USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=25 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 36 SER OG : rot -112:sc= 0.991 USER MOD Set 1.2: A 80 TYR OH : rot 0:sc= -0.3 USER MOD Set 2.1: A 34 TYR OH : rot 24:sc= 1.53 USER MOD Set 2.2: A 47 THR OG1 : rot 16:sc= 2.02 USER MOD Single : A 6 LYS NZ :NH3+ -145:sc= -0.384 (180deg=-1.5!) USER MOD Single : A 7 TYR OH : rot 30:sc= -1.46 USER MOD Single : A 13 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.488) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 45:sc= 0.537 USER MOD Single : A 49 GLN : amide:sc= -0.986 X(o=-0.99,f=-0.63) USER MOD Single : A 54 TYR OH : rot -156:sc= 0.861 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -4.4 K(o=-4.4,f=-3.8!) USER MOD Single : A 60 SER OG : rot -157:sc= -0.0493 USER MOD Single : A 61 LYS NZ :NH3+ -104:sc= 0.319 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -4.94 K(o=-4.9,f=-6.2!) USER MOD Single : A 68 CYS SG : rot -146:sc= -3.08! USER MOD Single : A 69 THR OG1 : rot -100:sc= -0.413 USER MOD Single : A 83 LYS NZ :NH3+ -105:sc= -0.377 (180deg=-2.29!) USER MOD Single : A 84 MET CE :methyl 146:sc= -4.02! (180deg=-8.23!) USER MOD Single : A 93 GLN : amide:sc= -6.68! C(o=-6.7!,f=-19!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 1:sc= 1.48 USER MOD Single : A 102 LYS NZ :NH3+ 158:sc= -0.189 (180deg=-0.757) USER MOD Single : A 103 HIS : no HD1:sc= -0.151 K(o=-0.15,f=-1.5) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -90:sc= -0.686 USER MOD Single : A 119 SER OG : rot 173:sc= -0.776! USER MOD Single : A 124 THR OG1 : rot 180:sc= 0.893 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 121:sc= -0.543! USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.142 K(o=-0.14,f=-1) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -3.552 11.934 3.201 1.00 0.00 N ATOM 22 CA LEU A 4 -3.449 10.923 2.153 1.00 0.00 C ATOM 23 C LEU A 4 -3.906 11.482 0.810 1.00 0.00 C ATOM 24 O LEU A 4 -3.422 11.066 -0.244 1.00 0.00 O ATOM 25 CB LEU A 4 -4.281 9.690 2.515 1.00 0.00 C ATOM 26 CG LEU A 4 -4.018 9.105 3.907 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.658 7.731 4.036 1.00 0.00 C ATOM 28 CD2 LEU A 4 -2.523 9.024 4.182 1.00 0.00 C ATOM 0 HA LEU A 4 -2.402 10.632 2.069 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -5.337 9.951 2.443 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -4.093 8.915 1.772 1.00 0.00 H new ATOM 0 HG LEU A 4 -4.467 9.767 4.647 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.462 7.330 5.030 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.734 7.815 3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.237 7.062 3.285 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -2.358 8.606 5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -2.050 8.385 3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.089 10.023 4.132 1.00 0.00 H new ATOM 40 N ASP A 5 -4.839 12.428 0.853 1.00 0.00 N ATOM 41 CA ASP A 5 -5.361 13.044 -0.362 1.00 0.00 C ATOM 42 C ASP A 5 -4.243 13.710 -1.158 1.00 0.00 C ATOM 43 O ASP A 5 -4.189 13.599 -2.383 1.00 0.00 O ATOM 44 CB ASP A 5 -6.438 14.072 -0.015 1.00 0.00 C ATOM 45 CG ASP A 5 -7.817 13.450 0.095 1.00 0.00 C ATOM 46 OD1 ASP A 5 -7.938 12.385 0.735 1.00 0.00 O ATOM 47 OD2 ASP A 5 -8.775 14.030 -0.458 1.00 0.00 O ATOM 0 H ASP A 5 -5.249 12.785 1.716 1.00 0.00 H new ATOM 0 HA ASP A 5 -5.802 12.259 -0.977 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -6.184 14.556 0.928 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -6.453 14.850 -0.778 1.00 0.00 H new ATOM 52 N LYS A 6 -3.355 14.407 -0.454 1.00 0.00 N ATOM 53 CA LYS A 6 -2.233 15.099 -1.115 1.00 0.00 C ATOM 54 C LYS A 6 -1.470 14.143 -2.028 1.00 0.00 C ATOM 55 O LYS A 6 -1.177 14.467 -3.179 1.00 0.00 O ATOM 56 CB LYS A 6 -1.249 15.724 -0.099 1.00 0.00 C ATOM 57 CG LYS A 6 0.029 16.234 -0.740 1.00 0.00 C ATOM 58 CD LYS A 6 0.865 17.039 0.242 1.00 0.00 C ATOM 59 CE LYS A 6 0.658 18.533 0.057 1.00 0.00 C ATOM 60 NZ LYS A 6 0.876 18.953 -1.355 1.00 0.00 N ATOM 0 H LYS A 6 -3.382 14.512 0.560 1.00 0.00 H new ATOM 0 HA LYS A 6 -2.670 15.904 -1.706 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -1.743 16.548 0.416 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -0.997 14.981 0.657 1.00 0.00 H new ATOM 0 HG2 LYS A 6 0.613 15.391 -1.110 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -0.218 16.854 -1.602 1.00 0.00 H new ATOM 0 HD2 LYS A 6 0.601 16.758 1.262 1.00 0.00 H new ATOM 0 HD3 LYS A 6 1.919 16.797 0.107 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -0.353 18.800 0.363 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.342 19.078 0.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 1.306 19.900 -1.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 1.510 18.276 -1.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.036 18.977 -1.855 1.00 0.00 H new ATOM 74 N TYR A 7 -1.151 12.965 -1.506 1.00 0.00 N ATOM 75 CA TYR A 7 -0.420 11.960 -2.271 1.00 0.00 C ATOM 76 C TYR A 7 -1.292 11.383 -3.380 1.00 0.00 C ATOM 77 O TYR A 7 -0.797 11.015 -4.445 1.00 0.00 O ATOM 78 CB TYR A 7 0.063 10.838 -1.348 1.00 0.00 C ATOM 79 CG TYR A 7 1.286 11.198 -0.528 1.00 0.00 C ATOM 80 CD1 TYR A 7 1.600 12.523 -0.245 1.00 0.00 C ATOM 81 CD2 TYR A 7 2.127 10.207 -0.036 1.00 0.00 C ATOM 82 CE1 TYR A 7 2.715 12.848 0.504 1.00 0.00 C ATOM 83 CE2 TYR A 7 3.243 10.525 0.715 1.00 0.00 C ATOM 84 CZ TYR A 7 3.532 11.846 0.982 1.00 0.00 C ATOM 85 OH TYR A 7 4.643 12.167 1.729 1.00 0.00 O ATOM 0 H TYR A 7 -1.387 12.681 -0.555 1.00 0.00 H new ATOM 0 HA TYR A 7 0.445 12.442 -2.727 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -0.747 10.563 -0.672 1.00 0.00 H new ATOM 0 HB3 TYR A 7 0.288 9.958 -1.950 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.962 13.311 -0.617 1.00 0.00 H new ATOM 0 HD2 TYR A 7 1.905 9.171 -0.244 1.00 0.00 H new ATOM 0 HE1 TYR A 7 2.945 13.882 0.714 1.00 0.00 H new ATOM 0 HE2 TYR A 7 3.885 9.742 1.091 1.00 0.00 H new ATOM 0 HH TYR A 7 4.478 12.999 2.220 1.00 0.00 H new ATOM 135 N ILE A 11 -9.880 11.261 -4.684 1.00 0.00 N ATOM 136 CA ILE A 11 -10.300 9.982 -4.127 1.00 0.00 C ATOM 137 C ILE A 11 -11.711 10.072 -3.555 1.00 0.00 C ATOM 138 O ILE A 11 -12.161 11.146 -3.156 1.00 0.00 O ATOM 139 CB ILE A 11 -9.339 9.512 -3.019 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.891 9.576 -3.510 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.696 8.101 -2.569 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.551 8.536 -4.558 1.00 0.00 C ATOM 0 HA ILE A 11 -10.285 9.259 -4.942 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.440 10.178 -2.162 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.701 10.567 -3.921 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.223 9.451 -2.658 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.007 7.784 -1.786 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.715 8.089 -2.183 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.621 7.419 -3.416 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.508 8.646 -4.855 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.707 7.539 -4.146 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.193 8.673 -5.428 1.00 0.00 H new ATOM 154 N GLU A 12 -12.406 8.940 -3.521 1.00 0.00 N ATOM 155 CA GLU A 12 -13.767 8.896 -3.000 1.00 0.00 C ATOM 156 C GLU A 12 -14.038 7.575 -2.286 1.00 0.00 C ATOM 157 O GLU A 12 -14.420 7.558 -1.116 1.00 0.00 O ATOM 158 CB GLU A 12 -14.776 9.093 -4.132 1.00 0.00 C ATOM 159 CG GLU A 12 -16.173 9.448 -3.648 1.00 0.00 C ATOM 160 CD GLU A 12 -16.182 10.649 -2.723 1.00 0.00 C ATOM 161 OE1 GLU A 12 -15.612 11.695 -3.102 1.00 0.00 O ATOM 162 OE2 GLU A 12 -16.758 10.545 -1.619 1.00 0.00 O ATOM 0 H GLU A 12 -12.050 8.042 -3.848 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.877 9.706 -2.279 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.418 9.882 -4.793 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -14.827 8.180 -4.725 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.811 9.652 -4.508 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.602 8.591 -3.129 1.00 0.00 H new ATOM 169 N LYS A 13 -13.841 6.470 -2.998 1.00 0.00 N ATOM 170 CA LYS A 13 -14.069 5.144 -2.427 1.00 0.00 C ATOM 171 C LYS A 13 -13.035 4.145 -2.934 1.00 0.00 C ATOM 172 O LYS A 13 -12.483 4.304 -4.023 1.00 0.00 O ATOM 173 CB LYS A 13 -15.476 4.652 -2.772 1.00 0.00 C ATOM 174 CG LYS A 13 -16.577 5.615 -2.356 1.00 0.00 C ATOM 175 CD LYS A 13 -17.911 5.239 -2.979 1.00 0.00 C ATOM 176 CE LYS A 13 -18.950 6.329 -2.773 1.00 0.00 C ATOM 177 NZ LYS A 13 -18.998 7.276 -3.921 1.00 0.00 N ATOM 0 H LYS A 13 -13.525 6.464 -3.968 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.972 5.223 -1.344 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.539 4.483 -3.847 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.644 3.690 -2.288 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.669 5.617 -1.270 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -16.308 6.628 -2.655 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.778 5.059 -4.046 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -18.268 4.307 -2.541 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -19.931 5.874 -2.637 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.724 6.878 -1.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.399 8.183 -3.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.036 7.430 -4.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -19.593 6.878 -4.675 1.00 0.00 H new ATOM 191 N LEU A 14 -12.778 3.114 -2.136 1.00 0.00 N ATOM 192 CA LEU A 14 -11.811 2.085 -2.500 1.00 0.00 C ATOM 193 C LEU A 14 -12.514 0.823 -2.996 1.00 0.00 C ATOM 194 O LEU A 14 -13.719 0.656 -2.806 1.00 0.00 O ATOM 195 CB LEU A 14 -10.913 1.753 -1.306 1.00 0.00 C ATOM 196 CG LEU A 14 -9.937 2.860 -0.903 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.008 2.380 0.202 1.00 0.00 C ATOM 198 CD2 LEU A 14 -9.135 3.330 -2.108 1.00 0.00 C ATOM 0 H LEU A 14 -13.227 2.969 -1.232 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.194 2.473 -3.311 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.545 1.517 -0.450 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.343 0.854 -1.539 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.514 3.703 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.322 3.182 0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.597 2.094 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.439 1.519 -0.149 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.446 4.117 -1.802 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.570 2.493 -2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.814 3.717 -2.868 1.00 0.00 H new ATOM 210 N ARG A 15 -11.751 -0.063 -3.630 1.00 0.00 N ATOM 211 CA ARG A 15 -12.289 -1.305 -4.153 1.00 0.00 C ATOM 212 C ARG A 15 -11.950 -2.466 -3.238 1.00 0.00 C ATOM 213 O ARG A 15 -10.834 -2.985 -3.237 1.00 0.00 O ATOM 214 CB ARG A 15 -11.757 -1.595 -5.548 1.00 0.00 C ATOM 215 CG ARG A 15 -12.036 -0.493 -6.557 1.00 0.00 C ATOM 216 CD ARG A 15 -12.209 -1.053 -7.961 1.00 0.00 C ATOM 217 NE ARG A 15 -13.541 -1.622 -8.165 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.824 -2.920 -8.057 1.00 0.00 C ATOM 219 NH1 ARG A 15 -12.877 -3.796 -7.744 1.00 0.00 N ATOM 220 NH2 ARG A 15 -15.064 -3.344 -8.264 1.00 0.00 N ATOM 0 H ARG A 15 -10.752 0.062 -3.792 1.00 0.00 H new ATOM 0 HA ARG A 15 -13.372 -1.190 -4.206 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -10.681 -1.756 -5.489 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -12.199 -2.524 -5.908 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -12.936 0.048 -6.267 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -11.216 0.225 -6.549 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -12.038 -0.261 -8.690 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -11.456 -1.820 -8.140 1.00 0.00 H new ATOM 0 HE ARG A 15 -14.301 -0.985 -8.405 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.921 -3.478 -7.583 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -13.105 -4.787 -7.664 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -15.797 -2.677 -8.505 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -15.284 -4.337 -8.182 1.00 0.00 H new ATOM 234 N ARG A 16 -12.938 -2.860 -2.472 1.00 0.00 N ATOM 235 CA ARG A 16 -12.810 -3.967 -1.532 1.00 0.00 C ATOM 236 C ARG A 16 -13.400 -5.244 -2.127 1.00 0.00 C ATOM 237 O ARG A 16 -14.054 -5.207 -3.169 1.00 0.00 O ATOM 238 CB ARG A 16 -13.513 -3.626 -0.215 1.00 0.00 C ATOM 239 CG ARG A 16 -13.106 -4.519 0.947 1.00 0.00 C ATOM 240 CD ARG A 16 -12.933 -3.722 2.230 1.00 0.00 C ATOM 241 NE ARG A 16 -11.942 -4.323 3.119 1.00 0.00 N ATOM 242 CZ ARG A 16 -11.404 -3.694 4.162 1.00 0.00 C ATOM 243 NH1 ARG A 16 -11.756 -2.448 4.448 1.00 0.00 N ATOM 244 NH2 ARG A 16 -10.512 -4.316 4.920 1.00 0.00 N ATOM 0 H ARG A 16 -13.861 -2.425 -2.477 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.751 -4.133 -1.334 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -13.298 -2.589 0.043 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -14.591 -3.702 -0.359 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.862 -5.290 1.096 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -12.173 -5.029 0.706 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -12.631 -2.704 1.986 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.890 -3.655 2.747 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.645 -5.280 2.930 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -12.443 -1.966 3.868 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -11.340 -1.972 5.248 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -10.239 -5.275 4.704 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -10.099 -3.836 5.719 1.00 0.00 H new ATOM 258 N GLY A 17 -13.165 -6.372 -1.463 1.00 0.00 N ATOM 259 CA GLY A 17 -13.679 -7.643 -1.946 1.00 0.00 C ATOM 260 C GLY A 17 -15.149 -7.582 -2.321 1.00 0.00 C ATOM 261 O GLY A 17 -15.491 -7.278 -3.464 1.00 0.00 O ATOM 0 H GLY A 17 -12.627 -6.429 -0.598 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.100 -7.957 -2.815 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -13.537 -8.402 -1.177 1.00 0.00 H new ATOM 265 N ASP A 18 -16.018 -7.879 -1.357 1.00 0.00 N ATOM 266 CA ASP A 18 -17.459 -7.868 -1.579 1.00 0.00 C ATOM 267 C ASP A 18 -17.894 -6.654 -2.397 1.00 0.00 C ATOM 268 O ASP A 18 -18.802 -6.743 -3.224 1.00 0.00 O ATOM 269 CB ASP A 18 -18.199 -7.884 -0.241 1.00 0.00 C ATOM 270 CG ASP A 18 -19.702 -7.991 -0.412 1.00 0.00 C ATOM 271 OD1 ASP A 18 -20.201 -9.121 -0.592 1.00 0.00 O ATOM 272 OD2 ASP A 18 -20.380 -6.942 -0.365 1.00 0.00 O ATOM 0 H ASP A 18 -15.744 -8.132 -0.408 1.00 0.00 H new ATOM 0 HA ASP A 18 -17.712 -8.764 -2.146 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.844 -8.723 0.357 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.963 -6.975 0.312 1.00 0.00 H new ATOM 277 N GLY A 19 -17.241 -5.523 -2.159 1.00 0.00 N ATOM 278 CA GLY A 19 -17.573 -4.308 -2.880 1.00 0.00 C ATOM 279 C GLY A 19 -16.667 -3.151 -2.507 1.00 0.00 C ATOM 280 O GLY A 19 -15.463 -3.332 -2.332 1.00 0.00 O ATOM 0 H GLY A 19 -16.487 -5.425 -1.479 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.500 -4.493 -3.952 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.608 -4.037 -2.673 1.00 0.00 H new ATOM 284 N GLU A 20 -17.245 -1.960 -2.389 1.00 0.00 N ATOM 285 CA GLU A 20 -16.477 -0.774 -2.036 1.00 0.00 C ATOM 286 C GLU A 20 -16.705 -0.387 -0.578 1.00 0.00 C ATOM 287 O GLU A 20 -17.770 -0.645 -0.015 1.00 0.00 O ATOM 288 CB GLU A 20 -16.843 0.391 -2.962 1.00 0.00 C ATOM 289 CG GLU A 20 -18.118 1.129 -2.572 1.00 0.00 C ATOM 290 CD GLU A 20 -19.362 0.280 -2.743 1.00 0.00 C ATOM 291 OE1 GLU A 20 -19.480 -0.397 -3.786 1.00 0.00 O ATOM 292 OE2 GLU A 20 -20.217 0.291 -1.833 1.00 0.00 O ATOM 0 H GLU A 20 -18.241 -1.792 -2.533 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.419 -1.004 -2.162 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -16.016 1.101 -2.976 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.954 0.011 -3.978 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -18.043 1.451 -1.533 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -18.212 2.030 -3.179 1.00 0.00 H new ATOM 299 N VAL A 21 -15.702 0.238 0.028 1.00 0.00 N ATOM 300 CA VAL A 21 -15.797 0.664 1.419 1.00 0.00 C ATOM 301 C VAL A 21 -15.533 2.158 1.550 1.00 0.00 C ATOM 302 O VAL A 21 -14.593 2.688 0.956 1.00 0.00 O ATOM 303 CB VAL A 21 -14.806 -0.101 2.315 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.175 -1.575 2.382 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.383 0.079 1.812 1.00 0.00 C ATOM 0 H VAL A 21 -14.814 0.461 -0.422 1.00 0.00 H new ATOM 0 HA VAL A 21 -16.812 0.443 1.748 1.00 0.00 H new ATOM 0 HB VAL A 21 -14.864 0.309 3.323 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -14.463 -2.100 3.020 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.178 -1.680 2.795 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.148 -2.003 1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.697 -0.469 2.458 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.306 -0.303 0.794 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.124 1.138 1.823 1.00 0.00 H new ATOM 315 N GLU A 22 -16.370 2.836 2.328 1.00 0.00 N ATOM 316 CA GLU A 22 -16.228 4.272 2.535 1.00 0.00 C ATOM 317 C GLU A 22 -14.848 4.612 3.088 1.00 0.00 C ATOM 318 O GLU A 22 -14.292 3.874 3.902 1.00 0.00 O ATOM 319 CB GLU A 22 -17.313 4.780 3.488 1.00 0.00 C ATOM 320 CG GLU A 22 -18.562 5.272 2.779 1.00 0.00 C ATOM 321 CD GLU A 22 -18.344 6.590 2.061 1.00 0.00 C ATOM 322 OE1 GLU A 22 -18.474 7.649 2.711 1.00 0.00 O ATOM 323 OE2 GLU A 22 -18.044 6.563 0.849 1.00 0.00 O ATOM 0 H GLU A 22 -17.154 2.414 2.826 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.341 4.765 1.569 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.587 3.979 4.174 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.905 5.591 4.091 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -18.887 4.520 2.060 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -19.366 5.387 3.506 1.00 0.00 H new ATOM 330 N VAL A 23 -14.303 5.739 2.642 1.00 0.00 N ATOM 331 CA VAL A 23 -12.989 6.187 3.090 1.00 0.00 C ATOM 332 C VAL A 23 -12.940 6.306 4.613 1.00 0.00 C ATOM 333 O VAL A 23 -11.879 6.172 5.224 1.00 0.00 O ATOM 334 CB VAL A 23 -12.620 7.545 2.457 1.00 0.00 C ATOM 335 CG1 VAL A 23 -11.320 8.081 3.038 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.523 7.416 0.943 1.00 0.00 C ATOM 0 H VAL A 23 -14.752 6.360 1.969 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.265 5.438 2.769 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.410 8.258 2.692 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.082 9.039 2.575 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.430 8.215 4.114 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.515 7.373 2.842 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.262 8.382 0.511 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.755 6.686 0.689 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.483 7.088 0.544 1.00 0.00 H new ATOM 346 N LYS A 24 -14.096 6.560 5.216 1.00 0.00 N ATOM 347 CA LYS A 24 -14.200 6.701 6.665 1.00 0.00 C ATOM 348 C LYS A 24 -13.561 5.516 7.387 1.00 0.00 C ATOM 349 O LYS A 24 -13.106 5.644 8.523 1.00 0.00 O ATOM 350 CB LYS A 24 -15.668 6.830 7.080 1.00 0.00 C ATOM 351 CG LYS A 24 -15.896 7.826 8.205 1.00 0.00 C ATOM 352 CD LYS A 24 -16.139 9.228 7.669 1.00 0.00 C ATOM 353 CE LYS A 24 -17.513 9.349 7.032 1.00 0.00 C ATOM 354 NZ LYS A 24 -17.563 10.443 6.022 1.00 0.00 N ATOM 0 H LYS A 24 -14.980 6.673 4.720 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.662 7.605 6.951 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -16.257 7.132 6.214 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -16.036 5.852 7.391 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.751 7.511 8.803 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.030 7.834 8.866 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.048 9.950 8.481 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -15.373 9.476 6.934 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -17.777 8.404 6.557 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.257 9.536 7.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -18.517 10.493 5.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -17.336 11.349 6.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -16.871 10.252 5.269 1.00 0.00 H new ATOM 368 N SER A 25 -13.532 4.363 6.726 1.00 0.00 N ATOM 369 CA SER A 25 -12.950 3.160 7.315 1.00 0.00 C ATOM 370 C SER A 25 -11.470 3.360 7.647 1.00 0.00 C ATOM 371 O SER A 25 -10.894 2.597 8.425 1.00 0.00 O ATOM 372 CB SER A 25 -13.113 1.975 6.363 1.00 0.00 C ATOM 373 OG SER A 25 -13.401 0.784 7.075 1.00 0.00 O ATOM 0 H SER A 25 -13.903 4.235 5.785 1.00 0.00 H new ATOM 0 HA SER A 25 -13.481 2.954 8.244 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.915 2.182 5.654 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.200 1.843 5.782 1.00 0.00 H new ATOM 0 HG SER A 25 -13.502 0.042 6.443 1.00 0.00 H new ATOM 379 N LEU A 26 -10.860 4.390 7.066 1.00 0.00 N ATOM 380 CA LEU A 26 -9.453 4.687 7.315 1.00 0.00 C ATOM 381 C LEU A 26 -9.322 5.853 8.290 1.00 0.00 C ATOM 382 O LEU A 26 -8.514 6.760 8.090 1.00 0.00 O ATOM 383 CB LEU A 26 -8.726 5.013 6.003 1.00 0.00 C ATOM 384 CG LEU A 26 -9.036 4.088 4.818 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.958 4.215 3.752 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.165 2.640 5.271 1.00 0.00 C ATOM 0 H LEU A 26 -11.318 5.032 6.420 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.991 3.804 7.756 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.975 6.035 5.716 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.652 4.986 6.189 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.991 4.394 4.391 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.191 3.553 2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.916 5.245 3.397 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.993 3.938 4.176 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.385 2.008 4.411 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.230 2.317 5.729 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.973 2.557 5.998 1.00 0.00 H new ATOM 398 N ALA A 27 -10.134 5.821 9.340 1.00 0.00 N ATOM 399 CA ALA A 27 -10.141 6.850 10.348 1.00 0.00 C ATOM 400 C ALA A 27 -9.624 6.315 11.666 1.00 0.00 C ATOM 401 O ALA A 27 -10.365 5.759 12.477 1.00 0.00 O ATOM 402 CB ALA A 27 -11.535 7.375 10.518 1.00 0.00 C ATOM 0 H ALA A 27 -10.806 5.072 9.508 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.484 7.658 10.028 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.540 8.154 11.281 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.885 7.790 9.573 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -12.195 6.563 10.824 1.00 0.00 H new ATOM 408 N GLY A 28 -8.347 6.499 11.852 1.00 0.00 N ATOM 409 CA GLY A 28 -7.678 6.052 13.062 1.00 0.00 C ATOM 410 C GLY A 28 -6.975 4.721 12.884 1.00 0.00 C ATOM 411 O GLY A 28 -7.138 3.806 13.692 1.00 0.00 O ATOM 0 H GLY A 28 -7.735 6.960 11.179 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.951 6.804 13.369 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -8.409 5.968 13.866 1.00 0.00 H new ATOM 415 N LYS A 29 -6.183 4.623 11.822 1.00 0.00 N ATOM 416 CA LYS A 29 -5.434 3.412 11.524 1.00 0.00 C ATOM 417 C LYS A 29 -4.396 3.695 10.440 1.00 0.00 C ATOM 418 O LYS A 29 -4.592 4.572 9.600 1.00 0.00 O ATOM 419 CB LYS A 29 -6.393 2.296 11.094 1.00 0.00 C ATOM 420 CG LYS A 29 -6.606 2.187 9.590 1.00 0.00 C ATOM 421 CD LYS A 29 -7.768 1.264 9.257 1.00 0.00 C ATOM 422 CE LYS A 29 -7.521 -0.152 9.754 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.650 -0.654 10.585 1.00 0.00 N ATOM 0 H LYS A 29 -6.044 5.376 11.149 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.908 3.082 12.420 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.011 1.344 11.463 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -7.358 2.460 11.573 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.796 3.177 9.176 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.697 1.814 9.119 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -8.682 1.653 9.706 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.924 1.249 8.178 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.375 -0.815 8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.601 -0.176 10.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.443 -1.622 10.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.774 -0.036 11.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -9.523 -0.655 10.020 1.00 0.00 H new ATOM 437 N LEU A 30 -3.291 2.956 10.460 1.00 0.00 N ATOM 438 CA LEU A 30 -2.241 3.156 9.471 1.00 0.00 C ATOM 439 C LEU A 30 -2.666 2.599 8.122 1.00 0.00 C ATOM 440 O LEU A 30 -3.542 1.737 8.042 1.00 0.00 O ATOM 441 CB LEU A 30 -0.932 2.504 9.920 1.00 0.00 C ATOM 442 CG LEU A 30 0.297 2.931 9.114 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.407 3.416 10.030 1.00 0.00 C ATOM 444 CD2 LEU A 30 0.789 1.790 8.238 1.00 0.00 C ATOM 0 H LEU A 30 -3.102 2.222 11.142 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.074 4.229 9.373 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.763 2.742 10.970 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.038 1.421 9.852 1.00 0.00 H new ATOM 0 HG LEU A 30 0.004 3.759 8.469 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.268 3.713 9.432 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.054 4.270 10.608 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.696 2.613 10.708 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.663 2.115 7.674 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.058 0.940 8.865 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.000 1.496 7.546 1.00 0.00 H new ATOM 456 N VAL A 31 -2.047 3.099 7.061 1.00 0.00 N ATOM 457 CA VAL A 31 -2.375 2.650 5.716 1.00 0.00 C ATOM 458 C VAL A 31 -1.125 2.463 4.867 1.00 0.00 C ATOM 459 O VAL A 31 -0.388 3.414 4.609 1.00 0.00 O ATOM 460 CB VAL A 31 -3.317 3.640 5.007 1.00 0.00 C ATOM 461 CG1 VAL A 31 -3.885 3.022 3.738 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.437 4.079 5.939 1.00 0.00 C ATOM 0 H VAL A 31 -1.319 3.812 7.105 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.879 1.689 5.825 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.740 4.522 4.730 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.548 3.737 3.251 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.070 2.765 3.062 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.445 2.121 3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.091 4.778 5.418 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.013 3.208 6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.011 4.566 6.816 1.00 0.00 H new ATOM 472 N PHE A 32 -0.897 1.231 4.425 1.00 0.00 N ATOM 473 CA PHE A 32 0.258 0.921 3.592 1.00 0.00 C ATOM 474 C PHE A 32 -0.130 0.973 2.116 1.00 0.00 C ATOM 475 O PHE A 32 -1.310 0.891 1.777 1.00 0.00 O ATOM 476 CB PHE A 32 0.828 -0.454 3.954 1.00 0.00 C ATOM 477 CG PHE A 32 0.935 -0.691 5.432 1.00 0.00 C ATOM 478 CD1 PHE A 32 -0.170 -1.090 6.164 1.00 0.00 C ATOM 479 CD2 PHE A 32 2.144 -0.518 6.087 1.00 0.00 C ATOM 480 CE1 PHE A 32 -0.072 -1.315 7.523 1.00 0.00 C ATOM 481 CE2 PHE A 32 2.249 -0.742 7.445 1.00 0.00 C ATOM 482 CZ PHE A 32 1.138 -1.142 8.164 1.00 0.00 C ATOM 0 H PHE A 32 -1.497 0.432 4.630 1.00 0.00 H new ATOM 0 HA PHE A 32 1.031 1.667 3.774 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.196 -1.227 3.516 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.816 -0.558 3.506 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -1.119 -1.227 5.667 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.014 -0.204 5.529 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -0.941 -1.626 8.084 1.00 0.00 H new ATOM 0 HE2 PHE A 32 3.197 -0.605 7.945 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.217 -1.319 9.226 1.00 0.00 H new ATOM 492 N PHE A 33 0.861 1.120 1.242 1.00 0.00 N ATOM 493 CA PHE A 33 0.605 1.193 -0.189 1.00 0.00 C ATOM 494 C PHE A 33 1.597 0.344 -0.972 1.00 0.00 C ATOM 495 O PHE A 33 2.764 0.707 -1.116 1.00 0.00 O ATOM 496 CB PHE A 33 0.680 2.643 -0.673 1.00 0.00 C ATOM 497 CG PHE A 33 -0.119 3.604 0.159 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.429 3.315 0.512 1.00 0.00 C ATOM 499 CD2 PHE A 33 0.439 4.797 0.587 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.165 4.201 1.275 1.00 0.00 C ATOM 501 CE2 PHE A 33 -0.293 5.686 1.350 1.00 0.00 C ATOM 502 CZ PHE A 33 -1.597 5.388 1.695 1.00 0.00 C ATOM 0 H PHE A 33 1.845 1.191 1.500 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.398 0.804 -0.364 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.723 2.961 -0.677 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.328 2.690 -1.704 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -1.878 2.388 0.187 1.00 0.00 H new ATOM 0 HD2 PHE A 33 1.458 5.035 0.321 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.184 3.966 1.543 1.00 0.00 H new ATOM 0 HE2 PHE A 33 0.154 6.613 1.677 1.00 0.00 H new ATOM 0 HZ PHE A 33 -2.171 6.081 2.292 1.00 0.00 H new ATOM 512 N TYR A 34 1.120 -0.780 -1.482 1.00 0.00 N ATOM 513 CA TYR A 34 1.959 -1.680 -2.264 1.00 0.00 C ATOM 514 C TYR A 34 1.848 -1.361 -3.752 1.00 0.00 C ATOM 515 O TYR A 34 0.793 -1.541 -4.360 1.00 0.00 O ATOM 516 CB TYR A 34 1.562 -3.136 -2.011 1.00 0.00 C ATOM 517 CG TYR A 34 2.407 -4.131 -2.773 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.670 -4.491 -2.317 1.00 0.00 C ATOM 519 CD2 TYR A 34 1.945 -4.709 -3.949 1.00 0.00 C ATOM 520 CE1 TYR A 34 4.448 -5.397 -3.012 1.00 0.00 C ATOM 521 CE2 TYR A 34 2.717 -5.617 -4.649 1.00 0.00 C ATOM 522 CZ TYR A 34 3.966 -5.957 -4.176 1.00 0.00 C ATOM 523 OH TYR A 34 4.738 -6.860 -4.871 1.00 0.00 O ATOM 0 H TYR A 34 0.156 -1.093 -1.370 1.00 0.00 H new ATOM 0 HA TYR A 34 2.994 -1.537 -1.952 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.641 -3.346 -0.944 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.516 -3.273 -2.287 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.049 -4.055 -1.404 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.967 -4.444 -4.322 1.00 0.00 H new ATOM 0 HE1 TYR A 34 5.428 -5.665 -2.646 1.00 0.00 H new ATOM 0 HE2 TYR A 34 2.344 -6.058 -5.562 1.00 0.00 H new ATOM 0 HH TYR A 34 5.386 -7.272 -4.263 1.00 0.00 H new ATOM 533 N PHE A 35 2.946 -0.886 -4.333 1.00 0.00 N ATOM 534 CA PHE A 35 2.977 -0.539 -5.751 1.00 0.00 C ATOM 535 C PHE A 35 3.600 -1.670 -6.566 1.00 0.00 C ATOM 536 O PHE A 35 4.686 -2.148 -6.242 1.00 0.00 O ATOM 537 CB PHE A 35 3.770 0.755 -5.967 1.00 0.00 C ATOM 538 CG PHE A 35 3.478 1.829 -4.953 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.966 1.735 -3.658 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.717 2.934 -5.298 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.698 2.722 -2.728 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.446 3.924 -4.372 1.00 0.00 C ATOM 543 CZ PHE A 35 2.936 3.817 -3.086 1.00 0.00 C ATOM 0 H PHE A 35 3.827 -0.732 -3.843 1.00 0.00 H new ATOM 0 HA PHE A 35 1.951 -0.387 -6.087 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.835 0.525 -5.941 1.00 0.00 H new ATOM 0 HB3 PHE A 35 3.552 1.141 -6.963 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.562 0.881 -3.373 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.331 3.023 -6.303 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.084 2.637 -1.723 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.852 4.780 -4.654 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.724 4.589 -2.361 1.00 0.00 H new ATOM 553 N SER A 36 2.910 -2.098 -7.622 1.00 0.00 N ATOM 554 CA SER A 36 3.414 -3.174 -8.466 1.00 0.00 C ATOM 555 C SER A 36 2.518 -3.385 -9.680 1.00 0.00 C ATOM 556 O SER A 36 1.451 -2.782 -9.790 1.00 0.00 O ATOM 557 CB SER A 36 3.518 -4.472 -7.664 1.00 0.00 C ATOM 558 OG SER A 36 3.960 -5.543 -8.480 1.00 0.00 O ATOM 0 H SER A 36 2.008 -1.718 -7.910 1.00 0.00 H new ATOM 0 HA SER A 36 4.406 -2.889 -8.817 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.210 -4.335 -6.833 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.547 -4.716 -7.234 1.00 0.00 H new ATOM 0 HG SER A 36 3.235 -6.194 -8.586 1.00 0.00 H new ATOM 564 N ALA A 37 2.958 -4.248 -10.589 1.00 0.00 N ATOM 565 CA ALA A 37 2.199 -4.541 -11.795 1.00 0.00 C ATOM 566 C ALA A 37 2.284 -6.024 -12.144 1.00 0.00 C ATOM 567 O ALA A 37 3.096 -6.754 -11.579 1.00 0.00 O ATOM 568 CB ALA A 37 2.705 -3.689 -12.951 1.00 0.00 C ATOM 0 H ALA A 37 3.839 -4.757 -10.511 1.00 0.00 H new ATOM 0 HA ALA A 37 1.152 -4.298 -11.612 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.130 -3.916 -13.849 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.589 -2.634 -12.703 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.758 -3.906 -13.130 1.00 0.00 H new ATOM 574 N SER A 38 1.444 -6.463 -13.075 1.00 0.00 N ATOM 575 CA SER A 38 1.435 -7.863 -13.491 1.00 0.00 C ATOM 576 C SER A 38 2.349 -8.088 -14.694 1.00 0.00 C ATOM 577 O SER A 38 2.295 -9.137 -15.337 1.00 0.00 O ATOM 578 CB SER A 38 0.011 -8.317 -13.826 1.00 0.00 C ATOM 579 OG SER A 38 -0.585 -8.977 -12.724 1.00 0.00 O ATOM 0 H SER A 38 0.763 -5.874 -13.555 1.00 0.00 H new ATOM 0 HA SER A 38 1.810 -8.457 -12.658 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.593 -7.454 -14.107 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.032 -8.986 -14.687 1.00 0.00 H new ATOM 0 HG SER A 38 -0.408 -8.470 -11.904 1.00 0.00 H new ATOM 585 N TRP A 39 3.189 -7.100 -14.999 1.00 0.00 N ATOM 586 CA TRP A 39 4.108 -7.200 -16.128 1.00 0.00 C ATOM 587 C TRP A 39 5.566 -7.082 -15.680 1.00 0.00 C ATOM 588 O TRP A 39 6.481 -7.365 -16.452 1.00 0.00 O ATOM 589 CB TRP A 39 3.788 -6.121 -17.166 1.00 0.00 C ATOM 590 CG TRP A 39 4.153 -4.735 -16.725 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.321 -3.806 -16.168 1.00 0.00 C ATOM 592 CD2 TRP A 39 5.443 -4.119 -16.807 1.00 0.00 C ATOM 593 NE1 TRP A 39 4.015 -2.652 -15.897 1.00 0.00 N ATOM 594 CE2 TRP A 39 5.321 -2.820 -16.280 1.00 0.00 C ATOM 595 CE3 TRP A 39 6.691 -4.542 -17.273 1.00 0.00 C ATOM 596 CZ2 TRP A 39 6.398 -1.941 -16.207 1.00 0.00 C ATOM 597 CZ3 TRP A 39 7.760 -3.668 -17.200 1.00 0.00 C ATOM 598 CH2 TRP A 39 7.608 -2.381 -16.670 1.00 0.00 C ATOM 0 H TRP A 39 3.251 -6.224 -14.481 1.00 0.00 H new ATOM 0 HA TRP A 39 3.976 -8.184 -16.578 1.00 0.00 H new ATOM 0 HB2 TRP A 39 4.318 -6.350 -18.091 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.722 -6.152 -17.393 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.270 -3.957 -15.969 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.623 -1.808 -15.479 1.00 0.00 H new ATOM 0 HE3 TRP A 39 6.818 -5.533 -17.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 6.283 -0.947 -15.800 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 8.729 -3.984 -17.558 1.00 0.00 H new ATOM 0 HH2 TRP A 39 8.463 -1.722 -16.626 1.00 0.00 H new ATOM 609 N CYS A 40 5.781 -6.661 -14.434 1.00 0.00 N ATOM 610 CA CYS A 40 7.132 -6.506 -13.901 1.00 0.00 C ATOM 611 C CYS A 40 7.961 -7.778 -14.113 1.00 0.00 C ATOM 612 O CYS A 40 7.414 -8.876 -14.209 1.00 0.00 O ATOM 613 CB CYS A 40 7.078 -6.118 -12.419 1.00 0.00 C ATOM 614 SG CYS A 40 6.628 -7.463 -11.270 1.00 0.00 S ATOM 0 H CYS A 40 5.038 -6.422 -13.777 1.00 0.00 H new ATOM 0 HA CYS A 40 7.626 -5.702 -14.447 1.00 0.00 H new ATOM 0 HB2 CYS A 40 8.053 -5.726 -12.128 1.00 0.00 H new ATOM 0 HB3 CYS A 40 6.360 -5.307 -12.300 1.00 0.00 H new ATOM 619 N PRO A 41 9.300 -7.638 -14.214 1.00 0.00 N ATOM 620 CA PRO A 41 10.203 -8.774 -14.445 1.00 0.00 C ATOM 621 C PRO A 41 10.051 -9.890 -13.411 1.00 0.00 C ATOM 622 O PRO A 41 9.899 -11.055 -13.778 1.00 0.00 O ATOM 623 CB PRO A 41 11.602 -8.155 -14.376 1.00 0.00 C ATOM 624 CG PRO A 41 11.398 -6.705 -14.661 1.00 0.00 C ATOM 625 CD PRO A 41 10.030 -6.361 -14.136 1.00 0.00 C ATOM 0 HA PRO A 41 9.987 -9.259 -15.397 1.00 0.00 H new ATOM 0 HB2 PRO A 41 12.052 -8.305 -13.394 1.00 0.00 H new ATOM 0 HB3 PRO A 41 12.271 -8.610 -15.106 1.00 0.00 H new ATOM 0 HG2 PRO A 41 12.164 -6.101 -14.175 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.466 -6.505 -15.730 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.075 -5.986 -13.113 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.552 -5.588 -14.738 1.00 0.00 H new ATOM 633 N PRO A 42 10.080 -9.565 -12.106 1.00 0.00 N ATOM 634 CA PRO A 42 9.932 -10.566 -11.050 1.00 0.00 C ATOM 635 C PRO A 42 8.485 -11.023 -10.934 1.00 0.00 C ATOM 636 O PRO A 42 8.141 -12.148 -11.299 1.00 0.00 O ATOM 637 CB PRO A 42 10.376 -9.832 -9.772 1.00 0.00 C ATOM 638 CG PRO A 42 10.881 -8.496 -10.217 1.00 0.00 C ATOM 639 CD PRO A 42 10.238 -8.218 -11.546 1.00 0.00 C ATOM 0 HA PRO A 42 10.518 -11.465 -11.243 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.544 -9.722 -9.076 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.155 -10.390 -9.252 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.624 -7.723 -9.493 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.967 -8.502 -10.305 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.281 -7.709 -11.436 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.864 -7.587 -12.176 1.00 0.00 H new ATOM 647 N CYS A 43 7.639 -10.123 -10.449 1.00 0.00 N ATOM 648 CA CYS A 43 6.203 -10.397 -10.307 1.00 0.00 C ATOM 649 C CYS A 43 5.956 -11.783 -9.714 1.00 0.00 C ATOM 650 O CYS A 43 4.941 -12.418 -9.999 1.00 0.00 O ATOM 651 CB CYS A 43 5.543 -10.289 -11.680 1.00 0.00 C ATOM 652 SG CYS A 43 5.244 -8.579 -12.253 1.00 0.00 S ATOM 0 H CYS A 43 7.918 -9.191 -10.144 1.00 0.00 H new ATOM 0 HA CYS A 43 5.771 -9.666 -9.624 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.172 -10.798 -12.411 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.592 -10.820 -11.653 1.00 0.00 H new ATOM 657 N ARG A 44 6.888 -12.241 -8.887 1.00 0.00 N ATOM 658 CA ARG A 44 6.771 -13.550 -8.253 1.00 0.00 C ATOM 659 C ARG A 44 7.859 -13.746 -7.201 1.00 0.00 C ATOM 660 O ARG A 44 8.318 -14.865 -6.971 1.00 0.00 O ATOM 661 CB ARG A 44 6.854 -14.658 -9.304 1.00 0.00 C ATOM 662 CG ARG A 44 5.855 -15.781 -9.084 1.00 0.00 C ATOM 663 CD ARG A 44 6.335 -16.754 -8.019 1.00 0.00 C ATOM 664 NE ARG A 44 5.737 -16.475 -6.715 1.00 0.00 N ATOM 665 CZ ARG A 44 5.891 -17.255 -5.646 1.00 0.00 C ATOM 666 NH1 ARG A 44 6.622 -18.360 -5.723 1.00 0.00 N ATOM 667 NH2 ARG A 44 5.313 -16.929 -4.499 1.00 0.00 N ATOM 0 H ARG A 44 7.733 -11.726 -8.639 1.00 0.00 H new ATOM 0 HA ARG A 44 5.801 -13.601 -7.758 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.689 -14.225 -10.290 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.862 -15.074 -9.303 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.894 -15.361 -8.788 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.695 -16.315 -10.020 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.089 -17.772 -8.321 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.421 -16.698 -7.940 1.00 0.00 H new ATOM 0 HE ARG A 44 5.168 -15.634 -6.618 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.069 -18.615 -6.604 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.737 -18.954 -4.902 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.750 -16.081 -4.435 1.00 0.00 H new ATOM 0 HH22 ARG A 44 5.431 -17.526 -3.681 1.00 0.00 H new ATOM 681 N GLY A 45 8.270 -12.652 -6.566 1.00 0.00 N ATOM 682 CA GLY A 45 9.303 -12.730 -5.548 1.00 0.00 C ATOM 683 C GLY A 45 8.973 -11.930 -4.299 1.00 0.00 C ATOM 684 O GLY A 45 9.746 -11.928 -3.341 1.00 0.00 O ATOM 0 H GLY A 45 7.907 -11.714 -6.738 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.456 -13.774 -5.273 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.243 -12.369 -5.965 1.00 0.00 H new ATOM 688 N PHE A 46 7.828 -11.251 -4.302 1.00 0.00 N ATOM 689 CA PHE A 46 7.415 -10.450 -3.155 1.00 0.00 C ATOM 690 C PHE A 46 6.039 -9.833 -3.383 1.00 0.00 C ATOM 691 O PHE A 46 5.867 -8.986 -4.259 1.00 0.00 O ATOM 692 CB PHE A 46 8.438 -9.347 -2.878 1.00 0.00 C ATOM 693 CG PHE A 46 8.181 -8.598 -1.601 1.00 0.00 C ATOM 694 CD1 PHE A 46 8.331 -9.224 -0.374 1.00 0.00 C ATOM 695 CD2 PHE A 46 7.789 -7.270 -1.627 1.00 0.00 C ATOM 696 CE1 PHE A 46 8.095 -8.539 0.803 1.00 0.00 C ATOM 697 CE2 PHE A 46 7.550 -6.579 -0.454 1.00 0.00 C ATOM 698 CZ PHE A 46 7.704 -7.215 0.763 1.00 0.00 C ATOM 0 H PHE A 46 7.173 -11.240 -5.084 1.00 0.00 H new ATOM 0 HA PHE A 46 7.358 -11.111 -2.290 1.00 0.00 H new ATOM 0 HB2 PHE A 46 9.434 -9.788 -2.837 1.00 0.00 H new ATOM 0 HB3 PHE A 46 8.435 -8.643 -3.710 1.00 0.00 H new ATOM 0 HD1 PHE A 46 8.636 -10.259 -0.337 1.00 0.00 H new ATOM 0 HD2 PHE A 46 7.669 -6.768 -2.576 1.00 0.00 H new ATOM 0 HE1 PHE A 46 8.216 -9.038 1.753 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.243 -5.544 -0.489 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.519 -6.678 1.681 1.00 0.00 H new ATOM 708 N THR A 47 5.066 -10.260 -2.585 1.00 0.00 N ATOM 709 CA THR A 47 3.706 -9.747 -2.692 1.00 0.00 C ATOM 710 C THR A 47 2.818 -10.345 -1.596 1.00 0.00 C ATOM 711 O THR A 47 2.337 -9.624 -0.722 1.00 0.00 O ATOM 712 CB THR A 47 3.138 -10.035 -4.091 1.00 0.00 C ATOM 713 OG1 THR A 47 3.498 -9.006 -4.995 1.00 0.00 O ATOM 714 CG2 THR A 47 1.628 -10.165 -4.135 1.00 0.00 C ATOM 0 H THR A 47 5.195 -10.961 -1.856 1.00 0.00 H new ATOM 0 HA THR A 47 3.725 -8.666 -2.551 1.00 0.00 H new ATOM 0 HB THR A 47 3.570 -10.995 -4.373 1.00 0.00 H new ATOM 0 HG1 THR A 47 4.232 -8.479 -4.615 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.310 -10.368 -5.158 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.314 -10.984 -3.488 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.173 -9.236 -3.791 1.00 0.00 H new ATOM 722 N PRO A 48 2.592 -11.672 -1.619 1.00 0.00 N ATOM 723 CA PRO A 48 1.765 -12.348 -0.618 1.00 0.00 C ATOM 724 C PRO A 48 2.528 -12.654 0.671 1.00 0.00 C ATOM 725 O PRO A 48 2.029 -13.370 1.540 1.00 0.00 O ATOM 726 CB PRO A 48 1.387 -13.646 -1.323 1.00 0.00 C ATOM 727 CG PRO A 48 2.573 -13.955 -2.170 1.00 0.00 C ATOM 728 CD PRO A 48 3.123 -12.625 -2.619 1.00 0.00 C ATOM 0 HA PRO A 48 0.919 -11.737 -0.304 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.188 -14.445 -0.609 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.487 -13.525 -1.926 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.319 -14.515 -1.607 1.00 0.00 H new ATOM 0 HG3 PRO A 48 2.292 -14.569 -3.025 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.213 -12.626 -2.632 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.792 -12.374 -3.627 1.00 0.00 H new ATOM 736 N GLN A 49 3.737 -12.111 0.792 1.00 0.00 N ATOM 737 CA GLN A 49 4.558 -12.336 1.976 1.00 0.00 C ATOM 738 C GLN A 49 4.078 -11.478 3.139 1.00 0.00 C ATOM 739 O GLN A 49 4.233 -11.848 4.302 1.00 0.00 O ATOM 740 CB GLN A 49 6.029 -12.026 1.671 1.00 0.00 C ATOM 741 CG GLN A 49 6.871 -13.263 1.410 1.00 0.00 C ATOM 742 CD GLN A 49 6.769 -14.287 2.524 1.00 0.00 C ATOM 743 OE1 GLN A 49 7.449 -14.182 3.544 1.00 0.00 O ATOM 744 NE2 GLN A 49 5.913 -15.284 2.333 1.00 0.00 N ATOM 0 H GLN A 49 4.168 -11.514 0.086 1.00 0.00 H new ATOM 0 HA GLN A 49 4.466 -13.385 2.258 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.081 -11.372 0.801 1.00 0.00 H new ATOM 0 HB3 GLN A 49 6.457 -11.476 2.509 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.556 -13.720 0.472 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.913 -12.969 1.287 1.00 0.00 H new ATOM 0 HE21 GLN A 49 5.369 -15.331 1.471 1.00 0.00 H new ATOM 0 HE22 GLN A 49 5.799 -16.002 3.048 1.00 0.00 H new ATOM 753 N LEU A 50 3.511 -10.321 2.818 1.00 0.00 N ATOM 754 CA LEU A 50 3.031 -9.402 3.828 1.00 0.00 C ATOM 755 C LEU A 50 1.612 -9.746 4.277 1.00 0.00 C ATOM 756 O LEU A 50 1.220 -9.431 5.400 1.00 0.00 O ATOM 757 CB LEU A 50 3.134 -7.974 3.279 1.00 0.00 C ATOM 758 CG LEU A 50 1.884 -7.090 3.382 1.00 0.00 C ATOM 759 CD1 LEU A 50 2.047 -6.072 4.493 1.00 0.00 C ATOM 760 CD2 LEU A 50 1.622 -6.411 2.046 1.00 0.00 C ATOM 0 H LEU A 50 3.375 -10.001 1.859 1.00 0.00 H new ATOM 0 HA LEU A 50 3.652 -9.485 4.720 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.948 -7.470 3.800 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.418 -8.036 2.228 1.00 0.00 H new ATOM 0 HG LEU A 50 1.023 -7.712 3.626 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.152 -5.453 4.553 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.195 -6.589 5.441 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.911 -5.441 4.285 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.733 -5.785 2.124 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.479 -5.793 1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.466 -7.168 1.278 1.00 0.00 H new ATOM 772 N ILE A 51 0.839 -10.378 3.399 1.00 0.00 N ATOM 773 CA ILE A 51 -0.534 -10.738 3.731 1.00 0.00 C ATOM 774 C ILE A 51 -0.605 -11.514 5.046 1.00 0.00 C ATOM 775 O ILE A 51 -1.464 -11.251 5.881 1.00 0.00 O ATOM 776 CB ILE A 51 -1.194 -11.570 2.608 1.00 0.00 C ATOM 777 CG1 ILE A 51 -1.290 -10.747 1.321 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.578 -12.051 3.031 1.00 0.00 C ATOM 779 CD1 ILE A 51 -2.171 -9.524 1.450 1.00 0.00 C ATOM 0 H ILE A 51 1.136 -10.649 2.462 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.082 -9.802 3.841 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.570 -12.444 2.421 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -0.289 -10.434 1.024 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.676 -11.380 0.522 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.023 -12.634 2.225 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.491 -12.672 3.922 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.211 -11.191 3.249 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.192 -8.989 0.500 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -3.182 -9.831 1.717 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.774 -8.870 2.226 1.00 0.00 H new ATOM 791 N GLU A 52 0.286 -12.480 5.215 1.00 0.00 N ATOM 792 CA GLU A 52 0.297 -13.298 6.421 1.00 0.00 C ATOM 793 C GLU A 52 0.548 -12.465 7.676 1.00 0.00 C ATOM 794 O GLU A 52 -0.086 -12.685 8.707 1.00 0.00 O ATOM 795 CB GLU A 52 1.352 -14.399 6.306 1.00 0.00 C ATOM 796 CG GLU A 52 1.369 -15.353 7.489 1.00 0.00 C ATOM 797 CD GLU A 52 1.742 -16.767 7.091 1.00 0.00 C ATOM 798 OE1 GLU A 52 2.661 -16.927 6.261 1.00 0.00 O ATOM 799 OE2 GLU A 52 1.115 -17.715 7.610 1.00 0.00 O ATOM 0 H GLU A 52 1.009 -12.717 4.535 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.691 -13.749 6.515 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.173 -14.968 5.394 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.335 -13.939 6.207 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.077 -14.990 8.234 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.386 -15.359 7.960 1.00 0.00 H new ATOM 806 N PHE A 53 1.478 -11.521 7.595 1.00 0.00 N ATOM 807 CA PHE A 53 1.800 -10.683 8.746 1.00 0.00 C ATOM 808 C PHE A 53 0.697 -9.675 9.039 1.00 0.00 C ATOM 809 O PHE A 53 0.371 -9.418 10.197 1.00 0.00 O ATOM 810 CB PHE A 53 3.114 -9.922 8.523 1.00 0.00 C ATOM 811 CG PHE A 53 3.530 -9.082 9.709 1.00 0.00 C ATOM 812 CD1 PHE A 53 2.997 -9.322 10.971 1.00 0.00 C ATOM 813 CD2 PHE A 53 4.443 -8.048 9.564 1.00 0.00 C ATOM 814 CE1 PHE A 53 3.368 -8.552 12.057 1.00 0.00 C ATOM 815 CE2 PHE A 53 4.816 -7.273 10.650 1.00 0.00 C ATOM 816 CZ PHE A 53 4.277 -7.526 11.896 1.00 0.00 C ATOM 0 H PHE A 53 2.018 -11.317 6.754 1.00 0.00 H new ATOM 0 HA PHE A 53 1.902 -11.354 9.599 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.906 -10.637 8.298 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.009 -9.278 7.650 1.00 0.00 H new ATOM 0 HD1 PHE A 53 2.283 -10.121 11.104 1.00 0.00 H new ATOM 0 HD2 PHE A 53 4.868 -7.845 8.592 1.00 0.00 H new ATOM 0 HE1 PHE A 53 2.947 -8.753 13.031 1.00 0.00 H new ATOM 0 HE2 PHE A 53 5.528 -6.471 10.522 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.566 -6.922 12.743 1.00 0.00 H new ATOM 826 N TYR A 54 0.165 -9.070 7.989 1.00 0.00 N ATOM 827 CA TYR A 54 -0.855 -8.045 8.144 1.00 0.00 C ATOM 828 C TYR A 54 -2.276 -8.607 8.240 1.00 0.00 C ATOM 829 O TYR A 54 -3.110 -8.045 8.950 1.00 0.00 O ATOM 830 CB TYR A 54 -0.735 -7.040 7.000 1.00 0.00 C ATOM 831 CG TYR A 54 0.451 -6.104 7.154 1.00 0.00 C ATOM 832 CD1 TYR A 54 1.627 -6.525 7.773 1.00 0.00 C ATOM 833 CD2 TYR A 54 0.398 -4.799 6.685 1.00 0.00 C ATOM 834 CE1 TYR A 54 2.706 -5.674 7.915 1.00 0.00 C ATOM 835 CE2 TYR A 54 1.475 -3.943 6.822 1.00 0.00 C ATOM 836 CZ TYR A 54 2.625 -4.386 7.436 1.00 0.00 C ATOM 837 OH TYR A 54 3.699 -3.537 7.574 1.00 0.00 O ATOM 0 H TYR A 54 0.422 -9.270 7.022 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.677 -7.547 9.097 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.645 -7.580 6.057 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.651 -6.451 6.944 1.00 0.00 H new ATOM 0 HD1 TYR A 54 1.696 -7.535 8.149 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.502 -4.445 6.204 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.608 -6.017 8.399 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.415 -2.931 6.449 1.00 0.00 H new ATOM 0 HH TYR A 54 3.387 -2.608 7.550 1.00 0.00 H new ATOM 847 N ASP A 55 -2.565 -9.701 7.539 1.00 0.00 N ATOM 848 CA ASP A 55 -3.907 -10.281 7.588 1.00 0.00 C ATOM 849 C ASP A 55 -4.138 -11.043 8.891 1.00 0.00 C ATOM 850 O ASP A 55 -5.274 -11.187 9.342 1.00 0.00 O ATOM 851 CB ASP A 55 -4.143 -11.206 6.394 1.00 0.00 C ATOM 852 CG ASP A 55 -4.056 -10.470 5.072 1.00 0.00 C ATOM 853 OD1 ASP A 55 -3.116 -9.665 4.900 1.00 0.00 O ATOM 854 OD2 ASP A 55 -4.929 -10.698 4.207 1.00 0.00 O ATOM 0 H ASP A 55 -1.904 -10.196 6.941 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.619 -9.457 7.543 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.407 -12.010 6.409 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.125 -11.670 6.485 1.00 0.00 H new ATOM 859 N LYS A 56 -3.059 -11.542 9.484 1.00 0.00 N ATOM 860 CA LYS A 56 -3.149 -12.300 10.723 1.00 0.00 C ATOM 861 C LYS A 56 -3.163 -11.395 11.954 1.00 0.00 C ATOM 862 O LYS A 56 -3.414 -11.860 13.066 1.00 0.00 O ATOM 863 CB LYS A 56 -1.977 -13.275 10.826 1.00 0.00 C ATOM 864 CG LYS A 56 -1.982 -14.349 9.749 1.00 0.00 C ATOM 865 CD LYS A 56 -2.913 -15.495 10.111 1.00 0.00 C ATOM 866 CE LYS A 56 -4.250 -15.373 9.396 1.00 0.00 C ATOM 867 NZ LYS A 56 -5.125 -16.550 9.653 1.00 0.00 N ATOM 0 H LYS A 56 -2.111 -11.434 9.124 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.092 -12.846 10.698 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -1.043 -12.716 10.765 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.999 -13.754 11.805 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.292 -13.913 8.800 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.971 -14.731 9.609 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.444 -16.443 9.849 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -3.075 -15.507 11.189 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -4.756 -14.465 9.725 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -4.081 -15.273 8.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -6.026 -16.429 9.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.653 -17.413 9.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -5.308 -16.631 10.674 1.00 0.00 H new ATOM 881 N PHE A 57 -2.876 -10.111 11.765 1.00 0.00 N ATOM 882 CA PHE A 57 -2.842 -9.172 12.881 1.00 0.00 C ATOM 883 C PHE A 57 -3.647 -7.905 12.587 1.00 0.00 C ATOM 884 O PHE A 57 -3.672 -6.981 13.399 1.00 0.00 O ATOM 885 CB PHE A 57 -1.390 -8.810 13.205 1.00 0.00 C ATOM 886 CG PHE A 57 -0.974 -9.176 14.602 1.00 0.00 C ATOM 887 CD1 PHE A 57 -1.362 -10.384 15.164 1.00 0.00 C ATOM 888 CD2 PHE A 57 -0.193 -8.313 15.355 1.00 0.00 C ATOM 889 CE1 PHE A 57 -0.979 -10.722 16.448 1.00 0.00 C ATOM 890 CE2 PHE A 57 0.192 -8.647 16.639 1.00 0.00 C ATOM 891 CZ PHE A 57 -0.200 -9.852 17.187 1.00 0.00 C ATOM 0 H PHE A 57 -2.665 -9.699 10.856 1.00 0.00 H new ATOM 0 HA PHE A 57 -3.302 -9.658 13.741 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.732 -9.313 12.496 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -1.252 -7.738 13.063 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.970 -11.068 14.591 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.118 -7.369 14.933 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -1.288 -11.665 16.874 1.00 0.00 H new ATOM 0 HE2 PHE A 57 0.800 -7.965 17.215 1.00 0.00 H new ATOM 0 HZ PHE A 57 0.101 -10.114 18.190 1.00 0.00 H new ATOM 901 N HIS A 58 -4.293 -7.856 11.423 1.00 0.00 N ATOM 902 CA HIS A 58 -5.075 -6.688 11.034 1.00 0.00 C ATOM 903 C HIS A 58 -6.054 -6.268 12.131 1.00 0.00 C ATOM 904 O HIS A 58 -6.387 -5.090 12.257 1.00 0.00 O ATOM 905 CB HIS A 58 -5.844 -6.969 9.742 1.00 0.00 C ATOM 906 CG HIS A 58 -6.809 -8.108 9.852 1.00 0.00 C ATOM 907 ND1 HIS A 58 -7.998 -8.159 9.156 1.00 0.00 N ATOM 908 CD2 HIS A 58 -6.756 -9.247 10.584 1.00 0.00 C ATOM 909 CE1 HIS A 58 -8.634 -9.278 9.455 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.901 -9.955 10.319 1.00 0.00 N ATOM 0 H HIS A 58 -4.289 -8.610 10.736 1.00 0.00 H new ATOM 0 HA HIS A 58 -4.375 -5.869 10.873 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -6.388 -6.070 9.451 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -5.132 -7.183 8.945 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -5.960 -9.543 11.252 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -9.591 -9.586 9.060 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -8.146 -10.858 10.724 1.00 0.00 H new ATOM 919 N GLU A 59 -6.519 -7.235 12.913 1.00 0.00 N ATOM 920 CA GLU A 59 -7.468 -6.961 13.988 1.00 0.00 C ATOM 921 C GLU A 59 -6.771 -6.413 15.232 1.00 0.00 C ATOM 922 O GLU A 59 -7.362 -5.652 15.998 1.00 0.00 O ATOM 923 CB GLU A 59 -8.242 -8.231 14.344 1.00 0.00 C ATOM 924 CG GLU A 59 -9.086 -8.770 13.200 1.00 0.00 C ATOM 925 CD GLU A 59 -9.505 -10.211 13.414 1.00 0.00 C ATOM 926 OE1 GLU A 59 -10.299 -10.466 14.344 1.00 0.00 O ATOM 927 OE2 GLU A 59 -9.040 -11.084 12.652 1.00 0.00 O ATOM 0 H GLU A 59 -6.255 -8.216 12.824 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.161 -6.200 13.629 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.537 -9.000 14.658 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.889 -8.025 15.196 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.975 -8.150 13.086 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.522 -8.694 12.270 1.00 0.00 H new ATOM 934 N SER A 60 -5.522 -6.815 15.439 1.00 0.00 N ATOM 935 CA SER A 60 -4.760 -6.373 16.603 1.00 0.00 C ATOM 936 C SER A 60 -4.222 -4.955 16.423 1.00 0.00 C ATOM 937 O SER A 60 -4.672 -4.020 17.085 1.00 0.00 O ATOM 938 CB SER A 60 -3.603 -7.335 16.872 1.00 0.00 C ATOM 939 OG SER A 60 -2.756 -7.440 15.740 1.00 0.00 O ATOM 0 H SER A 60 -5.015 -7.445 14.817 1.00 0.00 H new ATOM 0 HA SER A 60 -5.438 -6.369 17.457 1.00 0.00 H new ATOM 0 HB2 SER A 60 -3.028 -6.987 17.730 1.00 0.00 H new ATOM 0 HB3 SER A 60 -3.996 -8.319 17.129 1.00 0.00 H new ATOM 0 HG SER A 60 -2.271 -8.291 15.772 1.00 0.00 H new ATOM 945 N LYS A 61 -3.247 -4.806 15.531 1.00 0.00 N ATOM 946 CA LYS A 61 -2.632 -3.506 15.271 1.00 0.00 C ATOM 947 C LYS A 61 -3.604 -2.540 14.582 1.00 0.00 C ATOM 948 O LYS A 61 -3.294 -1.360 14.415 1.00 0.00 O ATOM 949 CB LYS A 61 -1.371 -3.686 14.419 1.00 0.00 C ATOM 950 CG LYS A 61 -0.074 -3.469 15.187 1.00 0.00 C ATOM 951 CD LYS A 61 1.132 -4.018 14.431 1.00 0.00 C ATOM 952 CE LYS A 61 1.200 -3.460 12.988 1.00 0.00 C ATOM 953 NZ LYS A 61 2.376 -3.992 12.248 1.00 0.00 N ATOM 0 H LYS A 61 -2.864 -5.570 14.975 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.363 -3.068 16.232 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.369 -4.691 13.998 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.407 -2.989 13.581 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.066 -2.404 15.370 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.143 -3.953 16.161 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.046 -3.760 14.965 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.078 -5.106 14.399 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.286 -3.719 12.454 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.252 -2.372 13.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.112 -3.259 12.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.753 -4.823 12.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.087 -4.266 11.287 1.00 0.00 H new ATOM 967 N ASN A 62 -4.775 -3.042 14.181 1.00 0.00 N ATOM 968 CA ASN A 62 -5.784 -2.227 13.515 1.00 0.00 C ATOM 969 C ASN A 62 -5.174 -1.356 12.418 1.00 0.00 C ATOM 970 O ASN A 62 -4.879 -0.179 12.623 1.00 0.00 O ATOM 971 CB ASN A 62 -6.531 -1.379 14.545 1.00 0.00 C ATOM 972 CG ASN A 62 -5.662 -0.322 15.197 1.00 0.00 C ATOM 973 OD1 ASN A 62 -4.888 -0.614 16.109 1.00 0.00 O ATOM 974 ND2 ASN A 62 -5.790 0.917 14.736 1.00 0.00 N ATOM 0 H ASN A 62 -5.045 -4.017 14.309 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.495 -2.894 13.028 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -7.378 -0.894 14.060 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.937 -2.032 15.317 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -5.234 1.671 15.140 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.444 1.114 13.978 1.00 0.00 H new ATOM 981 N PHE A 63 -4.988 -1.960 11.251 1.00 0.00 N ATOM 982 CA PHE A 63 -4.410 -1.268 10.100 1.00 0.00 C ATOM 983 C PHE A 63 -5.089 -1.705 8.804 1.00 0.00 C ATOM 984 O PHE A 63 -5.877 -2.652 8.797 1.00 0.00 O ATOM 985 CB PHE A 63 -2.907 -1.533 10.015 1.00 0.00 C ATOM 986 CG PHE A 63 -2.540 -2.962 10.289 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.724 -3.506 11.547 1.00 0.00 C ATOM 988 CD2 PHE A 63 -2.015 -3.760 9.290 1.00 0.00 C ATOM 989 CE1 PHE A 63 -2.394 -4.819 11.805 1.00 0.00 C ATOM 990 CE2 PHE A 63 -1.682 -5.075 9.544 1.00 0.00 C ATOM 991 CZ PHE A 63 -1.871 -5.606 10.801 1.00 0.00 C ATOM 0 H PHE A 63 -5.230 -2.935 11.074 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.574 -0.199 10.234 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.552 -1.258 9.022 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.391 -0.889 10.727 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.132 -2.894 12.338 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -1.864 -3.351 8.302 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.545 -5.231 12.792 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.272 -5.689 8.756 1.00 0.00 H new ATOM 0 HZ PHE A 63 -1.610 -6.635 10.999 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.784 -1.011 7.710 1.00 0.00 N ATOM 1002 CA GLU A 64 -5.365 -1.327 6.418 1.00 0.00 C ATOM 1003 C GLU A 64 -4.325 -1.200 5.310 1.00 0.00 C ATOM 1004 O GLU A 64 -3.522 -0.268 5.294 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.546 -0.405 6.125 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.591 -1.025 5.213 1.00 0.00 C ATOM 1007 CD GLU A 64 -8.108 -2.352 5.735 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.456 -3.386 5.477 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -9.164 -2.357 6.403 1.00 0.00 O ATOM 0 H GLU A 64 -4.135 -0.224 7.698 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.717 -2.358 6.450 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.018 -0.124 7.066 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -6.175 0.512 5.668 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -8.426 -0.333 5.100 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.162 -1.171 4.222 1.00 0.00 H new ATOM 1016 N VAL A 65 -4.354 -2.144 4.387 1.00 0.00 N ATOM 1017 CA VAL A 65 -3.425 -2.162 3.259 1.00 0.00 C ATOM 1018 C VAL A 65 -4.147 -1.919 1.938 1.00 0.00 C ATOM 1019 O VAL A 65 -5.127 -2.594 1.623 1.00 0.00 O ATOM 1020 CB VAL A 65 -2.680 -3.509 3.155 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.689 -3.498 1.994 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.976 -3.834 4.460 1.00 0.00 C ATOM 0 H VAL A 65 -5.017 -2.919 4.393 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.710 -1.361 3.444 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.417 -4.288 2.960 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -1.177 -4.459 1.943 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -2.224 -3.322 1.061 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.957 -2.705 2.148 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.457 -4.788 4.366 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.255 -3.049 4.690 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.710 -3.899 5.263 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.646 -0.967 1.160 1.00 0.00 N ATOM 1033 CA VAL A 66 -4.234 -0.661 -0.137 1.00 0.00 C ATOM 1034 C VAL A 66 -3.393 -1.274 -1.253 1.00 0.00 C ATOM 1035 O VAL A 66 -2.164 -1.282 -1.180 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.351 0.858 -0.365 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -5.170 1.150 -1.612 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.961 1.535 0.853 1.00 0.00 C ATOM 0 H VAL A 66 -2.837 -0.396 1.404 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.237 -1.088 -0.150 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.350 1.262 -0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.241 2.228 -1.756 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.687 0.699 -2.479 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.170 0.732 -1.496 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.036 2.608 0.674 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.955 1.127 1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.330 1.356 1.723 1.00 0.00 H new ATOM 1048 N PHE A 67 -4.055 -1.799 -2.280 1.00 0.00 N ATOM 1049 CA PHE A 67 -3.355 -2.422 -3.395 1.00 0.00 C ATOM 1050 C PHE A 67 -3.414 -1.549 -4.641 1.00 0.00 C ATOM 1051 O PHE A 67 -4.389 -1.585 -5.392 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.956 -3.796 -3.693 1.00 0.00 C ATOM 1053 CG PHE A 67 -3.223 -4.556 -4.760 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -1.994 -5.139 -4.495 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -3.763 -4.689 -6.029 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -1.318 -5.839 -5.475 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -3.092 -5.388 -7.014 1.00 0.00 C ATOM 1058 CZ PHE A 67 -1.868 -5.964 -6.736 1.00 0.00 C ATOM 0 H PHE A 67 -5.072 -1.805 -2.362 1.00 0.00 H new ATOM 0 HA PHE A 67 -2.309 -2.539 -3.111 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.962 -4.387 -2.777 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.995 -3.670 -3.997 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.560 -5.045 -3.511 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -4.720 -4.241 -6.251 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.361 -6.288 -5.256 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -3.524 -5.484 -7.999 1.00 0.00 H new ATOM 0 HZ PHE A 67 -1.341 -6.512 -7.504 1.00 0.00 H new ATOM 1068 N CYS A 68 -2.359 -0.773 -4.863 1.00 0.00 N ATOM 1069 CA CYS A 68 -2.287 0.098 -6.026 1.00 0.00 C ATOM 1070 C CYS A 68 -1.630 -0.637 -7.191 1.00 0.00 C ATOM 1071 O CYS A 68 -0.787 -1.510 -6.988 1.00 0.00 O ATOM 1072 CB CYS A 68 -1.528 1.389 -5.678 1.00 0.00 C ATOM 1073 SG CYS A 68 0.145 1.510 -6.364 1.00 0.00 S ATOM 0 H CYS A 68 -1.543 -0.731 -4.252 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.297 0.376 -6.329 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -2.110 2.240 -6.031 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -1.465 1.473 -4.593 1.00 0.00 H new ATOM 0 HG CYS A 68 0.908 2.160 -5.536 1.00 0.00 H new ATOM 1079 N THR A 69 -2.028 -0.290 -8.407 1.00 0.00 N ATOM 1080 CA THR A 69 -1.482 -0.931 -9.595 1.00 0.00 C ATOM 1081 C THR A 69 -0.366 -0.095 -10.220 1.00 0.00 C ATOM 1082 O THR A 69 -0.257 1.107 -9.974 1.00 0.00 O ATOM 1083 CB THR A 69 -2.596 -1.170 -10.615 1.00 0.00 C ATOM 1084 OG1 THR A 69 -2.186 -2.106 -11.598 1.00 0.00 O ATOM 1085 CG2 THR A 69 -3.034 0.088 -11.332 1.00 0.00 C ATOM 0 H THR A 69 -2.725 0.430 -8.597 1.00 0.00 H new ATOM 0 HA THR A 69 -1.053 -1.887 -9.296 1.00 0.00 H new ATOM 0 HB THR A 69 -3.438 -1.549 -10.036 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.912 -1.629 -12.409 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.826 -0.154 -12.040 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.405 0.810 -10.605 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.186 0.515 -11.868 1.00 0.00 H new ATOM 1093 N TRP A 70 0.455 -0.746 -11.034 1.00 0.00 N ATOM 1094 CA TRP A 70 1.568 -0.083 -11.710 1.00 0.00 C ATOM 1095 C TRP A 70 1.750 -0.626 -13.128 1.00 0.00 C ATOM 1096 O TRP A 70 2.873 -0.739 -13.619 1.00 0.00 O ATOM 1097 CB TRP A 70 2.858 -0.272 -10.907 1.00 0.00 C ATOM 1098 CG TRP A 70 3.419 1.009 -10.375 1.00 0.00 C ATOM 1099 CD1 TRP A 70 2.989 1.697 -9.278 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.516 1.756 -10.914 1.00 0.00 C ATOM 1101 NE1 TRP A 70 3.751 2.825 -9.100 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.695 2.885 -10.092 1.00 0.00 C ATOM 1103 CE3 TRP A 70 5.365 1.580 -12.010 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.688 3.831 -10.332 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 6.350 2.520 -12.249 1.00 0.00 C ATOM 1106 CH2 TRP A 70 6.504 3.633 -11.413 1.00 0.00 C ATOM 0 H TRP A 70 0.372 -1.741 -11.245 1.00 0.00 H new ATOM 0 HA TRP A 70 1.340 0.981 -11.778 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.663 -0.948 -10.075 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.604 -0.752 -11.540 1.00 0.00 H new ATOM 0 HD1 TRP A 70 2.169 1.398 -8.642 1.00 0.00 H new ATOM 0 HE1 TRP A 70 3.634 3.508 -8.351 1.00 0.00 H new ATOM 0 HE3 TRP A 70 5.253 0.724 -12.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.810 4.690 -9.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 7.011 2.394 -13.094 1.00 0.00 H new ATOM 0 HH2 TRP A 70 7.283 4.350 -11.626 1.00 0.00 H new ATOM 1117 N ASP A 71 0.640 -0.964 -13.779 1.00 0.00 N ATOM 1118 CA ASP A 71 0.675 -1.499 -15.135 1.00 0.00 C ATOM 1119 C ASP A 71 0.433 -0.399 -16.163 1.00 0.00 C ATOM 1120 O ASP A 71 0.186 0.754 -15.809 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.382 -2.595 -15.296 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.263 -3.677 -14.241 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.406 -3.357 -13.043 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -0.028 -4.846 -14.614 1.00 0.00 O ATOM 0 H ASP A 71 -0.297 -0.876 -13.387 1.00 0.00 H new ATOM 0 HA ASP A 71 1.665 -1.921 -15.306 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.375 -2.148 -15.243 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.287 -3.044 -16.285 1.00 0.00 H new ATOM 1129 N GLU A 72 0.501 -0.767 -17.439 1.00 0.00 N ATOM 1130 CA GLU A 72 0.282 0.182 -18.523 1.00 0.00 C ATOM 1131 C GLU A 72 -1.117 0.019 -19.109 1.00 0.00 C ATOM 1132 O GLU A 72 -1.709 0.976 -19.607 1.00 0.00 O ATOM 1133 CB GLU A 72 1.333 -0.010 -19.617 1.00 0.00 C ATOM 1134 CG GLU A 72 2.674 0.628 -19.293 1.00 0.00 C ATOM 1135 CD GLU A 72 2.633 2.142 -19.369 1.00 0.00 C ATOM 1136 OE1 GLU A 72 1.522 2.709 -19.303 1.00 0.00 O ATOM 1137 OE2 GLU A 72 3.712 2.760 -19.495 1.00 0.00 O ATOM 0 H GLU A 72 0.706 -1.717 -17.747 1.00 0.00 H new ATOM 0 HA GLU A 72 0.373 1.190 -18.117 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.479 -1.077 -19.785 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.956 0.411 -20.549 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.983 0.326 -18.292 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.427 0.253 -19.986 1.00 0.00 H new ATOM 1144 N GLU A 73 -1.640 -1.203 -19.042 1.00 0.00 N ATOM 1145 CA GLU A 73 -2.970 -1.497 -19.563 1.00 0.00 C ATOM 1146 C GLU A 73 -3.905 -1.941 -18.442 1.00 0.00 C ATOM 1147 O GLU A 73 -3.456 -2.333 -17.365 1.00 0.00 O ATOM 1148 CB GLU A 73 -2.891 -2.582 -20.638 1.00 0.00 C ATOM 1149 CG GLU A 73 -4.093 -2.609 -21.567 1.00 0.00 C ATOM 1150 CD GLU A 73 -3.936 -3.609 -22.695 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -3.439 -4.725 -22.434 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -4.311 -3.277 -23.840 1.00 0.00 O ATOM 0 H GLU A 73 -1.162 -2.005 -18.632 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.370 -0.586 -20.007 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.989 -2.430 -21.230 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -2.795 -3.554 -20.154 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.986 -2.853 -20.992 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.246 -1.615 -21.987 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.207 -1.875 -18.702 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.205 -2.269 -17.714 1.00 0.00 C ATOM 1161 C GLU A 74 -6.249 -3.786 -17.550 1.00 0.00 C ATOM 1162 O GLU A 74 -6.618 -4.293 -16.491 1.00 0.00 O ATOM 1163 CB GLU A 74 -7.586 -1.750 -18.119 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.608 -0.263 -18.437 1.00 0.00 C ATOM 1165 CD GLU A 74 -8.744 0.119 -19.364 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -9.266 -0.776 -20.061 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.111 1.312 -19.394 1.00 0.00 O ATOM 0 H GLU A 74 -5.595 -1.552 -19.588 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.922 -1.829 -16.758 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.932 -2.305 -18.991 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.291 -1.951 -17.313 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.696 0.302 -17.509 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -6.660 0.021 -18.894 1.00 0.00 H new ATOM 1174 N ASP A 75 -5.875 -4.505 -18.604 1.00 0.00 N ATOM 1175 CA ASP A 75 -5.876 -5.964 -18.576 1.00 0.00 C ATOM 1176 C ASP A 75 -5.026 -6.494 -17.425 1.00 0.00 C ATOM 1177 O ASP A 75 -5.421 -7.430 -16.730 1.00 0.00 O ATOM 1178 CB ASP A 75 -5.358 -6.519 -19.904 1.00 0.00 C ATOM 1179 CG ASP A 75 -5.919 -7.893 -20.213 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -5.912 -8.755 -19.309 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -6.366 -8.108 -21.361 1.00 0.00 O ATOM 0 H ASP A 75 -5.567 -4.101 -19.489 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.903 -6.296 -18.424 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.621 -5.833 -20.709 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.270 -6.572 -19.873 1.00 0.00 H new ATOM 1186 N GLY A 76 -3.857 -5.892 -17.229 1.00 0.00 N ATOM 1187 CA GLY A 76 -2.974 -6.322 -16.160 1.00 0.00 C ATOM 1188 C GLY A 76 -3.570 -6.084 -14.786 1.00 0.00 C ATOM 1189 O GLY A 76 -3.701 -7.013 -13.991 1.00 0.00 O ATOM 0 H GLY A 76 -3.506 -5.116 -17.790 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.754 -7.383 -16.279 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.026 -5.789 -16.239 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.932 -4.836 -14.509 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.519 -4.471 -13.223 1.00 0.00 C ATOM 1195 C PHE A 77 -5.740 -5.337 -12.908 1.00 0.00 C ATOM 1196 O PHE A 77 -6.081 -5.546 -11.744 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.912 -2.989 -13.231 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.721 -2.561 -12.037 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -5.393 -3.003 -10.766 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.810 -1.717 -12.191 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -6.137 -2.609 -9.668 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -7.556 -1.321 -11.097 1.00 0.00 C ATOM 1203 CZ PHE A 77 -7.220 -1.767 -9.835 1.00 0.00 C ATOM 0 H PHE A 77 -3.829 -4.057 -15.160 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.774 -4.643 -12.446 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.006 -2.384 -13.278 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.482 -2.780 -14.136 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.548 -3.662 -10.631 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -7.078 -1.365 -13.176 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -5.872 -2.959 -8.681 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -8.402 -0.663 -11.230 1.00 0.00 H new ATOM 0 HZ PHE A 77 -7.802 -1.459 -8.979 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.395 -5.830 -13.953 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.581 -6.666 -13.793 1.00 0.00 C ATOM 1215 C ALA A 78 -7.229 -8.039 -13.257 1.00 0.00 C ATOM 1216 O ALA A 78 -7.741 -8.470 -12.224 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.235 -6.831 -15.133 1.00 0.00 C ATOM 0 H ALA A 78 -6.125 -5.665 -14.923 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.248 -6.180 -13.081 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.124 -7.454 -15.030 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.520 -5.853 -15.522 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.537 -7.306 -15.823 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.317 -8.706 -13.951 1.00 0.00 N ATOM 1224 CA GLY A 79 -5.869 -10.003 -13.517 1.00 0.00 C ATOM 1225 C GLY A 79 -4.951 -9.842 -12.337 1.00 0.00 C ATOM 1226 O GLY A 79 -4.647 -10.796 -11.623 1.00 0.00 O ATOM 0 H GLY A 79 -5.882 -8.366 -14.809 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.723 -10.624 -13.246 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.350 -10.512 -14.329 1.00 0.00 H new ATOM 1230 N TYR A 80 -4.511 -8.601 -12.148 1.00 0.00 N ATOM 1231 CA TYR A 80 -3.608 -8.270 -11.048 1.00 0.00 C ATOM 1232 C TYR A 80 -4.374 -7.776 -9.821 1.00 0.00 C ATOM 1233 O TYR A 80 -3.789 -7.575 -8.757 1.00 0.00 O ATOM 1234 CB TYR A 80 -2.592 -7.215 -11.490 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.414 -7.079 -10.551 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -0.783 -8.202 -10.031 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -0.933 -5.828 -10.185 1.00 0.00 C ATOM 1238 CE1 TYR A 80 0.293 -8.084 -9.173 1.00 0.00 C ATOM 1239 CE2 TYR A 80 0.144 -5.702 -9.328 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.753 -6.832 -8.825 1.00 0.00 C ATOM 1241 OH TYR A 80 1.825 -6.711 -7.971 1.00 0.00 O ATOM 0 H TYR A 80 -4.764 -7.810 -12.740 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.080 -9.182 -10.771 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.226 -7.469 -12.485 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.094 -6.251 -11.572 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -1.140 -9.185 -10.302 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -1.408 -4.940 -10.576 1.00 0.00 H new ATOM 0 HE1 TYR A 80 0.771 -8.968 -8.777 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.507 -4.723 -9.054 1.00 0.00 H new ATOM 0 HH TYR A 80 2.136 -7.602 -7.708 1.00 0.00 H new ATOM 1251 N PHE A 81 -5.682 -7.578 -9.971 1.00 0.00 N ATOM 1252 CA PHE A 81 -6.513 -7.107 -8.867 1.00 0.00 C ATOM 1253 C PHE A 81 -6.852 -8.246 -7.908 1.00 0.00 C ATOM 1254 O PHE A 81 -7.088 -8.019 -6.722 1.00 0.00 O ATOM 1255 CB PHE A 81 -7.799 -6.476 -9.403 1.00 0.00 C ATOM 1256 CG PHE A 81 -8.699 -5.940 -8.326 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -8.498 -4.671 -7.805 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -9.745 -6.705 -7.834 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -9.322 -4.176 -6.813 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -10.572 -6.214 -6.841 1.00 0.00 C ATOM 1261 CZ PHE A 81 -10.361 -4.949 -6.331 1.00 0.00 C ATOM 0 H PHE A 81 -6.187 -7.736 -10.843 1.00 0.00 H new ATOM 0 HA PHE A 81 -5.947 -6.355 -8.318 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.540 -5.666 -10.085 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.344 -7.220 -9.984 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -7.688 -4.063 -8.179 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -9.916 -7.695 -8.231 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.154 -3.186 -6.415 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -11.383 -6.820 -6.464 1.00 0.00 H new ATOM 0 HZ PHE A 81 -11.007 -4.564 -5.556 1.00 0.00 H new ATOM 1271 N ALA A 82 -6.880 -9.468 -8.430 1.00 0.00 N ATOM 1272 CA ALA A 82 -7.196 -10.640 -7.620 1.00 0.00 C ATOM 1273 C ALA A 82 -6.273 -10.749 -6.410 1.00 0.00 C ATOM 1274 O ALA A 82 -6.668 -11.250 -5.358 1.00 0.00 O ATOM 1275 CB ALA A 82 -7.110 -11.902 -8.465 1.00 0.00 C ATOM 0 H ALA A 82 -6.688 -9.673 -9.411 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.215 -10.526 -7.251 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.348 -12.769 -7.849 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.820 -11.837 -9.290 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -6.100 -12.005 -8.863 1.00 0.00 H new ATOM 1281 N LYS A 83 -5.039 -10.278 -6.566 1.00 0.00 N ATOM 1282 CA LYS A 83 -4.060 -10.326 -5.485 1.00 0.00 C ATOM 1283 C LYS A 83 -4.444 -9.373 -4.358 1.00 0.00 C ATOM 1284 O LYS A 83 -4.805 -8.222 -4.605 1.00 0.00 O ATOM 1285 CB LYS A 83 -2.669 -9.976 -6.015 1.00 0.00 C ATOM 1286 CG LYS A 83 -2.082 -11.037 -6.932 1.00 0.00 C ATOM 1287 CD LYS A 83 -1.249 -12.044 -6.158 1.00 0.00 C ATOM 1288 CE LYS A 83 -2.051 -13.291 -5.820 1.00 0.00 C ATOM 1289 NZ LYS A 83 -2.560 -13.262 -4.421 1.00 0.00 N ATOM 0 H LYS A 83 -4.694 -9.859 -7.430 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.045 -11.340 -5.086 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.722 -9.031 -6.555 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -1.996 -9.824 -5.171 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -2.887 -11.554 -7.454 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -1.464 -10.560 -7.693 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -0.374 -12.322 -6.746 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.884 -11.585 -5.239 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.890 -13.381 -6.510 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.427 -14.173 -5.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.997 -13.910 -3.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.483 -12.296 -4.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -3.556 -13.560 -4.408 1.00 0.00 H new ATOM 1303 N MET A 84 -4.344 -9.862 -3.118 1.00 0.00 N ATOM 1304 CA MET A 84 -4.663 -9.071 -1.926 1.00 0.00 C ATOM 1305 C MET A 84 -5.747 -8.024 -2.206 1.00 0.00 C ATOM 1306 O MET A 84 -5.455 -6.838 -2.361 1.00 0.00 O ATOM 1307 CB MET A 84 -3.397 -8.396 -1.417 1.00 0.00 C ATOM 1308 CG MET A 84 -2.538 -7.816 -2.527 1.00 0.00 C ATOM 1309 SD MET A 84 -0.991 -7.120 -1.918 1.00 0.00 S ATOM 1310 CE MET A 84 -0.007 -8.602 -1.716 1.00 0.00 C ATOM 0 H MET A 84 -4.041 -10.814 -2.913 1.00 0.00 H new ATOM 0 HA MET A 84 -5.056 -9.746 -1.165 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.671 -7.599 -0.725 1.00 0.00 H new ATOM 0 HB3 MET A 84 -2.809 -9.120 -0.853 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.319 -8.596 -3.256 1.00 0.00 H new ATOM 0 HG3 MET A 84 -3.100 -7.041 -3.048 1.00 0.00 H new ATOM 0 HE1 MET A 84 1.036 -8.379 -1.940 1.00 0.00 H new ATOM 0 HE2 MET A 84 -0.090 -8.956 -0.689 1.00 0.00 H new ATOM 0 HE3 MET A 84 -0.368 -9.374 -2.396 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.010 -8.466 -2.308 1.00 0.00 N ATOM 1321 CA PRO A 85 -8.155 -7.592 -2.608 1.00 0.00 C ATOM 1322 C PRO A 85 -8.632 -6.738 -1.431 1.00 0.00 C ATOM 1323 O PRO A 85 -9.661 -6.070 -1.537 1.00 0.00 O ATOM 1324 CB PRO A 85 -9.268 -8.579 -2.989 1.00 0.00 C ATOM 1325 CG PRO A 85 -8.613 -9.916 -3.097 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.430 -9.863 -2.181 1.00 0.00 C ATOM 0 HA PRO A 85 -7.881 -6.871 -3.378 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -10.055 -8.590 -2.235 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -9.735 -8.296 -3.932 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.298 -10.712 -2.806 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.305 -10.119 -4.123 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -7.696 -10.117 -1.155 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.645 -10.555 -2.487 1.00 0.00 H new ATOM 1334 N TRP A 86 -7.917 -6.771 -0.308 1.00 0.00 N ATOM 1335 CA TRP A 86 -8.326 -5.999 0.874 1.00 0.00 C ATOM 1336 C TRP A 86 -8.866 -4.614 0.489 1.00 0.00 C ATOM 1337 O TRP A 86 -10.077 -4.395 0.525 1.00 0.00 O ATOM 1338 CB TRP A 86 -7.189 -5.878 1.900 1.00 0.00 C ATOM 1339 CG TRP A 86 -5.807 -5.837 1.311 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.446 -5.437 0.055 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -4.597 -6.226 1.969 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.086 -5.529 -0.099 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.542 -6.022 1.061 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -4.304 -6.724 3.241 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.216 -6.300 1.387 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -2.989 -7.000 3.563 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.959 -6.787 2.639 1.00 0.00 C ATOM 0 H TRP A 86 -7.062 -7.315 -0.187 1.00 0.00 H new ATOM 0 HA TRP A 86 -9.138 -6.553 1.345 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -7.345 -4.973 2.488 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -7.250 -6.720 2.589 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.132 -5.097 -0.706 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.565 -5.273 -0.938 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -5.092 -6.890 3.960 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.419 -6.137 0.676 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -2.752 -7.386 4.543 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.941 -7.012 2.921 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.991 -3.690 0.092 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.427 -2.373 -0.323 1.00 0.00 C ATOM 1360 C LEU A 87 -7.618 -1.940 -1.535 1.00 0.00 C ATOM 1361 O LEU A 87 -6.405 -2.114 -1.562 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.275 -1.352 0.806 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.532 -1.133 1.655 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.255 -0.141 2.777 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.688 -0.653 0.784 1.00 0.00 C ATOM 0 H LEU A 87 -6.982 -3.836 0.052 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.485 -2.421 -0.581 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.465 -1.674 1.460 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -7.976 -0.397 0.374 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.814 -2.085 2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.159 0.001 3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.461 -0.527 3.416 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.946 0.814 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.572 -0.503 1.403 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.416 0.288 0.305 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.903 -1.400 0.020 1.00 0.00 H new ATOM 1377 N ALA A 88 -8.284 -1.412 -2.547 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.594 -1.003 -3.757 1.00 0.00 C ATOM 1379 C ALA A 88 -8.258 0.199 -4.417 1.00 0.00 C ATOM 1380 O ALA A 88 -9.454 0.181 -4.700 1.00 0.00 O ATOM 1381 CB ALA A 88 -7.566 -2.170 -4.713 1.00 0.00 C ATOM 0 H ALA A 88 -9.292 -1.258 -2.556 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.581 -0.701 -3.492 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.050 -1.878 -5.628 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.041 -3.006 -4.251 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.587 -2.470 -4.951 1.00 0.00 H new ATOM 1387 N VAL A 89 -7.469 1.234 -4.677 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.988 2.433 -5.325 1.00 0.00 C ATOM 1389 C VAL A 89 -8.514 2.097 -6.719 1.00 0.00 C ATOM 1390 O VAL A 89 -7.742 1.719 -7.601 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.911 3.528 -5.447 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.521 4.817 -5.982 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -6.236 3.766 -4.105 1.00 0.00 C ATOM 0 H VAL A 89 -6.475 1.268 -4.451 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.798 2.811 -4.701 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.152 3.190 -6.153 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.747 5.580 -6.062 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.953 4.634 -6.966 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.300 5.161 -5.302 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.479 4.543 -4.211 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.980 4.083 -3.374 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.765 2.843 -3.766 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.835 2.220 -6.945 1.00 0.00 N ATOM 1404 CA PRO A 90 -10.440 1.916 -8.243 1.00 0.00 C ATOM 1405 C PRO A 90 -9.741 2.642 -9.388 1.00 0.00 C ATOM 1406 O PRO A 90 -9.068 3.649 -9.179 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.893 2.396 -8.106 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.947 3.182 -6.836 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.841 2.657 -5.966 1.00 0.00 C ATOM 0 HA PRO A 90 -10.361 0.856 -8.483 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -12.183 3.010 -8.958 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.582 1.552 -8.072 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.815 4.246 -7.032 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.914 3.065 -6.348 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -10.450 3.427 -5.301 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -11.178 1.833 -5.337 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.907 2.121 -10.600 1.00 0.00 N ATOM 1418 CA PHE A 91 -9.292 2.720 -11.781 1.00 0.00 C ATOM 1419 C PHE A 91 -9.644 4.202 -11.889 1.00 0.00 C ATOM 1420 O PHE A 91 -8.918 4.978 -12.512 1.00 0.00 O ATOM 1421 CB PHE A 91 -9.742 1.985 -13.044 1.00 0.00 C ATOM 1422 CG PHE A 91 -9.103 2.503 -14.301 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -9.554 3.673 -14.891 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -8.051 1.821 -14.891 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -8.968 4.152 -16.047 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -7.461 2.295 -16.047 1.00 0.00 C ATOM 1427 CZ PHE A 91 -7.920 3.463 -16.626 1.00 0.00 C ATOM 0 H PHE A 91 -10.461 1.286 -10.791 1.00 0.00 H new ATOM 0 HA PHE A 91 -8.210 2.629 -11.681 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.511 0.925 -12.939 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.825 2.068 -13.136 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -10.372 4.216 -14.442 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.688 0.908 -14.442 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -9.329 5.065 -16.498 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.642 1.754 -16.498 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.460 3.836 -17.529 1.00 0.00 H new ATOM 1437 N ALA A 92 -10.764 4.587 -11.283 1.00 0.00 N ATOM 1438 CA ALA A 92 -11.216 5.975 -11.316 1.00 0.00 C ATOM 1439 C ALA A 92 -10.115 6.942 -10.879 1.00 0.00 C ATOM 1440 O ALA A 92 -9.995 8.039 -11.425 1.00 0.00 O ATOM 1441 CB ALA A 92 -12.445 6.146 -10.437 1.00 0.00 C ATOM 0 H ALA A 92 -11.375 3.957 -10.763 1.00 0.00 H new ATOM 0 HA ALA A 92 -11.474 6.214 -12.348 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.774 7.185 -10.469 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -13.245 5.501 -10.801 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.199 5.875 -9.410 1.00 0.00 H new ATOM 1447 N GLN A 93 -9.314 6.540 -9.894 1.00 0.00 N ATOM 1448 CA GLN A 93 -8.235 7.387 -9.401 1.00 0.00 C ATOM 1449 C GLN A 93 -6.874 6.795 -9.747 1.00 0.00 C ATOM 1450 O GLN A 93 -5.887 7.041 -9.052 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.344 7.566 -7.886 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.771 7.557 -7.361 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.201 6.193 -6.860 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.827 5.167 -7.423 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -10.994 6.177 -5.794 1.00 0.00 N ATOM 0 H GLN A 93 -9.393 5.638 -9.425 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.328 8.359 -9.886 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.783 6.771 -7.396 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.872 8.508 -7.607 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.861 8.282 -6.552 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.447 7.878 -8.153 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -11.280 7.054 -5.358 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -11.317 5.288 -5.412 1.00 0.00 H new ATOM 1464 N SER A 94 -6.819 6.014 -10.824 1.00 0.00 N ATOM 1465 CA SER A 94 -5.568 5.394 -11.249 1.00 0.00 C ATOM 1466 C SER A 94 -4.475 6.445 -11.413 1.00 0.00 C ATOM 1467 O SER A 94 -3.300 6.175 -11.167 1.00 0.00 O ATOM 1468 CB SER A 94 -5.764 4.631 -12.559 1.00 0.00 C ATOM 1469 OG SER A 94 -5.708 5.504 -13.674 1.00 0.00 O ATOM 0 H SER A 94 -7.622 5.797 -11.415 1.00 0.00 H new ATOM 0 HA SER A 94 -5.260 4.689 -10.477 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.995 3.865 -12.655 1.00 0.00 H new ATOM 0 HB3 SER A 94 -6.725 4.118 -12.544 1.00 0.00 H new ATOM 0 HG SER A 94 -5.835 4.990 -14.499 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.873 7.647 -11.820 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.926 8.740 -12.000 1.00 0.00 C ATOM 1477 C GLU A 95 -3.200 9.029 -10.692 1.00 0.00 C ATOM 1478 O GLU A 95 -2.024 9.392 -10.685 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.649 9.997 -12.489 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.710 11.083 -12.985 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.380 12.440 -13.067 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -5.628 12.485 -13.108 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -3.657 13.459 -13.090 1.00 0.00 O ATOM 0 H GLU A 95 -5.842 7.887 -12.030 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.194 8.444 -12.751 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.332 9.724 -13.293 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.256 10.396 -11.677 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.850 11.146 -12.319 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.331 10.809 -13.970 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.914 8.847 -9.584 1.00 0.00 N ATOM 1491 CA ALA A 96 -3.348 9.070 -8.261 1.00 0.00 C ATOM 1492 C ALA A 96 -2.158 8.163 -8.026 1.00 0.00 C ATOM 1493 O ALA A 96 -1.177 8.551 -7.399 1.00 0.00 O ATOM 1494 CB ALA A 96 -4.384 8.799 -7.189 1.00 0.00 C ATOM 0 H ALA A 96 -4.888 8.545 -9.579 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.027 10.111 -8.210 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.944 8.970 -6.206 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -5.234 9.467 -7.328 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.720 7.764 -7.261 1.00 0.00 H new ATOM 1500 N VAL A 97 -2.268 6.943 -8.522 1.00 0.00 N ATOM 1501 CA VAL A 97 -1.216 5.956 -8.360 1.00 0.00 C ATOM 1502 C VAL A 97 0.098 6.462 -8.942 1.00 0.00 C ATOM 1503 O VAL A 97 1.171 6.222 -8.389 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.611 4.619 -9.016 1.00 0.00 C ATOM 1505 CG1 VAL A 97 -0.492 3.604 -8.874 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.913 4.101 -8.415 1.00 0.00 C ATOM 0 H VAL A 97 -3.080 6.611 -9.043 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.078 5.788 -7.292 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.774 4.783 -10.081 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.790 2.666 -9.343 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.407 3.983 -9.359 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.289 3.432 -7.817 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.181 3.156 -8.887 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.784 3.948 -7.344 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.707 4.829 -8.584 1.00 0.00 H new ATOM 1516 N GLN A 98 -0.002 7.173 -10.053 1.00 0.00 N ATOM 1517 CA GLN A 98 1.169 7.735 -10.715 1.00 0.00 C ATOM 1518 C GLN A 98 1.574 9.060 -10.066 1.00 0.00 C ATOM 1519 O GLN A 98 2.748 9.426 -10.067 1.00 0.00 O ATOM 1520 CB GLN A 98 0.888 7.946 -12.204 1.00 0.00 C ATOM 1521 CG GLN A 98 0.224 6.754 -12.871 1.00 0.00 C ATOM 1522 CD GLN A 98 0.443 6.730 -14.372 1.00 0.00 C ATOM 1523 OE1 GLN A 98 -0.102 7.557 -15.103 1.00 0.00 O ATOM 1524 NE2 GLN A 98 1.243 5.779 -14.840 1.00 0.00 N ATOM 0 H GLN A 98 -0.886 7.377 -10.519 1.00 0.00 H new ATOM 0 HA GLN A 98 1.993 7.030 -10.607 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.250 8.821 -12.325 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.826 8.162 -12.715 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.615 5.834 -12.436 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.846 6.775 -12.664 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.674 5.114 -14.198 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.426 5.714 -15.841 1.00 0.00 H new ATOM 1533 N LYS A 99 0.593 9.771 -9.511 1.00 0.00 N ATOM 1534 CA LYS A 99 0.851 11.050 -8.855 1.00 0.00 C ATOM 1535 C LYS A 99 1.363 10.829 -7.435 1.00 0.00 C ATOM 1536 O LYS A 99 2.153 11.623 -6.923 1.00 0.00 O ATOM 1537 CB LYS A 99 -0.422 11.914 -8.817 1.00 0.00 C ATOM 1538 CG LYS A 99 -0.975 12.326 -10.184 1.00 0.00 C ATOM 1539 CD LYS A 99 -2.489 12.466 -10.143 1.00 0.00 C ATOM 1540 CE LYS A 99 -2.925 13.526 -9.144 1.00 0.00 C ATOM 1541 NZ LYS A 99 -3.275 14.809 -9.813 1.00 0.00 N ATOM 0 H LYS A 99 -0.385 9.483 -9.503 1.00 0.00 H new ATOM 0 HA LYS A 99 1.613 11.574 -9.432 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -1.197 11.367 -8.280 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -0.212 12.816 -8.242 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -0.528 13.271 -10.491 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.695 11.584 -10.932 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.858 12.726 -11.135 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -2.937 11.508 -9.877 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.786 13.163 -8.582 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.124 13.698 -8.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.567 15.505 -9.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -2.447 15.169 -10.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.056 14.650 -10.481 1.00 0.00 H new ATOM 1555 N LEU A 100 0.917 9.746 -6.803 1.00 0.00 N ATOM 1556 CA LEU A 100 1.351 9.438 -5.441 1.00 0.00 C ATOM 1557 C LEU A 100 2.730 8.793 -5.470 1.00 0.00 C ATOM 1558 O LEU A 100 3.643 9.211 -4.758 1.00 0.00 O ATOM 1559 CB LEU A 100 0.329 8.532 -4.719 1.00 0.00 C ATOM 1560 CG LEU A 100 0.737 7.069 -4.500 1.00 0.00 C ATOM 1561 CD1 LEU A 100 1.847 6.970 -3.465 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.467 6.244 -4.067 1.00 0.00 C ATOM 0 H LEU A 100 0.263 9.074 -7.205 1.00 0.00 H new ATOM 0 HA LEU A 100 1.412 10.369 -4.878 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.111 8.973 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.599 8.544 -5.290 1.00 0.00 H new ATOM 0 HG LEU A 100 1.112 6.672 -5.443 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.121 5.924 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 100 2.716 7.530 -3.809 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.500 7.384 -2.518 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.163 5.208 -3.915 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.867 6.645 -3.136 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.235 6.287 -4.840 1.00 0.00 H new ATOM 1574 N SER A 101 2.866 7.770 -6.301 1.00 0.00 N ATOM 1575 CA SER A 101 4.131 7.051 -6.439 1.00 0.00 C ATOM 1576 C SER A 101 5.287 8.017 -6.684 1.00 0.00 C ATOM 1577 O SER A 101 6.394 7.816 -6.184 1.00 0.00 O ATOM 1578 CB SER A 101 4.047 6.042 -7.585 1.00 0.00 C ATOM 1579 OG SER A 101 3.554 4.793 -7.131 1.00 0.00 O ATOM 0 H SER A 101 2.115 7.416 -6.893 1.00 0.00 H new ATOM 0 HA SER A 101 4.317 6.519 -5.506 1.00 0.00 H new ATOM 0 HB2 SER A 101 3.396 6.430 -8.368 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.034 5.908 -8.028 1.00 0.00 H new ATOM 0 HG SER A 101 3.353 4.849 -6.174 1.00 0.00 H new ATOM 1585 N LYS A 102 5.021 9.065 -7.457 1.00 0.00 N ATOM 1586 CA LYS A 102 6.038 10.063 -7.768 1.00 0.00 C ATOM 1587 C LYS A 102 6.476 10.803 -6.509 1.00 0.00 C ATOM 1588 O LYS A 102 7.624 11.232 -6.396 1.00 0.00 O ATOM 1589 CB LYS A 102 5.506 11.059 -8.801 1.00 0.00 C ATOM 1590 CG LYS A 102 6.522 12.113 -9.208 1.00 0.00 C ATOM 1591 CD LYS A 102 5.936 13.092 -10.213 1.00 0.00 C ATOM 1592 CE LYS A 102 4.898 13.997 -9.569 1.00 0.00 C ATOM 1593 NZ LYS A 102 5.423 14.661 -8.344 1.00 0.00 N ATOM 0 H LYS A 102 4.110 9.245 -7.879 1.00 0.00 H new ATOM 0 HA LYS A 102 6.903 9.547 -8.184 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.186 10.513 -9.688 1.00 0.00 H new ATOM 0 HB3 LYS A 102 4.624 11.554 -8.395 1.00 0.00 H new ATOM 0 HG2 LYS A 102 6.860 12.655 -8.325 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.398 11.628 -9.639 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.735 13.699 -10.640 1.00 0.00 H new ATOM 0 HD3 LYS A 102 5.480 12.541 -11.036 1.00 0.00 H new ATOM 0 HE2 LYS A 102 4.583 14.755 -10.286 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.014 13.412 -9.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 4.867 15.517 -8.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 5.350 14.009 -7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.419 14.921 -8.490 1.00 0.00 H new ATOM 1607 N HIS A 103 5.554 10.947 -5.562 1.00 0.00 N ATOM 1608 CA HIS A 103 5.845 11.635 -4.309 1.00 0.00 C ATOM 1609 C HIS A 103 6.745 10.784 -3.417 1.00 0.00 C ATOM 1610 O HIS A 103 7.542 11.310 -2.642 1.00 0.00 O ATOM 1611 CB HIS A 103 4.545 11.966 -3.573 1.00 0.00 C ATOM 1612 CG HIS A 103 3.763 13.072 -4.211 1.00 0.00 C ATOM 1613 ND1 HIS A 103 2.403 13.003 -4.431 1.00 0.00 N ATOM 1614 CD2 HIS A 103 4.155 14.281 -4.678 1.00 0.00 C ATOM 1615 CE1 HIS A 103 1.994 14.120 -5.006 1.00 0.00 C ATOM 1616 NE2 HIS A 103 3.038 14.912 -5.165 1.00 0.00 N ATOM 0 H HIS A 103 4.599 10.596 -5.639 1.00 0.00 H new ATOM 0 HA HIS A 103 6.369 12.562 -4.544 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.924 11.071 -3.528 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.779 12.243 -2.545 1.00 0.00 H new ATOM 0 HD2 HIS A 103 5.160 14.676 -4.669 1.00 0.00 H new ATOM 0 HE1 HIS A 103 0.979 14.346 -5.296 1.00 0.00 H new ATOM 0 HE2 HIS A 103 3.018 15.842 -5.582 1.00 0.00 H new ATOM 1625 N PHE A 104 6.610 9.466 -3.534 1.00 0.00 N ATOM 1626 CA PHE A 104 7.412 8.543 -2.739 1.00 0.00 C ATOM 1627 C PHE A 104 8.766 8.273 -3.394 1.00 0.00 C ATOM 1628 O PHE A 104 9.553 7.467 -2.897 1.00 0.00 O ATOM 1629 CB PHE A 104 6.661 7.226 -2.543 1.00 0.00 C ATOM 1630 CG PHE A 104 5.724 7.238 -1.371 1.00 0.00 C ATOM 1631 CD1 PHE A 104 6.150 7.683 -0.130 1.00 0.00 C ATOM 1632 CD2 PHE A 104 4.416 6.804 -1.509 1.00 0.00 C ATOM 1633 CE1 PHE A 104 5.290 7.696 0.950 1.00 0.00 C ATOM 1634 CE2 PHE A 104 3.550 6.814 -0.432 1.00 0.00 C ATOM 1635 CZ PHE A 104 3.988 7.261 0.799 1.00 0.00 C ATOM 0 H PHE A 104 5.954 9.014 -4.171 1.00 0.00 H new ATOM 0 HA PHE A 104 7.590 9.008 -1.769 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.096 7.002 -3.447 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.384 6.421 -2.411 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.167 8.024 -0.006 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.069 6.454 -2.470 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.635 8.046 1.912 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.532 6.473 -0.553 1.00 0.00 H new ATOM 0 HZ PHE A 104 3.313 7.270 1.642 1.00 0.00 H new ATOM 1645 N ASN A 105 9.037 8.949 -4.509 1.00 0.00 N ATOM 1646 CA ASN A 105 10.297 8.777 -5.221 1.00 0.00 C ATOM 1647 C ASN A 105 10.548 7.307 -5.545 1.00 0.00 C ATOM 1648 O ASN A 105 11.695 6.867 -5.627 1.00 0.00 O ATOM 1649 CB ASN A 105 11.452 9.333 -4.389 1.00 0.00 C ATOM 1650 CG ASN A 105 12.569 9.892 -5.249 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.351 10.786 -6.065 1.00 0.00 O ATOM 1652 ND2 ASN A 105 13.774 9.363 -5.070 1.00 0.00 N ATOM 0 H ASN A 105 8.399 9.620 -4.937 1.00 0.00 H new ATOM 0 HA ASN A 105 10.233 9.328 -6.160 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.077 10.117 -3.731 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.849 8.544 -3.751 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.565 9.697 -5.621 1.00 0.00 H new ATOM 0 HD22 ASN A 105 13.909 8.623 -4.381 1.00 0.00 H new ATOM 1659 N VAL A 106 9.469 6.552 -5.730 1.00 0.00 N ATOM 1660 CA VAL A 106 9.574 5.130 -6.047 1.00 0.00 C ATOM 1661 C VAL A 106 10.490 4.901 -7.245 1.00 0.00 C ATOM 1662 O VAL A 106 10.078 5.065 -8.394 1.00 0.00 O ATOM 1663 CB VAL A 106 8.192 4.510 -6.347 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.313 3.009 -6.563 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.215 4.815 -5.222 1.00 0.00 C ATOM 0 H VAL A 106 8.512 6.900 -5.666 1.00 0.00 H new ATOM 0 HA VAL A 106 9.996 4.644 -5.168 1.00 0.00 H new ATOM 0 HB VAL A 106 7.807 4.956 -7.264 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.328 2.591 -6.773 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.977 2.815 -7.406 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.721 2.544 -5.665 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.246 4.370 -5.451 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.594 4.399 -4.288 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.103 5.894 -5.120 1.00 0.00 H new ATOM 1675 N GLU A 107 11.733 4.520 -6.970 1.00 0.00 N ATOM 1676 CA GLU A 107 12.708 4.267 -8.027 1.00 0.00 C ATOM 1677 C GLU A 107 12.168 3.250 -9.027 1.00 0.00 C ATOM 1678 O GLU A 107 12.405 3.360 -10.230 1.00 0.00 O ATOM 1679 CB GLU A 107 14.023 3.766 -7.429 1.00 0.00 C ATOM 1680 CG GLU A 107 15.011 4.877 -7.115 1.00 0.00 C ATOM 1681 CD GLU A 107 16.438 4.375 -7.008 1.00 0.00 C ATOM 1682 OE1 GLU A 107 17.083 4.189 -8.061 1.00 0.00 O ATOM 1683 OE2 GLU A 107 16.911 4.168 -5.871 1.00 0.00 O ATOM 0 H GLU A 107 12.090 4.379 -6.025 1.00 0.00 H new ATOM 0 HA GLU A 107 12.893 5.205 -8.551 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.809 3.212 -6.515 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.485 3.066 -8.125 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.955 5.639 -7.893 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.727 5.357 -6.178 1.00 0.00 H new ATOM 1690 N SER A 108 11.438 2.262 -8.519 1.00 0.00 N ATOM 1691 CA SER A 108 10.858 1.226 -9.364 1.00 0.00 C ATOM 1692 C SER A 108 10.092 0.207 -8.527 1.00 0.00 C ATOM 1693 O SER A 108 10.428 -0.040 -7.368 1.00 0.00 O ATOM 1694 CB SER A 108 11.946 0.518 -10.173 1.00 0.00 C ATOM 1695 OG SER A 108 12.986 0.051 -9.331 1.00 0.00 O ATOM 0 H SER A 108 11.234 2.158 -7.525 1.00 0.00 H new ATOM 0 HA SER A 108 10.162 1.707 -10.051 1.00 0.00 H new ATOM 0 HB2 SER A 108 11.511 -0.320 -10.718 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.355 1.203 -10.916 1.00 0.00 H new ATOM 0 HG SER A 108 13.668 -0.399 -9.872 1.00 0.00 H new ATOM 1701 N ILE A 109 9.064 -0.381 -9.125 1.00 0.00 N ATOM 1702 CA ILE A 109 8.247 -1.376 -8.440 1.00 0.00 C ATOM 1703 C ILE A 109 8.928 -2.744 -8.441 1.00 0.00 C ATOM 1704 O ILE A 109 9.816 -2.999 -9.256 1.00 0.00 O ATOM 1705 CB ILE A 109 6.841 -1.494 -9.075 1.00 0.00 C ATOM 1706 CG1 ILE A 109 6.905 -1.510 -10.612 1.00 0.00 C ATOM 1707 CG2 ILE A 109 5.966 -0.344 -8.604 1.00 0.00 C ATOM 1708 CD1 ILE A 109 8.003 -2.384 -11.181 1.00 0.00 C ATOM 0 H ILE A 109 8.775 -0.186 -10.084 1.00 0.00 H new ATOM 0 HA ILE A 109 8.133 -1.038 -7.410 1.00 0.00 H new ATOM 0 HB ILE A 109 6.409 -2.442 -8.754 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.946 -1.853 -11.000 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.047 -0.490 -10.969 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.977 -0.431 -9.054 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.875 -0.377 -7.518 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.418 0.602 -8.902 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.977 -2.338 -12.270 1.00 0.00 H new ATOM 0 HD12 ILE A 109 8.971 -2.030 -10.826 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.852 -3.414 -10.858 1.00 0.00 H new ATOM 1720 N PRO A 110 8.532 -3.649 -7.524 1.00 0.00 N ATOM 1721 CA PRO A 110 7.482 -3.398 -6.528 1.00 0.00 C ATOM 1722 C PRO A 110 7.951 -2.480 -5.402 1.00 0.00 C ATOM 1723 O PRO A 110 9.147 -2.247 -5.232 1.00 0.00 O ATOM 1724 CB PRO A 110 7.161 -4.797 -5.971 1.00 0.00 C ATOM 1725 CG PRO A 110 7.914 -5.762 -6.830 1.00 0.00 C ATOM 1726 CD PRO A 110 9.077 -5.001 -7.392 1.00 0.00 C ATOM 0 HA PRO A 110 6.624 -2.894 -6.972 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.466 -4.882 -4.928 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.090 -4.995 -6.007 1.00 0.00 H new ATOM 0 HG2 PRO A 110 8.254 -6.619 -6.248 1.00 0.00 H new ATOM 0 HG3 PRO A 110 7.280 -6.150 -7.628 1.00 0.00 H new ATOM 0 HD2 PRO A 110 9.940 -5.028 -6.727 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.401 -5.404 -8.351 1.00 0.00 H new ATOM 1734 N THR A 111 6.994 -1.966 -4.635 1.00 0.00 N ATOM 1735 CA THR A 111 7.298 -1.076 -3.520 1.00 0.00 C ATOM 1736 C THR A 111 6.209 -1.162 -2.452 1.00 0.00 C ATOM 1737 O THR A 111 5.058 -1.477 -2.753 1.00 0.00 O ATOM 1738 CB THR A 111 7.440 0.368 -4.009 1.00 0.00 C ATOM 1739 OG1 THR A 111 7.608 0.407 -5.416 1.00 0.00 O ATOM 1740 CG2 THR A 111 8.611 1.098 -3.387 1.00 0.00 C ATOM 0 H THR A 111 6.000 -2.151 -4.766 1.00 0.00 H new ATOM 0 HA THR A 111 8.244 -1.392 -3.081 1.00 0.00 H new ATOM 0 HB THR A 111 6.519 0.867 -3.707 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.563 0.364 -5.633 1.00 0.00 H new ATOM 0 HG21 THR A 111 8.654 2.115 -3.776 1.00 0.00 H new ATOM 0 HG22 THR A 111 8.487 1.129 -2.305 1.00 0.00 H new ATOM 0 HG23 THR A 111 9.536 0.576 -3.631 1.00 0.00 H new ATOM 1748 N LEU A 112 6.577 -0.866 -1.210 1.00 0.00 N ATOM 1749 CA LEU A 112 5.614 -0.900 -0.101 1.00 0.00 C ATOM 1750 C LEU A 112 5.956 0.163 0.940 1.00 0.00 C ATOM 1751 O LEU A 112 7.064 0.183 1.469 1.00 0.00 O ATOM 1752 CB LEU A 112 5.548 -2.306 0.554 1.00 0.00 C ATOM 1753 CG LEU A 112 4.525 -2.479 1.688 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.193 -1.855 1.347 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.333 -3.940 2.035 1.00 0.00 C ATOM 0 H LEU A 112 7.525 -0.601 -0.941 1.00 0.00 H new ATOM 0 HA LEU A 112 4.628 -0.681 -0.512 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.324 -3.036 -0.224 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.536 -2.549 0.944 1.00 0.00 H new ATOM 0 HG LEU A 112 4.931 -1.960 2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.500 -2.001 2.176 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.326 -0.788 1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.790 -2.325 0.450 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.604 -4.030 2.840 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.973 -4.478 1.158 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.283 -4.365 2.357 1.00 0.00 H new ATOM 1767 N ILE A 113 5.000 1.043 1.231 1.00 0.00 N ATOM 1768 CA ILE A 113 5.209 2.103 2.218 1.00 0.00 C ATOM 1769 C ILE A 113 3.991 2.253 3.131 1.00 0.00 C ATOM 1770 O ILE A 113 2.873 1.920 2.742 1.00 0.00 O ATOM 1771 CB ILE A 113 5.509 3.457 1.537 1.00 0.00 C ATOM 1772 CG1 ILE A 113 6.798 3.360 0.715 1.00 0.00 C ATOM 1773 CG2 ILE A 113 5.618 4.564 2.579 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.279 4.690 0.171 1.00 0.00 C ATOM 0 H ILE A 113 4.076 1.044 0.800 1.00 0.00 H new ATOM 0 HA ILE A 113 6.072 1.813 2.818 1.00 0.00 H new ATOM 0 HB ILE A 113 4.687 3.701 0.865 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.582 2.927 1.336 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.636 2.675 -0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.830 5.511 2.083 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.678 4.643 3.126 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.424 4.331 3.275 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.196 4.540 -0.399 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.514 5.116 -0.478 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.474 5.372 0.998 1.00 0.00 H new ATOM 1786 N GLY A 114 4.215 2.758 4.347 1.00 0.00 N ATOM 1787 CA GLY A 114 3.123 2.943 5.290 1.00 0.00 C ATOM 1788 C GLY A 114 2.898 4.401 5.646 1.00 0.00 C ATOM 1789 O GLY A 114 3.848 5.137 5.906 1.00 0.00 O ATOM 0 H GLY A 114 5.132 3.041 4.693 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.208 2.531 4.865 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.334 2.380 6.199 1.00 0.00 H new ATOM 1793 N VAL A 115 1.633 4.817 5.663 1.00 0.00 N ATOM 1794 CA VAL A 115 1.281 6.186 5.996 1.00 0.00 C ATOM 1795 C VAL A 115 0.133 6.222 6.997 1.00 0.00 C ATOM 1796 O VAL A 115 -0.671 5.294 7.072 1.00 0.00 O ATOM 1797 CB VAL A 115 0.892 6.996 4.741 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.956 6.854 3.664 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.470 6.565 4.212 1.00 0.00 C ATOM 0 H VAL A 115 0.835 4.219 5.448 1.00 0.00 H new ATOM 0 HA VAL A 115 2.165 6.642 6.442 1.00 0.00 H new ATOM 0 HB VAL A 115 0.825 8.047 5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.665 7.432 2.787 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.909 7.224 4.043 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.058 5.804 3.390 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.719 7.152 3.328 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.440 5.508 3.949 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.226 6.727 4.980 1.00 0.00 H new ATOM 1809 N ASP A 116 0.066 7.301 7.755 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.981 7.473 8.756 1.00 0.00 C ATOM 1811 C ASP A 116 -2.206 8.152 8.151 1.00 0.00 C ATOM 1812 O ASP A 116 -2.099 9.212 7.535 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.457 8.294 9.936 1.00 0.00 C ATOM 1814 CG ASP A 116 -0.269 7.457 11.186 1.00 0.00 C ATOM 1815 OD1 ASP A 116 -0.990 6.448 11.339 1.00 0.00 O ATOM 1816 OD2 ASP A 116 0.600 7.808 12.012 1.00 0.00 O ATOM 0 H ASP A 116 0.726 8.077 7.699 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.275 6.486 9.112 1.00 0.00 H new ATOM 0 HB2 ASP A 116 0.494 8.752 9.663 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -1.153 9.106 10.147 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.368 7.532 8.328 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.613 8.077 7.799 1.00 0.00 C ATOM 1823 C ALA A 117 -5.024 9.340 8.550 1.00 0.00 C ATOM 1824 O ALA A 117 -5.341 10.362 7.941 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.720 7.034 7.872 1.00 0.00 C ATOM 0 H ALA A 117 -3.474 6.652 8.833 1.00 0.00 H new ATOM 0 HA ALA A 117 -4.448 8.344 6.755 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.643 7.455 7.474 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.436 6.161 7.285 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.874 6.739 8.910 1.00 0.00 H new ATOM 1831 N ASP A 118 -5.019 9.261 9.877 1.00 0.00 N ATOM 1832 CA ASP A 118 -5.394 10.397 10.712 1.00 0.00 C ATOM 1833 C ASP A 118 -4.257 11.410 10.801 1.00 0.00 C ATOM 1834 O ASP A 118 -4.457 12.602 10.565 1.00 0.00 O ATOM 1835 CB ASP A 118 -5.776 9.919 12.114 1.00 0.00 C ATOM 1836 CG ASP A 118 -6.882 10.756 12.728 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -7.048 11.921 12.307 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -7.580 10.247 13.630 1.00 0.00 O ATOM 0 H ASP A 118 -4.760 8.423 10.397 1.00 0.00 H new ATOM 0 HA ASP A 118 -6.254 10.885 10.252 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -6.096 8.878 12.066 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.898 9.953 12.759 1.00 0.00 H new ATOM 1843 N SER A 119 -3.066 10.930 11.145 1.00 0.00 N ATOM 1844 CA SER A 119 -1.899 11.797 11.266 1.00 0.00 C ATOM 1845 C SER A 119 -1.610 12.512 9.950 1.00 0.00 C ATOM 1846 O SER A 119 -1.328 13.711 9.933 1.00 0.00 O ATOM 1847 CB SER A 119 -0.677 10.985 11.698 1.00 0.00 C ATOM 1848 OG SER A 119 -1.064 9.814 12.398 1.00 0.00 O ATOM 0 H SER A 119 -2.884 9.946 11.345 1.00 0.00 H new ATOM 0 HA SER A 119 -2.115 12.549 12.025 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.090 10.711 10.821 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.036 11.597 12.333 1.00 0.00 H new ATOM 0 HG SER A 119 -0.276 9.255 12.562 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.681 11.770 8.850 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.423 12.352 7.546 1.00 0.00 C ATOM 1856 C GLY A 120 0.043 12.296 7.164 1.00 0.00 C ATOM 1857 O GLY A 120 0.390 11.846 6.071 1.00 0.00 O ATOM 0 H GLY A 120 -1.912 10.777 8.838 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.011 11.826 6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.756 13.390 7.543 1.00 0.00 H new ATOM 1861 N ASP A 121 0.906 12.756 8.064 1.00 0.00 N ATOM 1862 CA ASP A 121 2.343 12.758 7.815 1.00 0.00 C ATOM 1863 C ASP A 121 2.849 11.349 7.521 1.00 0.00 C ATOM 1864 O ASP A 121 2.284 10.364 7.997 1.00 0.00 O ATOM 1865 CB ASP A 121 3.089 13.337 9.019 1.00 0.00 C ATOM 1866 CG ASP A 121 2.486 14.642 9.499 1.00 0.00 C ATOM 1867 OD1 ASP A 121 1.809 15.316 8.694 1.00 0.00 O ATOM 1868 OD2 ASP A 121 2.689 14.992 10.682 1.00 0.00 O ATOM 0 H ASP A 121 0.635 13.132 8.973 1.00 0.00 H new ATOM 0 HA ASP A 121 2.533 13.382 6.942 1.00 0.00 H new ATOM 0 HB2 ASP A 121 3.076 12.613 9.833 1.00 0.00 H new ATOM 0 HB3 ASP A 121 4.133 13.499 8.752 1.00 0.00 H new ATOM 1873 N VAL A 122 3.915 11.262 6.732 1.00 0.00 N ATOM 1874 CA VAL A 122 4.497 9.975 6.374 1.00 0.00 C ATOM 1875 C VAL A 122 5.059 9.265 7.601 1.00 0.00 C ATOM 1876 O VAL A 122 5.893 9.815 8.321 1.00 0.00 O ATOM 1877 CB VAL A 122 5.619 10.139 5.330 1.00 0.00 C ATOM 1878 CG1 VAL A 122 6.104 8.781 4.850 1.00 0.00 C ATOM 1879 CG2 VAL A 122 5.142 10.989 4.160 1.00 0.00 C ATOM 0 H VAL A 122 4.393 12.068 6.329 1.00 0.00 H new ATOM 0 HA VAL A 122 3.696 9.373 5.945 1.00 0.00 H new ATOM 0 HB VAL A 122 6.457 10.652 5.802 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.896 8.917 4.113 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.489 8.212 5.696 1.00 0.00 H new ATOM 0 HG13 VAL A 122 5.275 8.238 4.395 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.948 11.093 3.434 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.286 10.508 3.686 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.850 11.975 4.522 1.00 0.00 H new ATOM 1889 N VAL A 123 4.595 8.043 7.834 1.00 0.00 N ATOM 1890 CA VAL A 123 5.049 7.257 8.974 1.00 0.00 C ATOM 1891 C VAL A 123 6.189 6.325 8.581 1.00 0.00 C ATOM 1892 O VAL A 123 7.123 6.111 9.352 1.00 0.00 O ATOM 1893 CB VAL A 123 3.902 6.424 9.576 1.00 0.00 C ATOM 1894 CG1 VAL A 123 4.353 5.736 10.855 1.00 0.00 C ATOM 1895 CG2 VAL A 123 2.685 7.298 9.833 1.00 0.00 C ATOM 0 H VAL A 123 3.904 7.575 7.248 1.00 0.00 H new ATOM 0 HA VAL A 123 5.405 7.964 9.723 1.00 0.00 H new ATOM 0 HB VAL A 123 3.622 5.654 8.857 1.00 0.00 H new ATOM 0 HG11 VAL A 123 3.528 5.153 11.265 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.192 5.075 10.636 1.00 0.00 H new ATOM 0 HG13 VAL A 123 4.663 6.487 11.582 1.00 0.00 H new ATOM 0 HG21 VAL A 123 1.885 6.692 10.258 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.949 8.093 10.531 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.348 7.737 8.894 1.00 0.00 H new ATOM 1905 N THR A 124 6.107 5.775 7.375 1.00 0.00 N ATOM 1906 CA THR A 124 7.133 4.868 6.879 1.00 0.00 C ATOM 1907 C THR A 124 7.453 5.172 5.417 1.00 0.00 C ATOM 1908 O THR A 124 6.693 5.863 4.738 1.00 0.00 O ATOM 1909 CB THR A 124 6.686 3.402 7.034 1.00 0.00 C ATOM 1910 OG1 THR A 124 6.377 2.827 5.775 1.00 0.00 O ATOM 1911 CG2 THR A 124 5.471 3.223 7.923 1.00 0.00 C ATOM 0 H THR A 124 5.340 5.942 6.723 1.00 0.00 H new ATOM 0 HA THR A 124 8.035 5.017 7.472 1.00 0.00 H new ATOM 0 HB THR A 124 7.535 2.904 7.502 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.098 1.896 5.900 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.217 2.165 7.983 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.692 3.601 8.921 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.629 3.775 7.504 1.00 0.00 H new ATOM 1919 N THR A 125 8.582 4.657 4.943 1.00 0.00 N ATOM 1920 CA THR A 125 9.004 4.872 3.564 1.00 0.00 C ATOM 1921 C THR A 125 9.911 3.741 3.094 1.00 0.00 C ATOM 1922 O THR A 125 10.896 3.967 2.392 1.00 0.00 O ATOM 1923 CB THR A 125 9.719 6.215 3.434 1.00 0.00 C ATOM 1924 OG1 THR A 125 10.751 6.331 4.397 1.00 0.00 O ATOM 1925 CG2 THR A 125 8.788 7.394 3.610 1.00 0.00 C ATOM 0 H THR A 125 9.223 4.086 5.495 1.00 0.00 H new ATOM 0 HA THR A 125 8.117 4.884 2.931 1.00 0.00 H new ATOM 0 HB THR A 125 10.126 6.236 2.423 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.197 7.198 4.295 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.352 8.321 3.507 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.007 7.358 2.850 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.333 7.354 4.600 1.00 0.00 H new ATOM 1933 N ARG A 126 9.563 2.523 3.490 1.00 0.00 N ATOM 1934 CA ARG A 126 10.330 1.340 3.121 1.00 0.00 C ATOM 1935 C ARG A 126 9.684 0.093 3.712 1.00 0.00 C ATOM 1936 O ARG A 126 10.351 -0.731 4.340 1.00 0.00 O ATOM 1937 CB ARG A 126 11.776 1.465 3.606 1.00 0.00 C ATOM 1938 CG ARG A 126 11.897 1.721 5.100 1.00 0.00 C ATOM 1939 CD ARG A 126 12.376 3.136 5.390 1.00 0.00 C ATOM 1940 NE ARG A 126 13.790 3.314 5.062 1.00 0.00 N ATOM 1941 CZ ARG A 126 14.233 3.877 3.938 1.00 0.00 C ATOM 1942 NH1 ARG A 126 13.382 4.325 3.022 1.00 0.00 N ATOM 1943 NH2 ARG A 126 15.537 3.994 3.729 1.00 0.00 N ATOM 0 H ARG A 126 8.748 2.328 4.071 1.00 0.00 H new ATOM 0 HA ARG A 126 10.336 1.255 2.034 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.314 0.550 3.358 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.263 2.277 3.066 1.00 0.00 H new ATOM 0 HG2 ARG A 126 10.930 1.559 5.577 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.592 1.004 5.537 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.779 3.845 4.817 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.217 3.364 6.444 1.00 0.00 H new ATOM 0 HE ARG A 126 14.481 2.986 5.737 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.377 4.240 3.175 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.733 4.754 2.166 1.00 0.00 H new ATOM 0 HH21 ARG A 126 16.198 3.654 4.427 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.879 4.424 2.870 1.00 0.00 H new ATOM 1957 N ALA A 127 8.377 -0.034 3.510 1.00 0.00 N ATOM 1958 CA ALA A 127 7.629 -1.171 4.023 1.00 0.00 C ATOM 1959 C ALA A 127 7.924 -2.441 3.234 1.00 0.00 C ATOM 1960 O ALA A 127 7.501 -3.530 3.620 1.00 0.00 O ATOM 1961 CB ALA A 127 6.133 -0.868 4.018 1.00 0.00 C ATOM 0 H ALA A 127 7.814 0.641 2.992 1.00 0.00 H new ATOM 0 HA ALA A 127 7.949 -1.344 5.051 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.586 -1.728 4.405 1.00 0.00 H new ATOM 0 HB2 ALA A 127 5.935 0.000 4.647 1.00 0.00 H new ATOM 0 HB3 ALA A 127 5.807 -0.659 2.999 1.00 0.00 H new ATOM 1967 N ARG A 128 8.661 -2.304 2.138 1.00 0.00 N ATOM 1968 CA ARG A 128 9.014 -3.455 1.324 1.00 0.00 C ATOM 1969 C ARG A 128 10.226 -4.162 1.916 1.00 0.00 C ATOM 1970 O ARG A 128 10.285 -5.388 1.948 1.00 0.00 O ATOM 1971 CB ARG A 128 9.297 -3.029 -0.120 1.00 0.00 C ATOM 1972 CG ARG A 128 10.239 -1.839 -0.241 1.00 0.00 C ATOM 1973 CD ARG A 128 11.466 -2.179 -1.072 1.00 0.00 C ATOM 1974 NE ARG A 128 11.863 -1.073 -1.940 1.00 0.00 N ATOM 1975 CZ ARG A 128 12.736 -1.188 -2.938 1.00 0.00 C ATOM 1976 NH1 ARG A 128 13.305 -2.360 -3.198 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.041 -0.132 -3.679 1.00 0.00 N ATOM 0 H ARG A 128 9.022 -1.413 1.796 1.00 0.00 H new ATOM 0 HA ARG A 128 8.172 -4.147 1.317 1.00 0.00 H new ATOM 0 HB2 ARG A 128 9.724 -3.874 -0.660 1.00 0.00 H new ATOM 0 HB3 ARG A 128 8.353 -2.783 -0.607 1.00 0.00 H new ATOM 0 HG2 ARG A 128 9.711 -1.001 -0.696 1.00 0.00 H new ATOM 0 HG3 ARG A 128 10.550 -1.518 0.753 1.00 0.00 H new ATOM 0 HD2 ARG A 128 12.293 -2.435 -0.410 1.00 0.00 H new ATOM 0 HD3 ARG A 128 11.260 -3.060 -1.679 1.00 0.00 H new ATOM 0 HE ARG A 128 11.446 -0.158 -1.771 1.00 0.00 H new ATOM 0 HH11 ARG A 128 13.073 -3.176 -2.632 1.00 0.00 H new ATOM 0 HH12 ARG A 128 13.974 -2.444 -3.964 1.00 0.00 H new ATOM 0 HH21 ARG A 128 12.606 0.770 -3.485 1.00 0.00 H new ATOM 0 HH22 ARG A 128 13.710 -0.222 -4.444 1.00 0.00 H new ATOM 1991 N ALA A 129 11.187 -3.374 2.385 1.00 0.00 N ATOM 1992 CA ALA A 129 12.405 -3.903 2.985 1.00 0.00 C ATOM 1993 C ALA A 129 12.229 -4.215 4.470 1.00 0.00 C ATOM 1994 O ALA A 129 12.789 -5.184 4.982 1.00 0.00 O ATOM 1995 CB ALA A 129 13.538 -2.907 2.803 1.00 0.00 C ATOM 0 H ALA A 129 11.144 -2.355 2.360 1.00 0.00 H new ATOM 0 HA ALA A 129 12.641 -4.839 2.479 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.448 -3.305 3.253 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.704 -2.735 1.740 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.276 -1.966 3.286 1.00 0.00 H new ATOM 2001 N THR A 130 11.483 -3.362 5.163 1.00 0.00 N ATOM 2002 CA THR A 130 11.263 -3.498 6.584 1.00 0.00 C ATOM 2003 C THR A 130 10.434 -4.716 6.941 1.00 0.00 C ATOM 2004 O THR A 130 10.815 -5.496 7.811 1.00 0.00 O ATOM 2005 CB THR A 130 10.612 -2.227 7.100 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.359 -2.015 6.481 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.458 -0.992 6.868 1.00 0.00 C ATOM 0 H THR A 130 11.016 -2.557 4.747 1.00 0.00 H new ATOM 0 HA THR A 130 12.230 -3.648 7.064 1.00 0.00 H new ATOM 0 HB THR A 130 10.496 -2.375 8.174 1.00 0.00 H new ATOM 0 HG1 THR A 130 8.658 -1.984 7.165 1.00 0.00 H new ATOM 0 HG21 THR A 130 10.939 -0.117 7.258 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.414 -1.105 7.379 1.00 0.00 H new ATOM 0 HG23 THR A 130 11.631 -0.865 5.799 1.00 0.00 H new ATOM 2015 N LEU A 131 9.304 -4.883 6.286 1.00 0.00 N ATOM 2016 CA LEU A 131 8.446 -6.016 6.573 1.00 0.00 C ATOM 2017 C LEU A 131 9.218 -7.331 6.490 1.00 0.00 C ATOM 2018 O LEU A 131 8.942 -8.268 7.240 1.00 0.00 O ATOM 2019 CB LEU A 131 7.267 -6.043 5.607 1.00 0.00 C ATOM 2020 CG LEU A 131 6.123 -6.963 6.025 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.784 -6.286 5.791 1.00 0.00 C ATOM 2022 CD2 LEU A 131 6.205 -8.282 5.271 1.00 0.00 C ATOM 0 H LEU A 131 8.960 -4.256 5.558 1.00 0.00 H new ATOM 0 HA LEU A 131 8.074 -5.904 7.591 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.880 -5.030 5.499 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.625 -6.354 4.626 1.00 0.00 H new ATOM 0 HG LEU A 131 6.213 -7.173 7.091 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.980 -6.956 6.094 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.733 -5.369 6.377 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.677 -6.047 4.733 1.00 0.00 H new ATOM 0 HD21 LEU A 131 5.383 -8.929 5.579 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.137 -8.093 4.200 1.00 0.00 H new ATOM 0 HD23 LEU A 131 7.154 -8.770 5.494 1.00 0.00 H new ATOM 2034 N VAL A 132 10.184 -7.398 5.578 1.00 0.00 N ATOM 2035 CA VAL A 132 10.986 -8.596 5.408 1.00 0.00 C ATOM 2036 C VAL A 132 12.222 -8.562 6.296 1.00 0.00 C ATOM 2037 O VAL A 132 12.629 -9.576 6.862 1.00 0.00 O ATOM 2038 CB VAL A 132 11.429 -8.786 3.943 1.00 0.00 C ATOM 2039 CG1 VAL A 132 11.064 -10.175 3.440 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.847 -7.718 3.033 1.00 0.00 C ATOM 0 H VAL A 132 10.427 -6.634 4.947 1.00 0.00 H new ATOM 0 HA VAL A 132 10.353 -9.435 5.697 1.00 0.00 H new ATOM 0 HB VAL A 132 12.514 -8.683 3.919 1.00 0.00 H new ATOM 0 HG11 VAL A 132 11.387 -10.284 2.405 1.00 0.00 H new ATOM 0 HG12 VAL A 132 11.559 -10.926 4.055 1.00 0.00 H new ATOM 0 HG13 VAL A 132 9.984 -10.311 3.499 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.184 -7.888 2.010 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.759 -7.763 3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.181 -6.735 3.366 1.00 0.00 H new ATOM 2050 N LYS A 133 12.832 -7.384 6.377 1.00 0.00 N ATOM 2051 CA LYS A 133 14.048 -7.193 7.152 1.00 0.00 C ATOM 2052 C LYS A 133 13.751 -6.652 8.549 1.00 0.00 C ATOM 2053 O LYS A 133 14.611 -6.050 9.194 1.00 0.00 O ATOM 2054 CB LYS A 133 14.975 -6.251 6.386 1.00 0.00 C ATOM 2055 CG LYS A 133 15.190 -6.667 4.938 1.00 0.00 C ATOM 2056 CD LYS A 133 16.006 -5.636 4.176 1.00 0.00 C ATOM 2057 CE LYS A 133 15.658 -5.633 2.697 1.00 0.00 C ATOM 2058 NZ LYS A 133 16.326 -6.747 1.968 1.00 0.00 N ATOM 0 H LYS A 133 12.498 -6.541 5.910 1.00 0.00 H new ATOM 0 HA LYS A 133 14.535 -8.158 7.289 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.559 -5.244 6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 133 15.939 -6.210 6.892 1.00 0.00 H new ATOM 0 HG2 LYS A 133 15.699 -7.630 4.907 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.225 -6.801 4.450 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.826 -4.646 4.595 1.00 0.00 H new ATOM 0 HD3 LYS A 133 17.068 -5.847 4.301 1.00 0.00 H new ATOM 0 HE2 LYS A 133 14.578 -5.717 2.578 1.00 0.00 H new ATOM 0 HE3 LYS A 133 15.954 -4.681 2.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 16.063 -6.711 0.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 17.358 -6.653 2.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 16.024 -7.657 2.372 1.00 0.00 H new ATOM 2072 N ASP A 134 12.531 -6.889 9.011 1.00 0.00 N ATOM 2073 CA ASP A 134 12.095 -6.453 10.336 1.00 0.00 C ATOM 2074 C ASP A 134 10.923 -7.312 10.805 1.00 0.00 C ATOM 2075 O ASP A 134 9.787 -6.845 10.886 1.00 0.00 O ATOM 2076 CB ASP A 134 11.702 -4.970 10.319 1.00 0.00 C ATOM 2077 CG ASP A 134 12.339 -4.193 11.454 1.00 0.00 C ATOM 2078 OD1 ASP A 134 12.734 -4.824 12.459 1.00 0.00 O ATOM 2079 OD2 ASP A 134 12.445 -2.954 11.340 1.00 0.00 O ATOM 0 H ASP A 134 11.815 -7.387 8.482 1.00 0.00 H new ATOM 0 HA ASP A 134 12.924 -6.574 11.034 1.00 0.00 H new ATOM 0 HB2 ASP A 134 11.999 -4.529 9.368 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.618 -4.883 10.386 1.00 0.00 H new ATOM 2084 N PRO A 135 11.188 -8.598 11.107 1.00 0.00 N ATOM 2085 CA PRO A 135 10.159 -9.541 11.551 1.00 0.00 C ATOM 2086 C PRO A 135 9.814 -9.411 13.033 1.00 0.00 C ATOM 2087 O PRO A 135 9.144 -10.278 13.595 1.00 0.00 O ATOM 2088 CB PRO A 135 10.802 -10.896 11.273 1.00 0.00 C ATOM 2089 CG PRO A 135 12.262 -10.659 11.452 1.00 0.00 C ATOM 2090 CD PRO A 135 12.516 -9.237 11.018 1.00 0.00 C ATOM 0 HA PRO A 135 9.211 -9.373 11.039 1.00 0.00 H new ATOM 0 HB2 PRO A 135 10.436 -11.658 11.961 1.00 0.00 H new ATOM 0 HB3 PRO A 135 10.577 -11.243 10.265 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.555 -10.807 12.491 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.846 -11.358 10.854 1.00 0.00 H new ATOM 0 HD2 PRO A 135 13.241 -8.745 11.666 1.00 0.00 H new ATOM 0 HD3 PRO A 135 12.914 -9.193 10.004 1.00 0.00 H new ATOM 2098 N GLU A 136 10.261 -8.330 13.665 1.00 0.00 N ATOM 2099 CA GLU A 136 9.977 -8.108 15.074 1.00 0.00 C ATOM 2100 C GLU A 136 8.907 -7.036 15.233 1.00 0.00 C ATOM 2101 O GLU A 136 8.220 -6.976 16.252 1.00 0.00 O ATOM 2102 CB GLU A 136 11.248 -7.693 15.817 1.00 0.00 C ATOM 2103 CG GLU A 136 12.432 -8.609 15.555 1.00 0.00 C ATOM 2104 CD GLU A 136 13.760 -7.953 15.883 1.00 0.00 C ATOM 2105 OE1 GLU A 136 13.923 -7.484 17.029 1.00 0.00 O ATOM 2106 OE2 GLU A 136 14.634 -7.907 14.993 1.00 0.00 O ATOM 0 H GLU A 136 10.819 -7.599 13.224 1.00 0.00 H new ATOM 0 HA GLU A 136 9.610 -9.040 15.503 1.00 0.00 H new ATOM 0 HB2 GLU A 136 11.514 -6.677 15.526 1.00 0.00 H new ATOM 0 HB3 GLU A 136 11.043 -7.674 16.887 1.00 0.00 H new ATOM 0 HG2 GLU A 136 12.323 -9.517 16.148 1.00 0.00 H new ATOM 0 HG3 GLU A 136 12.429 -8.911 14.508 1.00 0.00 H new ATOM 2113 N GLY A 137 8.777 -6.185 14.217 1.00 0.00 N ATOM 2114 CA GLY A 137 7.795 -5.121 14.267 1.00 0.00 C ATOM 2115 C GLY A 137 7.984 -4.230 15.479 1.00 0.00 C ATOM 2116 O GLY A 137 7.062 -3.527 15.890 1.00 0.00 O ATOM 0 H GLY A 137 9.334 -6.216 13.363 1.00 0.00 H new ATOM 0 HA2 GLY A 137 7.865 -4.520 13.361 1.00 0.00 H new ATOM 0 HA3 GLY A 137 6.794 -5.552 14.287 1.00 0.00 H new ATOM 2120 N GLU A 138 9.184 -4.265 16.055 1.00 0.00 N ATOM 2121 CA GLU A 138 9.484 -3.454 17.232 1.00 0.00 C ATOM 2122 C GLU A 138 9.464 -1.962 16.899 1.00 0.00 C ATOM 2123 O GLU A 138 9.415 -1.120 17.795 1.00 0.00 O ATOM 2124 CB GLU A 138 10.837 -3.854 17.838 1.00 0.00 C ATOM 2125 CG GLU A 138 12.043 -3.498 16.980 1.00 0.00 C ATOM 2126 CD GLU A 138 13.182 -4.487 17.140 1.00 0.00 C ATOM 2127 OE1 GLU A 138 13.564 -4.770 18.295 1.00 0.00 O ATOM 2128 OE2 GLU A 138 13.691 -4.977 16.111 1.00 0.00 O ATOM 0 H GLU A 138 9.959 -4.842 15.728 1.00 0.00 H new ATOM 0 HA GLU A 138 8.705 -3.642 17.971 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.943 -3.371 18.809 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.838 -4.930 18.015 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.742 -3.462 15.933 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.392 -2.500 17.246 1.00 0.00 H new ATOM 2135 N GLN A 139 9.491 -1.640 15.607 1.00 0.00 N ATOM 2136 CA GLN A 139 9.466 -0.257 15.156 1.00 0.00 C ATOM 2137 C GLN A 139 8.494 -0.101 13.992 1.00 0.00 C ATOM 2138 O GLN A 139 8.603 0.841 13.219 1.00 0.00 O ATOM 2139 CB GLN A 139 10.859 0.177 14.699 1.00 0.00 C ATOM 2140 CG GLN A 139 12.007 -0.574 15.358 1.00 0.00 C ATOM 2141 CD GLN A 139 13.169 0.333 15.712 1.00 0.00 C ATOM 2142 OE1 GLN A 139 13.335 1.406 15.131 1.00 0.00 O ATOM 2143 NE2 GLN A 139 13.984 -0.094 16.671 1.00 0.00 N ATOM 0 H GLN A 139 9.530 -2.326 14.853 1.00 0.00 H new ATOM 0 HA GLN A 139 9.144 0.368 15.989 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.929 0.046 13.619 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.977 1.242 14.899 1.00 0.00 H new ATOM 0 HG2 GLN A 139 11.645 -1.064 16.262 1.00 0.00 H new ATOM 0 HG3 GLN A 139 12.355 -1.360 14.687 1.00 0.00 H new ATOM 0 HE21 GLN A 139 13.810 -0.990 17.127 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.783 0.474 16.951 1.00 0.00 H new ATOM 2152 N PHE A 140 7.574 -1.059 13.863 1.00 0.00 N ATOM 2153 CA PHE A 140 6.582 -1.089 12.773 1.00 0.00 C ATOM 2154 C PHE A 140 6.368 0.253 12.085 1.00 0.00 C ATOM 2155 O PHE A 140 6.558 0.348 10.875 1.00 0.00 O ATOM 2156 CB PHE A 140 5.256 -1.711 13.237 1.00 0.00 C ATOM 2157 CG PHE A 140 4.017 -1.030 12.712 1.00 0.00 C ATOM 2158 CD1 PHE A 140 3.835 -0.833 11.353 1.00 0.00 C ATOM 2159 CD2 PHE A 140 3.037 -0.585 13.587 1.00 0.00 C ATOM 2160 CE1 PHE A 140 2.702 -0.205 10.876 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.900 0.043 13.113 1.00 0.00 C ATOM 2162 CZ PHE A 140 1.733 0.234 11.756 1.00 0.00 C ATOM 0 H PHE A 140 7.491 -1.842 14.512 1.00 0.00 H new ATOM 0 HA PHE A 140 7.012 -1.734 12.007 1.00 0.00 H new ATOM 0 HB2 PHE A 140 5.235 -2.757 12.931 1.00 0.00 H new ATOM 0 HB3 PHE A 140 5.227 -1.697 14.327 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.588 -1.175 10.659 1.00 0.00 H new ATOM 0 HD2 PHE A 140 3.163 -0.731 14.650 1.00 0.00 H new ATOM 0 HE1 PHE A 140 2.574 -0.057 9.814 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.143 0.384 13.804 1.00 0.00 H new ATOM 0 HZ PHE A 140 0.846 0.726 11.384 1.00 0.00 H new ATOM 2172 N PRO A 141 5.990 1.316 12.799 1.00 0.00 N ATOM 2173 CA PRO A 141 5.803 2.615 12.157 1.00 0.00 C ATOM 2174 C PRO A 141 7.102 3.112 11.512 1.00 0.00 C ATOM 2175 O PRO A 141 7.171 4.250 11.049 1.00 0.00 O ATOM 2176 CB PRO A 141 5.370 3.535 13.300 1.00 0.00 C ATOM 2177 CG PRO A 141 5.788 2.833 14.551 1.00 0.00 C ATOM 2178 CD PRO A 141 5.730 1.362 14.246 1.00 0.00 C ATOM 0 HA PRO A 141 5.073 2.577 11.349 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.846 4.512 13.220 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.293 3.702 13.284 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.794 3.130 14.846 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.125 3.085 15.379 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.478 0.803 14.809 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.758 0.936 14.496 1.00 0.00 H new ATOM 2186 N TRP A 142 8.121 2.230 11.490 1.00 0.00 N ATOM 2187 CA TRP A 142 9.446 2.509 10.918 1.00 0.00 C ATOM 2188 C TRP A 142 9.592 3.949 10.440 1.00 0.00 C ATOM 2189 O TRP A 142 9.752 4.212 9.248 1.00 0.00 O ATOM 2190 CB TRP A 142 9.740 1.528 9.777 1.00 0.00 C ATOM 2191 CG TRP A 142 9.156 0.162 10.006 1.00 0.00 C ATOM 2192 CD1 TRP A 142 9.356 -0.651 11.090 1.00 0.00 C ATOM 2193 CD2 TRP A 142 8.268 -0.547 9.134 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.634 -1.814 10.947 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.963 -1.775 9.754 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.696 -0.261 7.892 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 7.114 -2.713 9.173 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.854 -1.193 7.317 1.00 0.00 C ATOM 2199 CH2 TRP A 142 6.569 -2.406 7.957 1.00 0.00 C ATOM 0 H TRP A 142 8.041 1.289 11.876 1.00 0.00 H new ATOM 0 HA TRP A 142 10.177 2.372 11.715 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.344 1.934 8.846 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.819 1.439 9.652 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.988 -0.414 11.933 1.00 0.00 H new ATOM 0 HE1 TRP A 142 8.604 -2.580 11.620 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.908 0.672 7.391 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 6.894 -3.649 9.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 6.407 -0.983 6.356 1.00 0.00 H new ATOM 0 HH2 TRP A 142 5.906 -3.113 7.481 1.00 0.00 H new ATOM 2210 N LYS A 143 9.534 4.872 11.389 1.00 0.00 N ATOM 2211 CA LYS A 143 9.658 6.294 11.090 1.00 0.00 C ATOM 2212 C LYS A 143 11.013 6.829 11.541 1.00 0.00 C ATOM 2213 O LYS A 143 11.659 6.250 12.415 1.00 0.00 O ATOM 2214 CB LYS A 143 8.534 7.080 11.772 1.00 0.00 C ATOM 2215 CG LYS A 143 8.600 7.040 13.290 1.00 0.00 C ATOM 2216 CD LYS A 143 7.248 7.344 13.914 1.00 0.00 C ATOM 2217 CE LYS A 143 7.390 7.817 15.351 1.00 0.00 C ATOM 2218 NZ LYS A 143 7.601 6.681 16.292 1.00 0.00 N ATOM 0 H LYS A 143 9.401 4.661 12.378 1.00 0.00 H new ATOM 0 HA LYS A 143 9.578 6.421 10.010 1.00 0.00 H new ATOM 0 HB2 LYS A 143 8.575 8.118 11.442 1.00 0.00 H new ATOM 0 HB3 LYS A 143 7.573 6.680 11.447 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.939 6.056 13.615 1.00 0.00 H new ATOM 0 HG3 LYS A 143 9.336 7.763 13.643 1.00 0.00 H new ATOM 0 HD2 LYS A 143 6.739 8.109 13.327 1.00 0.00 H new ATOM 0 HD3 LYS A 143 6.624 6.451 13.884 1.00 0.00 H new ATOM 0 HE2 LYS A 143 8.229 8.509 15.424 1.00 0.00 H new ATOM 0 HE3 LYS A 143 6.496 8.368 15.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 7.693 7.046 17.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 6.789 6.033 16.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 8.468 6.170 16.031 1.00 0.00 H new