2.333 -6.027 17.332 1.00 0.00 C ATOM 936 C SER A 60 -1.909 -4.820 16.500 1.00 0.00 C ATOM 937 O SER A 60 -1.768 -3.714 17.022 1.00 0.00 O ATOM 938 CB SER A 60 -1.094 -6.784 17.814 1.00 0.00 C ATOM 939 OG SER A 60 -0.505 -6.141 18.930 1.00 0.00 O ATOM 0 H SER A 60 -2.731 -7.716 16.149 1.00 0.00 H new ATOM 0 HA SER A 60 -2.896 -5.665 18.192 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.369 -7.804 18.082 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.368 -6.852 17.004 1.00 0.00 H new ATOM 0 HG SER A 60 0.284 -6.645 19.219 1.00 0.00 H new ATOM 945 N LYS A 61 -1.695 -5.040 15.207 1.00 0.00 N ATOM 946 CA LYS A 61 -1.274 -3.969 14.309 1.00 0.00 C ATOM 947 C LYS A 61 -2.466 -3.163 13.801 1.00 0.00 C ATOM 948 O LYS A 61 -2.375 -1.947 13.632 1.00 0.00 O ATOM 949 CB LYS A 61 -0.497 -4.553 13.130 1.00 0.00 C ATOM 950 CG LYS A 61 0.860 -3.900 12.908 1.00 0.00 C ATOM 951 CD LYS A 61 1.966 -4.612 13.677 1.00 0.00 C ATOM 952 CE LYS A 61 1.609 -4.759 15.177 1.00 0.00 C ATOM 953 NZ LYS A 61 2.687 -5.458 15.931 1.00 0.00 N ATOM 0 H LYS A 61 -1.806 -5.949 14.757 1.00 0.00 H new ATOM 0 HA LYS A 61 -0.629 -3.294 14.871 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -0.354 -5.621 13.294 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.094 -4.447 12.224 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.096 -3.906 11.844 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.816 -2.856 13.219 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.136 -5.598 13.244 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.898 -4.055 13.576 1.00 0.00 H new ATOM 0 HE2 LYS A 61 1.442 -3.773 15.610 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.676 -5.313 15.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.415 -5.539 16.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.829 -6.408 15.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.571 -4.915 15.856 1.00 0.00 H new ATOM 967 N ASN A 62 -3.584 -3.847 13.562 1.00 0.00 N ATOM 968 CA ASN A 62 -4.801 -3.202 13.075 1.00 0.00 C ATOM 969 C ASN A 62 -4.504 -2.146 12.007 1.00 0.00 C ATOM 970 O ASN A 62 -4.719 -0.953 12.221 1.00 0.00 O ATOM 971 CB ASN A 62 -5.560 -2.581 14.247 1.00 0.00 C ATOM 972 CG ASN A 62 -4.806 -1.433 14.893 1.00 0.00 C ATOM 973 OD1 ASN A 62 -3.833 -1.643 15.617 1.00 0.00 O ATOM 974 ND2 ASN A 62 -5.256 -0.210 14.635 1.00 0.00 N ATOM 0 H ASN A 62 -3.671 -4.854 13.699 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.420 -3.966 12.605 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.529 -2.223 13.898 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.755 -3.349 14.996 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -4.791 0.601 15.043 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.066 -0.082 14.029 1.00 0.00 H new ATOM 981 N PHE A 63 -4.012 -2.596 10.854 1.00 0.00 N ATOM 982 CA PHE A 63 -3.693 -1.693 9.752 1.00 0.00 C ATOM 983 C PHE A 63 -4.408 -2.120 8.474 1.00 0.00 C ATOM 984 O PHE A 63 -5.006 -3.194 8.416 1.00 0.00 O ATOM 985 CB PHE A 63 -2.182 -1.627 9.517 1.00 0.00 C ATOM 986 CG PHE A 63 -1.559 -2.938 9.122 1.00 0.00 C ATOM 987 CD1 PHE A 63 -1.844 -3.519 7.895 1.00 0.00 C ATOM 988 CD2 PHE A 63 -0.686 -3.585 9.977 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.268 -4.722 7.533 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.106 -4.788 9.621 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.398 -5.358 8.397 1.00 0.00 C ATOM 0 H PHE A 63 -3.826 -3.580 10.660 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.042 -0.698 10.027 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -1.979 -0.892 8.738 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -1.700 -1.268 10.427 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.523 -3.026 7.215 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.454 -3.145 10.936 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.498 -5.165 6.575 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.575 -5.282 10.299 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.053 -6.298 8.116 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.348 -1.270 7.452 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.991 -1.556 6.182 1.00 0.00 C ATOM 1003 C GLU A 64 -4.009 -1.385 5.025 1.00 0.00 C ATOM 1004 O GLU A 64 -3.408 -0.325 4.854 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.193 -0.637 5.974 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.492 -1.384 5.733 1.00 0.00 C ATOM 1007 CD GLU A 64 -8.050 -2.008 6.997 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.262 -2.260 7.932 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -9.275 -2.247 7.050 1.00 0.00 O ATOM 0 H GLU A 64 -3.858 -0.376 7.484 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.331 -2.591 6.204 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.308 0.002 6.850 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.997 0.018 5.125 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -8.229 -0.698 5.315 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.326 -2.164 4.990 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.866 -2.432 4.232 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.971 -2.413 3.080 1.00 0.00 C ATOM 1018 C VAL A 65 -3.757 -2.198 1.790 1.00 0.00 C ATOM 1019 O VAL A 65 -4.618 -3.004 1.438 1.00 0.00 O ATOM 1020 CB VAL A 65 -2.173 -3.728 2.958 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.058 -3.593 1.920 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.603 -4.138 4.310 1.00 0.00 C ATOM 0 H VAL A 65 -4.361 -3.314 4.363 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.275 -1.588 3.234 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.855 -4.509 2.623 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.509 -4.532 1.851 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.492 -3.354 0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.377 -2.796 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.044 -5.067 4.202 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.939 -3.356 4.677 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.418 -4.285 5.019 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.457 -1.110 1.092 1.00 0.00 N ATOM 1033 CA VAL A 66 -4.137 -0.796 -0.158 1.00 0.00 C ATOM 1034 C VAL A 66 -3.394 -1.396 -1.348 1.00 0.00 C ATOM 1035 O VAL A 66 -2.167 -1.507 -1.325 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.271 0.725 -0.359 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -5.111 1.033 -1.589 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.868 1.376 0.880 1.00 0.00 C ATOM 0 H VAL A 66 -2.748 -0.431 1.370 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.134 -1.232 -0.097 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.275 1.140 -0.517 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.193 2.113 -1.712 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.637 0.602 -2.471 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.106 0.605 -1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.955 2.451 0.720 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.855 0.956 1.072 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.221 1.188 1.737 1.00 0.00 H new ATOM 1048 N PHE A 67 -4.133 -1.789 -2.383 1.00 0.00 N ATOM 1049 CA PHE A 67 -3.519 -2.381 -3.564 1.00 0.00 C ATOM 1050 C PHE A 67 -3.315 -1.336 -4.656 1.00 0.00 C ATOM 1051 O PHE A 67 -4.228 -1.041 -5.427 1.00 0.00 O ATOM 1052 CB PHE A 67 -4.376 -3.545 -4.081 1.00 0.00 C ATOM 1053 CG PHE A 67 -4.265 -3.781 -5.563 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -3.060 -4.166 -6.127 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -5.366 -3.616 -6.389 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -2.954 -4.382 -7.489 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -5.266 -3.830 -7.751 1.00 0.00 C ATOM 1058 CZ PHE A 67 -4.059 -4.214 -8.301 1.00 0.00 C ATOM 0 H PHE A 67 -5.149 -1.708 -2.426 1.00 0.00 H new ATOM 0 HA PHE A 67 -2.539 -2.767 -3.284 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -4.087 -4.456 -3.557 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -5.420 -3.352 -3.832 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -2.194 -4.299 -5.496 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -6.313 -3.317 -5.964 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -2.009 -4.682 -7.917 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -6.131 -3.697 -8.384 1.00 0.00 H new ATOM 0 HZ PHE A 67 -3.979 -4.383 -9.365 1.00 0.00 H new ATOM 1068 N CYS A 68 -2.106 -0.792 -4.724 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.775 0.204 -5.731 1.00 0.00 C ATOM 1070 C CYS A 68 -1.157 -0.472 -6.948 1.00 0.00 C ATOM 1071 O CYS A 68 -0.043 -0.993 -6.885 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.813 1.243 -5.157 1.00 0.00 C ATOM 1073 SG CYS A 68 -1.623 2.731 -4.526 1.00 0.00 S ATOM 0 H CYS A 68 -1.339 -1.025 -4.093 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.690 0.712 -6.036 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -0.240 0.785 -4.351 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -0.101 1.530 -5.931 1.00 0.00 H new ATOM 0 HG CYS A 68 -0.739 3.501 -3.965 1.00 0.00 H new ATOM 1079 N THR A 69 -1.894 -0.473 -8.049 1.00 0.00 N ATOM 1080 CA THR A 69 -1.430 -1.102 -9.279 1.00 0.00 C ATOM 1081 C THR A 69 -0.359 -0.265 -9.969 1.00 0.00 C ATOM 1082 O THR A 69 -0.180 0.913 -9.668 1.00 0.00 O ATOM 1083 CB THR A 69 -2.606 -1.326 -10.232 1.00 0.00 C ATOM 1084 OG1 THR A 69 -2.231 -2.175 -11.302 1.00 0.00 O ATOM 1085 CG2 THR A 69 -3.138 -0.042 -10.830 1.00 0.00 C ATOM 0 H THR A 69 -2.817 -0.045 -8.117 1.00 0.00 H new ATOM 0 HA THR A 69 -0.988 -2.062 -9.013 1.00 0.00 H new ATOM 0 HB THR A 69 -3.389 -1.781 -9.625 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.632 -1.848 -12.135 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.970 -0.268 -11.496 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.481 0.616 -10.032 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.346 0.452 -11.393 1.00 0.00 H new ATOM 1093 N TRP A 70 0.345 -0.889 -10.905 1.00 0.00 N ATOM 1094 CA TRP A 70 1.398 -0.217 -11.658 1.00 0.00 C ATOM 1095 C TRP A 70 1.465 -0.753 -13.087 1.00 0.00 C ATOM 1096 O TRP A 70 2.547 -0.924 -13.649 1.00 0.00 O ATOM 1097 CB TRP A 70 2.749 -0.403 -10.963 1.00 0.00 C ATOM 1098 CG TRP A 70 3.429 0.891 -10.638 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.038 1.806 -9.705 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.616 1.414 -11.243 1.00 0.00 C ATOM 1101 NE1 TRP A 70 3.912 2.865 -9.688 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.889 2.649 -10.624 1.00 0.00 C ATOM 1103 CE3 TRP A 70 5.477 0.957 -12.245 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.986 3.432 -10.976 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 6.565 1.736 -12.594 1.00 0.00 C ATOM 1106 CH2 TRP A 70 6.811 2.961 -11.961 1.00 0.00 C ATOM 0 H TRP A 70 0.205 -1.866 -11.162 1.00 0.00 H new ATOM 0 HA TRP A 70 1.165 0.847 -11.698 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.602 -0.970 -10.044 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.401 -0.998 -11.603 1.00 0.00 H new ATOM 0 HD1 TRP A 70 2.168 1.711 -9.072 1.00 0.00 H new ATOM 0 HE1 TRP A 70 3.845 3.680 -9.078 1.00 0.00 H new ATOM 0 HE3 TRP A 70 5.296 0.013 -12.737 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 6.178 4.377 -10.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 7.236 1.394 -13.368 1.00 0.00 H new ATOM 0 HH2 TRP A 70 7.670 3.546 -12.256 1.00 0.00 H new ATOM 1117 N ASP A 71 0.298 -1.018 -13.668 1.00 0.00 N ATOM 1118 CA ASP A 71 0.217 -1.536 -15.029 1.00 0.00 C ATOM 1119 C ASP A 71 -0.091 -0.420 -16.020 1.00 0.00 C ATOM 1120 O ASP A 71 -1.117 0.253 -15.911 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.861 -2.619 -15.121 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.615 -3.767 -14.162 1.00 0.00 C ATOM 1123 OD1 ASP A 71 0.239 -4.625 -14.469 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -1.277 -3.809 -13.104 1.00 0.00 O ATOM 0 H ASP A 71 -0.606 -0.882 -13.216 1.00 0.00 H new ATOM 0 HA ASP A 71 1.185 -1.968 -15.282 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.835 -2.177 -14.911 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.899 -3.003 -16.140 1.00 0.00 H new ATOM 1129 N GLU A 72 0.796 -0.231 -16.989 1.00 0.00 N ATOM 1130 CA GLU A 72 0.610 0.801 -18.001 1.00 0.00 C ATOM 1131 C GLU A 72 -0.660 0.541 -18.805 1.00 0.00 C ATOM 1132 O GLU A 72 -1.283 1.471 -19.320 1.00 0.00 O ATOM 1133 CB GLU A 72 1.819 0.855 -18.937 1.00 0.00 C ATOM 1134 CG GLU A 72 1.996 2.198 -19.626 1.00 0.00 C ATOM 1135 CD GLU A 72 1.475 2.195 -21.050 1.00 0.00 C ATOM 1136 OE1 GLU A 72 0.252 2.369 -21.236 1.00 0.00 O ATOM 1137 OE2 GLU A 72 2.290 2.018 -21.980 1.00 0.00 O ATOM 0 H GLU A 72 1.650 -0.778 -17.095 1.00 0.00 H new ATOM 0 HA GLU A 72 0.513 1.761 -17.495 1.00 0.00 H new ATOM 0 HB2 GLU A 72 2.720 0.627 -18.367 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.716 0.078 -19.695 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.476 2.967 -19.054 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.053 2.464 -19.630 1.00 0.00 H new ATOM 1144 N GLU A 73 -1.040 -0.729 -18.907 1.00 0.00 N ATOM 1145 CA GLU A 73 -2.238 -1.115 -19.644 1.00 0.00 C ATOM 1146 C GLU A 73 -3.234 -1.821 -18.729 1.00 0.00 C ATOM 1147 O GLU A 73 -2.904 -2.188 -17.602 1.00 0.00 O ATOM 1148 CB GLU A 73 -1.868 -2.026 -20.816 1.00 0.00 C ATOM 1149 CG GLU A 73 -2.690 -1.769 -22.068 1.00 0.00 C ATOM 1150 CD GLU A 73 -2.621 -0.324 -22.524 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -1.630 0.358 -22.188 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -3.558 0.126 -23.216 1.00 0.00 O ATOM 0 H GLU A 73 -0.534 -1.509 -18.488 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.706 -0.210 -20.031 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.812 -1.892 -21.051 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.998 -3.065 -20.513 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -2.336 -2.417 -22.870 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.729 -2.037 -21.877 1.00 0.00 H new ATOM 1159 N GLU A 74 -4.454 -2.003 -19.222 1.00 0.00 N ATOM 1160 CA GLU A 74 -5.502 -2.663 -18.449 1.00 0.00 C ATOM 1161 C GLU A 74 -5.250 -4.164 -18.346 1.00 0.00 C ATOM 1162 O GLU A 74 -5.703 -4.816 -17.404 1.00 0.00 O ATOM 1163 CB GLU A 74 -6.869 -2.406 -19.084 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.330 -0.962 -18.973 1.00 0.00 C ATOM 1165 CD GLU A 74 -8.319 -0.751 -17.842 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -8.335 -1.577 -16.906 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.076 0.241 -17.894 1.00 0.00 O ATOM 0 H GLU A 74 -4.743 -1.703 -20.153 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.489 -2.245 -17.442 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -6.830 -2.686 -20.137 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.608 -3.052 -18.610 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -6.464 -0.319 -18.818 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.789 -0.658 -19.914 1.00 0.00 H new ATOM 1174 N ASP A 75 -4.532 -4.713 -19.322 1.00 0.00 N ATOM 1175 CA ASP A 75 -4.227 -6.140 -19.341 1.00 0.00 C ATOM 1176 C ASP A 75 -3.532 -6.575 -18.053 1.00 0.00 C ATOM 1177 O ASP A 75 -3.851 -7.621 -17.489 1.00 0.00 O ATOM 1178 CB ASP A 75 -3.348 -6.477 -20.546 1.00 0.00 C ATOM 1179 CG ASP A 75 -3.095 -7.966 -20.679 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -3.881 -8.754 -20.113 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -2.110 -8.343 -21.349 1.00 0.00 O ATOM 0 H ASP A 75 -4.150 -4.191 -20.111 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.169 -6.682 -19.420 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.825 -6.110 -21.454 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -2.395 -5.956 -20.454 1.00 0.00 H new ATOM 1186 N GLY A 76 -2.582 -5.767 -17.594 1.00 0.00 N ATOM 1187 CA GLY A 76 -1.860 -6.092 -16.377 1.00 0.00 C ATOM 1188 C GLY A 76 -2.755 -6.088 -15.152 1.00 0.00 C ATOM 1189 O GLY A 76 -2.836 -7.082 -14.432 1.00 0.00 O ATOM 0 H GLY A 76 -2.299 -4.895 -18.041 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -1.399 -7.074 -16.483 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.052 -5.374 -16.235 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.428 -4.967 -14.920 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.326 -4.828 -13.777 1.00 0.00 C ATOM 1195 C PHE A 77 -5.363 -5.951 -13.751 1.00 0.00 C ATOM 1196 O PHE A 77 -5.874 -6.313 -12.692 1.00 0.00 O ATOM 1197 CB PHE A 77 -5.028 -3.467 -13.825 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.998 -3.242 -12.700 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -7.292 -3.732 -12.777 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -5.618 -2.535 -11.570 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -8.188 -3.522 -11.746 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -6.511 -2.321 -10.538 1.00 0.00 C ATOM 1203 CZ PHE A 77 -7.797 -2.815 -10.625 1.00 0.00 C ATOM 0 H PHE A 77 -3.369 -4.137 -15.510 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.730 -4.895 -12.867 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.274 -2.680 -13.805 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.559 -3.376 -14.773 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -7.603 -4.284 -13.652 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -4.613 -2.147 -11.496 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -9.193 -3.910 -11.816 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -6.203 -1.767 -9.663 1.00 0.00 H new ATOM 0 HZ PHE A 77 -8.496 -2.649 -9.819 1.00 0.00 H new ATOM 1213 N ALA A 78 -5.672 -6.493 -14.925 1.00 0.00 N ATOM 1214 CA ALA A 78 -6.651 -7.568 -15.042 1.00 0.00 C ATOM 1215 C ALA A 78 -6.058 -8.907 -14.651 1.00 0.00 C ATOM 1216 O ALA A 78 -6.577 -9.598 -13.775 1.00 0.00 O ATOM 1217 CB ALA A 78 -7.126 -7.655 -16.461 1.00 0.00 C ATOM 0 H ALA A 78 -5.257 -6.204 -15.811 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.477 -7.341 -14.368 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.858 -8.458 -16.551 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.587 -6.710 -16.749 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.279 -7.861 -17.116 1.00 0.00 H new ATOM 1223 N GLY A 79 -4.938 -9.250 -15.282 1.00 0.00 N ATOM 1224 CA GLY A 79 -4.266 -10.486 -14.957 1.00 0.00 C ATOM 1225 C GLY A 79 -3.843 -10.469 -13.512 1.00 0.00 C ATOM 1226 O GLY A 79 -3.492 -11.496 -12.932 1.00 0.00 O ATOM 0 H GLY A 79 -4.489 -8.693 -16.009 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.929 -11.331 -15.142 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -3.395 -10.618 -15.599 1.00 0.00 H new ATOM 1230 N TYR A 80 -3.882 -9.270 -12.939 1.00 0.00 N ATOM 1231 CA TYR A 80 -3.504 -9.072 -11.543 1.00 0.00 C ATOM 1232 C TYR A 80 -4.725 -9.084 -10.623 1.00 0.00 C ATOM 1233 O TYR A 80 -4.592 -8.994 -9.402 1.00 0.00 O ATOM 1234 CB TYR A 80 -2.751 -7.753 -11.383 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.691 -7.785 -10.304 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -0.830 -8.868 -10.182 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.553 -6.733 -9.408 1.00 0.00 C ATOM 1238 CE1 TYR A 80 0.139 -8.901 -9.197 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.586 -6.758 -8.420 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.258 -7.845 -8.320 1.00 0.00 C ATOM 1241 OH TYR A 80 1.221 -7.874 -7.339 1.00 0.00 O ATOM 0 H TYR A 80 -4.172 -8.419 -13.421 1.00 0.00 H new ATOM 0 HA TYR A 80 -2.855 -9.900 -11.256 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.282 -7.495 -12.333 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.466 -6.962 -11.155 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -0.919 -9.698 -10.868 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.212 -5.881 -9.484 1.00 0.00 H new ATOM 0 HE1 TYR A 80 0.800 -9.751 -9.115 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -0.492 -5.932 -7.731 1.00 0.00 H new ATOM 0 HH TYR A 80 1.171 -7.053 -6.807 1.00 0.00 H new ATOM 1251 N PHE A 81 -5.913 -9.194 -11.213 1.00 0.00 N ATOM 1252 CA PHE A 81 -7.158 -9.215 -10.447 1.00 0.00 C ATOM 1253 C PHE A 81 -7.082 -10.209 -9.286 1.00 0.00 C ATOM 1254 O PHE A 81 -7.768 -10.049 -8.276 1.00 0.00 O ATOM 1255 CB PHE A 81 -8.339 -9.559 -11.361 1.00 0.00 C ATOM 1256 CG PHE A 81 -8.439 -11.019 -11.712 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -7.327 -11.719 -12.154 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -9.647 -11.690 -11.596 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -7.419 -13.060 -12.475 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -9.743 -13.031 -11.917 1.00 0.00 C ATOM 1261 CZ PHE A 81 -8.629 -13.717 -12.356 1.00 0.00 C ATOM 0 H PHE A 81 -6.040 -9.270 -12.222 1.00 0.00 H new ATOM 0 HA PHE A 81 -7.309 -8.220 -10.028 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -9.264 -9.249 -10.874 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.254 -8.980 -12.281 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -6.379 -11.211 -12.248 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -10.522 -11.159 -11.251 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -6.546 -13.594 -12.819 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -10.690 -13.542 -11.824 1.00 0.00 H new ATOM 0 HZ PHE A 81 -8.703 -14.765 -12.606 1.00 0.00 H new ATOM 1271 N ALA A 82 -6.243 -11.230 -9.434 1.00 0.00 N ATOM 1272 CA ALA A 82 -6.076 -12.243 -8.397 1.00 0.00 C ATOM 1273 C ALA A 82 -5.455 -11.651 -7.130 1.00 0.00 C ATOM 1274 O ALA A 82 -5.397 -12.312 -6.093 1.00 0.00 O ATOM 1275 CB ALA A 82 -5.222 -13.390 -8.917 1.00 0.00 C ATOM 0 H ALA A 82 -5.668 -11.378 -10.263 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.064 -12.622 -8.137 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.104 -14.140 -8.135 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.707 -13.842 -9.782 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.242 -13.011 -9.207 1.00 0.00 H new ATOM 1281 N LYS A 83 -4.984 -10.408 -7.225 1.00 0.00 N ATOM 1282 CA LYS A 83 -4.360 -9.721 -6.096 1.00 0.00 C ATOM 1283 C LYS A 83 -5.207 -9.818 -4.826 1.00 0.00 C ATOM 1284 O LYS A 83 -6.251 -10.471 -4.803 1.00 0.00 O ATOM 1285 CB LYS A 83 -4.122 -8.250 -6.449 1.00 0.00 C ATOM 1286 CG LYS A 83 -5.325 -7.569 -7.085 1.00 0.00 C ATOM 1287 CD LYS A 83 -6.175 -6.850 -6.049 1.00 0.00 C ATOM 1288 CE LYS A 83 -7.482 -7.583 -5.792 1.00 0.00 C ATOM 1289 NZ LYS A 83 -8.351 -7.611 -7.001 1.00 0.00 N ATOM 0 H LYS A 83 -5.024 -9.853 -8.080 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.408 -10.214 -5.897 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.846 -7.709 -5.544 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -3.275 -8.182 -7.132 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.985 -6.856 -7.836 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -5.932 -8.311 -7.603 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.617 -6.762 -5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -6.386 -5.837 -6.391 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -7.269 -8.604 -5.474 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -8.015 -7.099 -4.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -9.347 -7.529 -6.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -8.104 -6.817 -7.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -8.210 -8.507 -7.509 1.00 0.00 H new ATOM 1303 N MET A 84 -4.744 -9.152 -3.771 1.00 0.00 N ATOM 1304 CA MET A 84 -5.444 -9.148 -2.486 1.00 0.00 C ATOM 1305 C MET A 84 -6.676 -8.239 -2.556 1.00 0.00 C ATOM 1306 O MET A 84 -6.647 -7.197 -3.210 1.00 0.00 O ATOM 1307 CB MET A 84 -4.506 -8.688 -1.363 1.00 0.00 C ATOM 1308 CG MET A 84 -3.024 -8.868 -1.674 1.00 0.00 C ATOM 1309 SD MET A 84 -2.079 -9.483 -0.270 1.00 0.00 S ATOM 1310 CE MET A 84 -1.904 -11.209 -0.716 1.00 0.00 C ATOM 0 H MET A 84 -3.883 -8.605 -3.780 1.00 0.00 H new ATOM 0 HA MET A 84 -5.771 -10.165 -2.267 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.697 -7.635 -1.154 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.745 -9.242 -0.455 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.915 -9.560 -2.509 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.607 -7.913 -1.995 1.00 0.00 H new ATOM 0 HE1 MET A 84 -1.466 -11.758 0.118 1.00 0.00 H new ATOM 0 HE2 MET A 84 -2.884 -11.626 -0.949 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.256 -11.296 -1.588 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.786 -8.635 -1.908 1.00 0.00 N ATOM 1321 CA PRO A 85 -9.037 -7.870 -1.929 1.00 0.00 C ATOM 1322 C PRO A 85 -9.165 -6.827 -0.816 1.00 0.00 C ATOM 1323 O PRO A 85 -10.070 -5.992 -0.852 1.00 0.00 O ATOM 1324 CB PRO A 85 -10.078 -8.962 -1.725 1.00 0.00 C ATOM 1325 CG PRO A 85 -9.406 -9.974 -0.855 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.925 -9.881 -1.133 1.00 0.00 C ATOM 0 HA PRO A 85 -9.127 -7.286 -2.845 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -10.977 -8.568 -1.251 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -10.384 -9.399 -2.676 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.614 -9.777 0.197 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.777 -10.976 -1.071 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -7.347 -9.843 -0.210 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.570 -10.744 -1.697 1.00 0.00 H new ATOM 1334 N TRP A 86 -8.285 -6.895 0.178 1.00 0.00 N ATOM 1335 CA TRP A 86 -8.321 -5.971 1.321 1.00 0.00 C ATOM 1336 C TRP A 86 -8.822 -4.565 0.938 1.00 0.00 C ATOM 1337 O TRP A 86 -10.013 -4.287 1.073 1.00 0.00 O ATOM 1338 CB TRP A 86 -6.953 -5.913 2.005 1.00 0.00 C ATOM 1339 CG TRP A 86 -5.797 -5.852 1.049 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.815 -5.459 -0.262 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -4.451 -6.220 1.336 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.551 -5.521 -0.788 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.697 -5.994 0.170 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -3.810 -6.708 2.473 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.334 -6.242 0.109 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -2.457 -6.959 2.412 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.730 -6.723 1.233 1.00 0.00 C ATOM 0 H TRP A 86 -7.532 -7.582 0.220 1.00 0.00 H new ATOM 0 HA TRP A 86 -9.048 -6.365 2.031 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -6.920 -5.039 2.656 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -6.839 -6.790 2.642 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.696 -5.146 -0.803 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -4.290 -5.258 -1.738 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -4.363 -6.886 3.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.772 -6.061 -0.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -1.947 -7.343 3.283 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.670 -6.927 1.217 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.943 -3.682 0.449 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.359 -2.354 0.055 1.00 0.00 C ATOM 1360 C LEU A 87 -7.642 -1.958 -1.229 1.00 0.00 C ATOM 1361 O LEU A 87 -6.454 -2.236 -1.386 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.072 -1.337 1.160 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.267 -1.002 2.056 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -8.890 0.073 3.065 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.460 -0.556 1.216 1.00 0.00 C ATOM 0 H LEU A 87 -6.949 -3.872 0.322 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.435 -2.362 -0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.265 -1.719 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -7.711 -0.416 0.701 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.551 -1.902 2.602 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.751 0.299 3.694 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.069 -0.284 3.687 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.579 0.975 2.537 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.299 -0.322 1.871 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.190 0.331 0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.744 -1.357 0.534 1.00 0.00 H new ATOM 1377 N ALA A 88 -8.356 -1.343 -2.159 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.752 -0.961 -3.422 1.00 0.00 C ATOM 1379 C ALA A 88 -8.365 0.307 -4.001 1.00 0.00 C ATOM 1380 O ALA A 88 -9.482 0.687 -3.658 1.00 0.00 O ATOM 1381 CB ALA A 88 -7.916 -2.103 -4.392 1.00 0.00 C ATOM 0 H ALA A 88 -9.342 -1.101 -2.064 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.698 -0.747 -3.248 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.468 -1.835 -5.349 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.422 -2.990 -3.996 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.977 -2.311 -4.534 1.00 0.00 H new ATOM 1387 N VAL A 89 -7.624 0.943 -4.901 1.00 0.00 N ATOM 1388 CA VAL A 89 -8.091 2.156 -5.558 1.00 0.00 C ATOM 1389 C VAL A 89 -8.688 1.822 -6.923 1.00 0.00 C ATOM 1390 O VAL A 89 -8.011 1.242 -7.772 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.952 3.177 -5.748 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.483 4.468 -6.362 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -6.260 3.453 -4.422 1.00 0.00 C ATOM 0 H VAL A 89 -6.696 0.637 -5.192 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.851 2.599 -4.914 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.219 2.753 -6.435 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.663 5.175 -6.488 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.929 4.253 -7.333 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.237 4.900 -5.705 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.458 4.176 -4.573 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.982 3.856 -3.712 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.843 2.526 -4.029 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.960 2.181 -7.162 1.00 0.00 N ATOM 1404 CA PRO A 90 -10.620 1.907 -8.440 1.00 0.00 C ATOM 1405 C PRO A 90 -9.832 2.475 -9.613 1.00 0.00 C ATOM 1406 O PRO A 90 -9.182 3.513 -9.490 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.982 2.607 -8.315 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.855 3.520 -7.141 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.853 2.881 -6.226 1.00 0.00 C ATOM 0 HA PRO A 90 -10.706 0.838 -8.634 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -12.222 3.164 -9.221 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.783 1.883 -8.164 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.523 4.511 -7.452 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.815 3.647 -6.640 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -10.317 3.621 -5.632 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -11.326 2.192 -5.526 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.890 1.790 -10.752 1.00 0.00 N ATOM 1418 CA PHE A 91 -9.176 2.231 -11.946 1.00 0.00 C ATOM 1419 C PHE A 91 -9.418 3.716 -12.203 1.00 0.00 C ATOM 1420 O PHE A 91 -8.571 4.406 -12.771 1.00 0.00 O ATOM 1421 CB PHE A 91 -9.617 1.412 -13.161 1.00 0.00 C ATOM 1422 CG PHE A 91 -8.678 1.519 -14.329 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -7.492 0.803 -14.348 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -8.984 2.333 -15.407 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -6.626 0.900 -15.422 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -8.123 2.433 -16.483 1.00 0.00 C ATOM 1427 CZ PHE A 91 -6.942 1.716 -16.490 1.00 0.00 C ATOM 0 H PHE A 91 -10.423 0.929 -10.873 1.00 0.00 H new ATOM 0 HA PHE A 91 -8.110 2.077 -11.782 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.705 0.365 -12.871 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.609 1.742 -13.471 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.241 0.162 -13.515 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -9.906 2.896 -15.407 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -5.704 0.338 -15.425 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -8.373 3.071 -17.318 1.00 0.00 H new ATOM 0 HZ PHE A 91 -6.267 1.794 -17.330 1.00 0.00 H new ATOM 1437 N ALA A 92 -10.582 4.200 -11.780 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.944 5.600 -11.960 1.00 0.00 C ATOM 1439 C ALA A 92 -9.872 6.544 -11.410 1.00 0.00 C ATOM 1440 O ALA A 92 -9.615 7.598 -11.990 1.00 0.00 O ATOM 1441 CB ALA A 92 -12.283 5.884 -11.296 1.00 0.00 C ATOM 0 H ALA A 92 -11.292 3.640 -11.309 1.00 0.00 H new ATOM 0 HA ALA A 92 -11.024 5.783 -13.031 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.544 6.933 -11.437 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -13.052 5.256 -11.745 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.214 5.667 -10.230 1.00 0.00 H new ATOM 1447 N GLN A 93 -9.252 6.171 -10.290 1.00 0.00 N ATOM 1448 CA GLN A 93 -8.220 7.007 -9.685 1.00 0.00 C ATOM 1449 C GLN A 93 -6.849 6.343 -9.763 1.00 0.00 C ATOM 1450 O GLN A 93 -5.951 6.666 -8.986 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.565 7.308 -8.225 1.00 0.00 C ATOM 1452 CG GLN A 93 -10.041 7.595 -7.994 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.274 8.859 -7.191 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.393 9.712 -7.083 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.468 8.988 -6.624 1.00 0.00 N ATOM 0 H GLN A 93 -9.445 5.304 -9.789 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.181 7.940 -10.247 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -8.268 6.460 -7.608 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.980 8.165 -7.892 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.544 7.683 -8.957 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.494 6.751 -7.474 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.169 8.256 -6.739 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -11.684 9.819 -6.073 1.00 0.00 H new ATOM 1464 N SER A 94 -6.686 5.420 -10.707 1.00 0.00 N ATOM 1465 CA SER A 94 -5.412 4.729 -10.874 1.00 0.00 C ATOM 1466 C SER A 94 -4.302 5.729 -11.182 1.00 0.00 C ATOM 1467 O SER A 94 -3.136 5.494 -10.865 1.00 0.00 O ATOM 1468 CB SER A 94 -5.505 3.686 -11.986 1.00 0.00 C ATOM 1469 OG SER A 94 -5.349 4.282 -13.262 1.00 0.00 O ATOM 0 H SER A 94 -7.414 5.135 -11.363 1.00 0.00 H new ATOM 0 HA SER A 94 -5.176 4.218 -9.941 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.737 2.926 -11.840 1.00 0.00 H new ATOM 0 HB3 SER A 94 -6.469 3.180 -11.934 1.00 0.00 H new ATOM 0 HG SER A 94 -5.411 3.592 -13.955 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.676 6.850 -11.795 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.722 7.893 -12.137 1.00 0.00 C ATOM 1477 C GLU A 95 -2.927 8.316 -10.911 1.00 0.00 C ATOM 1478 O GLU A 95 -1.714 8.521 -10.977 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.461 9.096 -12.713 1.00 0.00 C ATOM 1480 CG GLU A 95 -5.626 9.570 -11.858 1.00 0.00 C ATOM 1481 CD GLU A 95 -6.227 10.868 -12.363 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -5.484 11.673 -12.964 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -7.442 11.078 -12.161 1.00 0.00 O ATOM 0 H GLU A 95 -5.638 7.056 -12.064 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.029 7.501 -12.881 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -3.756 9.918 -12.837 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.832 8.841 -13.706 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -6.397 8.799 -11.840 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.287 9.706 -10.831 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.625 8.436 -9.791 1.00 0.00 N ATOM 1491 CA ALA A 96 -3.004 8.826 -8.531 1.00 0.00 C ATOM 1492 C ALA A 96 -1.814 7.941 -8.213 1.00 0.00 C ATOM 1493 O ALA A 96 -0.794 8.409 -7.720 1.00 0.00 O ATOM 1494 CB ALA A 96 -4.006 8.730 -7.396 1.00 0.00 C ATOM 0 H ALA A 96 -4.629 8.268 -9.728 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.664 9.856 -8.636 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.527 9.024 -6.462 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.848 9.393 -7.597 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.364 7.704 -7.312 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.964 6.657 -8.488 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.912 5.692 -8.221 1.00 0.00 C ATOM 1502 C VAL A 97 0.376 6.066 -8.941 1.00 0.00 C ATOM 1503 O VAL A 97 1.477 5.846 -8.436 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.357 4.284 -8.626 1.00 0.00 C ATOM 1505 CG1 VAL A 97 -0.222 3.291 -8.444 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.578 3.892 -7.811 1.00 0.00 C ATOM 0 H VAL A 97 -2.808 6.257 -8.898 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.716 5.703 -7.149 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.626 4.275 -9.682 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.558 2.296 -8.737 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.623 3.586 -9.066 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.085 3.277 -7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.899 2.890 -8.096 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.327 3.905 -6.750 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.385 4.599 -8.002 1.00 0.00 H new ATOM 1516 N GLN A 98 0.219 6.639 -10.120 1.00 0.00 N ATOM 1517 CA GLN A 98 1.354 7.064 -10.931 1.00 0.00 C ATOM 1518 C GLN A 98 2.097 8.219 -10.276 1.00 0.00 C ATOM 1519 O GLN A 98 3.305 8.163 -10.055 1.00 0.00 O ATOM 1520 CB GLN A 98 0.846 7.533 -12.290 1.00 0.00 C ATOM 1521 CG GLN A 98 0.033 6.485 -13.034 1.00 0.00 C ATOM 1522 CD GLN A 98 0.248 6.537 -14.534 1.00 0.00 C ATOM 1523 OE1 GLN A 98 1.306 6.952 -15.007 1.00 0.00 O ATOM 1524 NE2 GLN A 98 -0.759 6.115 -15.290 1.00 0.00 N ATOM 0 H GLN A 98 -0.690 6.824 -10.544 1.00 0.00 H new ATOM 0 HA GLN A 98 2.034 6.218 -11.035 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.234 8.424 -12.151 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.697 7.824 -12.905 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.301 5.494 -12.666 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.025 6.630 -12.817 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -1.618 5.779 -14.854 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.673 6.127 -16.306 1.00 0.00 H new ATOM 1533 N LYS A 99 1.348 9.269 -9.991 1.00 0.00 N ATOM 1534 CA LYS A 99 1.901 10.477 -9.378 1.00 0.00 C ATOM 1535 C LYS A 99 2.202 10.276 -7.894 1.00 0.00 C ATOM 1536 O LYS A 99 3.156 10.849 -7.368 1.00 0.00 O ATOM 1537 CB LYS A 99 0.964 11.675 -9.586 1.00 0.00 C ATOM 1538 CG LYS A 99 -0.320 11.622 -8.772 1.00 0.00 C ATOM 1539 CD LYS A 99 -0.653 12.978 -8.166 1.00 0.00 C ATOM 1540 CE LYS A 99 0.388 13.410 -7.144 1.00 0.00 C ATOM 1541 NZ LYS A 99 0.588 14.885 -7.144 1.00 0.00 N ATOM 0 H LYS A 99 0.346 9.315 -10.174 1.00 0.00 H new ATOM 0 HA LYS A 99 2.847 10.688 -9.877 1.00 0.00 H new ATOM 0 HB2 LYS A 99 1.502 12.589 -9.333 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.706 11.739 -10.643 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -1.142 11.295 -9.408 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.218 10.882 -7.978 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -0.717 13.724 -8.958 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -1.633 12.933 -7.690 1.00 0.00 H new ATOM 0 HE2 LYS A 99 0.078 13.086 -6.151 1.00 0.00 H new ATOM 0 HE3 LYS A 99 1.335 12.915 -7.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 1.305 15.138 -6.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 0.909 15.192 -8.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -0.310 15.357 -6.913 1.00 0.00 H new ATOM 1555 N LEU A 100 1.400 9.456 -7.220 1.00 0.00 N ATOM 1556 CA LEU A 100 1.614 9.189 -5.795 1.00 0.00 C ATOM 1557 C LEU A 100 3.032 8.676 -5.560 1.00 0.00 C ATOM 1558 O LEU A 100 3.633 8.935 -4.518 1.00 0.00 O ATOM 1559 CB LEU A 100 0.607 8.156 -5.281 1.00 0.00 C ATOM 1560 CG LEU A 100 0.526 7.989 -3.767 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.374 9.339 -3.083 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.633 7.065 -3.408 1.00 0.00 C ATOM 0 H LEU A 100 0.603 8.968 -7.629 1.00 0.00 H new ATOM 0 HA LEU A 100 1.472 10.123 -5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.382 8.429 -5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.854 7.189 -5.719 1.00 0.00 H new ATOM 0 HG LEU A 100 1.454 7.539 -3.413 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.318 9.196 -2.004 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.233 9.967 -3.322 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.538 9.823 -3.432 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.685 6.950 -2.325 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.566 7.494 -3.773 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.477 6.090 -3.869 1.00 0.00 H new ATOM 1574 N SER A 101 3.559 7.945 -6.540 1.00 0.00 N ATOM 1575 CA SER A 101 4.905 7.394 -6.444 1.00 0.00 C ATOM 1576 C SER A 101 5.953 8.500 -6.499 1.00 0.00 C ATOM 1577 O SER A 101 7.007 8.403 -5.871 1.00 0.00 O ATOM 1578 CB SER A 101 5.148 6.388 -7.571 1.00 0.00 C ATOM 1579 OG SER A 101 5.236 7.040 -8.826 1.00 0.00 O ATOM 0 H SER A 101 3.073 7.722 -7.409 1.00 0.00 H new ATOM 0 HA SER A 101 4.993 6.884 -5.485 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.069 5.837 -7.379 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.338 5.659 -7.593 1.00 0.00 H new ATOM 0 HG SER A 101 4.341 7.315 -9.115 1.00 0.00 H new ATOM 1585 N LYS A 102 5.656 9.553 -7.256 1.00 0.00 N ATOM 1586 CA LYS A 102 6.574 10.678 -7.392 1.00 0.00 C ATOM 1587 C LYS A 102 6.901 11.285 -6.031 1.00 0.00 C ATOM 1588 O LYS A 102 7.990 11.818 -5.823 1.00 0.00 O ATOM 1589 CB LYS A 102 5.971 11.746 -8.309 1.00 0.00 C ATOM 1590 CG LYS A 102 6.976 12.363 -9.268 1.00 0.00 C ATOM 1591 CD LYS A 102 6.910 11.710 -10.639 1.00 0.00 C ATOM 1592 CE LYS A 102 7.858 10.527 -10.739 1.00 0.00 C ATOM 1593 NZ LYS A 102 7.385 9.519 -11.728 1.00 0.00 N ATOM 0 H LYS A 102 4.788 9.650 -7.783 1.00 0.00 H new ATOM 0 HA LYS A 102 7.499 10.308 -7.834 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.158 11.302 -8.884 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.535 12.535 -7.696 1.00 0.00 H new ATOM 0 HG2 LYS A 102 6.782 13.431 -9.363 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.982 12.257 -8.861 1.00 0.00 H new ATOM 0 HD2 LYS A 102 5.891 11.378 -10.836 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.160 12.444 -11.405 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.849 10.879 -11.025 1.00 0.00 H new ATOM 0 HE3 LYS A 102 7.957 10.057 -9.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.059 8.728 -11.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.450 9.164 -11.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.315 9.960 -12.667 1.00 0.00 H new ATOM 1607 N HIS A 103 5.950 11.198 -5.107 1.00 0.00 N ATOM 1608 CA HIS A 103 6.136 11.737 -3.765 1.00 0.00 C ATOM 1609 C HIS A 103 6.955 10.784 -2.901 1.00 0.00 C ATOM 1610 O HIS A 103 7.688 11.213 -2.011 1.00 0.00 O ATOM 1611 CB HIS A 103 4.781 12.005 -3.107 1.00 0.00 C ATOM 1612 CG HIS A 103 4.145 13.287 -3.550 1.00 0.00 C ATOM 1613 ND1 HIS A 103 4.335 14.486 -2.898 1.00 0.00 N ATOM 1614 CD2 HIS A 103 3.316 13.552 -4.588 1.00 0.00 C ATOM 1615 CE1 HIS A 103 3.651 15.434 -3.515 1.00 0.00 C ATOM 1616 NE2 HIS A 103 3.026 14.893 -4.543 1.00 0.00 N ATOM 0 H HIS A 103 5.043 10.759 -5.263 1.00 0.00 H new ATOM 0 HA HIS A 103 6.682 12.676 -3.852 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.107 11.178 -3.331 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.910 12.027 -2.025 1.00 0.00 H new ATOM 0 HD1 HIS A 103 4.913 14.621 -2.069 1.00 0.00 H new ATOM 0 HD2 HIS A 103 2.951 12.841 -5.315 1.00 0.00 H new ATOM 0 HE1 HIS A 103 3.611 16.474 -3.227 1.00 0.00 H new ATOM 1625 N PHE A 104 6.825 9.487 -3.169 1.00 0.00 N ATOM 1626 CA PHE A 104 7.556 8.476 -2.413 1.00 0.00 C ATOM 1627 C PHE A 104 8.879 8.123 -3.092 1.00 0.00 C ATOM 1628 O PHE A 104 9.535 7.151 -2.717 1.00 0.00 O ATOM 1629 CB PHE A 104 6.700 7.220 -2.247 1.00 0.00 C ATOM 1630 CG PHE A 104 5.447 7.450 -1.451 1.00 0.00 C ATOM 1631 CD1 PHE A 104 5.490 8.155 -0.259 1.00 0.00 C ATOM 1632 CD2 PHE A 104 4.228 6.963 -1.895 1.00 0.00 C ATOM 1633 CE1 PHE A 104 4.340 8.370 0.477 1.00 0.00 C ATOM 1634 CE2 PHE A 104 3.075 7.175 -1.164 1.00 0.00 C ATOM 1635 CZ PHE A 104 3.131 7.879 0.023 1.00 0.00 C ATOM 0 H PHE A 104 6.222 9.113 -3.902 1.00 0.00 H new ATOM 0 HA PHE A 104 7.781 8.890 -1.430 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.430 6.841 -3.233 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.294 6.447 -1.760 1.00 0.00 H new ATOM 0 HD1 PHE A 104 6.433 8.541 0.099 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.179 6.412 -2.822 1.00 0.00 H new ATOM 0 HE1 PHE A 104 4.386 8.921 1.405 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.131 6.791 -1.520 1.00 0.00 H new ATOM 0 HZ PHE A 104 2.231 8.046 0.596 1.00 0.00 H new ATOM 1645 N ASN A 105 9.265 8.918 -4.090 1.00 0.00 N ATOM 1646 CA ASN A 105 10.511 8.698 -4.822 1.00 0.00 C ATOM 1647 C ASN A 105 10.702 7.224 -5.172 1.00 0.00 C ATOM 1648 O ASN A 105 11.817 6.705 -5.131 1.00 0.00 O ATOM 1649 CB ASN A 105 11.702 9.207 -4.008 1.00 0.00 C ATOM 1650 CG ASN A 105 11.940 8.397 -2.749 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.619 7.370 -2.776 1.00 0.00 O ATOM 1652 ND2 ASN A 105 11.380 8.855 -1.635 1.00 0.00 N ATOM 0 H ASN A 105 8.729 9.724 -4.411 1.00 0.00 H new ATOM 0 HA ASN A 105 10.451 9.258 -5.755 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.598 9.179 -4.628 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.533 10.249 -3.738 1.00 0.00 H new ATOM 0 HD21 ASN A 105 11.505 8.351 -0.757 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.825 9.710 -1.658 1.00 0.00 H new ATOM 1659 N VAL A 106 9.606 6.555 -5.516 1.00 0.00 N ATOM 1660 CA VAL A 106 9.654 5.143 -5.874 1.00 0.00 C ATOM 1661 C VAL A 106 10.589 4.909 -7.055 1.00 0.00 C ATOM 1662 O VAL A 106 10.228 5.162 -8.204 1.00 0.00 O ATOM 1663 CB VAL A 106 8.256 4.602 -6.227 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.297 3.091 -6.404 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.246 4.993 -5.159 1.00 0.00 C ATOM 0 H VAL A 106 8.674 6.968 -5.554 1.00 0.00 H new ATOM 0 HA VAL A 106 10.031 4.609 -5.002 1.00 0.00 H new ATOM 0 HB VAL A 106 7.942 5.047 -7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.300 2.727 -6.653 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.988 2.837 -7.208 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.633 2.625 -5.477 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.264 4.602 -5.426 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.553 4.578 -4.199 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.196 6.079 -5.086 1.00 0.00 H new ATOM 1675 N GLU A 107 11.792 4.420 -6.766 1.00 0.00 N ATOM 1676 CA GLU A 107 12.778 4.150 -7.807 1.00 0.00 C ATOM 1677 C GLU A 107 12.205 3.211 -8.863 1.00 0.00 C ATOM 1678 O GLU A 107 12.277 3.486 -10.059 1.00 0.00 O ATOM 1679 CB GLU A 107 14.041 3.541 -7.195 1.00 0.00 C ATOM 1680 CG GLU A 107 15.136 3.265 -8.212 1.00 0.00 C ATOM 1681 CD GLU A 107 16.158 4.383 -8.284 1.00 0.00 C ATOM 1682 OE1 GLU A 107 16.808 4.660 -7.254 1.00 0.00 O ATOM 1683 OE2 GLU A 107 16.309 4.981 -9.370 1.00 0.00 O ATOM 0 H GLU A 107 12.107 4.203 -5.820 1.00 0.00 H new ATOM 0 HA GLU A 107 13.036 5.094 -8.287 1.00 0.00 H new ATOM 0 HB2 GLU A 107 14.427 4.217 -6.432 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.779 2.609 -6.693 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.639 2.333 -7.955 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.687 3.124 -9.195 1.00 0.00 H new ATOM 1690 N SER A 108 11.629 2.103 -8.407 1.00 0.00 N ATOM 1691 CA SER A 108 11.035 1.123 -9.306 1.00 0.00 C ATOM 1692 C SER A 108 10.194 0.117 -8.530 1.00 0.00 C ATOM 1693 O SER A 108 10.469 -0.169 -7.365 1.00 0.00 O ATOM 1694 CB SER A 108 12.120 0.391 -10.096 1.00 0.00 C ATOM 1695 OG SER A 108 12.742 1.254 -11.032 1.00 0.00 O ATOM 0 H SER A 108 11.562 1.862 -7.418 1.00 0.00 H new ATOM 0 HA SER A 108 10.388 1.656 -10.003 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.868 -0.006 -9.410 1.00 0.00 H new ATOM 0 HB3 SER A 108 11.682 -0.460 -10.617 1.00 0.00 H new ATOM 0 HG SER A 108 12.263 2.109 -11.057 1.00 0.00 H new ATOM 1701 N ILE A 109 9.169 -0.415 -9.183 1.00 0.00 N ATOM 1702 CA ILE A 109 8.287 -1.389 -8.553 1.00 0.00 C ATOM 1703 C ILE A 109 8.908 -2.787 -8.565 1.00 0.00 C ATOM 1704 O ILE A 109 9.778 -3.079 -9.386 1.00 0.00 O ATOM 1705 CB ILE A 109 6.899 -1.428 -9.233 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.012 -1.410 -10.767 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.065 -0.247 -8.762 1.00 0.00 C ATOM 1708 CD1 ILE A 109 8.083 -2.321 -11.326 1.00 0.00 C ATOM 0 H ILE A 109 8.928 -0.189 -10.148 1.00 0.00 H new ATOM 0 HA ILE A 109 8.154 -1.071 -7.519 1.00 0.00 H new ATOM 0 HB ILE A 109 6.414 -2.362 -8.949 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.050 -1.696 -11.193 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.214 -0.389 -11.092 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.087 -0.277 -9.243 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.939 -0.299 -7.681 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.570 0.683 -9.024 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.093 -2.246 -12.413 1.00 0.00 H new ATOM 0 HD12 ILE A 109 9.055 -2.024 -10.933 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.873 -3.350 -11.035 1.00 0.00 H new ATOM 1720 N PRO A 110 8.476 -3.676 -7.650 1.00 0.00 N ATOM 1721 CA PRO A 110 7.444 -3.372 -6.651 1.00 0.00 C ATOM 1722 C PRO A 110 7.971 -2.510 -5.508 1.00 0.00 C ATOM 1723 O PRO A 110 9.172 -2.480 -5.241 1.00 0.00 O ATOM 1724 CB PRO A 110 7.051 -4.753 -6.131 1.00 0.00 C ATOM 1725 CG PRO A 110 8.287 -5.569 -6.282 1.00 0.00 C ATOM 1726 CD PRO A 110 8.968 -5.061 -7.524 1.00 0.00 C ATOM 0 HA PRO A 110 6.619 -2.802 -7.078 1.00 0.00 H new ATOM 0 HB2 PRO A 110 6.728 -4.709 -5.091 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.224 -5.173 -6.704 1.00 0.00 H new ATOM 0 HG2 PRO A 110 8.934 -5.463 -5.411 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.047 -6.628 -6.374 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.053 -5.093 -7.427 1.00 0.00 H new ATOM 0 HD3 PRO A 110 8.708 -5.660 -8.397 1.00 0.00 H new ATOM 1734 N THR A 111 7.061 -1.817 -4.833 1.00 0.00 N ATOM 1735 CA THR A 111 7.426 -0.960 -3.713 1.00 0.00 C ATOM 1736 C THR A 111 6.370 -1.043 -2.612 1.00 0.00 C ATOM 1737 O THR A 111 5.277 -1.567 -2.828 1.00 0.00 O ATOM 1738 CB THR A 111 7.608 0.489 -4.183 1.00 0.00 C ATOM 1739 OG1 THR A 111 8.552 1.166 -3.371 1.00 0.00 O ATOM 1740 CG2 THR A 111 6.329 1.302 -4.172 1.00 0.00 C ATOM 0 H THR A 111 6.063 -1.833 -5.043 1.00 0.00 H new ATOM 0 HA THR A 111 8.375 -1.308 -3.304 1.00 0.00 H new ATOM 0 HB THR A 111 7.953 0.408 -5.214 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.331 2.120 -3.338 1.00 0.00 H new ATOM 0 HG21 THR A 111 6.539 2.315 -4.517 1.00 0.00 H new ATOM 0 HG22 THR A 111 5.597 0.838 -4.833 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.930 1.339 -3.158 1.00 0.00 H new ATOM 1748 N LEU A 112 6.696 -0.513 -1.440 1.00 0.00 N ATOM 1749 CA LEU A 112 5.752 -0.521 -0.316 1.00 0.00 C ATOM 1750 C LEU A 112 5.938 0.723 0.548 1.00 0.00 C ATOM 1751 O LEU A 112 7.053 1.040 0.958 1.00 0.00 O ATOM 1752 CB LEU A 112 5.888 -1.817 0.529 1.00 0.00 C ATOM 1753 CG LEU A 112 4.982 -1.937 1.767 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.606 -1.350 1.542 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.853 -3.383 2.198 1.00 0.00 C ATOM 0 H LEU A 112 7.595 -0.075 -1.238 1.00 0.00 H new ATOM 0 HA LEU A 112 4.742 -0.505 -0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.689 -2.669 -0.121 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.924 -1.901 0.857 1.00 0.00 H new ATOM 0 HG LEU A 112 5.462 -1.359 2.557 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.010 -1.462 2.448 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.697 -0.292 1.297 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.118 -1.872 0.719 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.208 -3.445 3.075 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.419 -3.967 1.386 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.838 -3.779 2.443 1.00 0.00 H new ATOM 1767 N ILE A 113 4.842 1.432 0.812 1.00 0.00 N ATOM 1768 CA ILE A 113 4.894 2.648 1.620 1.00 0.00 C ATOM 1769 C ILE A 113 3.821 2.644 2.707 1.00 0.00 C ATOM 1770 O ILE A 113 2.748 2.067 2.534 1.00 0.00 O ATOM 1771 CB ILE A 113 4.707 3.908 0.748 1.00 0.00 C ATOM 1772 CG1 ILE A 113 5.690 3.899 -0.428 1.00 0.00 C ATOM 1773 CG2 ILE A 113 4.877 5.168 1.586 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.111 4.244 -0.038 1.00 0.00 C ATOM 0 H ILE A 113 3.910 1.186 0.479 1.00 0.00 H new ATOM 0 HA ILE A 113 5.879 2.670 2.086 1.00 0.00 H new ATOM 0 HB ILE A 113 3.694 3.902 0.345 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.679 2.912 -0.891 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.347 4.608 -1.181 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.742 6.046 0.954 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.135 5.177 2.384 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.877 5.184 2.020 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.748 4.217 -0.922 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.136 5.243 0.397 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.474 3.521 0.692 1.00 0.00 H new ATOM 1786 N GLY A 114 4.118 3.304 3.825 1.00 0.00 N ATOM 1787 CA GLY A 114 3.170 3.380 4.920 1.00 0.00 C ATOM 1788 C GLY A 114 2.926 4.810 5.361 1.00 0.00 C ATOM 1789 O GLY A 114 3.872 5.558 5.608 1.00 0.00 O ATOM 0 H GLY A 114 5.001 3.788 3.990 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.226 2.929 4.614 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.543 2.799 5.763 1.00 0.00 H new ATOM 1793 N VAL A 115 1.658 5.198 5.455 1.00 0.00 N ATOM 1794 CA VAL A 115 1.305 6.544 5.861 1.00 0.00 C ATOM 1795 C VAL A 115 0.210 6.527 6.919 1.00 0.00 C ATOM 1796 O VAL A 115 -0.480 5.525 7.105 1.00 0.00 O ATOM 1797 CB VAL A 115 0.836 7.393 4.662 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.915 7.450 3.593 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.464 6.845 4.088 1.00 0.00 C ATOM 0 H VAL A 115 0.860 4.595 5.254 1.00 0.00 H new ATOM 0 HA VAL A 115 2.205 6.993 6.280 1.00 0.00 H new ATOM 0 HB VAL A 115 0.649 8.408 5.014 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.566 8.053 2.755 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.817 7.897 4.010 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.137 6.441 3.246 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.776 7.459 3.243 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.310 5.819 3.753 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.237 6.864 4.856 1.00 0.00 H new ATOM 1809 N ASP A 116 0.062 7.648 7.601 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.948 7.788 8.643 1.00 0.00 C ATOM 1811 C ASP A 116 -2.118 8.631 8.148 1.00 0.00 C ATOM 1812 O ASP A 116 -1.965 9.820 7.868 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.340 8.422 9.897 1.00 0.00 C ATOM 1814 CG ASP A 116 0.536 9.618 9.579 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.402 10.174 8.469 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.355 10.000 10.441 1.00 0.00 O ATOM 0 H ASP A 116 0.631 8.482 7.453 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.316 6.793 8.895 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -1.141 8.731 10.568 1.00 0.00 H new ATOM 0 HB3 ASP A 116 0.250 7.675 10.428 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.286 8.010 8.041 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.480 8.704 7.576 1.00 0.00 C ATOM 1823 C ALA A 117 -4.822 9.881 8.485 1.00 0.00 C ATOM 1824 O ALA A 117 -5.308 10.913 8.024 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.652 7.740 7.497 1.00 0.00 C ATOM 0 H ALA A 117 -3.432 7.027 8.270 1.00 0.00 H new ATOM 0 HA ALA A 117 -4.277 9.096 6.579 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.537 8.272 7.148 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.415 6.935 6.802 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.846 7.321 8.484 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.566 9.717 9.779 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.850 10.763 10.755 1.00 0.00 C ATOM 1833 C ASP A 118 -3.976 11.992 10.513 1.00 0.00 C ATOM 1834 O ASP A 118 -4.481 13.074 10.216 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.630 10.238 12.175 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.789 10.563 13.097 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -6.950 10.357 12.687 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -5.535 11.026 14.230 1.00 0.00 O ATOM 0 H ASP A 118 -4.162 8.869 10.176 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.894 11.056 10.640 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.487 9.158 12.142 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.715 10.668 12.581 1.00 0.00 H new ATOM 1843 N SER A 119 -2.666 11.817 10.645 1.00 0.00 N ATOM 1844 CA SER A 119 -1.725 12.914 10.444 1.00 0.00 C ATOM 1845 C SER A 119 -1.688 13.341 8.980 1.00 0.00 C ATOM 1846 O SER A 119 -1.693 14.532 8.671 1.00 0.00 O ATOM 1847 CB SER A 119 -0.324 12.502 10.901 1.00 0.00 C ATOM 1848 OG SER A 119 -0.388 11.580 11.975 1.00 0.00 O ATOM 0 H SER A 119 -2.231 10.927 10.890 1.00 0.00 H new ATOM 0 HA SER A 119 -2.062 13.761 11.042 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.217 12.056 10.067 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.236 13.385 11.209 1.00 0.00 H new ATOM 0 HG SER A 119 0.252 10.854 11.821 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.652 12.361 8.084 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.616 12.657 6.664 1.00 0.00 C ATOM 1856 C GLY A 120 -0.224 12.522 6.077 1.00 0.00 C ATOM 1857 O GLY A 120 -0.041 11.895 5.034 1.00 0.00 O ATOM 0 H GLY A 120 -1.647 11.368 8.315 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.295 11.985 6.139 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.980 13.671 6.498 1.00 0.00 H new ATOM 1861 N ASP A 121 0.759 13.113 6.747 1.00 0.00 N ATOM 1862 CA ASP A 121 2.142 13.057 6.285 1.00 0.00 C ATOM 1863 C ASP A 121 2.625 11.614 6.188 1.00 0.00 C ATOM 1864 O ASP A 121 1.927 10.685 6.594 1.00 0.00 O ATOM 1865 CB ASP A 121 3.049 13.848 7.230 1.00 0.00 C ATOM 1866 CG ASP A 121 4.146 14.590 6.492 1.00 0.00 C ATOM 1867 OD1 ASP A 121 3.843 15.224 5.459 1.00 0.00 O ATOM 1868 OD2 ASP A 121 5.308 14.539 6.947 1.00 0.00 O ATOM 0 H ASP A 121 0.624 13.637 7.612 1.00 0.00 H new ATOM 0 HA ASP A 121 2.186 13.503 5.291 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.448 14.561 7.794 1.00 0.00 H new ATOM 0 HB3 ASP A 121 3.498 13.167 7.953 1.00 0.00 H new ATOM 1873 N VAL A 122 3.824 11.431 5.645 1.00 0.00 N ATOM 1874 CA VAL A 122 4.400 10.103 5.494 1.00 0.00 C ATOM 1875 C VAL A 122 5.028 9.624 6.799 1.00 0.00 C ATOM 1876 O VAL A 122 5.729 10.375 7.476 1.00 0.00 O ATOM 1877 CB VAL A 122 5.469 10.081 4.386 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.927 8.660 4.114 1.00 0.00 C ATOM 1879 CG2 VAL A 122 4.936 10.729 3.117 1.00 0.00 C ATOM 0 H VAL A 122 4.415 12.188 5.302 1.00 0.00 H new ATOM 0 HA VAL A 122 3.585 9.433 5.219 1.00 0.00 H new ATOM 0 HB VAL A 122 6.330 10.656 4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.682 8.665 3.328 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.352 8.234 5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 122 5.076 8.058 3.795 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.705 10.704 2.345 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.058 10.184 2.771 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.663 11.764 3.324 1.00 0.00 H new ATOM 1889 N VAL A 123 4.766 8.368 7.147 1.00 0.00 N ATOM 1890 CA VAL A 123 5.300 7.787 8.370 1.00 0.00 C ATOM 1891 C VAL A 123 6.452 6.828 8.078 1.00 0.00 C ATOM 1892 O VAL A 123 7.316 6.610 8.925 1.00 0.00 O ATOM 1893 CB VAL A 123 4.210 7.033 9.156 1.00 0.00 C ATOM 1894 CG1 VAL A 123 4.716 6.648 10.539 1.00 0.00 C ATOM 1895 CG2 VAL A 123 2.946 7.871 9.257 1.00 0.00 C ATOM 0 H VAL A 123 4.186 7.734 6.597 1.00 0.00 H new ATOM 0 HA VAL A 123 5.670 8.617 8.972 1.00 0.00 H new ATOM 0 HB VAL A 123 3.968 6.118 8.616 1.00 0.00 H new ATOM 0 HG11 VAL A 123 3.932 6.117 11.078 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.589 6.003 10.440 1.00 0.00 H new ATOM 0 HG13 VAL A 123 4.989 7.548 11.090 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.189 7.321 9.815 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.169 8.806 9.772 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.573 8.088 8.256 1.00 0.00 H new ATOM 1905 N THR A 124 6.456 6.254 6.879 1.00 0.00 N ATOM 1906 CA THR A 124 7.501 5.318 6.486 1.00 0.00 C ATOM 1907 C THR A 124 7.540 5.176 4.968 1.00 0.00 C ATOM 1908 O THR A 124 6.561 5.472 4.283 1.00 0.00 O ATOM 1909 CB THR A 124 7.277 3.952 7.149 1.00 0.00 C ATOM 1910 OG1 THR A 124 7.728 2.902 6.312 1.00 0.00 O ATOM 1911 CG2 THR A 124 5.825 3.676 7.488 1.00 0.00 C ATOM 0 H THR A 124 5.748 6.421 6.164 1.00 0.00 H new ATOM 0 HA THR A 124 8.461 5.709 6.823 1.00 0.00 H new ATOM 0 HB THR A 124 7.849 3.991 8.076 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.979 2.306 6.103 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.740 2.694 7.953 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.461 4.437 8.178 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.228 3.698 6.576 1.00 0.00 H new ATOM 1919 N THR A 125 8.679 4.736 4.448 1.00 0.00 N ATOM 1920 CA THR A 125 8.841 4.575 3.006 1.00 0.00 C ATOM 1921 C THR A 125 9.399 3.199 2.636 1.00 0.00 C ATOM 1922 O THR A 125 8.815 2.491 1.818 1.00 0.00 O ATOM 1923 CB THR A 125 9.737 5.681 2.457 1.00 0.00 C ATOM 1924 OG1 THR A 125 10.977 5.711 3.140 1.00 0.00 O ATOM 1925 CG2 THR A 125 9.108 7.053 2.580 1.00 0.00 C ATOM 0 H THR A 125 9.500 4.485 4.998 1.00 0.00 H new ATOM 0 HA THR A 125 7.853 4.650 2.552 1.00 0.00 H new ATOM 0 HB THR A 125 9.882 5.450 1.402 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.536 6.426 2.771 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.788 7.803 2.175 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.171 7.075 2.024 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.912 7.271 3.630 1.00 0.00 H new ATOM 1933 N ARG A 126 10.523 2.815 3.235 1.00 0.00 N ATOM 1934 CA ARG A 126 11.131 1.518 2.954 1.00 0.00 C ATOM 1935 C ARG A 126 10.313 0.392 3.582 1.00 0.00 C ATOM 1936 O ARG A 126 10.854 -0.490 4.250 1.00 0.00 O ATOM 1937 CB ARG A 126 12.574 1.478 3.473 1.00 0.00 C ATOM 1938 CG ARG A 126 12.692 1.489 4.995 1.00 0.00 C ATOM 1939 CD ARG A 126 12.918 2.889 5.563 1.00 0.00 C ATOM 1940 NE ARG A 126 13.422 3.836 4.569 1.00 0.00 N ATOM 1941 CZ ARG A 126 14.696 3.902 4.187 1.00 0.00 C ATOM 1942 NH1 ARG A 126 15.597 3.078 4.708 1.00 0.00 N ATOM 1943 NH2 ARG A 126 15.070 4.792 3.279 1.00 0.00 N ATOM 0 H ARG A 126 11.030 3.381 3.916 1.00 0.00 H new ATOM 0 HA ARG A 126 11.144 1.375 1.874 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.062 0.582 3.088 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.117 2.334 3.071 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.784 1.069 5.428 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.517 0.843 5.295 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.980 3.265 5.971 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.625 2.829 6.391 1.00 0.00 H new ATOM 0 HE ARG A 126 12.759 4.484 4.143 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.315 2.389 5.405 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.571 3.134 4.411 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.382 5.426 2.873 1.00 0.00 H new ATOM 0 HH22 ARG A 126 16.046 4.843 2.986 1.00 0.00 H new ATOM 1957 N ALA A 127 9.005 0.436 3.364 1.00 0.00 N ATOM 1958 CA ALA A 127 8.098 -0.567 3.907 1.00 0.00 C ATOM 1959 C ALA A 127 8.234 -1.906 3.187 1.00 0.00 C ATOM 1960 O ALA A 127 7.637 -2.900 3.599 1.00 0.00 O ATOM 1961 CB ALA A 127 6.658 -0.069 3.832 1.00 0.00 C ATOM 0 H ALA A 127 8.546 1.160 2.811 1.00 0.00 H new ATOM 0 HA ALA A 127 8.369 -0.728 4.950 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.989 -0.827 4.240 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.560 0.850 4.409 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.394 0.126 2.793 1.00 0.00 H new ATOM 1967 N ARG A 128 9.024 -1.936 2.120 1.00 0.00 N ATOM 1968 CA ARG A 128 9.227 -3.165 1.368 1.00 0.00 C ATOM 1969 C ARG A 128 10.195 -4.081 2.106 1.00 0.00 C ATOM 1970 O ARG A 128 10.045 -5.299 2.089 1.00 0.00 O ATOM 1971 CB ARG A 128 9.758 -2.854 -0.032 1.00 0.00 C ATOM 1972 CG ARG A 128 10.063 -4.093 -0.860 1.00 0.00 C ATOM 1973 CD ARG A 128 11.525 -4.493 -0.747 1.00 0.00 C ATOM 1974 NE ARG A 128 12.422 -3.383 -1.064 1.00 0.00 N ATOM 1975 CZ ARG A 128 12.610 -2.912 -2.294 1.00 0.00 C ATOM 1976 NH1 ARG A 128 11.971 -3.452 -3.324 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.441 -1.899 -2.495 1.00 0.00 N ATOM 0 H ARG A 128 9.531 -1.128 1.759 1.00 0.00 H new ATOM 0 HA ARG A 128 8.268 -3.673 1.270 1.00 0.00 H new ATOM 0 HB2 ARG A 128 9.025 -2.245 -0.562 1.00 0.00 H new ATOM 0 HB3 ARG A 128 10.665 -2.256 0.058 1.00 0.00 H new ATOM 0 HG2 ARG A 128 9.432 -4.918 -0.528 1.00 0.00 H new ATOM 0 HG3 ARG A 128 9.816 -3.903 -1.905 1.00 0.00 H new ATOM 0 HD2 ARG A 128 11.727 -4.845 0.264 1.00 0.00 H new ATOM 0 HD3 ARG A 128 11.726 -5.326 -1.421 1.00 0.00 H new ATOM 0 HE ARG A 128 12.933 -2.944 -0.298 1.00 0.00 H new ATOM 0 HH11 ARG A 128 11.332 -4.233 -3.175 1.00 0.00 H new ATOM 0 HH12 ARG A 128 12.119 -3.086 -4.265 1.00 0.00 H new ATOM 0 HH21 ARG A 128 13.936 -1.481 -1.707 1.00 0.00 H new ATOM 0 HH22 ARG A 128 13.586 -1.537 -3.438 1.00 0.00 H new ATOM 1991 N ALA A 129 11.190 -3.478 2.749 1.00 0.00 N ATOM 1992 CA ALA A 129 12.197 -4.222 3.496 1.00 0.00 C ATOM 1993 C ALA A 129 11.740 -4.540 4.918 1.00 0.00 C ATOM 1994 O ALA A 129 11.913 -5.655 5.406 1.00 0.00 O ATOM 1995 CB ALA A 129 13.488 -3.423 3.545 1.00 0.00 C ATOM 0 H ALA A 129 11.320 -2.467 2.767 1.00 0.00 H new ATOM 0 HA ALA A 129 12.357 -5.169 2.980 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.240 -3.980 4.104 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.846 -3.247 2.531 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.306 -2.467 4.036 1.00 0.00 H new ATOM 2001 N THR A 130 11.196 -3.531 5.586 1.00 0.00 N ATOM 2002 CA THR A 130 10.754 -3.646 6.956 1.00 0.00 C ATOM 2003 C THR A 130 9.704 -4.725 7.163 1.00 0.00 C ATOM 2004 O THR A 130 9.861 -5.585 8.025 1.00 0.00 O ATOM 2005 CB THR A 130 10.236 -2.292 7.414 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.151 -1.869 6.610 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.294 -1.207 7.374 1.00 0.00 C ATOM 0 H THR A 130 11.051 -2.605 5.183 1.00 0.00 H new ATOM 0 HA THR A 130 11.609 -3.953 7.558 1.00 0.00 H new ATOM 0 HB THR A 130 9.922 -2.435 8.448 1.00 0.00 H new ATOM 0 HG1 THR A 130 8.390 -1.638 7.183 1.00 0.00 H new ATOM 0 HG21 THR A 130 10.862 -0.265 7.712 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.122 -1.482 8.027 1.00 0.00 H new ATOM 0 HG23 THR A 130 11.660 -1.093 6.354 1.00 0.00 H new ATOM 2015 N LEU A 131 8.634 -4.683 6.393 1.00 0.00 N ATOM 2016 CA LEU A 131 7.578 -5.671 6.540 1.00 0.00 C ATOM 2017 C LEU A 131 8.131 -7.093 6.479 1.00 0.00 C ATOM 2018 O LEU A 131 7.605 -7.997 7.129 1.00 0.00 O ATOM 2019 CB LEU A 131 6.517 -5.483 5.459 1.00 0.00 C ATOM 2020 CG LEU A 131 5.332 -6.446 5.554 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.047 -5.687 5.848 1.00 0.00 C ATOM 2022 CD2 LEU A 131 5.201 -7.258 4.274 1.00 0.00 C ATOM 0 H LEU A 131 8.472 -3.985 5.667 1.00 0.00 H new ATOM 0 HA LEU A 131 7.124 -5.523 7.520 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.142 -4.461 5.510 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.987 -5.602 4.483 1.00 0.00 H new ATOM 0 HG LEU A 131 5.513 -7.136 6.378 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.216 -6.389 5.912 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.147 -5.156 6.795 1.00 0.00 H new ATOM 0 HD13 LEU A 131 3.856 -4.971 5.049 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.353 -7.938 4.359 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.043 -6.585 3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 131 6.113 -7.834 4.113 1.00 0.00 H new ATOM 2034 N VAL A 132 9.190 -7.291 5.700 1.00 0.00 N ATOM 2035 CA VAL A 132 9.799 -8.602 5.567 1.00 0.00 C ATOM 2036 C VAL A 132 10.886 -8.815 6.613 1.00 0.00 C ATOM 2037 O VAL A 132 11.051 -9.911 7.149 1.00 0.00 O ATOM 2038 CB VAL A 132 10.415 -8.813 4.169 1.00 0.00 C ATOM 2039 CG1 VAL A 132 9.952 -10.131 3.567 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.103 -7.657 3.237 1.00 0.00 C ATOM 0 H VAL A 132 9.641 -6.558 5.153 1.00 0.00 H new ATOM 0 HA VAL A 132 8.998 -9.326 5.715 1.00 0.00 H new ATOM 0 HB VAL A 132 11.497 -8.851 4.292 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.399 -10.258 2.581 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.258 -10.954 4.213 1.00 0.00 H new ATOM 0 HG13 VAL A 132 8.866 -10.127 3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 132 10.554 -7.843 2.262 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.023 -7.562 3.125 1.00 0.00 H new ATOM 0 HG23 VAL A 132 10.507 -6.734 3.654 1.00 0.00 H new ATOM 2050 N LYS A 133 11.652 -7.757 6.858 1.00 0.00 N ATOM 2051 CA LYS A 133 12.764 -7.805 7.793 1.00 0.00 C ATOM 2052 C LYS A 133 12.375 -7.268 9.170 1.00 0.00 C ATOM 2053 O LYS A 133 13.231 -6.869 9.959 1.00 0.00 O ATOM 2054 CB LYS A 133 13.930 -7.009 7.209 1.00 0.00 C ATOM 2055 CG LYS A 133 14.226 -7.357 5.757 1.00 0.00 C ATOM 2056 CD LYS A 133 14.860 -8.732 5.632 1.00 0.00 C ATOM 2057 CE LYS A 133 15.242 -9.042 4.193 1.00 0.00 C ATOM 2058 NZ LYS A 133 16.516 -8.378 3.802 1.00 0.00 N ATOM 0 H LYS A 133 11.518 -6.848 6.415 1.00 0.00 H new ATOM 0 HA LYS A 133 13.058 -8.845 7.936 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.708 -5.944 7.283 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.822 -7.191 7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.302 -7.327 5.179 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.893 -6.608 5.331 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.747 -8.784 6.264 1.00 0.00 H new ATOM 0 HD3 LYS A 133 14.165 -9.489 5.996 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.341 -10.120 4.068 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.443 -8.716 3.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 16.742 -8.614 2.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 16.414 -7.347 3.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 17.284 -8.708 4.421 1.00 0.00 H new ATOM 2072 N ASP A 134 11.078 -7.274 9.449 1.00 0.00 N ATOM 2073 CA ASP A 134 10.557 -6.804 10.729 1.00 0.00 C ATOM 2074 C ASP A 134 9.310 -7.594 11.112 1.00 0.00 C ATOM 2075 O ASP A 134 8.225 -7.031 11.262 1.00 0.00 O ATOM 2076 CB ASP A 134 10.235 -5.308 10.664 1.00 0.00 C ATOM 2077 CG ASP A 134 10.137 -4.678 12.039 1.00 0.00 C ATOM 2078 OD1 ASP A 134 9.063 -4.785 12.667 1.00 0.00 O ATOM 2079 OD2 ASP A 134 11.136 -4.074 12.487 1.00 0.00 O ATOM 0 H ASP A 134 10.361 -7.602 8.801 1.00 0.00 H new ATOM 0 HA ASP A 134 11.321 -6.960 11.490 1.00 0.00 H new ATOM 0 HB2 ASP A 134 11.007 -4.798 10.088 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.294 -5.164 10.134 1.00 0.00 H new ATOM 2084 N PRO A 135 9.451 -8.923 11.271 1.00 0.00 N ATOM 2085 CA PRO A 135 8.339 -9.800 11.631 1.00 0.00 C ATOM 2086 C PRO A 135 8.078 -9.845 13.134 1.00 0.00 C ATOM 2087 O PRO A 135 7.411 -10.754 13.626 1.00 0.00 O ATOM 2088 CB PRO A 135 8.816 -11.160 11.133 1.00 0.00 C ATOM 2089 CG PRO A 135 10.298 -11.117 11.291 1.00 0.00 C ATOM 2090 CD PRO A 135 10.710 -9.677 11.103 1.00 0.00 C ATOM 0 HA PRO A 135 7.396 -9.464 11.201 1.00 0.00 H new ATOM 0 HB2 PRO A 135 8.378 -11.971 11.715 1.00 0.00 H new ATOM 0 HB3 PRO A 135 8.532 -11.324 10.093 1.00 0.00 H new ATOM 0 HG2 PRO A 135 10.593 -11.479 12.276 1.00 0.00 H new ATOM 0 HG3 PRO A 135 10.785 -11.758 10.556 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.457 -9.376 11.837 1.00 0.00 H new ATOM 0 HD3 PRO A 135 11.147 -9.512 10.118 1.00 0.00 H new ATOM 2098 N GLU A 136 8.598 -8.859 13.861 1.00 0.00 N ATOM 2099 CA GLU A 136 8.404 -8.797 15.300 1.00 0.00 C ATOM 2100 C GLU A 136 7.329 -7.777 15.643 1.00 0.00 C ATOM 2101 O GLU A 136 6.611 -7.923 16.632 1.00 0.00 O ATOM 2102 CB GLU A 136 9.715 -8.432 15.999 1.00 0.00 C ATOM 2103 CG GLU A 136 10.892 -9.297 15.576 1.00 0.00 C ATOM 2104 CD GLU A 136 10.615 -10.778 15.739 1.00 0.00 C ATOM 2105 OE1 GLU A 136 9.669 -11.280 15.096 1.00 0.00 O ATOM 2106 OE2 GLU A 136 11.344 -11.437 16.511 1.00 0.00 O ATOM 0 H GLU A 136 9.155 -8.096 13.475 1.00 0.00 H new ATOM 0 HA GLU A 136 8.083 -9.778 15.649 1.00 0.00 H new ATOM 0 HB2 GLU A 136 9.949 -7.388 15.791 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.579 -8.520 17.077 1.00 0.00 H new ATOM 0 HG2 GLU A 136 11.135 -9.089 14.534 1.00 0.00 H new ATOM 0 HG3 GLU A 136 11.767 -9.028 16.167 1.00 0.00 H new ATOM 2113 N GLY A 137 7.225 -6.741 14.817 1.00 0.00 N ATOM 2114 CA GLY A 137 6.236 -5.709 15.049 1.00 0.00 C ATOM 2115 C GLY A 137 6.683 -4.737 16.117 1.00 0.00 C ATOM 2116 O GLY A 137 5.864 -4.192 16.857 1.00 0.00 O ATOM 0 H GLY A 137 7.808 -6.599 13.992 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.049 -5.169 14.121 1.00 0.00 H new ATOM 0 HA3 GLY A 137 5.293 -6.168 15.346 1.00 0.00 H new ATOM 2120 N GLU A 138 7.991 -4.533 16.201 1.00 0.00 N ATOM 2121 CA GLU A 138 8.562 -3.633 17.195 1.00 0.00 C ATOM 2122 C GLU A 138 8.399 -2.169 16.796 1.00 0.00 C ATOM 2123 O GLU A 138 8.194 -1.308 17.650 1.00 0.00 O ATOM 2124 CB GLU A 138 10.045 -3.949 17.401 1.00 0.00 C ATOM 2125 CG GLU A 138 10.324 -5.422 17.652 1.00 0.00 C ATOM 2126 CD GLU A 138 11.303 -5.645 18.788 1.00 0.00 C ATOM 2127 OE1 GLU A 138 12.255 -4.847 18.916 1.00 0.00 O ATOM 2128 OE2 GLU A 138 11.119 -6.619 19.549 1.00 0.00 O ATOM 0 H GLU A 138 8.677 -4.979 15.592 1.00 0.00 H new ATOM 0 HA GLU A 138 8.020 -3.789 18.127 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.602 -3.627 16.521 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.418 -3.368 18.245 1.00 0.00 H new ATOM 0 HG2 GLU A 138 9.388 -5.932 17.879 1.00 0.00 H new ATOM 0 HG3 GLU A 138 10.720 -5.873 16.742 1.00 0.00 H new ATOM 2135 N GLN A 139 8.509 -1.883 15.501 1.00 0.00 N ATOM 2136 CA GLN A 139 8.390 -0.513 15.018 1.00 0.00 C ATOM 2137 C GLN A 139 7.676 -0.461 13.678 1.00 0.00 C ATOM 2138 O GLN A 139 8.075 0.299 12.808 1.00 0.00 O ATOM 2139 CB GLN A 139 9.775 0.108 14.825 1.00 0.00 C ATOM 2140 CG GLN A 139 10.859 -0.404 15.759 1.00 0.00 C ATOM 2141 CD GLN A 139 11.070 0.493 16.962 1.00 0.00 C ATOM 2142 OE1 GLN A 139 10.646 1.649 16.972 1.00 0.00 O ATOM 2143 NE2 GLN A 139 11.728 -0.036 17.987 1.00 0.00 N ATOM 0 H GLN A 139 8.679 -2.577 14.773 1.00 0.00 H new ATOM 0 HA GLN A 139 7.819 0.039 15.765 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.093 -0.068 13.797 1.00 0.00 H new ATOM 0 HB3 GLN A 139 9.691 1.187 14.952 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.595 -1.405 16.100 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.795 -0.491 15.208 1.00 0.00 H new ATOM 0 HE21 GLN A 139 12.062 -0.998 17.937 1.00 0.00 H new ATOM 0 HE22 GLN A 139 11.899 0.520 18.825 1.00 0.00 H new ATOM 2152 N PHE A 140 6.647 -1.277 13.494 1.00 0.00 N ATOM 2153 CA PHE A 140 5.940 -1.318 12.214 1.00 0.00 C ATOM 2154 C PHE A 140 5.734 0.049 11.571 1.00 0.00 C ATOM 2155 O PHE A 140 5.921 0.176 10.363 1.00 0.00 O ATOM 2156 CB PHE A 140 4.638 -2.100 12.303 1.00 0.00 C ATOM 2157 CG PHE A 140 3.730 -1.696 13.430 1.00 0.00 C ATOM 2158 CD1 PHE A 140 3.980 -2.113 14.729 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.621 -0.902 13.188 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.141 -1.744 15.763 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.778 -0.530 14.219 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.039 -0.951 15.508 1.00 0.00 C ATOM 0 H PHE A 140 6.284 -1.914 14.203 1.00 0.00 H new ATOM 0 HA PHE A 140 6.607 -1.858 11.542 1.00 0.00 H new ATOM 0 HB2 PHE A 140 4.098 -1.986 11.363 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.874 -3.159 12.408 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.840 -2.733 14.935 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.412 -0.569 12.182 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.347 -2.075 16.770 1.00 0.00 H new ATOM 0 HE2 PHE A 140 0.917 0.089 14.016 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.383 -0.661 16.315 1.00 0.00 H new ATOM 2172 N PRO A 141 5.392 1.109 12.318 1.00 0.00 N ATOM 2173 CA PRO A 141 5.250 2.422 11.701 1.00 0.00 C ATOM 2174 C PRO A 141 6.616 2.974 11.285 1.00 0.00 C ATOM 2175 O PRO A 141 6.725 4.128 10.871 1.00 0.00 O ATOM 2176 CB PRO A 141 4.630 3.278 12.801 1.00 0.00 C ATOM 2177 CG PRO A 141 5.041 2.621 14.075 1.00 0.00 C ATOM 2178 CD PRO A 141 5.161 1.148 13.777 1.00 0.00 C ATOM 0 HA PRO A 141 4.644 2.400 10.795 1.00 0.00 H new ATOM 0 HB2 PRO A 141 4.990 4.306 12.752 1.00 0.00 H new ATOM 0 HB3 PRO A 141 3.545 3.316 12.708 1.00 0.00 H new ATOM 0 HG2 PRO A 141 5.989 3.023 14.431 1.00 0.00 H new ATOM 0 HG3 PRO A 141 4.305 2.800 14.859 1.00 0.00 H new ATOM 0 HD2 PRO A 141 5.985 0.693 14.326 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.256 0.607 14.055 1.00 0.00 H new ATOM 2186 N TRP A 142 7.652 2.119 11.407 1.00 0.00 N ATOM 2187 CA TRP A 142 9.045 2.454 11.066 1.00 0.00 C ATOM 2188 C TRP A 142 9.219 3.929 10.716 1.00 0.00 C ATOM 2189 O TRP A 142 9.525 4.286 9.579 1.00 0.00 O ATOM 2190 CB TRP A 142 9.538 1.556 9.923 1.00 0.00 C ATOM 2191 CG TRP A 142 8.955 0.171 9.984 1.00 0.00 C ATOM 2192 CD1 TRP A 142 9.144 -0.766 10.966 1.00 0.00 C ATOM 2193 CD2 TRP A 142 8.078 -0.426 9.023 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.399 -1.890 10.690 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.752 -1.712 9.495 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.527 0.005 7.815 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.903 -2.568 8.799 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.686 -0.846 7.125 1.00 0.00 C ATOM 2199 CH2 TRP A 142 6.381 -2.119 7.618 1.00 0.00 C ATOM 0 H TRP A 142 7.540 1.165 11.750 1.00 0.00 H new ATOM 0 HA TRP A 142 9.654 2.270 11.951 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.279 2.014 8.968 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.625 1.491 9.960 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.782 -0.641 11.828 1.00 0.00 H new ATOM 0 HE1 TRP A 142 8.338 -2.720 11.279 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.754 0.987 7.427 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 6.665 -3.551 9.178 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 6.256 -0.523 6.188 1.00 0.00 H new ATOM 0 HH2 TRP A 142 5.720 -2.760 7.054 1.00 0.00 H new ATOM 2210 N LYS A 143 9.010 4.775 11.719 1.00 0.00 N ATOM 2211 CA LYS A 143 9.126 6.220 11.556 1.00 0.00 C ATOM 2212 C LYS A 143 10.550 6.626 11.180 1.00 0.00 C ATOM 2213 O LYS A 143 11.422 5.776 11.005 1.00 0.00 O ATOM 2214 CB LYS A 143 8.701 6.928 12.847 1.00 0.00 C ATOM 2215 CG LYS A 143 9.659 6.710 14.008 1.00 0.00 C ATOM 2216 CD LYS A 143 9.127 7.324 15.292 1.00 0.00 C ATOM 2217 CE LYS A 143 8.128 6.407 15.977 1.00 0.00 C ATOM 2218 NZ LYS A 143 7.025 7.169 16.625 1.00 0.00 N ATOM 0 H LYS A 143 8.757 4.481 12.662 1.00 0.00 H new ATOM 0 HA LYS A 143 8.466 6.522 10.743 1.00 0.00 H new ATOM 0 HB2 LYS A 143 8.616 7.997 12.653 1.00 0.00 H new ATOM 0 HB3 LYS A 143 7.710 6.577 13.134 1.00 0.00 H new ATOM 0 HG2 LYS A 143 9.819 5.642 14.153 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.628 7.148 13.768 1.00 0.00 H new ATOM 0 HD2 LYS A 143 9.956 7.530 15.969 1.00 0.00 H new ATOM 0 HD3 LYS A 143 8.652 8.280 15.070 1.00 0.00 H new ATOM 0 HE2 LYS A 143 7.710 5.715 15.246 1.00 0.00 H new ATOM 0 HE3 LYS A 143 8.642 5.806 16.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 6.366 6.506 17.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 7.421 7.811 17.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 6.517 7.723 15.906 1.00 0.00 H new