USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 890 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 91 HIS : no HD1:sc=-0.00648 X(o=-0.74,f=-0.82) USER MOD Set 1.2: A 124 SER OG : rot -40:sc= -0.737 USER MOD Set 2.1: A 72 SER OG : rot 95:sc= 0.257 USER MOD Set 2.2: A 103 CYS SG : rot 156:sc= -0.0559 USER MOD Set 3.1: A 64 LYS NZ :NH3+ 158:sc= 0 (180deg=0) USER MOD Set 3.2: A 107 ASN : amide:sc= -0.352 K(o=-0.35,f=1.3) USER MOD Set 4.1: A 53 HIS : no HD1:sc= -1.97 K(o=-0.7,f=-3!) USER MOD Set 4.2: A 71 TYR OH : rot -120:sc= 1.27 USER MOD Set 5.1: A 21 CYS SG : rot -175:sc= -1.64 USER MOD Set 5.2: A 25 MET CE :methyl 146:sc= -3.48 (180deg=-2.49!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -20:sc= 1.08 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.0274 K(o=-0.027,f=-0.66) USER MOD Single : A 38 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.394) USER MOD Single : A 42 LYS NZ :NH3+ -146:sc= -0.238 (180deg=-1.36) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ -155:sc= -0.0379 (180deg=-0.298) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 159:sc= -0.0557 (180deg=-0.364) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -160:sc= -0.062 (180deg=-0.387) USER MOD Single : A 58 ASN : amide:sc= -0.188 K(o=-0.19,f=-1.2!) USER MOD Single : A 63 HIS : no HD1:sc= -0.0356 X(o=-0.036,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot -40:sc= 1.54 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.686 K(o=-0.69,f=-5.5!) USER MOD Single : A 101 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.59) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 13:sc= 0.861 USER MOD Single : A 122 GLN : amide:sc= -0.0294 X(o=-0.029,f=0) USER MOD Single : A 128 THR OG1 : rot -107:sc= 1.32 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 10 1.575 4.886 -4.058 1.00 0.00 N ATOM 94 CA LEU A 10 2.775 4.075 -3.894 1.00 0.00 C ATOM 95 C LEU A 10 3.684 4.193 -5.113 1.00 0.00 C ATOM 96 O LEU A 10 3.381 4.923 -6.057 1.00 0.00 O ATOM 97 CB LEU A 10 2.398 2.610 -3.662 1.00 0.00 C ATOM 98 CG LEU A 10 1.696 2.326 -2.333 1.00 0.00 C ATOM 99 CD1 LEU A 10 1.187 0.894 -2.293 1.00 0.00 C ATOM 100 CD2 LEU A 10 2.638 2.592 -1.167 1.00 0.00 C ATOM 0 HA LEU A 10 3.317 4.445 -3.024 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.749 2.284 -4.475 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.303 2.005 -3.714 1.00 0.00 H new ATOM 0 HG LEU A 10 0.841 2.996 -2.245 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.691 0.711 -1.340 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.479 0.737 -3.107 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.026 0.207 -2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.123 2.385 -0.229 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.512 1.947 -1.251 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.954 3.635 -1.185 1.00 0.00 H new ATOM 112 N ASP A 11 4.800 3.472 -5.086 1.00 0.00 N ATOM 113 CA ASP A 11 5.754 3.498 -6.190 1.00 0.00 C ATOM 114 C ASP A 11 5.602 2.264 -7.073 1.00 0.00 C ATOM 115 O ASP A 11 4.897 1.318 -6.722 1.00 0.00 O ATOM 116 CB ASP A 11 7.184 3.585 -5.652 1.00 0.00 C ATOM 117 CG ASP A 11 8.000 4.652 -6.356 1.00 0.00 C ATOM 118 OD1 ASP A 11 8.263 4.497 -7.566 1.00 0.00 O ATOM 119 OD2 ASP A 11 8.377 5.643 -5.695 1.00 0.00 O ATOM 0 H ASP A 11 5.066 2.863 -4.313 1.00 0.00 H new ATOM 0 HA ASP A 11 5.547 4.380 -6.796 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.155 3.799 -4.584 1.00 0.00 H new ATOM 0 HB3 ASP A 11 7.674 2.619 -5.771 1.00 0.00 H new ATOM 124 N ALA A 12 6.270 2.280 -8.223 1.00 0.00 N ATOM 125 CA ALA A 12 6.212 1.165 -9.158 1.00 0.00 C ATOM 126 C ALA A 12 6.836 -0.091 -8.557 1.00 0.00 C ATOM 127 O ALA A 12 6.298 -1.190 -8.692 1.00 0.00 O ATOM 128 CB ALA A 12 6.910 1.531 -10.459 1.00 0.00 C ATOM 0 H ALA A 12 6.858 3.055 -8.528 1.00 0.00 H new ATOM 0 HA ALA A 12 5.163 0.953 -9.367 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.859 0.688 -11.149 1.00 0.00 H new ATOM 0 HB2 ALA A 12 6.418 2.395 -10.905 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.954 1.772 -10.257 1.00 0.00 H new ATOM 134 N ALA A 13 7.975 0.080 -7.894 1.00 0.00 N ATOM 135 CA ALA A 13 8.673 -1.040 -7.274 1.00 0.00 C ATOM 136 C ALA A 13 7.947 -1.512 -6.018 1.00 0.00 C ATOM 137 O ALA A 13 7.996 -2.692 -5.668 1.00 0.00 O ATOM 138 CB ALA A 13 10.106 -0.650 -6.943 1.00 0.00 C ATOM 0 H ALA A 13 8.434 0.983 -7.772 1.00 0.00 H new ATOM 0 HA ALA A 13 8.688 -1.866 -7.985 1.00 0.00 H new ATOM 0 HB1 ALA A 13 10.616 -1.495 -6.481 1.00 0.00 H new ATOM 0 HB2 ALA A 13 10.627 -0.368 -7.858 1.00 0.00 H new ATOM 0 HB3 ALA A 13 10.103 0.194 -6.253 1.00 0.00 H new ATOM 144 N ALA A 14 7.276 -0.585 -5.343 1.00 0.00 N ATOM 145 CA ALA A 14 6.541 -0.908 -4.126 1.00 0.00 C ATOM 146 C ALA A 14 5.204 -1.567 -4.450 1.00 0.00 C ATOM 147 O ALA A 14 4.758 -2.469 -3.741 1.00 0.00 O ATOM 148 CB ALA A 14 6.324 0.346 -3.294 1.00 0.00 C ATOM 0 H ALA A 14 7.226 0.396 -5.618 1.00 0.00 H new ATOM 0 HA ALA A 14 7.135 -1.617 -3.549 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.774 0.091 -2.388 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.289 0.775 -3.024 1.00 0.00 H new ATOM 0 HB3 ALA A 14 5.753 1.072 -3.873 1.00 0.00 H new ATOM 154 N ALA A 15 4.569 -1.111 -5.525 1.00 0.00 N ATOM 155 CA ALA A 15 3.283 -1.656 -5.942 1.00 0.00 C ATOM 156 C ALA A 15 3.446 -3.046 -6.546 1.00 0.00 C ATOM 157 O ALA A 15 2.553 -3.887 -6.444 1.00 0.00 O ATOM 158 CB ALA A 15 2.611 -0.722 -6.936 1.00 0.00 C ATOM 0 H ALA A 15 4.925 -0.365 -6.123 1.00 0.00 H new ATOM 0 HA ALA A 15 2.650 -1.744 -5.059 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.652 -1.142 -7.239 1.00 0.00 H new ATOM 0 HB2 ALA A 15 2.451 0.250 -6.470 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.248 -0.604 -7.813 1.00 0.00 H new ATOM 164 N LEU A 16 4.592 -3.282 -7.177 1.00 0.00 N ATOM 165 CA LEU A 16 4.871 -4.570 -7.799 1.00 0.00 C ATOM 166 C LEU A 16 4.878 -5.687 -6.760 1.00 0.00 C ATOM 167 O LEU A 16 4.298 -6.752 -6.973 1.00 0.00 O ATOM 168 CB LEU A 16 6.216 -4.527 -8.528 1.00 0.00 C ATOM 169 CG LEU A 16 6.145 -4.091 -9.993 1.00 0.00 C ATOM 170 CD1 LEU A 16 7.542 -3.880 -10.555 1.00 0.00 C ATOM 171 CD2 LEU A 16 5.387 -5.122 -10.817 1.00 0.00 C ATOM 0 H LEU A 16 5.342 -2.597 -7.271 1.00 0.00 H new ATOM 0 HA LEU A 16 4.080 -4.775 -8.521 1.00 0.00 H new ATOM 0 HB2 LEU A 16 6.880 -3.847 -7.994 1.00 0.00 H new ATOM 0 HB3 LEU A 16 6.669 -5.517 -8.481 1.00 0.00 H new ATOM 0 HG LEU A 16 5.608 -3.144 -10.046 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.472 -3.570 -11.598 1.00 0.00 H new ATOM 0 HD12 LEU A 16 8.052 -3.107 -9.980 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.105 -4.811 -10.490 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.345 -4.797 -11.857 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.898 -6.083 -10.757 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.374 -5.225 -10.428 1.00 0.00 H new ATOM 183 N SER A 17 5.538 -5.436 -5.634 1.00 0.00 N ATOM 184 CA SER A 17 5.621 -6.420 -4.561 1.00 0.00 C ATOM 185 C SER A 17 4.232 -6.782 -4.043 1.00 0.00 C ATOM 186 O SER A 17 3.985 -7.919 -3.642 1.00 0.00 O ATOM 187 CB SER A 17 6.481 -5.883 -3.415 1.00 0.00 C ATOM 188 OG SER A 17 7.001 -6.942 -2.628 1.00 0.00 O ATOM 0 H SER A 17 6.023 -4.560 -5.441 1.00 0.00 H new ATOM 0 HA SER A 17 6.084 -7.321 -4.964 1.00 0.00 H new ATOM 0 HB2 SER A 17 7.301 -5.289 -3.819 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.885 -5.219 -2.789 1.00 0.00 H new ATOM 0 HG SER A 17 7.548 -6.573 -1.903 1.00 0.00 H new ATOM 194 N VAL A 18 3.330 -5.806 -4.053 1.00 0.00 N ATOM 195 CA VAL A 18 1.967 -6.020 -3.583 1.00 0.00 C ATOM 196 C VAL A 18 1.219 -6.993 -4.488 1.00 0.00 C ATOM 197 O VAL A 18 0.333 -7.720 -4.037 1.00 0.00 O ATOM 198 CB VAL A 18 1.182 -4.697 -3.514 1.00 0.00 C ATOM 199 CG1 VAL A 18 -0.163 -4.908 -2.837 1.00 0.00 C ATOM 200 CG2 VAL A 18 1.992 -3.634 -2.787 1.00 0.00 C ATOM 0 H VAL A 18 3.519 -4.859 -4.382 1.00 0.00 H new ATOM 0 HA VAL A 18 2.042 -6.443 -2.581 1.00 0.00 H new ATOM 0 HB VAL A 18 0.999 -4.350 -4.531 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.703 -3.962 -2.798 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.745 -5.635 -3.403 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.006 -5.279 -1.824 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.422 -2.706 -2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.207 -3.971 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.928 -3.463 -3.319 1.00 0.00 H new ATOM 210 N ALA A 19 1.579 -7.002 -5.768 1.00 0.00 N ATOM 211 CA ALA A 19 0.941 -7.886 -6.735 1.00 0.00 C ATOM 212 C ALA A 19 1.593 -9.264 -6.738 1.00 0.00 C ATOM 213 O ALA A 19 0.943 -10.268 -7.028 1.00 0.00 O ATOM 214 CB ALA A 19 0.997 -7.271 -8.126 1.00 0.00 C ATOM 0 H ALA A 19 2.309 -6.407 -6.159 1.00 0.00 H new ATOM 0 HA ALA A 19 -0.102 -8.009 -6.443 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.517 -7.941 -8.840 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.477 -6.313 -8.121 1.00 0.00 H new ATOM 0 HB3 ALA A 19 2.037 -7.118 -8.415 1.00 0.00 H new ATOM 220 N GLU A 20 2.880 -9.306 -6.412 1.00 0.00 N ATOM 221 CA GLU A 20 3.620 -10.563 -6.378 1.00 0.00 C ATOM 222 C GLU A 20 3.377 -11.305 -5.068 1.00 0.00 C ATOM 223 O GLU A 20 3.402 -12.535 -5.025 1.00 0.00 O ATOM 224 CB GLU A 20 5.116 -10.303 -6.561 1.00 0.00 C ATOM 225 CG GLU A 20 5.464 -9.662 -7.894 1.00 0.00 C ATOM 226 CD GLU A 20 5.253 -10.600 -9.066 1.00 0.00 C ATOM 227 OE1 GLU A 20 4.114 -10.665 -9.577 1.00 0.00 O ATOM 228 OE2 GLU A 20 6.226 -11.271 -9.472 1.00 0.00 O ATOM 0 H GLU A 20 3.433 -8.484 -6.167 1.00 0.00 H new ATOM 0 HA GLU A 20 3.263 -11.187 -7.198 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.465 -9.658 -5.755 1.00 0.00 H new ATOM 0 HB3 GLU A 20 5.654 -11.247 -6.470 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.854 -8.769 -8.034 1.00 0.00 H new ATOM 0 HG3 GLU A 20 6.504 -9.338 -7.876 1.00 0.00 H new ATOM 235 N CYS A 21 3.143 -10.549 -3.999 1.00 0.00 N ATOM 236 CA CYS A 21 2.898 -11.137 -2.687 1.00 0.00 C ATOM 237 C CYS A 21 1.466 -11.648 -2.577 1.00 0.00 C ATOM 238 O CYS A 21 1.225 -12.747 -2.077 1.00 0.00 O ATOM 239 CB CYS A 21 3.170 -10.110 -1.586 1.00 0.00 C ATOM 240 SG CYS A 21 3.832 -10.820 -0.061 1.00 0.00 S ATOM 0 H CYS A 21 3.118 -9.529 -4.016 1.00 0.00 H new ATOM 0 HA CYS A 21 3.576 -11.981 -2.564 1.00 0.00 H new ATOM 0 HB2 CYS A 21 3.873 -9.367 -1.963 1.00 0.00 H new ATOM 0 HB3 CYS A 21 2.243 -9.585 -1.357 1.00 0.00 H new ATOM 0 HG CYS A 21 3.931 -9.891 0.843 1.00 0.00 H new ATOM 246 N VAL A 22 0.517 -10.845 -3.046 1.00 0.00 N ATOM 247 CA VAL A 22 -0.893 -11.216 -3.000 1.00 0.00 C ATOM 248 C VAL A 22 -1.144 -12.523 -3.748 1.00 0.00 C ATOM 249 O VAL A 22 -2.038 -13.290 -3.392 1.00 0.00 O ATOM 250 CB VAL A 22 -1.783 -10.108 -3.601 1.00 0.00 C ATOM 251 CG1 VAL A 22 -1.449 -9.885 -5.068 1.00 0.00 C ATOM 252 CG2 VAL A 22 -3.256 -10.449 -3.424 1.00 0.00 C ATOM 0 H VAL A 22 0.699 -9.932 -3.463 1.00 0.00 H new ATOM 0 HA VAL A 22 -1.153 -11.350 -1.950 1.00 0.00 H new ATOM 0 HB VAL A 22 -1.583 -9.180 -3.066 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.088 -9.100 -5.471 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.405 -9.587 -5.162 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -1.614 -10.808 -5.623 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.867 -9.656 -3.854 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.475 -11.390 -3.929 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -3.482 -10.546 -2.362 1.00 0.00 H new ATOM 262 N GLU A 23 -0.350 -12.769 -4.785 1.00 0.00 N ATOM 263 CA GLU A 23 -0.487 -13.981 -5.582 1.00 0.00 C ATOM 264 C GLU A 23 0.184 -15.169 -4.899 1.00 0.00 C ATOM 265 O GLU A 23 -0.188 -16.320 -5.127 1.00 0.00 O ATOM 266 CB GLU A 23 0.116 -13.772 -6.973 1.00 0.00 C ATOM 267 CG GLU A 23 -0.854 -13.161 -7.971 1.00 0.00 C ATOM 268 CD GLU A 23 -0.148 -12.480 -9.127 1.00 0.00 C ATOM 269 OE1 GLU A 23 0.865 -13.026 -9.610 1.00 0.00 O ATOM 270 OE2 GLU A 23 -0.610 -11.399 -9.549 1.00 0.00 O ATOM 0 H GLU A 23 0.395 -12.144 -5.093 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.551 -14.199 -5.680 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.991 -13.127 -6.888 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.463 -14.731 -7.357 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -1.510 -13.941 -8.359 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.488 -12.437 -7.459 1.00 0.00 H new ATOM 277 N ARG A 24 1.177 -14.884 -4.061 1.00 0.00 N ATOM 278 CA ARG A 24 1.899 -15.932 -3.348 1.00 0.00 C ATOM 279 C ARG A 24 1.155 -16.344 -2.082 1.00 0.00 C ATOM 280 O ARG A 24 1.201 -17.503 -1.672 1.00 0.00 O ATOM 281 CB ARG A 24 3.310 -15.458 -2.996 1.00 0.00 C ATOM 282 CG ARG A 24 4.379 -15.961 -3.953 1.00 0.00 C ATOM 283 CD ARG A 24 5.002 -17.259 -3.463 1.00 0.00 C ATOM 284 NE ARG A 24 6.459 -17.176 -3.395 1.00 0.00 N ATOM 285 CZ ARG A 24 7.258 -17.292 -4.454 1.00 0.00 C ATOM 286 NH1 ARG A 24 6.746 -17.496 -5.661 1.00 0.00 N ATOM 287 NH2 ARG A 24 8.572 -17.204 -4.305 1.00 0.00 N ATOM 0 H ARG A 24 1.499 -13.937 -3.860 1.00 0.00 H new ATOM 0 HA ARG A 24 1.968 -16.801 -4.003 1.00 0.00 H new ATOM 0 HB2 ARG A 24 3.326 -14.368 -2.987 1.00 0.00 H new ATOM 0 HB3 ARG A 24 3.554 -15.789 -1.986 1.00 0.00 H new ATOM 0 HG2 ARG A 24 3.942 -16.116 -4.939 1.00 0.00 H new ATOM 0 HG3 ARG A 24 5.155 -15.203 -4.064 1.00 0.00 H new ATOM 0 HD2 ARG A 24 4.606 -17.501 -2.477 1.00 0.00 H new ATOM 0 HD3 ARG A 24 4.716 -18.073 -4.130 1.00 0.00 H new ATOM 0 HE ARG A 24 6.889 -17.020 -2.483 1.00 0.00 H new ATOM 0 HH11 ARG A 24 5.735 -17.565 -5.781 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.363 -17.584 -6.468 1.00 0.00 H new ATOM 0 HH21 ARG A 24 8.971 -17.047 -3.379 1.00 0.00 H new ATOM 0 HH22 ARG A 24 9.184 -17.293 -5.116 1.00 0.00 H new ATOM 301 N MET A 25 0.473 -15.386 -1.463 1.00 0.00 N ATOM 302 CA MET A 25 -0.279 -15.651 -0.241 1.00 0.00 C ATOM 303 C MET A 25 -1.692 -16.135 -0.555 1.00 0.00 C ATOM 304 O MET A 25 -2.324 -16.801 0.265 1.00 0.00 O ATOM 305 CB MET A 25 -0.340 -14.393 0.627 1.00 0.00 C ATOM 306 CG MET A 25 -1.097 -13.244 -0.018 1.00 0.00 C ATOM 307 SD MET A 25 -0.933 -11.701 0.900 1.00 0.00 S ATOM 308 CE MET A 25 0.848 -11.589 1.058 1.00 0.00 C ATOM 0 H MET A 25 0.425 -14.420 -1.787 1.00 0.00 H new ATOM 0 HA MET A 25 0.238 -16.440 0.305 1.00 0.00 H new ATOM 0 HB2 MET A 25 -0.813 -14.640 1.577 1.00 0.00 H new ATOM 0 HB3 MET A 25 0.676 -14.067 0.851 1.00 0.00 H new ATOM 0 HG2 MET A 25 -0.731 -13.098 -1.034 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.152 -13.507 -0.094 1.00 0.00 H new ATOM 0 HE1 MET A 25 1.151 -10.543 1.023 1.00 0.00 H new ATOM 0 HE2 MET A 25 1.157 -12.025 2.008 1.00 0.00 H new ATOM 0 HE3 MET A 25 1.321 -12.131 0.239 1.00 0.00 H new ATOM 318 N ALA A 26 -2.183 -15.797 -1.743 1.00 0.00 N ATOM 319 CA ALA A 26 -3.523 -16.199 -2.160 1.00 0.00 C ATOM 320 C ALA A 26 -3.713 -17.709 -2.034 1.00 0.00 C ATOM 321 O ALA A 26 -4.663 -18.173 -1.402 1.00 0.00 O ATOM 322 CB ALA A 26 -3.788 -15.745 -3.589 1.00 0.00 C ATOM 0 H ALA A 26 -1.674 -15.246 -2.434 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.242 -15.717 -1.498 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.791 -16.051 -3.888 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.708 -14.660 -3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.056 -16.199 -4.257 1.00 0.00 H new ATOM 328 N PRO A 27 -2.809 -18.501 -2.636 1.00 0.00 N ATOM 329 CA PRO A 27 -2.884 -19.965 -2.586 1.00 0.00 C ATOM 330 C PRO A 27 -3.027 -20.489 -1.161 1.00 0.00 C ATOM 331 O PRO A 27 -3.854 -21.360 -0.889 1.00 0.00 O ATOM 332 CB PRO A 27 -1.549 -20.412 -3.188 1.00 0.00 C ATOM 333 CG PRO A 27 -1.140 -19.286 -4.073 1.00 0.00 C ATOM 334 CD PRO A 27 -1.643 -18.034 -3.411 1.00 0.00 C ATOM 0 HA PRO A 27 -3.755 -20.346 -3.119 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.806 -20.596 -2.412 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -1.659 -21.339 -3.751 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.057 -19.256 -4.191 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.567 -19.399 -5.070 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -0.885 -17.588 -2.767 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.924 -17.277 -4.144 1.00 0.00 H new ATOM 342 N THR A 28 -2.214 -19.954 -0.255 1.00 0.00 N ATOM 343 CA THR A 28 -2.249 -20.367 1.143 1.00 0.00 C ATOM 344 C THR A 28 -3.533 -19.895 1.819 1.00 0.00 C ATOM 345 O THR A 28 -4.057 -20.561 2.711 1.00 0.00 O ATOM 346 CB THR A 28 -1.033 -19.816 1.890 1.00 0.00 C ATOM 347 OG1 THR A 28 -0.989 -18.403 1.801 1.00 0.00 O ATOM 348 CG2 THR A 28 0.282 -20.350 1.366 1.00 0.00 C ATOM 0 H THR A 28 -1.523 -19.234 -0.465 1.00 0.00 H new ATOM 0 HA THR A 28 -2.223 -21.456 1.174 1.00 0.00 H new ATOM 0 HB THR A 28 -1.154 -20.143 2.923 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.535 -18.106 1.043 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.104 -19.920 1.939 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.299 -21.435 1.465 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.392 -20.080 0.316 1.00 0.00 H new ATOM 356 N LEU A 29 -4.035 -18.743 1.387 1.00 0.00 N ATOM 357 CA LEU A 29 -5.258 -18.182 1.950 1.00 0.00 C ATOM 358 C LEU A 29 -6.451 -19.096 1.677 1.00 0.00 C ATOM 359 O LEU A 29 -6.501 -19.775 0.652 1.00 0.00 O ATOM 360 CB LEU A 29 -5.522 -16.793 1.368 1.00 0.00 C ATOM 361 CG LEU A 29 -4.767 -15.651 2.052 1.00 0.00 C ATOM 362 CD1 LEU A 29 -5.014 -14.337 1.323 1.00 0.00 C ATOM 363 CD2 LEU A 29 -5.177 -15.539 3.513 1.00 0.00 C ATOM 0 H LEU A 29 -3.614 -18.179 0.649 1.00 0.00 H new ATOM 0 HA LEU A 29 -5.127 -18.097 3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.257 -16.802 0.311 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.591 -16.588 1.427 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.700 -15.870 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.470 -13.536 1.823 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -4.669 -14.422 0.293 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.080 -14.111 1.331 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -4.630 -14.722 3.983 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -6.247 -15.343 3.577 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -4.948 -16.472 4.028 1.00 0.00 H new ATOM 375 N PRO A 30 -7.434 -19.124 2.595 1.00 0.00 N ATOM 376 CA PRO A 30 -8.628 -19.961 2.445 1.00 0.00 C ATOM 377 C PRO A 30 -9.332 -19.728 1.113 1.00 0.00 C ATOM 378 O PRO A 30 -9.131 -18.702 0.464 1.00 0.00 O ATOM 379 CB PRO A 30 -9.523 -19.519 3.607 1.00 0.00 C ATOM 380 CG PRO A 30 -8.583 -18.970 4.622 1.00 0.00 C ATOM 381 CD PRO A 30 -7.456 -18.346 3.848 1.00 0.00 C ATOM 0 HA PRO A 30 -8.385 -21.023 2.458 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -10.244 -18.767 3.287 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -10.093 -20.357 4.008 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -9.078 -18.232 5.254 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.215 -19.758 5.280 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.634 -17.287 3.661 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -6.510 -18.420 4.384 1.00 0.00 H new ATOM 389 N LYS A 31 -10.161 -20.687 0.711 1.00 0.00 N ATOM 390 CA LYS A 31 -10.895 -20.586 -0.545 1.00 0.00 C ATOM 391 C LYS A 31 -12.397 -20.502 -0.292 1.00 0.00 C ATOM 392 O LYS A 31 -13.030 -21.491 0.079 1.00 0.00 O ATOM 393 CB LYS A 31 -10.583 -21.787 -1.441 1.00 0.00 C ATOM 394 CG LYS A 31 -10.972 -23.121 -0.827 1.00 0.00 C ATOM 395 CD LYS A 31 -10.286 -24.280 -1.532 1.00 0.00 C ATOM 396 CE LYS A 31 -11.202 -24.933 -2.553 1.00 0.00 C ATOM 397 NZ LYS A 31 -10.502 -25.993 -3.331 1.00 0.00 N ATOM 0 H LYS A 31 -10.341 -21.542 1.237 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.578 -19.673 -1.050 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -11.106 -21.667 -2.390 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -9.516 -21.796 -1.664 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.706 -23.128 0.230 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -12.053 -23.248 -0.884 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -9.383 -23.923 -2.028 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.973 -25.021 -0.796 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.063 -25.366 -2.044 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.584 -24.174 -3.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.162 -26.413 -4.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.695 -25.576 -3.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.160 -26.731 -2.683 1.00 0.00 H new ATOM 411 N SER A 32 -12.961 -19.316 -0.495 1.00 0.00 N ATOM 412 CA SER A 32 -14.389 -19.103 -0.289 1.00 0.00 C ATOM 413 C SER A 32 -15.106 -18.897 -1.620 1.00 0.00 C ATOM 414 O SER A 32 -14.728 -18.033 -2.412 1.00 0.00 O ATOM 415 CB SER A 32 -14.619 -17.895 0.620 1.00 0.00 C ATOM 416 OG SER A 32 -14.707 -18.289 1.979 1.00 0.00 O ATOM 0 H SER A 32 -12.451 -18.488 -0.802 1.00 0.00 H new ATOM 0 HA SER A 32 -14.799 -19.992 0.190 1.00 0.00 H new ATOM 0 HB2 SER A 32 -13.803 -17.183 0.497 1.00 0.00 H new ATOM 0 HB3 SER A 32 -15.536 -17.384 0.326 1.00 0.00 H new ATOM 0 HG SER A 32 -14.852 -17.499 2.540 1.00 0.00 H new ATOM 422 N ASP A 33 -16.140 -19.695 -1.858 1.00 0.00 N ATOM 423 CA ASP A 33 -16.911 -19.599 -3.093 1.00 0.00 C ATOM 424 C ASP A 33 -17.821 -18.375 -3.074 1.00 0.00 C ATOM 425 O ASP A 33 -18.202 -17.889 -2.008 1.00 0.00 O ATOM 426 CB ASP A 33 -17.745 -20.866 -3.297 1.00 0.00 C ATOM 427 CG ASP A 33 -17.960 -21.186 -4.764 1.00 0.00 C ATOM 428 OD1 ASP A 33 -17.864 -20.258 -5.594 1.00 0.00 O ATOM 429 OD2 ASP A 33 -18.224 -22.364 -5.081 1.00 0.00 O ATOM 0 H ASP A 33 -16.464 -20.416 -1.213 1.00 0.00 H new ATOM 0 HA ASP A 33 -16.211 -19.495 -3.922 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -17.248 -21.707 -2.813 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -18.712 -20.744 -2.809 1.00 0.00 H new ATOM 434 N LEU A 34 -18.165 -17.881 -4.259 1.00 0.00 N ATOM 435 CA LEU A 34 -19.031 -16.714 -4.379 1.00 0.00 C ATOM 436 C LEU A 34 -20.499 -17.108 -4.249 1.00 0.00 C ATOM 437 O LEU A 34 -21.328 -16.312 -3.806 1.00 0.00 O ATOM 438 CB LEU A 34 -18.795 -16.015 -5.719 1.00 0.00 C ATOM 439 CG LEU A 34 -17.618 -15.038 -5.740 1.00 0.00 C ATOM 440 CD1 LEU A 34 -17.250 -14.679 -7.172 1.00 0.00 C ATOM 441 CD2 LEU A 34 -17.951 -13.786 -4.943 1.00 0.00 C ATOM 0 H LEU A 34 -17.857 -18.271 -5.150 1.00 0.00 H new ATOM 0 HA LEU A 34 -18.786 -16.026 -3.569 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -18.631 -16.774 -6.484 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -19.701 -15.475 -5.995 1.00 0.00 H new ATOM 0 HG LEU A 34 -16.759 -15.522 -5.276 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -16.411 -13.983 -7.169 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -16.970 -15.583 -7.713 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.105 -14.213 -7.662 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.103 -13.102 -4.969 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -18.823 -13.299 -5.379 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -18.166 -14.059 -3.910 1.00 0.00 H new ATOM 453 N ASN A 35 -20.815 -18.339 -4.638 1.00 0.00 N ATOM 454 CA ASN A 35 -22.184 -18.838 -4.566 1.00 0.00 C ATOM 455 C ASN A 35 -22.708 -18.789 -3.134 1.00 0.00 C ATOM 456 O ASN A 35 -23.901 -18.587 -2.905 1.00 0.00 O ATOM 457 CB ASN A 35 -22.255 -20.270 -5.098 1.00 0.00 C ATOM 458 CG ASN A 35 -23.655 -20.658 -5.529 1.00 0.00 C ATOM 459 OD1 ASN A 35 -24.368 -19.868 -6.148 1.00 0.00 O ATOM 460 ND2 ASN A 35 -24.058 -21.881 -5.202 1.00 0.00 N ATOM 0 H ASN A 35 -20.141 -19.010 -5.007 1.00 0.00 H new ATOM 0 HA ASN A 35 -22.811 -18.196 -5.185 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -21.575 -20.374 -5.944 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -21.911 -20.959 -4.326 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -24.991 -22.198 -5.465 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -23.434 -22.503 -4.688 1.00 0.00 H new ATOM 467 N GLU A 36 -21.809 -18.974 -2.173 1.00 0.00 N ATOM 468 CA GLU A 36 -22.181 -18.952 -0.763 1.00 0.00 C ATOM 469 C GLU A 36 -22.547 -17.540 -0.318 1.00 0.00 C ATOM 470 O GLU A 36 -23.655 -17.296 0.160 1.00 0.00 O ATOM 471 CB GLU A 36 -21.036 -19.491 0.096 1.00 0.00 C ATOM 472 CG GLU A 36 -21.138 -20.981 0.381 1.00 0.00 C ATOM 473 CD GLU A 36 -19.802 -21.598 0.748 1.00 0.00 C ATOM 474 OE1 GLU A 36 -18.965 -21.781 -0.159 1.00 0.00 O ATOM 475 OE2 GLU A 36 -19.596 -21.896 1.942 1.00 0.00 O ATOM 0 H GLU A 36 -20.818 -19.141 -2.345 1.00 0.00 H new ATOM 0 HA GLU A 36 -23.055 -19.591 -0.633 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -20.090 -19.290 -0.407 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -21.016 -18.949 1.042 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -21.845 -21.144 1.195 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -21.539 -21.488 -0.496 1.00 0.00 H new ATOM 482 N VAL A 37 -21.609 -16.612 -0.478 1.00 0.00 N ATOM 483 CA VAL A 37 -21.834 -15.224 -0.093 1.00 0.00 C ATOM 484 C VAL A 37 -23.019 -14.628 -0.845 1.00 0.00 C ATOM 485 O VAL A 37 -23.709 -13.745 -0.334 1.00 0.00 O ATOM 486 CB VAL A 37 -20.587 -14.359 -0.357 1.00 0.00 C ATOM 487 CG1 VAL A 37 -19.506 -14.651 0.672 1.00 0.00 C ATOM 488 CG2 VAL A 37 -20.067 -14.589 -1.768 1.00 0.00 C ATOM 0 H VAL A 37 -20.686 -16.796 -0.872 1.00 0.00 H new ATOM 0 HA VAL A 37 -22.049 -15.224 0.976 1.00 0.00 H new ATOM 0 HB VAL A 37 -20.869 -13.310 -0.265 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -18.633 -14.030 0.469 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -19.884 -14.430 1.670 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -19.225 -15.703 0.616 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -19.186 -13.970 -1.937 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -19.801 -15.639 -1.891 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -20.840 -14.323 -2.489 1.00 0.00 H new ATOM 498 N LYS A 38 -23.250 -15.116 -2.059 1.00 0.00 N ATOM 499 CA LYS A 38 -24.353 -14.630 -2.880 1.00 0.00 C ATOM 500 C LYS A 38 -25.697 -14.977 -2.248 1.00 0.00 C ATOM 501 O LYS A 38 -26.675 -14.246 -2.403 1.00 0.00 O ATOM 502 CB LYS A 38 -24.268 -15.223 -4.288 1.00 0.00 C ATOM 503 CG LYS A 38 -23.517 -14.344 -5.274 1.00 0.00 C ATOM 504 CD LYS A 38 -22.773 -15.176 -6.307 1.00 0.00 C ATOM 505 CE LYS A 38 -23.561 -15.292 -7.601 1.00 0.00 C ATOM 506 NZ LYS A 38 -23.114 -14.298 -8.615 1.00 0.00 N ATOM 0 H LYS A 38 -22.689 -15.847 -2.496 1.00 0.00 H new ATOM 0 HA LYS A 38 -24.274 -13.545 -2.945 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -23.778 -16.195 -4.235 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -25.277 -15.395 -4.662 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -24.218 -13.679 -5.778 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -22.810 -13.713 -4.735 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -21.803 -14.723 -6.510 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -22.582 -16.171 -5.905 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -23.449 -16.298 -8.005 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -24.621 -15.148 -7.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -23.919 -14.030 -9.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -22.745 -13.453 -8.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -22.366 -14.716 -9.204 1.00 0.00 H new ATOM 520 N GLU A 39 -25.738 -16.097 -1.534 1.00 0.00 N ATOM 521 CA GLU A 39 -26.962 -16.542 -0.878 1.00 0.00 C ATOM 522 C GLU A 39 -27.110 -15.898 0.496 1.00 0.00 C ATOM 523 O GLU A 39 -28.224 -15.681 0.974 1.00 0.00 O ATOM 524 CB GLU A 39 -26.968 -18.066 -0.744 1.00 0.00 C ATOM 525 CG GLU A 39 -26.994 -18.794 -2.079 1.00 0.00 C ATOM 526 CD GLU A 39 -27.934 -19.984 -2.075 1.00 0.00 C ATOM 527 OE1 GLU A 39 -27.661 -20.955 -1.338 1.00 0.00 O ATOM 528 OE2 GLU A 39 -28.943 -19.945 -2.810 1.00 0.00 O ATOM 0 H GLU A 39 -24.937 -16.713 -1.395 1.00 0.00 H new ATOM 0 HA GLU A 39 -27.807 -16.235 -1.495 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -26.084 -18.377 -0.187 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -27.836 -18.368 -0.158 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -27.297 -18.099 -2.862 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -25.987 -19.132 -2.324 1.00 0.00 H new ATOM 535 N LEU A 40 -25.981 -15.594 1.127 1.00 0.00 N ATOM 536 CA LEU A 40 -25.986 -14.973 2.448 1.00 0.00 C ATOM 537 C LEU A 40 -26.716 -13.634 2.421 1.00 0.00 C ATOM 538 O LEU A 40 -27.279 -13.203 3.427 1.00 0.00 O ATOM 539 CB LEU A 40 -24.552 -14.776 2.946 1.00 0.00 C ATOM 540 CG LEU A 40 -23.968 -15.957 3.723 1.00 0.00 C ATOM 541 CD1 LEU A 40 -22.486 -16.114 3.422 1.00 0.00 C ATOM 542 CD2 LEU A 40 -24.195 -15.776 5.216 1.00 0.00 C ATOM 0 H LEU A 40 -25.051 -15.767 0.746 1.00 0.00 H new ATOM 0 HA LEU A 40 -26.514 -15.638 3.131 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -23.911 -14.572 2.089 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -24.523 -13.892 3.583 1.00 0.00 H new ATOM 0 HG LEU A 40 -24.480 -16.865 3.405 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -22.088 -16.959 3.984 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -22.348 -16.290 2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -21.958 -15.205 3.711 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -23.773 -16.625 5.754 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -23.710 -14.858 5.549 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -25.265 -15.714 5.417 1.00 0.00 H new ATOM 554 N LEU A 41 -26.705 -12.980 1.264 1.00 0.00 N ATOM 555 CA LEU A 41 -27.368 -11.690 1.110 1.00 0.00 C ATOM 556 C LEU A 41 -28.884 -11.849 1.138 1.00 0.00 C ATOM 557 O LEU A 41 -29.601 -10.973 1.624 1.00 0.00 O ATOM 558 CB LEU A 41 -26.939 -11.025 -0.200 1.00 0.00 C ATOM 559 CG LEU A 41 -25.431 -10.994 -0.448 1.00 0.00 C ATOM 560 CD1 LEU A 41 -25.137 -10.829 -1.931 1.00 0.00 C ATOM 561 CD2 LEU A 41 -24.782 -9.877 0.355 1.00 0.00 C ATOM 0 H LEU A 41 -26.245 -13.322 0.420 1.00 0.00 H new ATOM 0 HA LEU A 41 -27.072 -11.057 1.946 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -27.417 -11.548 -1.028 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -27.314 -10.002 -0.210 1.00 0.00 H new ATOM 0 HG LEU A 41 -25.008 -11.943 -0.119 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -24.059 -10.809 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -25.569 -11.664 -2.483 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -25.573 -9.895 -2.287 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -23.708 -9.870 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -25.209 -8.919 0.057 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -24.963 -10.040 1.417 1.00 0.00 H new ATOM 573 N LYS A 42 -29.367 -12.970 0.615 1.00 0.00 N ATOM 574 CA LYS A 42 -30.799 -13.243 0.580 1.00 0.00 C ATOM 575 C LYS A 42 -31.360 -13.402 1.990 1.00 0.00 C ATOM 576 O LYS A 42 -32.530 -13.111 2.238 1.00 0.00 O ATOM 577 CB LYS A 42 -31.078 -14.505 -0.238 1.00 0.00 C ATOM 578 CG LYS A 42 -31.037 -14.277 -1.740 1.00 0.00 C ATOM 579 CD LYS A 42 -29.611 -14.312 -2.272 1.00 0.00 C ATOM 580 CE LYS A 42 -29.473 -15.278 -3.438 1.00 0.00 C ATOM 581 NZ LYS A 42 -29.955 -16.642 -3.089 1.00 0.00 N ATOM 0 H LYS A 42 -28.788 -13.705 0.209 1.00 0.00 H new ATOM 0 HA LYS A 42 -31.293 -12.394 0.107 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -30.346 -15.268 0.025 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -32.058 -14.896 0.035 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -31.632 -15.040 -2.241 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -31.490 -13.314 -1.975 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -29.316 -13.312 -2.590 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -28.931 -14.606 -1.473 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -30.037 -14.901 -4.291 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -28.428 -15.330 -3.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -29.379 -17.351 -3.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -29.874 -16.787 -2.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -30.950 -16.742 -3.375 1.00 0.00 H new ATOM 595 N THR A 43 -30.519 -13.865 2.910 1.00 0.00 N ATOM 596 CA THR A 43 -30.935 -14.062 4.294 1.00 0.00 C ATOM 597 C THR A 43 -30.713 -12.794 5.114 1.00 0.00 C ATOM 598 O THR A 43 -31.452 -12.518 6.060 1.00 0.00 O ATOM 599 CB THR A 43 -30.169 -15.229 4.919 1.00 0.00 C ATOM 600 OG1 THR A 43 -30.572 -15.431 6.261 1.00 0.00 O ATOM 601 CG2 THR A 43 -28.669 -15.032 4.914 1.00 0.00 C ATOM 0 H THR A 43 -29.547 -14.110 2.722 1.00 0.00 H new ATOM 0 HA THR A 43 -32.000 -14.294 4.297 1.00 0.00 H new ATOM 0 HB THR A 43 -30.407 -16.095 4.301 1.00 0.00 H new ATOM 0 HG1 THR A 43 -30.072 -16.182 6.643 1.00 0.00 H new ATOM 0 HG21 THR A 43 -28.187 -15.896 5.372 1.00 0.00 H new ATOM 0 HG22 THR A 43 -28.320 -14.923 3.887 1.00 0.00 H new ATOM 0 HG23 THR A 43 -28.418 -14.135 5.480 1.00 0.00 H new ATOM 609 N ASN A 44 -29.693 -12.027 4.745 1.00 0.00 N ATOM 610 CA ASN A 44 -29.376 -10.788 5.446 1.00 0.00 C ATOM 611 C ASN A 44 -29.873 -9.576 4.664 1.00 0.00 C ATOM 612 O ASN A 44 -30.545 -9.718 3.643 1.00 0.00 O ATOM 613 CB ASN A 44 -27.866 -10.681 5.677 1.00 0.00 C ATOM 614 CG ASN A 44 -27.466 -11.085 7.081 1.00 0.00 C ATOM 615 OD1 ASN A 44 -26.950 -12.181 7.302 1.00 0.00 O ATOM 616 ND2 ASN A 44 -27.702 -10.199 8.042 1.00 0.00 N ATOM 0 H ASN A 44 -29.072 -12.241 3.965 1.00 0.00 H new ATOM 0 HA ASN A 44 -29.883 -10.805 6.411 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -27.346 -11.313 4.958 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -27.545 -9.656 5.491 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -27.454 -10.415 9.007 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -28.132 -9.302 7.815 1.00 0.00 H new ATOM 623 N LYS A 45 -29.537 -8.387 5.150 1.00 0.00 N ATOM 624 CA LYS A 45 -29.948 -7.150 4.496 1.00 0.00 C ATOM 625 C LYS A 45 -28.806 -6.138 4.475 1.00 0.00 C ATOM 626 O LYS A 45 -28.509 -5.544 3.438 1.00 0.00 O ATOM 627 CB LYS A 45 -31.164 -6.553 5.209 1.00 0.00 C ATOM 628 CG LYS A 45 -32.236 -6.044 4.258 1.00 0.00 C ATOM 629 CD LYS A 45 -31.881 -4.676 3.694 1.00 0.00 C ATOM 630 CE LYS A 45 -32.936 -3.637 4.042 1.00 0.00 C ATOM 631 NZ LYS A 45 -34.273 -3.996 3.495 1.00 0.00 N ATOM 0 H LYS A 45 -28.981 -8.253 5.995 1.00 0.00 H new ATOM 0 HA LYS A 45 -30.218 -7.384 3.466 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -31.599 -7.309 5.863 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -30.835 -5.732 5.846 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -32.364 -6.753 3.440 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -33.190 -5.986 4.782 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -30.914 -4.360 4.086 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -31.779 -4.743 2.611 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -33.002 -3.536 5.125 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -32.632 -2.666 3.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -34.840 -3.133 3.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -34.156 -4.470 2.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -34.758 -4.636 4.156 1.00 0.00 H new ATOM 645 N LYS A 46 -28.170 -5.949 5.626 1.00 0.00 N ATOM 646 CA LYS A 46 -27.060 -5.010 5.739 1.00 0.00 C ATOM 647 C LYS A 46 -25.919 -5.401 4.805 1.00 0.00 C ATOM 648 O LYS A 46 -25.194 -4.543 4.301 1.00 0.00 O ATOM 649 CB LYS A 46 -26.558 -4.952 7.184 1.00 0.00 C ATOM 650 CG LYS A 46 -27.128 -3.791 7.980 1.00 0.00 C ATOM 651 CD LYS A 46 -28.361 -4.204 8.768 1.00 0.00 C ATOM 652 CE LYS A 46 -29.055 -3.002 9.387 1.00 0.00 C ATOM 653 NZ LYS A 46 -28.534 -2.701 10.749 1.00 0.00 N ATOM 0 H LYS A 46 -28.404 -6.433 6.493 1.00 0.00 H new ATOM 0 HA LYS A 46 -27.420 -4.023 5.448 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -26.813 -5.885 7.686 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -25.470 -4.879 7.179 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -26.369 -3.411 8.664 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -27.384 -2.976 7.303 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -29.055 -4.728 8.111 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -28.075 -4.904 9.553 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -28.916 -2.132 8.745 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -30.127 -3.190 9.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -29.033 -1.875 11.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -28.689 -3.521 11.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -27.516 -2.496 10.694 1.00 0.00 H new ATOM 667 N LEU A 47 -25.768 -6.701 4.577 1.00 0.00 N ATOM 668 CA LEU A 47 -24.716 -7.207 3.702 1.00 0.00 C ATOM 669 C LEU A 47 -25.085 -7.008 2.235 1.00 0.00 C ATOM 670 O LEU A 47 -24.225 -6.721 1.402 1.00 0.00 O ATOM 671 CB LEU A 47 -24.462 -8.690 3.980 1.00 0.00 C ATOM 672 CG LEU A 47 -24.098 -9.024 5.428 1.00 0.00 C ATOM 673 CD1 LEU A 47 -23.813 -10.510 5.576 1.00 0.00 C ATOM 674 CD2 LEU A 47 -22.901 -8.201 5.878 1.00 0.00 C ATOM 0 H LEU A 47 -26.360 -7.424 4.986 1.00 0.00 H new ATOM 0 HA LEU A 47 -23.805 -6.645 3.908 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -25.354 -9.253 3.706 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -23.657 -9.033 3.330 1.00 0.00 H new ATOM 0 HG LEU A 47 -24.946 -8.773 6.065 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -23.556 -10.730 6.612 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -24.698 -11.080 5.293 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -22.981 -10.787 4.929 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -22.655 -8.451 6.910 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -22.047 -8.421 5.238 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -23.142 -7.140 5.809 1.00 0.00 H new ATOM 686 N ALA A 48 -26.368 -7.162 1.926 1.00 0.00 N ATOM 687 CA ALA A 48 -26.850 -7.000 0.561 1.00 0.00 C ATOM 688 C ALA A 48 -26.934 -5.526 0.178 1.00 0.00 C ATOM 689 O ALA A 48 -26.792 -5.168 -0.992 1.00 0.00 O ATOM 690 CB ALA A 48 -28.207 -7.668 0.397 1.00 0.00 C ATOM 0 H ALA A 48 -27.093 -7.399 2.604 1.00 0.00 H new ATOM 0 HA ALA A 48 -26.137 -7.482 -0.108 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -28.555 -7.539 -0.628 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -28.118 -8.732 0.619 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -28.922 -7.213 1.083 1.00 0.00 H new ATOM 696 N LYS A 49 -27.167 -4.674 1.171 1.00 0.00 N ATOM 697 CA LYS A 49 -27.269 -3.239 0.936 1.00 0.00 C ATOM 698 C LYS A 49 -25.889 -2.587 0.926 1.00 0.00 C ATOM 699 O LYS A 49 -25.686 -1.552 0.291 1.00 0.00 O ATOM 700 CB LYS A 49 -28.146 -2.586 2.007 1.00 0.00 C ATOM 701 CG LYS A 49 -29.637 -2.720 1.738 1.00 0.00 C ATOM 702 CD LYS A 49 -30.395 -1.477 2.172 1.00 0.00 C ATOM 703 CE LYS A 49 -30.293 -0.371 1.134 1.00 0.00 C ATOM 704 NZ LYS A 49 -31.009 -0.722 -0.125 1.00 0.00 N ATOM 0 H LYS A 49 -27.289 -4.952 2.145 1.00 0.00 H new ATOM 0 HA LYS A 49 -27.728 -3.090 -0.041 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -27.918 -3.034 2.974 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -27.892 -1.528 2.078 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -29.802 -2.895 0.675 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -30.027 -3.589 2.268 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -31.443 -1.728 2.336 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -29.999 -1.122 3.124 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -30.708 0.550 1.543 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -29.244 -0.177 0.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -31.226 0.146 -0.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -30.407 -1.340 -0.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -31.894 -1.218 0.105 1.00 0.00 H new ATOM 718 N MET A 50 -24.944 -3.200 1.633 1.00 0.00 N ATOM 719 CA MET A 50 -23.584 -2.678 1.705 1.00 0.00 C ATOM 720 C MET A 50 -22.769 -3.106 0.489 1.00 0.00 C ATOM 721 O MET A 50 -22.370 -2.276 -0.327 1.00 0.00 O ATOM 722 CB MET A 50 -22.899 -3.157 2.986 1.00 0.00 C ATOM 723 CG MET A 50 -21.585 -2.450 3.275 1.00 0.00 C ATOM 724 SD MET A 50 -20.753 -3.101 4.735 1.00 0.00 S ATOM 725 CE MET A 50 -20.565 -1.611 5.711 1.00 0.00 C ATOM 0 H MET A 50 -25.095 -4.058 2.164 1.00 0.00 H new ATOM 0 HA MET A 50 -23.641 -1.590 1.716 1.00 0.00 H new ATOM 0 HB2 MET A 50 -23.575 -3.007 3.828 1.00 0.00 H new ATOM 0 HB3 MET A 50 -22.716 -4.229 2.911 1.00 0.00 H new ATOM 0 HG2 MET A 50 -20.926 -2.549 2.412 1.00 0.00 H new ATOM 0 HG3 MET A 50 -21.772 -1.385 3.413 1.00 0.00 H new ATOM 0 HE1 MET A 50 -20.065 -1.851 6.649 1.00 0.00 H new ATOM 0 HE2 MET A 50 -19.969 -0.886 5.157 1.00 0.00 H new ATOM 0 HE3 MET A 50 -21.547 -1.188 5.922 1.00 0.00 H new ATOM 735 N ILE A 51 -22.524 -4.408 0.375 1.00 0.00 N ATOM 736 CA ILE A 51 -21.753 -4.945 -0.740 1.00 0.00 C ATOM 737 C ILE A 51 -22.505 -6.074 -1.439 1.00 0.00 C ATOM 738 O ILE A 51 -21.915 -7.088 -1.814 1.00 0.00 O ATOM 739 CB ILE A 51 -20.381 -5.466 -0.272 1.00 0.00 C ATOM 740 CG1 ILE A 51 -20.555 -6.479 0.860 1.00 0.00 C ATOM 741 CG2 ILE A 51 -19.499 -4.310 0.175 1.00 0.00 C ATOM 742 CD1 ILE A 51 -19.323 -7.321 1.113 1.00 0.00 C ATOM 0 H ILE A 51 -22.848 -5.110 1.041 1.00 0.00 H new ATOM 0 HA ILE A 51 -21.602 -4.127 -1.444 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.894 -5.966 -1.110 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -20.816 -5.948 1.775 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -21.392 -7.136 0.623 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.533 -4.695 0.503 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -19.352 -3.622 -0.657 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -19.979 -3.784 1.000 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -19.519 -8.017 1.929 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -19.073 -7.880 0.211 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.488 -6.673 1.381 1.00 0.00 H new ATOM 754 N GLY A 52 -23.809 -5.891 -1.613 1.00 0.00 N ATOM 755 CA GLY A 52 -24.618 -6.902 -2.268 1.00 0.00 C ATOM 756 C GLY A 52 -24.629 -6.748 -3.776 1.00 0.00 C ATOM 757 O GLY A 52 -24.791 -7.726 -4.506 1.00 0.00 O ATOM 0 H GLY A 52 -24.320 -5.061 -1.312 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -24.238 -7.890 -2.010 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -25.640 -6.845 -1.893 1.00 0.00 H new ATOM 761 N HIS A 53 -24.456 -5.515 -4.243 1.00 0.00 N ATOM 762 CA HIS A 53 -24.445 -5.236 -5.674 1.00 0.00 C ATOM 763 C HIS A 53 -23.139 -5.702 -6.310 1.00 0.00 C ATOM 764 O HIS A 53 -23.111 -6.098 -7.475 1.00 0.00 O ATOM 765 CB HIS A 53 -24.641 -3.739 -5.924 1.00 0.00 C ATOM 766 CG HIS A 53 -23.547 -2.890 -5.356 1.00 0.00 C ATOM 767 ND1 HIS A 53 -23.477 -2.546 -4.022 1.00 0.00 N ATOM 768 CD2 HIS A 53 -22.473 -2.314 -5.947 1.00 0.00 C ATOM 769 CE1 HIS A 53 -22.409 -1.795 -3.818 1.00 0.00 C ATOM 770 NE2 HIS A 53 -21.783 -1.640 -4.970 1.00 0.00 N ATOM 0 H HIS A 53 -24.322 -4.695 -3.652 1.00 0.00 H new ATOM 0 HA HIS A 53 -25.267 -5.786 -6.132 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -24.706 -3.564 -6.998 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -25.592 -3.428 -5.492 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -22.209 -2.374 -6.992 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -22.101 -1.379 -2.870 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -20.926 -1.106 -5.111 1.00 0.00 H new ATOM 779 N ILE A 54 -22.060 -5.652 -5.536 1.00 0.00 N ATOM 780 CA ILE A 54 -20.751 -6.070 -6.023 1.00 0.00 C ATOM 781 C ILE A 54 -20.635 -7.591 -6.053 1.00 0.00 C ATOM 782 O ILE A 54 -19.941 -8.153 -6.899 1.00 0.00 O ATOM 783 CB ILE A 54 -19.617 -5.497 -5.151 1.00 0.00 C ATOM 784 CG1 ILE A 54 -19.818 -3.996 -4.938 1.00 0.00 C ATOM 785 CG2 ILE A 54 -18.266 -5.771 -5.793 1.00 0.00 C ATOM 786 CD1 ILE A 54 -18.938 -3.417 -3.853 1.00 0.00 C ATOM 0 H ILE A 54 -22.066 -5.326 -4.569 1.00 0.00 H new ATOM 0 HA ILE A 54 -20.652 -5.681 -7.036 1.00 0.00 H new ATOM 0 HB ILE A 54 -19.641 -5.989 -4.179 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -19.618 -3.474 -5.874 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -20.862 -3.810 -4.686 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -17.475 -5.360 -5.166 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -18.124 -6.847 -5.898 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -18.229 -5.303 -6.777 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -19.134 -2.349 -3.757 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -19.154 -3.912 -2.906 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -17.891 -3.572 -4.113 1.00 0.00 H new ATOM 798 N PHE A 55 -21.321 -8.251 -5.124 1.00 0.00 N ATOM 799 CA PHE A 55 -21.295 -9.706 -5.046 1.00 0.00 C ATOM 800 C PHE A 55 -21.819 -10.330 -6.335 1.00 0.00 C ATOM 801 O PHE A 55 -21.213 -11.251 -6.883 1.00 0.00 O ATOM 802 CB PHE A 55 -22.129 -10.189 -3.857 1.00 0.00 C ATOM 803 CG PHE A 55 -21.327 -10.393 -2.604 1.00 0.00 C ATOM 804 CD1 PHE A 55 -20.159 -11.139 -2.627 1.00 0.00 C ATOM 805 CD2 PHE A 55 -21.740 -9.839 -1.403 1.00 0.00 C ATOM 806 CE1 PHE A 55 -19.419 -11.329 -1.476 1.00 0.00 C ATOM 807 CE2 PHE A 55 -21.004 -10.026 -0.248 1.00 0.00 C ATOM 808 CZ PHE A 55 -19.842 -10.771 -0.285 1.00 0.00 C ATOM 0 H PHE A 55 -21.901 -7.801 -4.416 1.00 0.00 H new ATOM 0 HA PHE A 55 -20.260 -10.018 -4.907 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -22.918 -9.464 -3.659 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -22.617 -11.127 -4.123 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -19.824 -11.577 -3.556 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -22.647 -9.254 -1.369 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -18.511 -11.913 -1.507 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -21.337 -9.590 0.682 1.00 0.00 H new ATOM 0 HZ PHE A 55 -19.265 -10.917 0.616 1.00 0.00 H new ATOM 818 N GLU A 56 -22.950 -9.822 -6.815 1.00 0.00 N ATOM 819 CA GLU A 56 -23.557 -10.328 -8.041 1.00 0.00 C ATOM 820 C GLU A 56 -22.845 -9.775 -9.273 1.00 0.00 C ATOM 821 O GLU A 56 -22.881 -10.380 -10.345 1.00 0.00 O ATOM 822 CB GLU A 56 -25.040 -9.961 -8.088 1.00 0.00 C ATOM 823 CG GLU A 56 -25.825 -10.444 -6.879 1.00 0.00 C ATOM 824 CD GLU A 56 -26.766 -11.587 -7.212 1.00 0.00 C ATOM 825 OE1 GLU A 56 -26.273 -12.668 -7.598 1.00 0.00 O ATOM 826 OE2 GLU A 56 -27.994 -11.400 -7.086 1.00 0.00 O ATOM 0 H GLU A 56 -23.465 -9.060 -6.373 1.00 0.00 H new ATOM 0 HA GLU A 56 -23.457 -11.413 -8.044 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -25.135 -8.878 -8.164 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -25.482 -10.384 -8.990 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -25.129 -10.765 -6.104 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -26.399 -9.614 -6.468 1.00 0.00 H new ATOM 833 N MET A 57 -22.199 -8.622 -9.115 1.00 0.00 N ATOM 834 CA MET A 57 -21.480 -7.990 -10.216 1.00 0.00 C ATOM 835 C MET A 57 -20.461 -8.947 -10.828 1.00 0.00 C ATOM 836 O MET A 57 -20.006 -9.887 -10.173 1.00 0.00 O ATOM 837 CB MET A 57 -20.778 -6.722 -9.731 1.00 0.00 C ATOM 838 CG MET A 57 -20.654 -5.646 -10.799 1.00 0.00 C ATOM 839 SD MET A 57 -21.380 -4.074 -10.296 1.00 0.00 S ATOM 840 CE MET A 57 -20.002 -2.962 -10.566 1.00 0.00 C ATOM 0 H MET A 57 -22.159 -8.107 -8.235 1.00 0.00 H new ATOM 0 HA MET A 57 -22.206 -7.726 -10.984 1.00 0.00 H new ATOM 0 HB2 MET A 57 -21.326 -6.316 -8.881 1.00 0.00 H new ATOM 0 HB3 MET A 57 -19.782 -6.983 -9.373 1.00 0.00 H new ATOM 0 HG2 MET A 57 -19.601 -5.495 -11.036 1.00 0.00 H new ATOM 0 HG3 MET A 57 -21.140 -5.990 -11.712 1.00 0.00 H new ATOM 0 HE1 MET A 57 -20.152 -2.050 -9.989 1.00 0.00 H new ATOM 0 HE2 MET A 57 -19.078 -3.444 -10.248 1.00 0.00 H new ATOM 0 HE3 MET A 57 -19.936 -2.714 -11.625 1.00 0.00 H new ATOM 850 N ASN A 58 -20.105 -8.703 -12.085 1.00 0.00 N ATOM 851 CA ASN A 58 -19.141 -9.542 -12.784 1.00 0.00 C ATOM 852 C ASN A 58 -17.719 -9.027 -12.580 1.00 0.00 C ATOM 853 O ASN A 58 -17.510 -7.978 -11.970 1.00 0.00 O ATOM 854 CB ASN A 58 -19.471 -9.596 -14.279 1.00 0.00 C ATOM 855 CG ASN A 58 -19.649 -11.015 -14.781 1.00 0.00 C ATOM 856 OD1 ASN A 58 -20.072 -11.900 -14.037 1.00 0.00 O ATOM 857 ND2 ASN A 58 -19.329 -11.239 -16.050 1.00 0.00 N ATOM 0 H ASN A 58 -20.471 -7.930 -12.640 1.00 0.00 H new ATOM 0 HA ASN A 58 -19.204 -10.548 -12.369 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -20.383 -9.030 -14.468 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -18.673 -9.112 -14.842 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -19.430 -12.174 -16.444 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -18.982 -10.476 -16.631 1.00 0.00 H new ATOM 864 N ASP A 59 -16.746 -9.771 -13.095 1.00 0.00 N ATOM 865 CA ASP A 59 -15.345 -9.389 -12.971 1.00 0.00 C ATOM 866 C ASP A 59 -14.940 -8.432 -14.087 1.00 0.00 C ATOM 867 O ASP A 59 -14.144 -7.518 -13.877 1.00 0.00 O ATOM 868 CB ASP A 59 -14.452 -10.631 -12.998 1.00 0.00 C ATOM 869 CG ASP A 59 -14.174 -11.175 -11.611 1.00 0.00 C ATOM 870 OD1 ASP A 59 -15.137 -11.588 -10.932 1.00 0.00 O ATOM 871 OD2 ASP A 59 -12.993 -11.189 -11.203 1.00 0.00 O ATOM 0 H ASP A 59 -16.902 -10.642 -13.602 1.00 0.00 H new ATOM 0 HA ASP A 59 -15.217 -8.879 -12.016 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -14.929 -11.405 -13.600 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -13.508 -10.386 -13.485 1.00 0.00 H new ATOM 876 N ASP A 60 -15.494 -8.650 -15.275 1.00 0.00 N ATOM 877 CA ASP A 60 -15.191 -7.807 -16.427 1.00 0.00 C ATOM 878 C ASP A 60 -15.567 -6.353 -16.154 1.00 0.00 C ATOM 879 O ASP A 60 -14.977 -5.434 -16.723 1.00 0.00 O ATOM 880 CB ASP A 60 -15.934 -8.315 -17.665 1.00 0.00 C ATOM 881 CG ASP A 60 -15.080 -8.257 -18.916 1.00 0.00 C ATOM 882 OD1 ASP A 60 -13.847 -8.416 -18.800 1.00 0.00 O ATOM 883 OD2 ASP A 60 -15.644 -8.053 -20.011 1.00 0.00 O ATOM 0 H ASP A 60 -16.155 -9.403 -15.466 1.00 0.00 H new ATOM 0 HA ASP A 60 -14.117 -7.856 -16.609 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.256 -9.342 -17.496 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -16.834 -7.719 -17.815 1.00 0.00 H new ATOM 888 N ASP A 61 -16.549 -6.153 -15.281 1.00 0.00 N ATOM 889 CA ASP A 61 -17.003 -4.810 -14.934 1.00 0.00 C ATOM 890 C ASP A 61 -15.847 -3.963 -14.400 1.00 0.00 C ATOM 891 O ASP A 61 -15.241 -4.302 -13.384 1.00 0.00 O ATOM 892 CB ASP A 61 -18.119 -4.882 -13.890 1.00 0.00 C ATOM 893 CG ASP A 61 -19.181 -3.821 -14.104 1.00 0.00 C ATOM 894 OD1 ASP A 61 -18.859 -2.623 -13.962 1.00 0.00 O ATOM 895 OD2 ASP A 61 -20.333 -4.189 -14.414 1.00 0.00 O ATOM 0 H ASP A 61 -17.046 -6.903 -14.801 1.00 0.00 H new ATOM 0 HA ASP A 61 -17.388 -4.339 -15.839 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -18.582 -5.868 -13.925 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -17.690 -4.767 -12.895 1.00 0.00 H new ATOM 900 N PRO A 62 -15.524 -2.845 -15.077 1.00 0.00 N ATOM 901 CA PRO A 62 -14.434 -1.958 -14.657 1.00 0.00 C ATOM 902 C PRO A 62 -14.779 -1.176 -13.394 1.00 0.00 C ATOM 903 O PRO A 62 -13.899 -0.830 -12.605 1.00 0.00 O ATOM 904 CB PRO A 62 -14.274 -1.009 -15.845 1.00 0.00 C ATOM 905 CG PRO A 62 -15.617 -0.980 -16.486 1.00 0.00 C ATOM 906 CD PRO A 62 -16.191 -2.357 -16.300 1.00 0.00 C ATOM 0 HA PRO A 62 -13.528 -2.512 -14.411 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -13.969 -0.015 -15.520 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -13.512 -1.366 -16.538 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -16.254 -0.225 -16.025 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -15.540 -0.728 -17.544 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -17.274 -2.328 -16.182 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -15.980 -2.999 -17.156 1.00 0.00 H new ATOM 914 N HIS A 63 -16.066 -0.898 -13.208 1.00 0.00 N ATOM 915 CA HIS A 63 -16.529 -0.155 -12.041 1.00 0.00 C ATOM 916 C HIS A 63 -16.249 -0.925 -10.753 1.00 0.00 C ATOM 917 O HIS A 63 -16.147 -0.334 -9.677 1.00 0.00 O ATOM 918 CB HIS A 63 -18.025 0.137 -12.158 1.00 0.00 C ATOM 919 CG HIS A 63 -18.335 1.359 -12.965 1.00 0.00 C ATOM 920 ND1 HIS A 63 -19.561 1.991 -12.935 1.00 0.00 N ATOM 921 CD2 HIS A 63 -17.570 2.069 -13.829 1.00 0.00 C ATOM 922 CE1 HIS A 63 -19.537 3.035 -13.745 1.00 0.00 C ATOM 923 NE2 HIS A 63 -18.340 3.105 -14.299 1.00 0.00 N ATOM 0 H HIS A 63 -16.807 -1.176 -13.851 1.00 0.00 H new ATOM 0 HA HIS A 63 -15.982 0.787 -12.004 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -18.520 -0.722 -12.610 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -18.443 0.256 -11.158 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -16.545 1.859 -14.098 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -20.357 3.715 -13.924 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -18.037 3.813 -14.967 1.00 0.00 H new ATOM 932 N LYS A 64 -16.129 -2.245 -10.867 1.00 0.00 N ATOM 933 CA LYS A 64 -15.864 -3.093 -9.708 1.00 0.00 C ATOM 934 C LYS A 64 -14.613 -2.631 -8.965 1.00 0.00 C ATOM 935 O LYS A 64 -14.598 -2.564 -7.736 1.00 0.00 O ATOM 936 CB LYS A 64 -15.708 -4.552 -10.144 1.00 0.00 C ATOM 937 CG LYS A 64 -16.792 -5.469 -9.602 1.00 0.00 C ATOM 938 CD LYS A 64 -16.302 -6.902 -9.484 1.00 0.00 C ATOM 939 CE LYS A 64 -15.885 -7.233 -8.060 1.00 0.00 C ATOM 940 NZ LYS A 64 -16.249 -8.626 -7.685 1.00 0.00 N ATOM 0 H LYS A 64 -16.211 -2.750 -11.749 1.00 0.00 H new ATOM 0 HA LYS A 64 -16.713 -3.013 -9.029 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -15.715 -4.600 -11.233 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -14.736 -4.919 -9.815 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.116 -5.113 -8.624 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -17.662 -5.434 -10.258 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -17.090 -7.584 -9.801 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.458 -7.056 -10.156 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.808 -7.099 -7.957 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.361 -6.535 -7.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.651 -8.940 -6.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -17.248 -8.658 -7.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -16.103 -9.254 -8.501 1.00 0.00 H new ATOM 954 N GLU A 65 -13.565 -2.313 -9.719 1.00 0.00 N ATOM 955 CA GLU A 65 -12.311 -1.858 -9.130 1.00 0.00 C ATOM 956 C GLU A 65 -12.522 -0.589 -8.310 1.00 0.00 C ATOM 957 O GLU A 65 -11.814 -0.343 -7.334 1.00 0.00 O ATOM 958 CB GLU A 65 -11.272 -1.606 -10.223 1.00 0.00 C ATOM 959 CG GLU A 65 -10.791 -2.874 -10.911 1.00 0.00 C ATOM 960 CD GLU A 65 -11.343 -3.021 -12.316 1.00 0.00 C ATOM 961 OE1 GLU A 65 -11.565 -1.985 -12.977 1.00 0.00 O ATOM 962 OE2 GLU A 65 -11.554 -4.171 -12.754 1.00 0.00 O ATOM 0 H GLU A 65 -13.560 -2.362 -10.738 1.00 0.00 H new ATOM 0 HA GLU A 65 -11.946 -2.641 -8.465 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -11.698 -0.937 -10.970 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -10.415 -1.092 -9.787 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -9.702 -2.870 -10.951 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -11.085 -3.739 -10.317 1.00 0.00 H new ATOM 969 N GLU A 66 -13.501 0.215 -8.714 1.00 0.00 N ATOM 970 CA GLU A 66 -13.805 1.459 -8.016 1.00 0.00 C ATOM 971 C GLU A 66 -14.581 1.188 -6.732 1.00 0.00 C ATOM 972 O GLU A 66 -14.377 1.857 -5.719 1.00 0.00 O ATOM 973 CB GLU A 66 -14.609 2.392 -8.924 1.00 0.00 C ATOM 974 CG GLU A 66 -13.768 3.074 -9.992 1.00 0.00 C ATOM 975 CD GLU A 66 -14.613 3.739 -11.062 1.00 0.00 C ATOM 976 OE1 GLU A 66 -15.097 3.025 -11.964 1.00 0.00 O ATOM 977 OE2 GLU A 66 -14.791 4.973 -10.996 1.00 0.00 O ATOM 0 H GLU A 66 -14.097 0.027 -9.520 1.00 0.00 H new ATOM 0 HA GLU A 66 -12.862 1.939 -7.754 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.402 1.821 -9.407 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.092 3.154 -8.312 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -13.128 3.821 -9.523 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -13.112 2.339 -10.457 1.00 0.00 H new ATOM 984 N GLU A 67 -15.472 0.203 -6.782 1.00 0.00 N ATOM 985 CA GLU A 67 -16.280 -0.156 -5.622 1.00 0.00 C ATOM 986 C GLU A 67 -15.435 -0.870 -4.571 1.00 0.00 C ATOM 987 O GLU A 67 -15.568 -0.613 -3.374 1.00 0.00 O ATOM 988 CB GLU A 67 -17.449 -1.048 -6.044 1.00 0.00 C ATOM 989 CG GLU A 67 -18.295 -0.453 -7.158 1.00 0.00 C ATOM 990 CD GLU A 67 -19.028 0.802 -6.728 1.00 0.00 C ATOM 991 OE1 GLU A 67 -18.357 1.759 -6.286 1.00 0.00 O ATOM 992 OE2 GLU A 67 -20.272 0.828 -6.831 1.00 0.00 O ATOM 0 H GLU A 67 -15.653 -0.361 -7.613 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.672 0.763 -5.186 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -17.060 -2.013 -6.370 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -18.083 -1.236 -5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.656 -0.222 -8.010 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.019 -1.195 -7.495 1.00 0.00 H new ATOM 999 N ILE A 68 -14.567 -1.768 -5.026 1.00 0.00 N ATOM 1000 CA ILE A 68 -13.702 -2.519 -4.124 1.00 0.00 C ATOM 1001 C ILE A 68 -12.719 -1.597 -3.410 1.00 0.00 C ATOM 1002 O ILE A 68 -12.601 -1.629 -2.185 1.00 0.00 O ATOM 1003 CB ILE A 68 -12.915 -3.608 -4.880 1.00 0.00 C ATOM 1004 CG1 ILE A 68 -13.868 -4.486 -5.695 1.00 0.00 C ATOM 1005 CG2 ILE A 68 -12.108 -4.455 -3.907 1.00 0.00 C ATOM 1006 CD1 ILE A 68 -13.261 -5.006 -6.979 1.00 0.00 C ATOM 0 H ILE A 68 -14.444 -1.993 -6.013 1.00 0.00 H new ATOM 0 HA ILE A 68 -14.348 -2.995 -3.386 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.222 -3.121 -5.566 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -14.183 -5.331 -5.083 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -14.764 -3.913 -5.932 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -11.559 -5.218 -4.458 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.405 -3.820 -3.368 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -12.782 -4.934 -3.197 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -13.992 -5.620 -7.505 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.971 -4.166 -7.611 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -12.381 -5.607 -6.748 1.00 0.00 H new ATOM 1018 N ARG A 69 -12.015 -0.778 -4.183 1.00 0.00 N ATOM 1019 CA ARG A 69 -11.040 0.153 -3.624 1.00 0.00 C ATOM 1020 C ARG A 69 -11.709 1.125 -2.657 1.00 0.00 C ATOM 1021 O ARG A 69 -11.110 1.535 -1.661 1.00 0.00 O ATOM 1022 CB ARG A 69 -10.343 0.927 -4.743 1.00 0.00 C ATOM 1023 CG ARG A 69 -9.274 0.123 -5.464 1.00 0.00 C ATOM 1024 CD ARG A 69 -8.888 0.769 -6.785 1.00 0.00 C ATOM 1025 NE ARG A 69 -7.577 0.322 -7.251 1.00 0.00 N ATOM 1026 CZ ARG A 69 -6.976 0.796 -8.340 1.00 0.00 C ATOM 1027 NH1 ARG A 69 -7.565 1.730 -9.077 1.00 0.00 N ATOM 1028 NH2 ARG A 69 -5.783 0.337 -8.692 1.00 0.00 N ATOM 0 H ARG A 69 -12.101 -0.739 -5.199 1.00 0.00 H new ATOM 0 HA ARG A 69 -10.297 -0.424 -3.074 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.090 1.254 -5.467 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -9.890 1.825 -4.324 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.392 0.036 -4.829 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -9.638 -0.888 -5.645 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.640 0.532 -7.538 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.882 1.853 -6.670 1.00 0.00 H new ATOM 0 HE ARG A 69 -7.094 -0.395 -6.710 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.482 2.088 -8.810 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -7.100 2.090 -9.911 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.326 -0.380 -8.128 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.323 0.700 -9.527 1.00 0.00 H new ATOM 1042 N LYS A 70 -12.951 1.489 -2.956 1.00 0.00 N ATOM 1043 CA LYS A 70 -13.701 2.413 -2.112 1.00 0.00 C ATOM 1044 C LYS A 70 -14.024 1.778 -0.764 1.00 0.00 C ATOM 1045 O LYS A 70 -13.899 2.416 0.281 1.00 0.00 O ATOM 1046 CB LYS A 70 -14.993 2.840 -2.811 1.00 0.00 C ATOM 1047 CG LYS A 70 -15.693 4.007 -2.134 1.00 0.00 C ATOM 1048 CD LYS A 70 -17.194 3.780 -2.039 1.00 0.00 C ATOM 1049 CE LYS A 70 -17.875 4.882 -1.243 1.00 0.00 C ATOM 1050 NZ LYS A 70 -19.351 4.878 -1.438 1.00 0.00 N ATOM 0 H LYS A 70 -13.460 1.159 -3.776 1.00 0.00 H new ATOM 0 HA LYS A 70 -13.082 3.293 -1.939 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -14.766 3.112 -3.842 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -15.674 1.990 -2.848 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -15.282 4.149 -1.135 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -15.497 4.923 -2.692 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -17.621 3.737 -3.041 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -17.388 2.816 -1.568 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -17.649 4.758 -0.184 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -17.472 5.849 -1.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -19.777 5.644 -0.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -19.569 5.022 -2.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -19.740 3.965 -1.127 1.00 0.00 H new ATOM 1064 N TYR A 71 -14.441 0.516 -0.796 1.00 0.00 N ATOM 1065 CA TYR A 71 -14.782 -0.208 0.423 1.00 0.00 C ATOM 1066 C TYR A 71 -13.528 -0.686 1.151 1.00 0.00 C ATOM 1067 O TYR A 71 -13.571 -0.986 2.344 1.00 0.00 O ATOM 1068 CB TYR A 71 -15.681 -1.402 0.095 1.00 0.00 C ATOM 1069 CG TYR A 71 -17.139 -1.035 -0.070 1.00 0.00 C ATOM 1070 CD1 TYR A 71 -17.879 -0.558 1.005 1.00 0.00 C ATOM 1071 CD2 TYR A 71 -17.774 -1.164 -1.299 1.00 0.00 C ATOM 1072 CE1 TYR A 71 -19.212 -0.221 0.860 1.00 0.00 C ATOM 1073 CE2 TYR A 71 -19.106 -0.828 -1.452 1.00 0.00 C ATOM 1074 CZ TYR A 71 -19.820 -0.358 -0.370 1.00 0.00 C ATOM 1075 OH TYR A 71 -21.146 -0.023 -0.519 1.00 0.00 O ATOM 0 H TYR A 71 -14.551 -0.026 -1.653 1.00 0.00 H new ATOM 0 HA TYR A 71 -15.318 0.476 1.080 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -15.327 -1.871 -0.823 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -15.589 -2.144 0.888 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -17.405 -0.449 1.969 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -17.218 -1.533 -2.148 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -19.774 0.148 1.705 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -19.585 -0.933 -2.414 1.00 0.00 H new ATOM 0 HH TYR A 71 -21.652 -0.811 -0.809 1.00 0.00 H new ATOM 1085 N SER A 72 -12.412 -0.754 0.430 1.00 0.00 N ATOM 1086 CA SER A 72 -11.151 -1.195 1.014 1.00 0.00 C ATOM 1087 C SER A 72 -10.305 -0.003 1.453 1.00 0.00 C ATOM 1088 O SER A 72 -9.084 -0.004 1.293 1.00 0.00 O ATOM 1089 CB SER A 72 -10.372 -2.048 0.011 1.00 0.00 C ATOM 1090 OG SER A 72 -10.707 -3.419 0.138 1.00 0.00 O ATOM 0 H SER A 72 -12.356 -0.509 -0.559 1.00 0.00 H new ATOM 0 HA SER A 72 -11.378 -1.797 1.894 1.00 0.00 H new ATOM 0 HB2 SER A 72 -10.587 -1.710 -1.003 1.00 0.00 H new ATOM 0 HB3 SER A 72 -9.302 -1.916 0.170 1.00 0.00 H new ATOM 0 HG SER A 72 -11.408 -3.646 -0.508 1.00 0.00 H new ATOM 1096 N ALA A 73 -10.961 1.010 2.011 1.00 0.00 N ATOM 1097 CA ALA A 73 -10.268 2.206 2.475 1.00 0.00 C ATOM 1098 C ALA A 73 -10.122 2.199 3.993 1.00 0.00 C ATOM 1099 O ALA A 73 -10.786 2.963 4.695 1.00 0.00 O ATOM 1100 CB ALA A 73 -11.006 3.455 2.017 1.00 0.00 C ATOM 0 H ALA A 73 -11.971 1.026 2.153 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.268 2.210 2.040 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.477 4.340 2.371 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.053 3.471 0.928 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -12.017 3.450 2.424 1.00 0.00 H new ATOM 1106 N ILE A 74 -9.250 1.331 4.494 1.00 0.00 N ATOM 1107 CA ILE A 74 -9.017 1.222 5.929 1.00 0.00 C ATOM 1108 C ILE A 74 -8.121 2.350 6.429 1.00 0.00 C ATOM 1109 O ILE A 74 -8.350 2.909 7.503 1.00 0.00 O ATOM 1110 CB ILE A 74 -8.372 -0.129 6.294 1.00 0.00 C ATOM 1111 CG1 ILE A 74 -9.144 -1.280 5.645 1.00 0.00 C ATOM 1112 CG2 ILE A 74 -8.320 -0.304 7.804 1.00 0.00 C ATOM 1113 CD1 ILE A 74 -8.365 -2.575 5.589 1.00 0.00 C ATOM 0 H ILE A 74 -8.693 0.692 3.927 1.00 0.00 H new ATOM 0 HA ILE A 74 -9.991 1.294 6.412 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.351 -0.140 5.913 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.068 -1.445 6.199 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -9.427 -0.992 4.633 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.862 -1.263 8.044 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.730 0.500 8.243 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.332 -0.274 8.209 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -8.974 -3.346 5.117 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.454 -2.427 5.009 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.105 -2.887 6.600 1.00 0.00 H new ATOM 1125 N TYR A 75 -7.099 2.679 5.646 1.00 0.00 N ATOM 1126 CA TYR A 75 -6.167 3.740 6.011 1.00 0.00 C ATOM 1127 C TYR A 75 -6.504 5.037 5.282 1.00 0.00 C ATOM 1128 O TYR A 75 -6.466 6.118 5.869 1.00 0.00 O ATOM 1129 CB TYR A 75 -4.732 3.319 5.692 1.00 0.00 C ATOM 1130 CG TYR A 75 -4.179 2.280 6.643 1.00 0.00 C ATOM 1131 CD1 TYR A 75 -4.624 0.966 6.599 1.00 0.00 C ATOM 1132 CD2 TYR A 75 -3.214 2.617 7.583 1.00 0.00 C ATOM 1133 CE1 TYR A 75 -4.121 0.014 7.467 1.00 0.00 C ATOM 1134 CE2 TYR A 75 -2.707 1.670 8.454 1.00 0.00 C ATOM 1135 CZ TYR A 75 -3.165 0.372 8.392 1.00 0.00 C ATOM 1136 OH TYR A 75 -2.661 -0.573 9.257 1.00 0.00 O ATOM 0 H TYR A 75 -6.895 2.226 4.755 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.257 3.915 7.083 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.695 2.926 4.676 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -4.090 4.200 5.716 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.375 0.683 5.876 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -2.854 3.634 7.635 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.476 -1.005 7.420 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -1.956 1.946 9.179 1.00 0.00 H new ATOM 0 HH TYR A 75 -3.385 -1.161 9.557 1.00 0.00 H new ATOM 1347 N LEU A 88 -3.090 9.238 5.161 1.00 0.00 N ATOM 1348 CA LEU A 88 -1.986 8.472 4.594 1.00 0.00 C ATOM 1349 C LEU A 88 -0.715 9.311 4.541 1.00 0.00 C ATOM 1350 O LEU A 88 -0.759 10.534 4.673 1.00 0.00 O ATOM 1351 CB LEU A 88 -2.347 7.982 3.190 1.00 0.00 C ATOM 1352 CG LEU A 88 -3.696 7.269 3.079 1.00 0.00 C ATOM 1353 CD1 LEU A 88 -4.390 7.634 1.776 1.00 0.00 C ATOM 1354 CD2 LEU A 88 -3.510 5.761 3.182 1.00 0.00 C ATOM 0 HA LEU A 88 -1.805 7.610 5.237 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.348 8.836 2.513 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.566 7.304 2.846 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.327 7.597 3.905 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.348 7.117 1.716 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.557 8.711 1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.764 7.337 0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -4.479 5.269 3.101 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.861 5.419 2.376 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.057 5.515 4.142 1.00 0.00 H new ATOM 1366 N THR A 89 0.419 8.645 4.347 1.00 0.00 N ATOM 1367 CA THR A 89 1.704 9.330 4.274 1.00 0.00 C ATOM 1368 C THR A 89 2.727 8.489 3.518 1.00 0.00 C ATOM 1369 O THR A 89 3.390 8.976 2.602 1.00 0.00 O ATOM 1370 CB THR A 89 2.222 9.639 5.681 1.00 0.00 C ATOM 1371 OG1 THR A 89 3.562 10.093 5.634 1.00 0.00 O ATOM 1372 CG2 THR A 89 2.174 8.447 6.611 1.00 0.00 C ATOM 0 H THR A 89 0.474 7.632 4.238 1.00 0.00 H new ATOM 0 HA THR A 89 1.558 10.265 3.734 1.00 0.00 H new ATOM 0 HB THR A 89 1.557 10.410 6.070 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.874 10.286 6.543 1.00 0.00 H new ATOM 0 HG21 THR A 89 2.555 8.734 7.591 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.144 8.103 6.709 1.00 0.00 H new ATOM 0 HG23 THR A 89 2.788 7.643 6.204 1.00 0.00 H new ATOM 1380 N LEU A 90 2.851 7.225 3.907 1.00 0.00 N ATOM 1381 CA LEU A 90 3.794 6.317 3.264 1.00 0.00 C ATOM 1382 C LEU A 90 3.432 4.862 3.547 1.00 0.00 C ATOM 1383 O LEU A 90 2.959 4.147 2.665 1.00 0.00 O ATOM 1384 CB LEU A 90 5.218 6.605 3.745 1.00 0.00 C ATOM 1385 CG LEU A 90 6.295 5.675 3.177 1.00 0.00 C ATOM 1386 CD1 LEU A 90 7.298 6.461 2.346 1.00 0.00 C ATOM 1387 CD2 LEU A 90 7.001 4.925 4.296 1.00 0.00 C ATOM 0 H LEU A 90 2.311 6.806 4.664 1.00 0.00 H new ATOM 0 HA LEU A 90 3.741 6.480 2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 90 5.472 7.632 3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.238 6.538 4.833 1.00 0.00 H new ATOM 0 HG LEU A 90 5.809 4.946 2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 90 8.055 5.783 1.952 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.782 6.949 1.519 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.777 7.215 2.971 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.762 4.270 3.871 1.00 0.00 H new ATOM 0 HD22 LEU A 90 7.472 5.639 4.972 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.275 4.328 4.848 1.00 0.00 H new ATOM 1399 N HIS A 91 3.659 4.432 4.784 1.00 0.00 N ATOM 1400 CA HIS A 91 3.360 3.063 5.184 1.00 0.00 C ATOM 1401 C HIS A 91 1.861 2.788 5.115 1.00 0.00 C ATOM 1402 O HIS A 91 1.437 1.661 4.857 1.00 0.00 O ATOM 1403 CB HIS A 91 3.872 2.799 6.601 1.00 0.00 C ATOM 1404 CG HIS A 91 3.787 1.361 7.010 1.00 0.00 C ATOM 1405 ND1 HIS A 91 2.869 0.892 7.927 1.00 0.00 N ATOM 1406 CD2 HIS A 91 4.510 0.285 6.622 1.00 0.00 C ATOM 1407 CE1 HIS A 91 3.032 -0.409 8.085 1.00 0.00 C ATOM 1408 NE2 HIS A 91 4.022 -0.802 7.304 1.00 0.00 N ATOM 0 H HIS A 91 4.049 5.013 5.526 1.00 0.00 H new ATOM 0 HA HIS A 91 3.866 2.392 4.490 1.00 0.00 H new ATOM 0 HB2 HIS A 91 4.909 3.127 6.671 1.00 0.00 H new ATOM 0 HB3 HIS A 91 3.298 3.403 7.304 1.00 0.00 H new ATOM 0 HD2 HIS A 91 5.321 0.282 5.908 1.00 0.00 H new ATOM 0 HE1 HIS A 91 2.454 -1.043 8.741 1.00 0.00 H new ATOM 0 HE2 HIS A 91 4.368 -1.758 7.221 1.00 0.00 H new ATOM 1417 N GLU A 92 1.062 3.824 5.349 1.00 0.00 N ATOM 1418 CA GLU A 92 -0.390 3.693 5.314 1.00 0.00 C ATOM 1419 C GLU A 92 -0.881 3.431 3.894 1.00 0.00 C ATOM 1420 O GLU A 92 -1.903 2.774 3.691 1.00 0.00 O ATOM 1421 CB GLU A 92 -1.051 4.955 5.871 1.00 0.00 C ATOM 1422 CG GLU A 92 -0.875 5.123 7.371 1.00 0.00 C ATOM 1423 CD GLU A 92 0.167 6.167 7.722 1.00 0.00 C ATOM 1424 OE1 GLU A 92 -0.187 7.363 7.779 1.00 0.00 O ATOM 1425 OE2 GLU A 92 1.337 5.788 7.940 1.00 0.00 O ATOM 0 H GLU A 92 1.396 4.763 5.565 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.667 2.842 5.936 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.635 5.826 5.365 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -2.116 4.930 5.639 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.830 5.404 7.816 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.588 4.167 7.809 1.00 0.00 H new ATOM 1432 N LEU A 93 -0.149 3.947 2.913 1.00 0.00 N ATOM 1433 CA LEU A 93 -0.511 3.768 1.511 1.00 0.00 C ATOM 1434 C LEU A 93 -0.252 2.334 1.061 1.00 0.00 C ATOM 1435 O LEU A 93 -1.020 1.770 0.280 1.00 0.00 O ATOM 1436 CB LEU A 93 0.278 4.740 0.630 1.00 0.00 C ATOM 1437 CG LEU A 93 -0.189 6.195 0.690 1.00 0.00 C ATOM 1438 CD1 LEU A 93 0.695 7.073 -0.182 1.00 0.00 C ATOM 1439 CD2 LEU A 93 -1.646 6.306 0.261 1.00 0.00 C ATOM 0 H LEU A 93 0.699 4.493 3.063 1.00 0.00 H new ATOM 0 HA LEU A 93 -1.576 3.976 1.408 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.328 4.699 0.921 1.00 0.00 H new ATOM 0 HB3 LEU A 93 0.220 4.398 -0.403 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.108 6.542 1.720 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.349 8.105 -0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.725 7.017 0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.646 6.727 -1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.961 7.348 0.310 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.753 5.942 -0.761 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -2.268 5.707 0.927 1.00 0.00 H new ATOM 1451 N THR A 94 0.834 1.750 1.557 1.00 0.00 N ATOM 1452 CA THR A 94 1.196 0.382 1.204 1.00 0.00 C ATOM 1453 C THR A 94 0.119 -0.604 1.648 1.00 0.00 C ATOM 1454 O THR A 94 -0.067 -1.653 1.031 1.00 0.00 O ATOM 1455 CB THR A 94 2.537 0.010 1.838 1.00 0.00 C ATOM 1456 OG1 THR A 94 3.514 0.996 1.559 1.00 0.00 O ATOM 1457 CG2 THR A 94 3.076 -1.321 1.360 1.00 0.00 C ATOM 0 H THR A 94 1.479 2.203 2.205 1.00 0.00 H new ATOM 0 HA THR A 94 1.284 0.326 0.119 1.00 0.00 H new ATOM 0 HB THR A 94 2.342 -0.059 2.908 1.00 0.00 H new ATOM 0 HG1 THR A 94 4.364 0.741 1.974 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.029 -1.524 1.848 1.00 0.00 H new ATOM 0 HG22 THR A 94 2.366 -2.111 1.606 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.222 -1.288 0.280 1.00 0.00 H new ATOM 1465 N VAL A 95 -0.586 -0.263 2.722 1.00 0.00 N ATOM 1466 CA VAL A 95 -1.640 -1.121 3.246 1.00 0.00 C ATOM 1467 C VAL A 95 -2.970 -0.855 2.547 1.00 0.00 C ATOM 1468 O VAL A 95 -3.704 -1.784 2.212 1.00 0.00 O ATOM 1469 CB VAL A 95 -1.824 -0.923 4.764 1.00 0.00 C ATOM 1470 CG1 VAL A 95 -2.815 -1.935 5.321 1.00 0.00 C ATOM 1471 CG2 VAL A 95 -0.487 -1.024 5.484 1.00 0.00 C ATOM 0 H VAL A 95 -0.446 0.601 3.245 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.332 -2.149 3.054 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.227 0.076 4.933 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.931 -1.779 6.393 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -3.780 -1.808 4.830 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.445 -2.944 5.139 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.638 -0.881 6.554 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.052 -2.008 5.307 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.188 -0.255 5.107 1.00 0.00 H new ATOM 1481 N ASN A 96 -3.273 0.420 2.329 1.00 0.00 N ATOM 1482 CA ASN A 96 -4.515 0.809 1.670 1.00 0.00 C ATOM 1483 C ASN A 96 -4.601 0.214 0.268 1.00 0.00 C ATOM 1484 O ASN A 96 -5.683 -0.138 -0.201 1.00 0.00 O ATOM 1485 CB ASN A 96 -4.622 2.334 1.596 1.00 0.00 C ATOM 1486 CG ASN A 96 -6.060 2.811 1.549 1.00 0.00 C ATOM 1487 OD1 ASN A 96 -6.951 2.196 2.136 1.00 0.00 O ATOM 1488 ND2 ASN A 96 -6.295 3.913 0.847 1.00 0.00 N ATOM 0 H ASN A 96 -2.676 1.202 2.599 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.345 0.420 2.260 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -4.125 2.773 2.461 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -4.095 2.690 0.711 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -7.244 4.281 0.779 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -5.527 4.391 0.376 1.00 0.00 H new ATOM 1495 N GLU A 97 -3.456 0.105 -0.395 1.00 0.00 N ATOM 1496 CA GLU A 97 -3.403 -0.447 -1.745 1.00 0.00 C ATOM 1497 C GLU A 97 -3.306 -1.970 -1.709 1.00 0.00 C ATOM 1498 O GLU A 97 -3.782 -2.654 -2.615 1.00 0.00 O ATOM 1499 CB GLU A 97 -2.212 0.137 -2.510 1.00 0.00 C ATOM 1500 CG GLU A 97 -2.614 0.981 -3.708 1.00 0.00 C ATOM 1501 CD GLU A 97 -2.335 2.457 -3.502 1.00 0.00 C ATOM 1502 OE1 GLU A 97 -1.172 2.808 -3.215 1.00 0.00 O ATOM 1503 OE2 GLU A 97 -3.281 3.263 -3.628 1.00 0.00 O ATOM 0 H GLU A 97 -2.551 0.391 -0.021 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.325 -0.174 -2.259 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.617 0.747 -1.830 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -1.573 -0.679 -2.849 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -2.076 0.633 -4.590 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.676 0.840 -3.907 1.00 0.00 H new ATOM 1510 N ALA A 98 -2.685 -2.495 -0.657 1.00 0.00 N ATOM 1511 CA ALA A 98 -2.524 -3.936 -0.506 1.00 0.00 C ATOM 1512 C ALA A 98 -3.853 -4.612 -0.190 1.00 0.00 C ATOM 1513 O ALA A 98 -4.188 -5.647 -0.768 1.00 0.00 O ATOM 1514 CB ALA A 98 -1.505 -4.239 0.582 1.00 0.00 C ATOM 0 H ALA A 98 -2.286 -1.944 0.103 1.00 0.00 H new ATOM 0 HA ALA A 98 -2.163 -4.336 -1.453 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.393 -5.318 0.686 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.545 -3.799 0.314 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.846 -3.817 1.527 1.00 0.00 H new ATOM 1520 N ALA A 99 -4.609 -4.023 0.730 1.00 0.00 N ATOM 1521 CA ALA A 99 -5.901 -4.572 1.124 1.00 0.00 C ATOM 1522 C ALA A 99 -6.852 -4.656 -0.067 1.00 0.00 C ATOM 1523 O ALA A 99 -7.725 -5.523 -0.115 1.00 0.00 O ATOM 1524 CB ALA A 99 -6.516 -3.729 2.232 1.00 0.00 C ATOM 0 H ALA A 99 -4.349 -3.165 1.217 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.738 -5.583 1.497 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.480 -4.150 2.517 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -5.852 -3.725 3.097 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.656 -2.708 1.877 1.00 0.00 H new ATOM 1530 N ALA A 100 -6.678 -3.752 -1.024 1.00 0.00 N ATOM 1531 CA ALA A 100 -7.522 -3.725 -2.213 1.00 0.00 C ATOM 1532 C ALA A 100 -7.223 -4.906 -3.130 1.00 0.00 C ATOM 1533 O ALA A 100 -8.134 -5.589 -3.598 1.00 0.00 O ATOM 1534 CB ALA A 100 -7.337 -2.414 -2.961 1.00 0.00 C ATOM 0 H ALA A 100 -5.960 -3.028 -1.000 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.560 -3.805 -1.891 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -7.973 -2.407 -3.846 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.611 -1.583 -2.311 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.295 -2.311 -3.262 1.00 0.00 H new ATOM 1540 N GLN A 101 -5.939 -5.141 -3.385 1.00 0.00 N ATOM 1541 CA GLN A 101 -5.519 -6.238 -4.249 1.00 0.00 C ATOM 1542 C GLN A 101 -5.995 -7.580 -3.699 1.00 0.00 C ATOM 1543 O GLN A 101 -6.247 -8.517 -4.456 1.00 0.00 O ATOM 1544 CB GLN A 101 -3.997 -6.245 -4.396 1.00 0.00 C ATOM 1545 CG GLN A 101 -3.462 -5.096 -5.236 1.00 0.00 C ATOM 1546 CD GLN A 101 -2.224 -5.478 -6.024 1.00 0.00 C ATOM 1547 OE1 GLN A 101 -2.221 -6.468 -6.755 1.00 0.00 O ATOM 1548 NE2 GLN A 101 -1.164 -4.691 -5.879 1.00 0.00 N ATOM 0 H GLN A 101 -5.172 -4.586 -3.005 1.00 0.00 H new ATOM 0 HA GLN A 101 -5.971 -6.088 -5.229 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.544 -6.202 -3.405 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -3.688 -7.188 -4.847 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.238 -4.762 -5.925 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.229 -4.253 -4.586 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.211 -3.880 -5.262 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -0.303 -4.897 -6.385 1.00 0.00 H new ATOM 1557 N LEU A 102 -6.114 -7.666 -2.379 1.00 0.00 N ATOM 1558 CA LEU A 102 -6.558 -8.894 -1.730 1.00 0.00 C ATOM 1559 C LEU A 102 -8.078 -9.014 -1.771 1.00 0.00 C ATOM 1560 O LEU A 102 -8.621 -10.117 -1.840 1.00 0.00 O ATOM 1561 CB LEU A 102 -6.071 -8.934 -0.281 1.00 0.00 C ATOM 1562 CG LEU A 102 -4.557 -9.078 -0.110 1.00 0.00 C ATOM 1563 CD1 LEU A 102 -4.076 -8.280 1.092 1.00 0.00 C ATOM 1564 CD2 LEU A 102 -4.176 -10.545 0.032 1.00 0.00 C ATOM 0 H LEU A 102 -5.909 -6.900 -1.737 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.131 -9.737 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.393 -8.021 0.220 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -6.559 -9.765 0.228 1.00 0.00 H new ATOM 0 HG LEU A 102 -4.070 -8.680 -1.000 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.997 -8.395 1.197 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -4.316 -7.226 0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.569 -8.646 1.993 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -3.096 -10.630 0.153 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -4.673 -10.967 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.485 -11.089 -0.860 1.00 0.00 H new ATOM 1576 N CYS A 103 -8.760 -7.875 -1.726 1.00 0.00 N ATOM 1577 CA CYS A 103 -10.218 -7.854 -1.758 1.00 0.00 C ATOM 1578 C CYS A 103 -10.740 -8.253 -3.134 1.00 0.00 C ATOM 1579 O CYS A 103 -11.779 -8.903 -3.250 1.00 0.00 O ATOM 1580 CB CYS A 103 -10.736 -6.463 -1.382 1.00 0.00 C ATOM 1581 SG CYS A 103 -11.703 -6.425 0.145 1.00 0.00 S ATOM 0 H CYS A 103 -8.326 -6.954 -1.667 1.00 0.00 H new ATOM 0 HA CYS A 103 -10.584 -8.579 -1.030 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -9.888 -5.786 -1.279 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -11.350 -6.083 -2.198 1.00 0.00 H new ATOM 0 HG CYS A 103 -11.660 -5.230 0.656 1.00 0.00 H new ATOM 1587 N VAL A 104 -10.013 -7.861 -4.176 1.00 0.00 N ATOM 1588 CA VAL A 104 -10.405 -8.179 -5.544 1.00 0.00 C ATOM 1589 C VAL A 104 -10.399 -9.685 -5.781 1.00 0.00 C ATOM 1590 O VAL A 104 -11.381 -10.251 -6.265 1.00 0.00 O ATOM 1591 CB VAL A 104 -9.470 -7.504 -6.566 1.00 0.00 C ATOM 1592 CG1 VAL A 104 -9.980 -7.722 -7.983 1.00 0.00 C ATOM 1593 CG2 VAL A 104 -9.329 -6.020 -6.265 1.00 0.00 C ATOM 0 H VAL A 104 -9.150 -7.323 -4.099 1.00 0.00 H new ATOM 0 HA VAL A 104 -11.417 -7.797 -5.681 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.484 -7.962 -6.485 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.307 -7.238 -8.691 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -10.022 -8.791 -8.194 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.978 -7.294 -8.081 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.665 -5.562 -6.998 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.308 -5.544 -6.315 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.913 -5.889 -5.266 1.00 0.00 H new ATOM 1603 N LYS A 105 -9.288 -10.329 -5.440 1.00 0.00 N ATOM 1604 CA LYS A 105 -9.155 -11.771 -5.617 1.00 0.00 C ATOM 1605 C LYS A 105 -10.228 -12.518 -4.828 1.00 0.00 C ATOM 1606 O LYS A 105 -10.680 -13.588 -5.235 1.00 0.00 O ATOM 1607 CB LYS A 105 -7.766 -12.234 -5.177 1.00 0.00 C ATOM 1608 CG LYS A 105 -6.648 -11.748 -6.085 1.00 0.00 C ATOM 1609 CD LYS A 105 -6.003 -12.897 -6.845 1.00 0.00 C ATOM 1610 CE LYS A 105 -6.923 -13.433 -7.929 1.00 0.00 C ATOM 1611 NZ LYS A 105 -6.291 -14.541 -8.697 1.00 0.00 N ATOM 0 H LYS A 105 -8.467 -9.876 -5.040 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.286 -11.996 -6.676 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -7.579 -11.881 -4.163 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -7.749 -13.323 -5.144 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -7.044 -11.020 -6.793 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -5.892 -11.235 -5.490 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -5.069 -12.559 -7.293 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -5.752 -13.699 -6.150 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -7.849 -13.787 -7.476 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.190 -12.625 -8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -6.951 -14.878 -9.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -5.421 -14.197 -9.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -6.059 -15.323 -8.051 1.00 0.00 H new ATOM 1625 N ASP A 106 -10.629 -11.946 -3.698 1.00 0.00 N ATOM 1626 CA ASP A 106 -11.649 -12.555 -2.852 1.00 0.00 C ATOM 1627 C ASP A 106 -12.659 -11.513 -2.381 1.00 0.00 C ATOM 1628 O ASP A 106 -12.338 -10.648 -1.566 1.00 0.00 O ATOM 1629 CB ASP A 106 -11.000 -13.237 -1.646 1.00 0.00 C ATOM 1630 CG ASP A 106 -12.010 -13.968 -0.783 1.00 0.00 C ATOM 1631 OD1 ASP A 106 -12.900 -13.301 -0.214 1.00 0.00 O ATOM 1632 OD2 ASP A 106 -11.912 -15.209 -0.677 1.00 0.00 O ATOM 0 H ASP A 106 -10.263 -11.061 -3.346 1.00 0.00 H new ATOM 0 HA ASP A 106 -12.177 -13.304 -3.443 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -10.245 -13.942 -1.994 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -10.484 -12.489 -1.043 1.00 0.00 H new ATOM 1637 N ASN A 107 -13.879 -11.601 -2.901 1.00 0.00 N ATOM 1638 CA ASN A 107 -14.935 -10.666 -2.535 1.00 0.00 C ATOM 1639 C ASN A 107 -15.348 -10.847 -1.077 1.00 0.00 C ATOM 1640 O ASN A 107 -15.812 -9.906 -0.432 1.00 0.00 O ATOM 1641 CB ASN A 107 -16.149 -10.854 -3.449 1.00 0.00 C ATOM 1642 CG ASN A 107 -16.767 -9.534 -3.869 1.00 0.00 C ATOM 1643 OD1 ASN A 107 -17.975 -9.334 -3.744 1.00 0.00 O ATOM 1644 ND2 ASN A 107 -15.938 -8.626 -4.371 1.00 0.00 N ATOM 0 H ASN A 107 -14.160 -12.311 -3.577 1.00 0.00 H new ATOM 0 HA ASN A 107 -14.547 -9.655 -2.658 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -15.849 -11.410 -4.337 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -16.898 -11.455 -2.934 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -16.296 -7.719 -4.671 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -14.943 -8.835 -4.456 1.00 0.00 H new ATOM 1651 N ALA A 108 -15.178 -12.060 -0.563 1.00 0.00 N ATOM 1652 CA ALA A 108 -15.536 -12.362 0.819 1.00 0.00 C ATOM 1653 C ALA A 108 -14.713 -11.530 1.798 1.00 0.00 C ATOM 1654 O ALA A 108 -15.159 -11.241 2.908 1.00 0.00 O ATOM 1655 CB ALA A 108 -15.348 -13.845 1.099 1.00 0.00 C ATOM 0 H ALA A 108 -14.795 -12.850 -1.082 1.00 0.00 H new ATOM 0 HA ALA A 108 -16.586 -12.104 0.959 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -15.618 -14.057 2.133 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.985 -14.425 0.431 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.306 -14.117 0.933 1.00 0.00 H new ATOM 1661 N LEU A 109 -13.510 -11.147 1.382 1.00 0.00 N ATOM 1662 CA LEU A 109 -12.627 -10.348 2.225 1.00 0.00 C ATOM 1663 C LEU A 109 -13.290 -9.035 2.629 1.00 0.00 C ATOM 1664 O LEU A 109 -12.977 -8.467 3.675 1.00 0.00 O ATOM 1665 CB LEU A 109 -11.309 -10.067 1.498 1.00 0.00 C ATOM 1666 CG LEU A 109 -10.173 -11.039 1.820 1.00 0.00 C ATOM 1667 CD1 LEU A 109 -8.945 -10.722 0.980 1.00 0.00 C ATOM 1668 CD2 LEU A 109 -9.835 -10.989 3.302 1.00 0.00 C ATOM 0 H LEU A 109 -13.124 -11.377 0.466 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.421 -10.919 3.130 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.492 -10.089 0.424 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.983 -9.057 1.745 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.503 -12.049 1.576 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.147 -11.424 1.223 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.195 -10.809 -0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.612 -9.706 1.192 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.025 -11.687 3.514 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.524 -9.979 3.570 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -10.714 -11.265 3.885 1.00 0.00 H new ATOM 1680 N LEU A 110 -14.208 -8.555 1.794 1.00 0.00 N ATOM 1681 CA LEU A 110 -14.912 -7.306 2.068 1.00 0.00 C ATOM 1682 C LEU A 110 -15.620 -7.363 3.419 1.00 0.00 C ATOM 1683 O LEU A 110 -15.657 -6.375 4.152 1.00 0.00 O ATOM 1684 CB LEU A 110 -15.925 -7.012 0.959 1.00 0.00 C ATOM 1685 CG LEU A 110 -15.387 -6.176 -0.202 1.00 0.00 C ATOM 1686 CD1 LEU A 110 -16.329 -6.249 -1.394 1.00 0.00 C ATOM 1687 CD2 LEU A 110 -15.185 -4.732 0.232 1.00 0.00 C ATOM 0 H LEU A 110 -14.481 -9.011 0.924 1.00 0.00 H new ATOM 0 HA LEU A 110 -14.175 -6.503 2.099 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -16.294 -7.959 0.565 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -16.779 -6.494 1.395 1.00 0.00 H new ATOM 0 HG LEU A 110 -14.422 -6.584 -0.503 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -15.930 -5.648 -2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -16.425 -7.285 -1.719 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -17.309 -5.867 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -14.802 -4.150 -0.606 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -16.137 -4.314 0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -14.471 -4.696 1.055 1.00 0.00 H new ATOM 1699 N THR A 111 -16.178 -8.524 3.742 1.00 0.00 N ATOM 1700 CA THR A 111 -16.882 -8.707 5.005 1.00 0.00 C ATOM 1701 C THR A 111 -15.895 -8.926 6.149 1.00 0.00 C ATOM 1702 O THR A 111 -16.161 -8.552 7.290 1.00 0.00 O ATOM 1703 CB THR A 111 -17.846 -9.891 4.913 1.00 0.00 C ATOM 1704 OG1 THR A 111 -17.241 -10.979 4.237 1.00 0.00 O ATOM 1705 CG2 THR A 111 -19.132 -9.560 4.187 1.00 0.00 C ATOM 0 H THR A 111 -16.156 -9.352 3.147 1.00 0.00 H new ATOM 0 HA THR A 111 -17.453 -7.801 5.208 1.00 0.00 H new ATOM 0 HB THR A 111 -18.085 -10.150 5.945 1.00 0.00 H new ATOM 0 HG1 THR A 111 -16.278 -10.818 4.154 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.771 -10.443 4.157 1.00 0.00 H new ATOM 0 HG22 THR A 111 -19.649 -8.756 4.711 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.904 -9.243 3.169 1.00 0.00 H new ATOM 1713 N ARG A 112 -14.756 -9.535 5.832 1.00 0.00 N ATOM 1714 CA ARG A 112 -13.728 -9.801 6.832 1.00 0.00 C ATOM 1715 C ARG A 112 -12.827 -8.585 7.019 1.00 0.00 C ATOM 1716 O ARG A 112 -12.223 -8.095 6.065 1.00 0.00 O ATOM 1717 CB ARG A 112 -12.891 -11.015 6.422 1.00 0.00 C ATOM 1718 CG ARG A 112 -13.700 -12.295 6.292 1.00 0.00 C ATOM 1719 CD ARG A 112 -12.816 -13.528 6.395 1.00 0.00 C ATOM 1720 NE ARG A 112 -12.650 -14.193 5.105 1.00 0.00 N ATOM 1721 CZ ARG A 112 -12.046 -15.369 4.949 1.00 0.00 C ATOM 1722 NH1 ARG A 112 -11.549 -16.012 5.998 1.00 0.00 N ATOM 1723 NH2 ARG A 112 -11.938 -15.903 3.740 1.00 0.00 N ATOM 0 H ARG A 112 -14.522 -9.853 4.891 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.222 -10.014 7.780 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -12.403 -10.805 5.470 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -12.102 -11.167 7.158 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -14.461 -12.326 7.072 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.223 -12.300 5.336 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -11.839 -13.242 6.783 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -13.251 -14.227 7.110 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.019 -13.729 4.275 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -11.629 -15.605 6.930 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -11.087 -16.913 5.872 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -12.318 -15.413 2.930 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.475 -16.804 3.620 1.00 0.00 H new ATOM 1737 N ARG A 113 -12.743 -8.101 8.254 1.00 0.00 N ATOM 1738 CA ARG A 113 -11.918 -6.940 8.565 1.00 0.00 C ATOM 1739 C ARG A 113 -10.586 -7.362 9.177 1.00 0.00 C ATOM 1740 O ARG A 113 -9.519 -7.025 8.663 1.00 0.00 O ATOM 1741 CB ARG A 113 -12.660 -6.005 9.522 1.00 0.00 C ATOM 1742 CG ARG A 113 -12.516 -4.533 9.171 1.00 0.00 C ATOM 1743 CD ARG A 113 -12.604 -3.652 10.406 1.00 0.00 C ATOM 1744 NE ARG A 113 -11.306 -3.087 10.770 1.00 0.00 N ATOM 1745 CZ ARG A 113 -10.764 -2.029 10.172 1.00 0.00 C ATOM 1746 NH1 ARG A 113 -11.401 -1.419 9.181 1.00 0.00 N ATOM 1747 NH2 ARG A 113 -9.581 -1.579 10.567 1.00 0.00 N ATOM 0 H ARG A 113 -13.236 -8.495 9.055 1.00 0.00 H new ATOM 0 HA ARG A 113 -11.715 -6.411 7.634 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -13.718 -6.267 9.525 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.289 -6.166 10.534 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -11.560 -4.369 8.674 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -13.296 -4.249 8.464 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -13.313 -2.844 10.225 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -12.992 -4.236 11.241 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.785 -3.530 11.527 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -12.312 -1.760 8.873 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -10.980 -0.608 8.727 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -9.087 -2.044 11.329 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -9.165 -0.768 10.109 1.00 0.00 H new ATOM 1761 N ASP A 114 -10.655 -8.101 10.280 1.00 0.00 N ATOM 1762 CA ASP A 114 -9.455 -8.568 10.966 1.00 0.00 C ATOM 1763 C ASP A 114 -8.583 -9.409 10.038 1.00 0.00 C ATOM 1764 O ASP A 114 -7.362 -9.450 10.187 1.00 0.00 O ATOM 1765 CB ASP A 114 -9.835 -9.383 12.203 1.00 0.00 C ATOM 1766 CG ASP A 114 -10.070 -8.510 13.421 1.00 0.00 C ATOM 1767 OD1 ASP A 114 -10.550 -7.370 13.250 1.00 0.00 O ATOM 1768 OD2 ASP A 114 -9.770 -8.966 14.545 1.00 0.00 O ATOM 0 H ASP A 114 -11.530 -8.389 10.718 1.00 0.00 H new ATOM 0 HA ASP A 114 -8.883 -7.693 11.275 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -10.736 -9.959 11.993 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -9.043 -10.099 12.420 1.00 0.00 H new ATOM 1773 N GLU A 115 -9.217 -10.081 9.083 1.00 0.00 N ATOM 1774 CA GLU A 115 -8.497 -10.922 8.135 1.00 0.00 C ATOM 1775 C GLU A 115 -7.752 -10.075 7.107 1.00 0.00 C ATOM 1776 O GLU A 115 -6.537 -10.193 6.955 1.00 0.00 O ATOM 1777 CB GLU A 115 -9.466 -11.872 7.426 1.00 0.00 C ATOM 1778 CG GLU A 115 -8.915 -13.277 7.246 1.00 0.00 C ATOM 1779 CD GLU A 115 -8.636 -13.968 8.565 1.00 0.00 C ATOM 1780 OE1 GLU A 115 -9.536 -13.980 9.432 1.00 0.00 O ATOM 1781 OE2 GLU A 115 -7.518 -14.498 8.734 1.00 0.00 O ATOM 0 H GLU A 115 -10.227 -10.059 8.945 1.00 0.00 H new ATOM 0 HA GLU A 115 -7.766 -11.508 8.692 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -10.393 -11.924 7.996 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.716 -11.460 6.448 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -9.626 -13.871 6.672 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.995 -13.230 6.663 1.00 0.00 H new ATOM 1788 N LEU A 116 -8.491 -9.224 6.403 1.00 0.00 N ATOM 1789 CA LEU A 116 -7.902 -8.359 5.387 1.00 0.00 C ATOM 1790 C LEU A 116 -6.819 -7.463 5.983 1.00 0.00 C ATOM 1791 O LEU A 116 -5.873 -7.075 5.297 1.00 0.00 O ATOM 1792 CB LEU A 116 -8.985 -7.499 4.730 1.00 0.00 C ATOM 1793 CG LEU A 116 -8.533 -6.717 3.497 1.00 0.00 C ATOM 1794 CD1 LEU A 116 -8.158 -7.667 2.370 1.00 0.00 C ATOM 1795 CD2 LEU A 116 -9.624 -5.757 3.046 1.00 0.00 C ATOM 0 H LEU A 116 -9.499 -9.115 6.517 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.441 -8.996 4.632 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -9.817 -8.144 4.447 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -9.365 -6.794 5.469 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.651 -6.135 3.763 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -7.839 -7.092 1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.344 -8.315 2.696 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -9.022 -8.276 2.105 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -9.285 -5.208 2.167 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -10.524 -6.320 2.798 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -9.845 -5.054 3.849 1.00 0.00 H new ATOM 1807 N PHE A 117 -6.965 -7.136 7.263 1.00 0.00 N ATOM 1808 CA PHE A 117 -5.999 -6.283 7.948 1.00 0.00 C ATOM 1809 C PHE A 117 -4.694 -7.030 8.213 1.00 0.00 C ATOM 1810 O PHE A 117 -3.631 -6.420 8.316 1.00 0.00 O ATOM 1811 CB PHE A 117 -6.583 -5.773 9.266 1.00 0.00 C ATOM 1812 CG PHE A 117 -5.922 -4.523 9.771 1.00 0.00 C ATOM 1813 CD1 PHE A 117 -6.154 -3.304 9.154 1.00 0.00 C ATOM 1814 CD2 PHE A 117 -5.069 -4.567 10.862 1.00 0.00 C ATOM 1815 CE1 PHE A 117 -5.546 -2.151 9.617 1.00 0.00 C ATOM 1816 CE2 PHE A 117 -4.459 -3.418 11.329 1.00 0.00 C ATOM 1817 CZ PHE A 117 -4.698 -2.209 10.705 1.00 0.00 C ATOM 0 H PHE A 117 -7.741 -7.448 7.846 1.00 0.00 H new ATOM 0 HA PHE A 117 -5.782 -5.434 7.299 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -7.648 -5.583 9.133 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -6.491 -6.554 10.021 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -6.817 -3.254 8.303 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -4.879 -5.510 11.353 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -5.734 -1.207 9.128 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -3.796 -3.465 12.181 1.00 0.00 H new ATOM 0 HZ PHE A 117 -4.222 -1.310 11.068 1.00 0.00 H new ATOM 1827 N ALA A 118 -4.783 -8.351 8.327 1.00 0.00 N ATOM 1828 CA ALA A 118 -3.608 -9.176 8.586 1.00 0.00 C ATOM 1829 C ALA A 118 -2.872 -9.527 7.295 1.00 0.00 C ATOM 1830 O ALA A 118 -1.713 -9.941 7.327 1.00 0.00 O ATOM 1831 CB ALA A 118 -4.010 -10.444 9.324 1.00 0.00 C ATOM 0 H ALA A 118 -5.655 -8.873 8.244 1.00 0.00 H new ATOM 0 HA ALA A 118 -2.926 -8.598 9.210 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.125 -11.052 9.512 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.477 -10.180 10.273 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -4.717 -11.010 8.717 1.00 0.00 H new ATOM 1837 N LEU A 119 -3.547 -9.364 6.160 1.00 0.00 N ATOM 1838 CA LEU A 119 -2.947 -9.672 4.866 1.00 0.00 C ATOM 1839 C LEU A 119 -2.225 -8.457 4.290 1.00 0.00 C ATOM 1840 O LEU A 119 -1.019 -8.497 4.046 1.00 0.00 O ATOM 1841 CB LEU A 119 -4.018 -10.153 3.886 1.00 0.00 C ATOM 1842 CG LEU A 119 -4.850 -11.344 4.369 1.00 0.00 C ATOM 1843 CD1 LEU A 119 -5.952 -11.664 3.371 1.00 0.00 C ATOM 1844 CD2 LEU A 119 -3.960 -12.559 4.591 1.00 0.00 C ATOM 0 H LEU A 119 -4.507 -9.022 6.110 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.215 -10.466 5.017 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.691 -9.323 3.670 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.535 -10.424 2.947 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.314 -11.079 5.319 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -6.533 -12.513 3.731 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.605 -10.798 3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.509 -11.910 2.406 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.567 -13.397 4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.469 -12.826 3.655 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.206 -12.325 5.343 1.00 0.00 H new ATOM 1856 N ALA A 120 -2.972 -7.379 4.070 1.00 0.00 N ATOM 1857 CA ALA A 120 -2.405 -6.153 3.517 1.00 0.00 C ATOM 1858 C ALA A 120 -1.224 -5.657 4.347 1.00 0.00 C ATOM 1859 O ALA A 120 -0.346 -4.961 3.838 1.00 0.00 O ATOM 1860 CB ALA A 120 -3.476 -5.075 3.426 1.00 0.00 C ATOM 0 H ALA A 120 -3.972 -7.329 4.266 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.036 -6.377 2.516 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.042 -4.165 3.012 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.284 -5.418 2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -3.870 -4.869 4.421 1.00 0.00 H new ATOM 1866 N ARG A 121 -1.210 -6.015 5.628 1.00 0.00 N ATOM 1867 CA ARG A 121 -0.135 -5.600 6.524 1.00 0.00 C ATOM 1868 C ARG A 121 1.105 -6.471 6.342 1.00 0.00 C ATOM 1869 O ARG A 121 2.225 -6.031 6.596 1.00 0.00 O ATOM 1870 CB ARG A 121 -0.607 -5.665 7.978 1.00 0.00 C ATOM 1871 CG ARG A 121 0.239 -4.834 8.929 1.00 0.00 C ATOM 1872 CD ARG A 121 -0.284 -3.412 9.042 1.00 0.00 C ATOM 1873 NE ARG A 121 0.159 -2.761 10.273 1.00 0.00 N ATOM 1874 CZ ARG A 121 -0.297 -3.075 11.483 1.00 0.00 C ATOM 1875 NH1 ARG A 121 -1.209 -4.029 11.630 1.00 0.00 N ATOM 1876 NH2 ARG A 121 0.159 -2.434 12.551 1.00 0.00 N ATOM 0 H ARG A 121 -1.929 -6.590 6.068 1.00 0.00 H new ATOM 0 HA ARG A 121 0.131 -4.573 6.275 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -1.641 -5.324 8.031 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.597 -6.704 8.309 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.245 -5.300 9.914 1.00 0.00 H new ATOM 0 HG3 ARG A 121 1.271 -4.816 8.579 1.00 0.00 H new ATOM 0 HD2 ARG A 121 0.055 -2.832 8.183 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -1.373 -3.423 9.010 1.00 0.00 H new ATOM 0 HE ARG A 121 0.859 -2.023 10.200 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -1.564 -4.526 10.813 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -1.555 -4.265 12.560 1.00 0.00 H new ATOM 0 HH21 ARG A 121 0.859 -1.700 12.445 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -0.191 -2.675 13.478 1.00 0.00 H new ATOM 1890 N GLN A 122 0.898 -7.709 5.904 1.00 0.00 N ATOM 1891 CA GLN A 122 2.002 -8.640 5.694 1.00 0.00 C ATOM 1892 C GLN A 122 2.932 -8.152 4.587 1.00 0.00 C ATOM 1893 O GLN A 122 4.142 -8.367 4.641 1.00 0.00 O ATOM 1894 CB GLN A 122 1.464 -10.030 5.349 1.00 0.00 C ATOM 1895 CG GLN A 122 1.269 -10.925 6.563 1.00 0.00 C ATOM 1896 CD GLN A 122 0.986 -12.366 6.186 1.00 0.00 C ATOM 1897 OE1 GLN A 122 1.642 -13.286 6.670 1.00 0.00 O ATOM 1898 NE2 GLN A 122 0.003 -12.567 5.316 1.00 0.00 N ATOM 0 H GLN A 122 -0.023 -8.091 5.688 1.00 0.00 H new ATOM 0 HA GLN A 122 2.574 -8.696 6.620 1.00 0.00 H new ATOM 0 HB2 GLN A 122 0.512 -9.923 4.830 1.00 0.00 H new ATOM 0 HB3 GLN A 122 2.152 -10.515 4.657 1.00 0.00 H new ATOM 0 HG2 GLN A 122 2.162 -10.885 7.186 1.00 0.00 H new ATOM 0 HG3 GLN A 122 0.444 -10.542 7.164 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -0.515 -11.773 4.940 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -0.234 -13.515 5.024 1.00 0.00 H new ATOM 1907 N ILE A 123 2.360 -7.498 3.581 1.00 0.00 N ATOM 1908 CA ILE A 123 3.141 -6.985 2.461 1.00 0.00 C ATOM 1909 C ILE A 123 3.784 -5.644 2.800 1.00 0.00 C ATOM 1910 O ILE A 123 4.855 -5.313 2.292 1.00 0.00 O ATOM 1911 CB ILE A 123 2.272 -6.818 1.200 1.00 0.00 C ATOM 1912 CG1 ILE A 123 1.460 -8.088 0.941 1.00 0.00 C ATOM 1913 CG2 ILE A 123 3.141 -6.484 -0.005 1.00 0.00 C ATOM 1914 CD1 ILE A 123 0.340 -7.896 -0.059 1.00 0.00 C ATOM 0 H ILE A 123 1.359 -7.311 3.518 1.00 0.00 H new ATOM 0 HA ILE A 123 3.923 -7.718 2.263 1.00 0.00 H new ATOM 0 HB ILE A 123 1.579 -5.993 1.363 1.00 0.00 H new ATOM 0 HG12 ILE A 123 2.128 -8.870 0.580 1.00 0.00 H new ATOM 0 HG13 ILE A 123 1.039 -8.439 1.883 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.511 -6.369 -0.887 1.00 0.00 H new ATOM 0 HG22 ILE A 123 3.678 -5.554 0.181 1.00 0.00 H new ATOM 0 HG23 ILE A 123 3.856 -7.289 -0.172 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.193 -8.837 -0.193 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.351 -7.137 0.309 1.00 0.00 H new ATOM 0 HD13 ILE A 123 0.756 -7.575 -1.014 1.00 0.00 H new ATOM 1926 N SER A 124 3.122 -4.876 3.659 1.00 0.00 N ATOM 1927 CA SER A 124 3.630 -3.568 4.062 1.00 0.00 C ATOM 1928 C SER A 124 4.975 -3.693 4.772 1.00 0.00 C ATOM 1929 O SER A 124 5.778 -2.761 4.767 1.00 0.00 O ATOM 1930 CB SER A 124 2.623 -2.868 4.976 1.00 0.00 C ATOM 1931 OG SER A 124 2.542 -1.484 4.679 1.00 0.00 O ATOM 0 H SER A 124 2.234 -5.135 4.089 1.00 0.00 H new ATOM 0 HA SER A 124 3.773 -2.972 3.161 1.00 0.00 H new ATOM 0 HB2 SER A 124 1.641 -3.326 4.859 1.00 0.00 H new ATOM 0 HB3 SER A 124 2.916 -3.003 6.017 1.00 0.00 H new ATOM 0 HG SER A 124 3.439 -1.136 4.494 1.00 0.00 H new ATOM 1937 N ARG A 125 5.215 -4.849 5.385 1.00 0.00 N ATOM 1938 CA ARG A 125 6.462 -5.087 6.101 1.00 0.00 C ATOM 1939 C ARG A 125 7.586 -5.464 5.139 1.00 0.00 C ATOM 1940 O ARG A 125 8.756 -5.178 5.394 1.00 0.00 O ATOM 1941 CB ARG A 125 6.273 -6.193 7.142 1.00 0.00 C ATOM 1942 CG ARG A 125 6.083 -5.671 8.558 1.00 0.00 C ATOM 1943 CD ARG A 125 6.857 -6.500 9.570 1.00 0.00 C ATOM 1944 NE ARG A 125 6.252 -7.813 9.778 1.00 0.00 N ATOM 1945 CZ ARG A 125 6.893 -8.850 10.314 1.00 0.00 C ATOM 1946 NH1 ARG A 125 8.159 -8.731 10.694 1.00 0.00 N ATOM 1947 NH2 ARG A 125 6.268 -10.009 10.468 1.00 0.00 N ATOM 0 H ARG A 125 4.563 -5.633 5.400 1.00 0.00 H new ATOM 0 HA ARG A 125 6.740 -4.163 6.607 1.00 0.00 H new ATOM 0 HB2 ARG A 125 5.407 -6.795 6.867 1.00 0.00 H new ATOM 0 HB3 ARG A 125 7.140 -6.853 7.120 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.411 -4.633 8.610 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.023 -5.683 8.812 1.00 0.00 H new ATOM 0 HD2 ARG A 125 7.884 -6.624 9.227 1.00 0.00 H new ATOM 0 HD3 ARG A 125 6.900 -5.966 10.519 1.00 0.00 H new ATOM 0 HE ARG A 125 5.281 -7.943 9.496 1.00 0.00 H new ATOM 0 HH11 ARG A 125 8.645 -7.842 10.576 1.00 0.00 H new ATOM 0 HH12 ARG A 125 8.645 -9.528 11.104 1.00 0.00 H new ATOM 0 HH21 ARG A 125 5.296 -10.107 10.176 1.00 0.00 H new ATOM 0 HH22 ARG A 125 6.760 -10.803 10.879 1.00 0.00 H new ATOM 1961 N GLU A 126 7.225 -6.111 4.035 1.00 0.00 N ATOM 1962 CA GLU A 126 8.205 -6.528 3.040 1.00 0.00 C ATOM 1963 C GLU A 126 8.529 -5.390 2.077 1.00 0.00 C ATOM 1964 O GLU A 126 9.684 -5.193 1.700 1.00 0.00 O ATOM 1965 CB GLU A 126 7.688 -7.737 2.259 1.00 0.00 C ATOM 1966 CG GLU A 126 7.513 -8.983 3.112 1.00 0.00 C ATOM 1967 CD GLU A 126 8.661 -9.962 2.957 1.00 0.00 C ATOM 1968 OE1 GLU A 126 8.709 -10.660 1.922 1.00 0.00 O ATOM 1969 OE2 GLU A 126 9.510 -10.030 3.869 1.00 0.00 O ATOM 0 H GLU A 126 6.262 -6.357 3.808 1.00 0.00 H new ATOM 0 HA GLU A 126 9.119 -6.805 3.566 1.00 0.00 H new ATOM 0 HB2 GLU A 126 6.732 -7.482 1.802 1.00 0.00 H new ATOM 0 HB3 GLU A 126 8.380 -7.957 1.447 1.00 0.00 H new ATOM 0 HG2 GLU A 126 7.427 -8.693 4.159 1.00 0.00 H new ATOM 0 HG3 GLU A 126 6.580 -9.477 2.840 1.00 0.00 H new ATOM 1976 N VAL A 127 7.502 -4.645 1.681 1.00 0.00 N ATOM 1977 CA VAL A 127 7.678 -3.529 0.759 1.00 0.00 C ATOM 1978 C VAL A 127 8.567 -2.445 1.364 1.00 0.00 C ATOM 1979 O VAL A 127 9.249 -1.717 0.644 1.00 0.00 O ATOM 1980 CB VAL A 127 6.324 -2.906 0.367 1.00 0.00 C ATOM 1981 CG1 VAL A 127 6.512 -1.860 -0.721 1.00 0.00 C ATOM 1982 CG2 VAL A 127 5.348 -3.984 -0.082 1.00 0.00 C ATOM 0 H VAL A 127 6.540 -4.794 1.984 1.00 0.00 H new ATOM 0 HA VAL A 127 8.159 -3.931 -0.133 1.00 0.00 H new ATOM 0 HB VAL A 127 5.905 -2.413 1.244 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.545 -1.431 -0.985 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.172 -1.072 -0.358 1.00 0.00 H new ATOM 0 HG13 VAL A 127 6.954 -2.326 -1.601 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.398 -3.524 -0.355 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.758 -4.509 -0.945 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.188 -4.692 0.731 1.00 0.00 H new ATOM 1992 N THR A 128 8.551 -2.341 2.689 1.00 0.00 N ATOM 1993 CA THR A 128 9.354 -1.343 3.386 1.00 0.00 C ATOM 1994 C THR A 128 10.823 -1.752 3.429 1.00 0.00 C ATOM 1995 O THR A 128 11.715 -0.917 3.277 1.00 0.00 O ATOM 1996 CB THR A 128 8.829 -1.138 4.808 1.00 0.00 C ATOM 1997 OG1 THR A 128 8.254 -2.331 5.307 1.00 0.00 O ATOM 1998 CG2 THR A 128 7.783 -0.048 4.908 1.00 0.00 C ATOM 0 H THR A 128 7.991 -2.935 3.301 1.00 0.00 H new ATOM 0 HA THR A 128 9.275 -0.405 2.836 1.00 0.00 H new ATOM 0 HB THR A 128 9.697 -0.842 5.397 1.00 0.00 H new ATOM 0 HG1 THR A 128 7.278 -2.241 5.325 1.00 0.00 H new ATOM 0 HG21 THR A 128 7.453 0.046 5.943 1.00 0.00 H new ATOM 0 HG22 THR A 128 8.211 0.898 4.576 1.00 0.00 H new ATOM 0 HG23 THR A 128 6.931 -0.302 4.277 1.00 0.00 H new ATOM 2006 N TYR A 129 11.068 -3.042 3.638 1.00 0.00 N ATOM 2007 CA TYR A 129 12.431 -3.559 3.703 1.00 0.00 C ATOM 2008 C TYR A 129 13.181 -3.290 2.401 1.00 0.00 C ATOM 2009 O TYR A 129 14.107 -2.479 2.365 1.00 0.00 O ATOM 2010 CB TYR A 129 12.415 -5.061 3.994 1.00 0.00 C ATOM 2011 CG TYR A 129 13.790 -5.648 4.220 1.00 0.00 C ATOM 2012 CD1 TYR A 129 14.552 -5.278 5.322 1.00 0.00 C ATOM 2013 CD2 TYR A 129 14.325 -6.573 3.332 1.00 0.00 C ATOM 2014 CE1 TYR A 129 15.810 -5.813 5.531 1.00 0.00 C ATOM 2015 CE2 TYR A 129 15.582 -7.112 3.535 1.00 0.00 C ATOM 2016 CZ TYR A 129 16.319 -6.730 4.635 1.00 0.00 C ATOM 2017 OH TYR A 129 17.570 -7.264 4.840 1.00 0.00 O ATOM 0 H TYR A 129 10.342 -3.747 3.765 1.00 0.00 H new ATOM 0 HA TYR A 129 12.949 -3.043 4.512 1.00 0.00 H new ATOM 0 HB2 TYR A 129 11.801 -5.245 4.875 1.00 0.00 H new ATOM 0 HB3 TYR A 129 11.940 -5.579 3.161 1.00 0.00 H new ATOM 0 HD1 TYR A 129 14.155 -4.561 6.026 1.00 0.00 H new ATOM 0 HD2 TYR A 129 13.750 -6.876 2.469 1.00 0.00 H new ATOM 0 HE1 TYR A 129 16.391 -5.514 6.391 1.00 0.00 H new ATOM 0 HE2 TYR A 129 15.984 -7.829 2.835 1.00 0.00 H new ATOM 0 HH TYR A 129 17.779 -7.894 4.119 1.00 0.00 H new ATOM 2027 N LYS A 130 12.777 -3.974 1.337 1.00 0.00 N ATOM 2028 CA LYS A 130 13.413 -3.809 0.035 1.00 0.00 C ATOM 2029 C LYS A 130 13.001 -2.489 -0.609 1.00 0.00 C ATOM 2030 O LYS A 130 11.883 -2.352 -1.105 1.00 0.00 O ATOM 2031 CB LYS A 130 13.050 -4.976 -0.885 1.00 0.00 C ATOM 2032 CG LYS A 130 13.274 -6.339 -0.252 1.00 0.00 C ATOM 2033 CD LYS A 130 12.592 -7.443 -1.045 1.00 0.00 C ATOM 2034 CE LYS A 130 13.593 -8.245 -1.863 1.00 0.00 C ATOM 2035 NZ LYS A 130 13.314 -9.706 -1.805 1.00 0.00 N ATOM 0 H LYS A 130 12.012 -4.648 1.350 1.00 0.00 H new ATOM 0 HA LYS A 130 14.493 -3.797 0.185 1.00 0.00 H new ATOM 0 HB2 LYS A 130 12.003 -4.887 -1.176 1.00 0.00 H new ATOM 0 HB3 LYS A 130 13.642 -4.906 -1.798 1.00 0.00 H new ATOM 0 HG2 LYS A 130 14.343 -6.541 -0.191 1.00 0.00 H new ATOM 0 HG3 LYS A 130 12.892 -6.334 0.769 1.00 0.00 H new ATOM 0 HD2 LYS A 130 12.063 -8.108 -0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 130 11.845 -7.007 -1.709 1.00 0.00 H new ATOM 0 HE2 LYS A 130 13.565 -7.911 -2.900 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.600 -8.053 -1.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 14.018 -10.217 -2.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 13.366 -10.030 -0.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 12.363 -9.893 -2.181 1.00 0.00 H new