USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 587 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 176 SER OG : rot 180:sc= 0.0595 USER MOD Single : A 179 GLN : amide:sc= 1.97 K(o=2,f=-4.2!) USER MOD Single : A 182 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 184 THR OG1 : rot -24:sc= 0.125 USER MOD Single : A 188 CYS SG : rot -98:sc= 1.16 USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 195 SER OG : rot 180:sc= 0 USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 199 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 203 SER OG : rot 78:sc= 2.09 USER MOD Single : A 204 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 205 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 207 LYS NZ :NH3+ 148:sc= 0 (180deg=-0.0612) USER MOD Single : A 209 HIS : no HE2:sc= -0.0882 K(o=-0.088,f=-2.5!) USER MOD Single : A 211 SER OG : rot 180:sc= 0 USER MOD Single : A 214 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 218 CYS SG : rot 147:sc= 0.054! USER MOD Single : A 224 SER OG : rot 68:sc= 1.26 USER MOD Single : A 228 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 229 LYS NZ :NH3+ -144:sc= 0.817 (180deg=-0.497!) USER MOD Single : A 231 HIS : no HD1:sc= -0.039 X(o=-0.039,f=0) USER MOD Single : A 234 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 235 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 236 HIS : no HD1:sc= -0.236 X(o=-0.24,f=-0.07) USER MOD Single : A 237 THR OG1 : rot 61:sc= 1.23 USER MOD Single : A 241 SER OG : rot -55:sc= 0.00303 USER MOD Single : A 243 HIS : no HE2:sc= 0.783 K(o=0.78,f=-2.4!) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 175 9.174 30.627 -33.943 1.00 44.44 N ATOM 2 CA ARG A 175 9.914 31.599 -34.753 1.00 25.31 C ATOM 3 C ARG A 175 9.140 31.954 -36.033 1.00 23.33 C ATOM 4 O ARG A 175 9.741 32.281 -37.055 1.00 72.25 O ATOM 5 CB ARG A 175 11.358 31.089 -34.960 1.00 63.20 C ATOM 6 CG ARG A 175 12.446 32.167 -34.848 1.00 35.43 C ATOM 7 CD ARG A 175 12.514 33.133 -36.043 1.00 51.31 C ATOM 8 NE ARG A 175 13.887 33.596 -36.307 1.00 63.41 N ATOM 9 CZ ARG A 175 14.734 34.221 -35.483 1.00 22.04 C ATOM 10 NH1 ARG A 175 14.348 34.697 -34.301 1.00 63.22 N1+ ATOM 11 NH2 ARG A 175 15.996 34.340 -35.869 1.00 52.51 N ATOM 0 HA ARG A 175 10.007 32.553 -34.235 1.00 25.31 H new ATOM 0 HB2 ARG A 175 11.562 30.310 -34.225 1.00 63.20 H new ATOM 0 HB3 ARG A 175 11.427 30.625 -35.944 1.00 63.20 H new ATOM 0 HG2 ARG A 175 12.275 32.745 -33.940 1.00 35.43 H new ATOM 0 HG3 ARG A 175 13.414 31.678 -34.737 1.00 35.43 H new ATOM 0 HD2 ARG A 175 12.122 32.637 -36.931 1.00 51.31 H new ATOM 0 HD3 ARG A 175 11.873 33.993 -35.849 1.00 51.31 H new ATOM 0 HE ARG A 175 14.240 33.415 -37.247 1.00 63.41 H new ATOM 0 HH11 ARG A 175 13.379 34.590 -34.000 1.00 63.22 H new ATOM 0 HH12 ARG A 175 15.021 35.169 -33.697 1.00 63.22 H new ATOM 0 HH21 ARG A 175 16.292 33.961 -36.768 1.00 52.51 H new ATOM 0 HH22 ARG A 175 16.671 34.811 -35.267 1.00 52.51 H new ATOM 25 N SER A 176 7.811 31.863 -35.992 1.00 54.30 N ATOM 26 CA SER A 176 6.895 32.259 -37.047 1.00 40.15 C ATOM 27 C SER A 176 6.608 33.765 -36.956 1.00 12.11 C ATOM 28 O SER A 176 7.109 34.460 -36.064 1.00 40.04 O ATOM 29 CB SER A 176 5.621 31.418 -36.874 1.00 24.33 C ATOM 30 OG SER A 176 5.161 31.493 -35.538 1.00 71.11 O ATOM 0 H SER A 176 7.325 31.491 -35.176 1.00 54.30 H new ATOM 0 HA SER A 176 7.319 32.082 -38.035 1.00 40.15 H new ATOM 0 HB2 SER A 176 4.847 31.775 -37.553 1.00 24.33 H new ATOM 0 HB3 SER A 176 5.823 30.380 -37.138 1.00 24.33 H new ATOM 0 HG SER A 176 4.348 30.954 -35.441 1.00 71.11 H new ATOM 36 N LEU A 177 5.753 34.267 -37.848 1.00 42.40 N ATOM 37 CA LEU A 177 5.147 35.597 -37.791 1.00 14.14 C ATOM 38 C LEU A 177 3.628 35.409 -37.893 1.00 25.25 C ATOM 39 O LEU A 177 3.156 34.282 -38.073 1.00 72.32 O ATOM 40 CB LEU A 177 5.718 36.485 -38.922 1.00 62.05 C ATOM 41 CG LEU A 177 6.243 37.869 -38.490 1.00 74.24 C ATOM 42 CD1 LEU A 177 5.171 38.748 -37.831 1.00 32.31 C ATOM 43 CD2 LEU A 177 7.463 37.753 -37.568 1.00 21.13 C ATOM 0 H LEU A 177 5.451 33.735 -38.664 1.00 42.40 H new ATOM 0 HA LEU A 177 5.378 36.109 -36.857 1.00 14.14 H new ATOM 0 HB2 LEU A 177 6.531 35.944 -39.407 1.00 62.05 H new ATOM 0 HB3 LEU A 177 4.940 36.630 -39.672 1.00 62.05 H new ATOM 0 HG LEU A 177 6.543 38.362 -39.414 1.00 74.24 H new ATOM 0 HD11 LEU A 177 5.608 39.707 -37.552 1.00 32.31 H new ATOM 0 HD12 LEU A 177 4.353 38.912 -38.533 1.00 32.31 H new ATOM 0 HD13 LEU A 177 4.789 38.250 -36.940 1.00 32.31 H new ATOM 0 HD21 LEU A 177 7.802 38.750 -37.286 1.00 21.13 H new ATOM 0 HD22 LEU A 177 7.190 37.196 -36.672 1.00 21.13 H new ATOM 0 HD23 LEU A 177 8.265 37.231 -38.090 1.00 21.13 H new ATOM 55 N ARG A 178 2.851 36.488 -37.778 1.00 24.30 N ATOM 56 CA ARG A 178 1.414 36.490 -38.035 1.00 3.45 C ATOM 57 C ARG A 178 1.054 37.837 -38.648 1.00 25.42 C ATOM 58 O ARG A 178 1.422 38.873 -38.097 1.00 34.30 O ATOM 59 CB ARG A 178 0.617 36.140 -36.765 1.00 73.44 C ATOM 60 CG ARG A 178 0.771 37.074 -35.549 1.00 23.23 C ATOM 61 CD ARG A 178 0.185 36.368 -34.317 1.00 61.32 C ATOM 62 NE ARG A 178 0.067 37.237 -33.137 1.00 43.12 N ATOM 63 CZ ARG A 178 0.962 37.400 -32.156 1.00 4.41 C ATOM 64 NH1 ARG A 178 2.186 36.884 -32.251 1.00 33.23 N1+ ATOM 65 NH2 ARG A 178 0.622 38.081 -31.067 1.00 63.23 N ATOM 0 H ARG A 178 3.212 37.400 -37.498 1.00 24.30 H new ATOM 0 HA ARG A 178 1.140 35.711 -38.746 1.00 3.45 H new ATOM 0 HB2 ARG A 178 -0.440 36.104 -37.030 1.00 73.44 H new ATOM 0 HB3 ARG A 178 0.902 35.135 -36.455 1.00 73.44 H new ATOM 0 HG2 ARG A 178 1.822 37.313 -35.385 1.00 23.23 H new ATOM 0 HG3 ARG A 178 0.254 38.017 -35.727 1.00 23.23 H new ATOM 0 HD2 ARG A 178 -0.801 35.976 -34.569 1.00 61.32 H new ATOM 0 HD3 ARG A 178 0.813 35.513 -34.066 1.00 61.32 H new ATOM 0 HE ARG A 178 -0.795 37.777 -33.057 1.00 43.12 H new ATOM 0 HH11 ARG A 178 2.453 36.355 -33.081 1.00 33.23 H new ATOM 0 HH12 ARG A 178 2.856 37.018 -31.494 1.00 33.23 H new ATOM 0 HH21 ARG A 178 -0.315 38.475 -30.984 1.00 63.23 H new ATOM 0 HH22 ARG A 178 1.298 38.210 -30.314 1.00 63.23 H new ATOM 79 N GLN A 179 0.456 37.812 -39.834 1.00 24.00 N ATOM 80 CA GLN A 179 0.037 38.985 -40.586 1.00 3.32 C ATOM 81 C GLN A 179 -1.277 39.545 -40.025 1.00 35.51 C ATOM 82 O GLN A 179 -1.860 38.987 -39.096 1.00 2.32 O ATOM 83 CB GLN A 179 -0.034 38.635 -42.093 1.00 52.52 C ATOM 84 CG GLN A 179 -1.272 37.870 -42.617 1.00 55.30 C ATOM 85 CD GLN A 179 -1.535 36.496 -41.994 1.00 71.53 C ATOM 86 OE1 GLN A 179 -0.648 35.849 -41.446 1.00 14.25 O ATOM 87 NE2 GLN A 179 -2.766 36.018 -42.051 1.00 3.14 N ATOM 0 H GLN A 179 0.242 36.938 -40.315 1.00 24.00 H new ATOM 0 HA GLN A 179 0.771 39.783 -40.478 1.00 3.32 H new ATOM 0 HB2 GLN A 179 0.041 39.567 -42.653 1.00 52.52 H new ATOM 0 HB3 GLN A 179 0.849 38.044 -42.338 1.00 52.52 H new ATOM 0 HG2 GLN A 179 -2.152 38.493 -42.456 1.00 55.30 H new ATOM 0 HG3 GLN A 179 -1.164 37.742 -43.694 1.00 55.30 H new ATOM 0 HE21 GLN A 179 -3.502 36.557 -42.507 1.00 3.14 H new ATOM 0 HE22 GLN A 179 -2.980 35.110 -41.639 1.00 3.14 H new ATOM 96 N ARG A 180 -1.784 40.628 -40.624 1.00 65.05 N ATOM 97 CA ARG A 180 -3.156 41.094 -40.431 1.00 64.25 C ATOM 98 C ARG A 180 -3.801 41.136 -41.807 1.00 43.03 C ATOM 99 O ARG A 180 -3.764 42.169 -42.464 1.00 61.12 O ATOM 100 CB ARG A 180 -3.201 42.463 -39.735 1.00 54.40 C ATOM 101 CG ARG A 180 -2.796 42.394 -38.258 1.00 40.31 C ATOM 102 CD ARG A 180 -3.012 43.769 -37.617 1.00 25.33 C ATOM 103 NE ARG A 180 -2.682 43.766 -36.182 1.00 63.12 N ATOM 104 CZ ARG A 180 -2.824 44.808 -35.353 1.00 4.44 C ATOM 105 NH1 ARG A 180 -3.293 45.971 -35.806 1.00 33.41 N1+ ATOM 106 NH2 ARG A 180 -2.494 44.683 -34.069 1.00 74.54 N ATOM 0 H ARG A 180 -1.244 41.211 -41.264 1.00 65.05 H new ATOM 0 HA ARG A 180 -3.702 40.418 -39.773 1.00 64.25 H new ATOM 0 HB2 ARG A 180 -2.537 43.152 -40.257 1.00 54.40 H new ATOM 0 HB3 ARG A 180 -4.209 42.871 -39.812 1.00 54.40 H new ATOM 0 HG2 ARG A 180 -3.388 41.640 -37.740 1.00 40.31 H new ATOM 0 HG3 ARG A 180 -1.751 42.096 -38.168 1.00 40.31 H new ATOM 0 HD2 ARG A 180 -2.396 44.509 -38.129 1.00 25.33 H new ATOM 0 HD3 ARG A 180 -4.051 44.072 -37.750 1.00 25.33 H new ATOM 0 HE ARG A 180 -2.315 42.900 -35.787 1.00 63.12 H new ATOM 0 HH11 ARG A 180 -3.546 46.071 -36.789 1.00 33.41 H new ATOM 0 HH12 ARG A 180 -3.399 46.761 -35.169 1.00 33.41 H new ATOM 0 HH21 ARG A 180 -2.134 43.795 -33.719 1.00 74.54 H new ATOM 0 HH22 ARG A 180 -2.601 45.475 -33.435 1.00 74.54 H new ATOM 120 N LEU A 181 -4.287 39.984 -42.260 1.00 42.44 N ATOM 121 CA LEU A 181 -5.088 39.800 -43.462 1.00 73.23 C ATOM 122 C LEU A 181 -5.713 38.422 -43.279 1.00 71.21 C ATOM 123 O LEU A 181 -4.976 37.436 -43.170 1.00 74.14 O ATOM 124 CB LEU A 181 -4.223 39.868 -44.740 1.00 33.22 C ATOM 125 CG LEU A 181 -5.038 40.111 -46.030 1.00 33.35 C ATOM 126 CD1 LEU A 181 -4.069 40.389 -47.186 1.00 5.21 C ATOM 127 CD2 LEU A 181 -5.940 38.935 -46.429 1.00 70.12 C ATOM 0 H LEU A 181 -4.122 39.105 -41.769 1.00 42.44 H new ATOM 0 HA LEU A 181 -5.835 40.583 -43.588 1.00 73.23 H new ATOM 0 HB2 LEU A 181 -3.489 40.666 -44.629 1.00 33.22 H new ATOM 0 HB3 LEU A 181 -3.668 38.936 -44.842 1.00 33.22 H new ATOM 0 HG LEU A 181 -5.691 40.959 -45.826 1.00 33.35 H new ATOM 0 HD11 LEU A 181 -4.635 40.562 -48.101 1.00 5.21 H new ATOM 0 HD12 LEU A 181 -3.472 41.272 -46.956 1.00 5.21 H new ATOM 0 HD13 LEU A 181 -3.410 39.531 -47.323 1.00 5.21 H new ATOM 0 HD21 LEU A 181 -6.478 39.183 -47.344 1.00 70.12 H new ATOM 0 HD22 LEU A 181 -5.329 38.048 -46.597 1.00 70.12 H new ATOM 0 HD23 LEU A 181 -6.654 38.737 -45.630 1.00 70.12 H new ATOM 139 N GLN A 182 -7.034 38.346 -43.154 1.00 62.31 N ATOM 140 CA GLN A 182 -7.806 37.098 -43.120 1.00 40.10 C ATOM 141 C GLN A 182 -9.162 37.288 -43.823 1.00 63.11 C ATOM 142 O GLN A 182 -10.016 36.412 -43.819 1.00 12.30 O ATOM 143 CB GLN A 182 -7.922 36.619 -41.660 1.00 72.53 C ATOM 144 CG GLN A 182 -8.623 35.261 -41.483 1.00 23.40 C ATOM 145 CD GLN A 182 -8.208 34.553 -40.194 1.00 41.05 C ATOM 146 OE1 GLN A 182 -8.755 34.773 -39.117 1.00 54.13 O ATOM 147 NE2 GLN A 182 -7.228 33.667 -40.265 1.00 22.23 N ATOM 0 H GLN A 182 -7.621 39.176 -43.070 1.00 62.31 H new ATOM 0 HA GLN A 182 -7.295 36.311 -43.675 1.00 40.10 H new ATOM 0 HB2 GLN A 182 -6.921 36.555 -41.232 1.00 72.53 H new ATOM 0 HB3 GLN A 182 -8.466 37.371 -41.087 1.00 72.53 H new ATOM 0 HG2 GLN A 182 -9.703 35.411 -41.480 1.00 23.40 H new ATOM 0 HG3 GLN A 182 -8.392 34.622 -42.335 1.00 23.40 H new ATOM 0 HE21 GLN A 182 -6.772 33.482 -41.158 1.00 22.23 H new ATOM 0 HE22 GLN A 182 -6.929 33.169 -39.427 1.00 22.23 H new ATOM 156 N ASP A 183 -9.346 38.432 -44.465 1.00 20.03 N ATOM 157 CA ASP A 183 -10.593 39.074 -44.864 1.00 43.12 C ATOM 158 C ASP A 183 -11.233 38.366 -46.046 1.00 32.23 C ATOM 159 O ASP A 183 -12.412 38.533 -46.341 1.00 34.24 O ATOM 160 CB ASP A 183 -10.289 40.554 -45.185 1.00 20.31 C ATOM 161 CG ASP A 183 -9.411 41.237 -44.122 1.00 12.13 C ATOM 162 OD1 ASP A 183 -8.222 40.830 -44.015 1.00 23.45 O1- ATOM 163 OD2 ASP A 183 -9.924 42.104 -43.388 1.00 22.45 O ATOM 0 H ASP A 183 -8.543 38.993 -44.749 1.00 20.03 H new ATOM 0 HA ASP A 183 -11.315 39.015 -44.049 1.00 43.12 H new ATOM 0 HB2 ASP A 183 -9.790 40.614 -46.152 1.00 20.31 H new ATOM 0 HB3 ASP A 183 -11.228 41.100 -45.276 1.00 20.31 H new ATOM 168 N THR A 184 -10.446 37.510 -46.686 1.00 51.30 N ATOM 169 CA THR A 184 -10.881 36.581 -47.700 1.00 22.11 C ATOM 170 C THR A 184 -11.705 35.424 -47.119 1.00 53.13 C ATOM 171 O THR A 184 -12.322 34.683 -47.884 1.00 71.31 O ATOM 172 CB THR A 184 -9.635 36.098 -48.472 1.00 3.31 C ATOM 173 OG1 THR A 184 -9.987 35.274 -49.561 1.00 25.41 O ATOM 174 CG2 THR A 184 -8.623 35.349 -47.585 1.00 51.10 C ATOM 0 H THR A 184 -9.445 37.448 -46.498 1.00 51.30 H new ATOM 0 HA THR A 184 -11.560 37.083 -48.390 1.00 22.11 H new ATOM 0 HB THR A 184 -9.156 37.007 -48.836 1.00 3.31 H new ATOM 0 HG1 THR A 184 -10.861 34.863 -49.392 1.00 25.41 H new ATOM 0 HG21 THR A 184 -7.771 35.037 -48.189 1.00 51.10 H new ATOM 0 HG22 THR A 184 -8.280 36.008 -46.788 1.00 51.10 H new ATOM 0 HG23 THR A 184 -9.100 34.471 -47.150 1.00 51.10 H new ATOM 182 N VAL A 185 -11.708 35.238 -45.799 1.00 43.51 N ATOM 183 CA VAL A 185 -12.458 34.173 -45.134 1.00 73.04 C ATOM 184 C VAL A 185 -13.803 34.775 -44.710 1.00 11.42 C ATOM 185 O VAL A 185 -14.133 34.873 -43.529 1.00 54.52 O ATOM 186 CB VAL A 185 -11.626 33.542 -43.993 1.00 23.54 C ATOM 187 CG1 VAL A 185 -12.290 32.270 -43.437 1.00 72.43 C ATOM 188 CG2 VAL A 185 -10.214 33.134 -44.461 1.00 23.12 C ATOM 0 H VAL A 185 -11.184 35.829 -45.154 1.00 43.51 H new ATOM 0 HA VAL A 185 -12.663 33.331 -45.795 1.00 73.04 H new ATOM 0 HB VAL A 185 -11.565 34.313 -43.225 1.00 23.54 H new ATOM 0 HG11 VAL A 185 -11.674 31.858 -42.638 1.00 72.43 H new ATOM 0 HG12 VAL A 185 -13.277 32.516 -43.045 1.00 72.43 H new ATOM 0 HG13 VAL A 185 -12.390 31.534 -44.234 1.00 72.43 H new ATOM 0 HG21 VAL A 185 -9.667 32.696 -43.627 1.00 23.12 H new ATOM 0 HG22 VAL A 185 -10.294 32.403 -45.266 1.00 23.12 H new ATOM 0 HG23 VAL A 185 -9.682 34.014 -44.822 1.00 23.12 H new ATOM 198 N GLY A 186 -14.585 35.204 -45.700 1.00 64.11 N ATOM 199 CA GLY A 186 -15.857 35.872 -45.529 1.00 14.24 C ATOM 200 C GLY A 186 -16.741 35.479 -46.699 1.00 62.45 C ATOM 201 O GLY A 186 -16.289 35.497 -47.841 1.00 21.23 O ATOM 0 H GLY A 186 -14.331 35.086 -46.681 1.00 64.11 H new ATOM 0 HA2 GLY A 186 -16.319 35.581 -44.585 1.00 14.24 H new ATOM 0 HA3 GLY A 186 -15.721 36.953 -45.498 1.00 14.24 H new ATOM 205 N LEU A 187 -17.984 35.097 -46.399 1.00 72.41 N ATOM 206 CA LEU A 187 -19.065 34.673 -47.301 1.00 12.03 C ATOM 207 C LEU A 187 -18.752 33.583 -48.339 1.00 61.21 C ATOM 208 O LEU A 187 -19.639 33.201 -49.097 1.00 12.43 O ATOM 209 CB LEU A 187 -19.800 35.890 -47.891 1.00 63.55 C ATOM 210 CG LEU A 187 -19.168 36.464 -49.181 1.00 32.34 C ATOM 211 CD1 LEU A 187 -20.154 36.338 -50.345 1.00 15.23 C ATOM 212 CD2 LEU A 187 -18.770 37.932 -48.997 1.00 11.21 C ATOM 0 H LEU A 187 -18.292 35.073 -45.427 1.00 72.41 H new ATOM 0 HA LEU A 187 -19.744 34.128 -46.646 1.00 12.03 H new ATOM 0 HB2 LEU A 187 -20.831 35.607 -48.103 1.00 63.55 H new ATOM 0 HB3 LEU A 187 -19.834 36.677 -47.138 1.00 63.55 H new ATOM 0 HG LEU A 187 -18.267 35.891 -49.401 1.00 32.34 H new ATOM 0 HD11 LEU A 187 -19.702 36.744 -51.250 1.00 15.23 H new ATOM 0 HD12 LEU A 187 -20.399 35.288 -50.502 1.00 15.23 H new ATOM 0 HD13 LEU A 187 -21.063 36.892 -50.113 1.00 15.23 H new ATOM 0 HD21 LEU A 187 -18.329 38.308 -49.920 1.00 11.21 H new ATOM 0 HD22 LEU A 187 -19.654 38.521 -48.751 1.00 11.21 H new ATOM 0 HD23 LEU A 187 -18.044 38.013 -48.188 1.00 11.21 H new ATOM 224 N CYS A 188 -17.538 33.046 -48.359 1.00 5.10 N ATOM 225 CA CYS A 188 -17.047 32.098 -49.343 1.00 41.23 C ATOM 226 C CYS A 188 -16.294 30.978 -48.623 1.00 61.24 C ATOM 227 O CYS A 188 -15.990 31.096 -47.437 1.00 13.40 O ATOM 228 CB CYS A 188 -16.209 32.870 -50.372 1.00 24.44 C ATOM 229 SG CYS A 188 -16.256 32.015 -51.975 1.00 53.45 S ATOM 0 H CYS A 188 -16.837 33.273 -47.653 1.00 5.10 H new ATOM 0 HA CYS A 188 -17.852 31.611 -49.893 1.00 41.23 H new ATOM 0 HB2 CYS A 188 -16.593 33.884 -50.480 1.00 24.44 H new ATOM 0 HB3 CYS A 188 -15.179 32.955 -50.025 1.00 24.44 H new ATOM 0 HG CYS A 188 -15.183 31.295 -52.114 1.00 53.45 H new ATOM 235 N PHE A 189 -15.999 29.900 -49.356 1.00 52.22 N ATOM 236 CA PHE A 189 -15.287 28.702 -48.907 1.00 21.13 C ATOM 237 C PHE A 189 -15.784 28.203 -47.536 1.00 22.14 C ATOM 238 O PHE A 189 -15.071 28.324 -46.538 1.00 63.21 O ATOM 239 CB PHE A 189 -13.768 28.933 -48.958 1.00 11.22 C ATOM 240 CG PHE A 189 -13.234 29.151 -50.361 1.00 52.44 C ATOM 241 CD1 PHE A 189 -13.427 30.389 -51.002 1.00 41.44 C ATOM 242 CD2 PHE A 189 -12.568 28.112 -51.040 1.00 72.12 C ATOM 243 CE1 PHE A 189 -12.947 30.593 -52.307 1.00 33.44 C ATOM 244 CE2 PHE A 189 -12.092 28.316 -52.347 1.00 71.13 C ATOM 245 CZ PHE A 189 -12.278 29.556 -52.982 1.00 32.31 C ATOM 0 H PHE A 189 -16.268 29.838 -50.338 1.00 52.22 H new ATOM 0 HA PHE A 189 -15.513 27.891 -49.599 1.00 21.13 H new ATOM 0 HB2 PHE A 189 -13.520 29.799 -48.345 1.00 11.22 H new ATOM 0 HB3 PHE A 189 -13.263 28.074 -48.515 1.00 11.22 H new ATOM 0 HD1 PHE A 189 -13.946 31.185 -50.489 1.00 41.44 H new ATOM 0 HD2 PHE A 189 -12.423 27.158 -50.556 1.00 72.12 H new ATOM 0 HE1 PHE A 189 -13.092 31.547 -52.792 1.00 33.44 H new ATOM 0 HE2 PHE A 189 -11.582 27.517 -52.865 1.00 71.13 H new ATOM 0 HZ PHE A 189 -11.909 29.712 -53.985 1.00 32.31 H new ATOM 255 N PRO A 190 -16.997 27.616 -47.465 1.00 74.42 N ATOM 256 CA PRO A 190 -17.573 27.118 -46.223 1.00 62.01 C ATOM 257 C PRO A 190 -16.801 25.882 -45.729 1.00 31.33 C ATOM 258 O PRO A 190 -17.175 24.738 -46.005 1.00 55.50 O ATOM 259 CB PRO A 190 -19.052 26.851 -46.540 1.00 44.41 C ATOM 260 CG PRO A 190 -19.040 26.509 -48.027 1.00 32.21 C ATOM 261 CD PRO A 190 -17.926 27.404 -48.570 1.00 14.15 C ATOM 0 HA PRO A 190 -17.499 27.828 -45.399 1.00 62.01 H new ATOM 0 HB2 PRO A 190 -19.449 26.030 -45.942 1.00 44.41 H new ATOM 0 HB3 PRO A 190 -19.671 27.724 -46.334 1.00 44.41 H new ATOM 0 HG2 PRO A 190 -18.830 25.453 -48.198 1.00 32.21 H new ATOM 0 HG3 PRO A 190 -19.998 26.724 -48.499 1.00 32.21 H new ATOM 0 HD2 PRO A 190 -17.424 26.932 -49.415 1.00 14.15 H new ATOM 0 HD3 PRO A 190 -18.328 28.352 -48.928 1.00 14.15 H new ATOM 269 N MET A 191 -15.711 26.117 -44.999 1.00 5.12 N ATOM 270 CA MET A 191 -14.728 25.131 -44.558 1.00 32.15 C ATOM 271 C MET A 191 -14.357 25.362 -43.082 1.00 53.20 C ATOM 272 O MET A 191 -13.275 24.964 -42.656 1.00 13.41 O ATOM 273 CB MET A 191 -13.525 25.194 -45.529 1.00 33.21 C ATOM 274 CG MET A 191 -12.514 24.044 -45.384 1.00 23.31 C ATOM 275 SD MET A 191 -11.278 23.924 -46.707 1.00 33.12 S ATOM 276 CE MET A 191 -12.261 23.045 -47.957 1.00 34.42 C ATOM 0 H MET A 191 -15.478 27.058 -44.681 1.00 5.12 H new ATOM 0 HA MET A 191 -15.132 24.119 -44.592 1.00 32.15 H new ATOM 0 HB2 MET A 191 -13.902 25.200 -46.552 1.00 33.21 H new ATOM 0 HB3 MET A 191 -13.003 26.139 -45.377 1.00 33.21 H new ATOM 0 HG2 MET A 191 -11.994 24.158 -44.433 1.00 23.31 H new ATOM 0 HG3 MET A 191 -13.063 23.104 -45.336 1.00 23.31 H new ATOM 0 HE1 MET A 191 -11.655 22.883 -48.849 1.00 34.42 H new ATOM 0 HE2 MET A 191 -12.582 22.083 -47.557 1.00 34.42 H new ATOM 0 HE3 MET A 191 -13.136 23.641 -48.216 1.00 34.42 H new ATOM 286 N ARG A 192 -15.213 26.055 -42.310 1.00 54.31 N ATOM 287 CA ARG A 192 -15.087 26.318 -40.871 1.00 71.24 C ATOM 288 C ARG A 192 -16.488 26.331 -40.284 1.00 74.33 C ATOM 289 O ARG A 192 -17.320 27.125 -40.738 1.00 44.54 O ATOM 290 CB ARG A 192 -14.389 27.672 -40.592 1.00 53.03 C ATOM 291 CG ARG A 192 -13.037 27.542 -39.877 1.00 10.34 C ATOM 292 CD ARG A 192 -12.090 26.716 -40.734 1.00 64.52 C ATOM 293 NE ARG A 192 -10.686 26.749 -40.335 1.00 53.10 N ATOM 294 CZ ARG A 192 -9.801 25.845 -40.763 1.00 23.44 C ATOM 295 NH1 ARG A 192 -10.176 24.876 -41.600 1.00 33.24 N1+ ATOM 296 NH2 ARG A 192 -8.550 25.922 -40.335 1.00 13.53 N ATOM 0 H ARG A 192 -16.060 26.469 -42.700 1.00 54.31 H new ATOM 0 HA ARG A 192 -14.472 25.542 -40.415 1.00 71.24 H new ATOM 0 HB2 ARG A 192 -14.240 28.194 -41.537 1.00 53.03 H new ATOM 0 HB3 ARG A 192 -15.050 28.292 -39.987 1.00 53.03 H new ATOM 0 HG2 ARG A 192 -12.613 28.529 -39.695 1.00 10.34 H new ATOM 0 HG3 ARG A 192 -13.171 27.069 -38.904 1.00 10.34 H new ATOM 0 HD2 ARG A 192 -12.428 25.680 -40.722 1.00 64.52 H new ATOM 0 HD3 ARG A 192 -12.164 27.064 -41.764 1.00 64.52 H new ATOM 0 HE ARG A 192 -10.370 27.488 -39.707 1.00 53.10 H new ATOM 0 HH11 ARG A 192 -11.144 24.822 -41.917 1.00 33.24 H new ATOM 0 HH12 ARG A 192 -9.495 24.189 -41.923 1.00 33.24 H new ATOM 0 HH21 ARG A 192 -8.277 26.663 -39.689 1.00 13.53 H new ATOM 0 HH22 ARG A 192 -7.860 25.240 -40.651 1.00 13.53 H new ATOM 310 N THR A 193 -16.764 25.490 -39.298 1.00 21.21 N ATOM 311 CA THR A 193 -18.016 25.471 -38.572 1.00 71.03 C ATOM 312 C THR A 193 -17.689 25.248 -37.096 1.00 61.34 C ATOM 313 O THR A 193 -16.608 24.758 -36.755 1.00 73.14 O ATOM 314 CB THR A 193 -18.945 24.382 -39.149 1.00 53.20 C ATOM 315 OG1 THR A 193 -18.393 23.094 -38.974 1.00 41.42 O ATOM 316 CG2 THR A 193 -19.211 24.568 -40.645 1.00 75.33 C ATOM 0 H THR A 193 -16.102 24.784 -38.975 1.00 21.21 H new ATOM 0 HA THR A 193 -18.553 26.414 -38.674 1.00 71.03 H new ATOM 0 HB THR A 193 -19.882 24.479 -38.601 1.00 53.20 H new ATOM 0 HG1 THR A 193 -19.003 22.423 -39.347 1.00 41.42 H new ATOM 0 HG21 THR A 193 -19.870 23.775 -40.999 1.00 75.33 H new ATOM 0 HG22 THR A 193 -19.685 25.535 -40.813 1.00 75.33 H new ATOM 0 HG23 THR A 193 -18.268 24.526 -41.190 1.00 75.33 H new ATOM 324 N TYR A 194 -18.629 25.550 -36.209 1.00 32.21 N ATOM 325 CA TYR A 194 -18.493 25.336 -34.770 1.00 24.41 C ATOM 326 C TYR A 194 -19.877 25.151 -34.136 1.00 2.42 C ATOM 327 O TYR A 194 -20.249 25.789 -33.147 1.00 43.14 O ATOM 328 CB TYR A 194 -17.628 26.433 -34.111 1.00 72.14 C ATOM 329 CG TYR A 194 -16.688 25.896 -33.042 1.00 73.13 C ATOM 330 CD1 TYR A 194 -17.153 24.983 -32.073 1.00 45.31 C ATOM 331 CD2 TYR A 194 -15.330 26.278 -33.040 1.00 72.31 C ATOM 332 CE1 TYR A 194 -16.263 24.432 -31.139 1.00 5.30 C ATOM 333 CE2 TYR A 194 -14.436 25.738 -32.099 1.00 32.21 C ATOM 334 CZ TYR A 194 -14.899 24.793 -31.158 1.00 42.51 C ATOM 335 OH TYR A 194 -14.077 24.281 -30.202 1.00 72.23 O ATOM 0 H TYR A 194 -19.526 25.959 -36.473 1.00 32.21 H new ATOM 0 HA TYR A 194 -17.946 24.411 -34.588 1.00 24.41 H new ATOM 0 HB2 TYR A 194 -17.042 26.936 -34.881 1.00 72.14 H new ATOM 0 HB3 TYR A 194 -18.282 27.184 -33.667 1.00 72.14 H new ATOM 0 HD1 TYR A 194 -18.197 24.707 -32.050 1.00 45.31 H new ATOM 0 HD2 TYR A 194 -14.974 26.992 -33.768 1.00 72.31 H new ATOM 0 HE1 TYR A 194 -16.623 23.729 -30.403 1.00 5.30 H new ATOM 0 HE2 TYR A 194 -13.400 26.045 -32.096 1.00 32.21 H new ATOM 0 HH TYR A 194 -13.166 24.615 -30.340 1.00 72.23 H new ATOM 345 N SER A 195 -20.665 24.246 -34.714 1.00 32.13 N ATOM 346 CA SER A 195 -21.807 23.675 -34.008 1.00 10.15 C ATOM 347 C SER A 195 -21.346 22.968 -32.728 1.00 61.15 C ATOM 348 O SER A 195 -20.189 22.550 -32.607 1.00 42.40 O ATOM 349 CB SER A 195 -22.603 22.773 -34.948 1.00 65.44 C ATOM 350 OG SER A 195 -23.011 23.516 -36.083 1.00 24.24 O ATOM 0 H SER A 195 -20.534 23.895 -35.663 1.00 32.13 H new ATOM 0 HA SER A 195 -22.483 24.469 -33.690 1.00 10.15 H new ATOM 0 HB2 SER A 195 -21.994 21.923 -35.256 1.00 65.44 H new ATOM 0 HB3 SER A 195 -23.474 22.370 -34.431 1.00 65.44 H new ATOM 0 HG SER A 195 -23.521 22.937 -36.687 1.00 24.24 H new ATOM 356 N LYS A 196 -22.229 22.913 -31.728 1.00 35.23 N ATOM 357 CA LYS A 196 -21.924 22.534 -30.355 1.00 32.13 C ATOM 358 C LYS A 196 -23.273 22.272 -29.691 1.00 0.52 C ATOM 359 O LYS A 196 -24.224 21.961 -30.411 1.00 54.11 O ATOM 360 CB LYS A 196 -21.077 23.626 -29.669 1.00 20.51 C ATOM 361 CG LYS A 196 -21.746 25.008 -29.597 1.00 51.31 C ATOM 362 CD LYS A 196 -20.877 25.969 -28.784 1.00 13.40 C ATOM 363 CE LYS A 196 -21.643 27.265 -28.523 1.00 13.14 C ATOM 364 NZ LYS A 196 -20.921 28.130 -27.572 1.00 11.14 N1+ ATOM 0 H LYS A 196 -23.214 23.141 -31.863 1.00 35.23 H new ATOM 0 HA LYS A 196 -21.310 21.636 -30.284 1.00 32.13 H new ATOM 0 HB2 LYS A 196 -20.839 23.300 -28.657 1.00 20.51 H new ATOM 0 HB3 LYS A 196 -20.132 23.722 -30.203 1.00 20.51 H new ATOM 0 HG2 LYS A 196 -21.895 25.402 -30.602 1.00 51.31 H new ATOM 0 HG3 LYS A 196 -22.732 24.921 -29.140 1.00 51.31 H new ATOM 0 HD2 LYS A 196 -20.594 25.506 -27.838 1.00 13.40 H new ATOM 0 HD3 LYS A 196 -19.954 26.184 -29.323 1.00 13.40 H new ATOM 0 HE2 LYS A 196 -21.792 27.798 -29.462 1.00 13.14 H new ATOM 0 HE3 LYS A 196 -22.632 27.033 -28.128 1.00 13.14 H new ATOM 0 HZ1 LYS A 196 -21.465 29.002 -27.414 1.00 11.14 H new ATOM 0 HZ2 LYS A 196 -20.801 27.629 -26.669 1.00 11.14 H new ATOM 0 HZ3 LYS A 196 -19.987 28.370 -27.961 1.00 11.14 H new ATOM 378 N GLN A 197 -23.375 22.415 -28.368 1.00 54.34 N ATOM 379 CA GLN A 197 -24.646 22.462 -27.649 1.00 31.24 C ATOM 380 C GLN A 197 -25.358 21.110 -27.753 1.00 14.24 C ATOM 381 O GLN A 197 -26.182 20.893 -28.640 1.00 54.12 O ATOM 382 CB GLN A 197 -25.500 23.663 -28.127 1.00 52.12 C ATOM 383 CG GLN A 197 -26.765 23.815 -27.253 1.00 43.43 C ATOM 384 CD GLN A 197 -27.816 24.790 -27.788 1.00 62.31 C ATOM 385 OE1 GLN A 197 -28.144 25.788 -27.157 1.00 22.03 O ATOM 386 NE2 GLN A 197 -28.421 24.526 -28.934 1.00 44.20 N ATOM 0 H GLN A 197 -22.562 22.503 -27.758 1.00 54.34 H new ATOM 0 HA GLN A 197 -24.467 22.633 -26.587 1.00 31.24 H new ATOM 0 HB2 GLN A 197 -24.908 24.577 -28.082 1.00 52.12 H new ATOM 0 HB3 GLN A 197 -25.787 23.520 -29.169 1.00 52.12 H new ATOM 0 HG2 GLN A 197 -27.228 22.835 -27.139 1.00 43.43 H new ATOM 0 HG3 GLN A 197 -26.462 24.143 -26.258 1.00 43.43 H new ATOM 0 HE21 GLN A 197 -28.159 23.699 -29.470 1.00 44.20 H new ATOM 0 HE22 GLN A 197 -29.150 25.149 -29.281 1.00 44.20 H new ATOM 395 N SER A 198 -25.050 20.211 -26.821 1.00 41.44 N ATOM 396 CA SER A 198 -25.424 18.799 -26.803 1.00 54.41 C ATOM 397 C SER A 198 -24.572 18.022 -27.812 1.00 63.14 C ATOM 398 O SER A 198 -25.065 17.320 -28.693 1.00 14.14 O ATOM 399 CB SER A 198 -26.933 18.612 -27.010 1.00 23.42 C ATOM 400 OG SER A 198 -27.418 17.486 -26.294 1.00 4.34 O ATOM 0 H SER A 198 -24.496 20.467 -26.004 1.00 41.44 H new ATOM 0 HA SER A 198 -25.214 18.386 -25.816 1.00 54.41 H new ATOM 0 HB2 SER A 198 -27.461 19.508 -26.683 1.00 23.42 H new ATOM 0 HB3 SER A 198 -27.144 18.488 -28.072 1.00 23.42 H new ATOM 0 HG SER A 198 -28.382 17.393 -26.444 1.00 4.34 H new ATOM 406 N LYS A 199 -23.259 18.147 -27.662 1.00 11.23 N ATOM 407 CA LYS A 199 -22.240 17.532 -28.503 1.00 2.21 C ATOM 408 C LYS A 199 -21.153 16.956 -27.594 1.00 2.30 C ATOM 409 O LYS A 199 -20.193 17.657 -27.275 1.00 75.01 O ATOM 410 CB LYS A 199 -21.722 18.556 -29.530 1.00 55.42 C ATOM 411 CG LYS A 199 -22.544 18.509 -30.835 1.00 60.32 C ATOM 412 CD LYS A 199 -21.653 18.083 -32.022 1.00 62.24 C ATOM 413 CE LYS A 199 -22.426 17.724 -33.299 1.00 63.50 C ATOM 414 NZ LYS A 199 -23.025 18.903 -33.954 1.00 45.33 N1+ ATOM 0 H LYS A 199 -22.856 18.709 -26.912 1.00 11.23 H new ATOM 0 HA LYS A 199 -22.644 16.707 -29.089 1.00 2.21 H new ATOM 0 HB2 LYS A 199 -21.771 19.558 -29.103 1.00 55.42 H new ATOM 0 HB3 LYS A 199 -20.674 18.354 -29.751 1.00 55.42 H new ATOM 0 HG2 LYS A 199 -23.372 17.809 -30.725 1.00 60.32 H new ATOM 0 HG3 LYS A 199 -22.979 19.489 -31.033 1.00 60.32 H new ATOM 0 HD2 LYS A 199 -20.958 18.892 -32.248 1.00 62.24 H new ATOM 0 HD3 LYS A 199 -21.054 17.224 -31.721 1.00 62.24 H new ATOM 0 HE2 LYS A 199 -21.753 17.228 -33.998 1.00 63.50 H new ATOM 0 HE3 LYS A 199 -23.213 17.011 -33.054 1.00 63.50 H new ATOM 0 HZ1 LYS A 199 -23.534 18.603 -34.810 1.00 45.33 H new ATOM 0 HZ2 LYS A 199 -23.689 19.364 -33.299 1.00 45.33 H new ATOM 0 HZ3 LYS A 199 -22.274 19.574 -34.215 1.00 45.33 H new ATOM 428 N PRO A 200 -21.320 15.718 -27.101 1.00 22.33 N ATOM 429 CA PRO A 200 -20.279 15.000 -26.386 1.00 61.21 C ATOM 430 C PRO A 200 -19.204 14.577 -27.393 1.00 63.15 C ATOM 431 O PRO A 200 -19.351 13.560 -28.075 1.00 70.42 O ATOM 432 CB PRO A 200 -20.985 13.810 -25.725 1.00 43.42 C ATOM 433 CG PRO A 200 -22.145 13.515 -26.670 1.00 75.53 C ATOM 434 CD PRO A 200 -22.518 14.894 -27.213 1.00 21.14 C ATOM 0 HA PRO A 200 -19.774 15.592 -25.623 1.00 61.21 H new ATOM 0 HB2 PRO A 200 -20.319 12.952 -25.627 1.00 43.42 H new ATOM 0 HB3 PRO A 200 -21.336 14.057 -24.723 1.00 43.42 H new ATOM 0 HG2 PRO A 200 -21.850 12.835 -27.469 1.00 75.53 H new ATOM 0 HG3 PRO A 200 -22.981 13.049 -26.148 1.00 75.53 H new ATOM 0 HD2 PRO A 200 -22.848 14.827 -28.250 1.00 21.14 H new ATOM 0 HD3 PRO A 200 -23.341 15.326 -26.644 1.00 21.14 H new ATOM 442 N LEU A 201 -18.124 15.347 -27.509 1.00 44.43 N ATOM 443 CA LEU A 201 -17.020 15.096 -28.426 1.00 11.42 C ATOM 444 C LEU A 201 -15.726 15.285 -27.653 1.00 51.40 C ATOM 445 O LEU A 201 -15.238 16.406 -27.496 1.00 54.24 O ATOM 446 CB LEU A 201 -17.096 15.918 -29.726 1.00 24.05 C ATOM 447 CG LEU A 201 -17.883 17.240 -29.730 1.00 44.05 C ATOM 448 CD1 LEU A 201 -17.307 18.317 -28.812 1.00 42.43 C ATOM 449 CD2 LEU A 201 -17.951 17.810 -31.145 1.00 3.33 C ATOM 0 H LEU A 201 -17.991 16.189 -26.949 1.00 44.43 H new ATOM 0 HA LEU A 201 -17.075 14.070 -28.789 1.00 11.42 H new ATOM 0 HB2 LEU A 201 -16.075 16.143 -30.033 1.00 24.05 H new ATOM 0 HB3 LEU A 201 -17.526 15.277 -30.495 1.00 24.05 H new ATOM 0 HG LEU A 201 -18.872 16.983 -29.351 1.00 44.05 H new ATOM 0 HD11 LEU A 201 -17.921 19.215 -28.875 1.00 42.43 H new ATOM 0 HD12 LEU A 201 -17.300 17.953 -27.784 1.00 42.43 H new ATOM 0 HD13 LEU A 201 -16.288 18.552 -29.121 1.00 42.43 H new ATOM 0 HD21 LEU A 201 -18.511 18.745 -31.134 1.00 3.33 H new ATOM 0 HD22 LEU A 201 -16.941 17.995 -31.511 1.00 3.33 H new ATOM 0 HD23 LEU A 201 -18.450 17.097 -31.801 1.00 3.33 H new ATOM 461 N PHE A 202 -15.232 14.182 -27.096 1.00 5.10 N ATOM 462 CA PHE A 202 -14.100 14.055 -26.194 1.00 64.12 C ATOM 463 C PHE A 202 -13.972 12.568 -25.839 1.00 52.51 C ATOM 464 O PHE A 202 -14.955 11.980 -25.383 1.00 4.24 O ATOM 465 CB PHE A 202 -14.342 14.885 -24.918 1.00 64.31 C ATOM 466 CG PHE A 202 -13.138 14.954 -24.009 1.00 42.43 C ATOM 467 CD1 PHE A 202 -12.914 13.953 -23.050 1.00 30.41 C ATOM 468 CD2 PHE A 202 -12.206 15.995 -24.164 1.00 65.05 C ATOM 469 CE1 PHE A 202 -11.724 13.955 -22.304 1.00 24.05 C ATOM 470 CE2 PHE A 202 -10.996 15.969 -23.454 1.00 14.43 C ATOM 471 CZ PHE A 202 -10.746 14.931 -22.544 1.00 35.32 C ATOM 0 H PHE A 202 -15.656 13.274 -27.285 1.00 5.10 H new ATOM 0 HA PHE A 202 -13.187 14.422 -26.663 1.00 64.12 H new ATOM 0 HB2 PHE A 202 -14.632 15.897 -25.201 1.00 64.31 H new ATOM 0 HB3 PHE A 202 -15.179 14.456 -24.368 1.00 64.31 H new ATOM 0 HD1 PHE A 202 -13.654 13.184 -22.887 1.00 30.41 H new ATOM 0 HD2 PHE A 202 -12.422 16.817 -24.831 1.00 65.05 H new ATOM 0 HE1 PHE A 202 -11.562 13.204 -21.545 1.00 24.05 H new ATOM 0 HE2 PHE A 202 -10.260 16.745 -23.607 1.00 14.43 H new ATOM 0 HZ PHE A 202 -9.799 14.883 -22.027 1.00 35.32 H new ATOM 481 N SER A 203 -12.784 11.979 -25.990 1.00 15.14 N ATOM 482 CA SER A 203 -12.476 10.580 -25.668 1.00 33.33 C ATOM 483 C SER A 203 -13.345 9.517 -26.365 1.00 3.11 C ATOM 484 O SER A 203 -14.298 9.803 -27.096 1.00 43.21 O ATOM 485 CB SER A 203 -12.399 10.359 -24.184 1.00 34.23 C ATOM 486 OG SER A 203 -11.501 11.219 -23.514 1.00 54.15 O ATOM 0 H SER A 203 -11.976 12.483 -26.355 1.00 15.14 H new ATOM 0 HA SER A 203 -11.488 10.422 -26.100 1.00 33.33 H new ATOM 0 HB2 SER A 203 -13.394 10.488 -23.757 1.00 34.23 H new ATOM 0 HB3 SER A 203 -12.103 9.327 -23.997 1.00 34.23 H new ATOM 0 HG SER A 203 -11.913 12.101 -23.404 1.00 54.15 H new ATOM 492 N ASN A 204 -12.986 8.246 -26.158 1.00 33.34 N ATOM 493 CA ASN A 204 -13.762 7.084 -26.580 1.00 23.22 C ATOM 494 C ASN A 204 -13.442 5.863 -25.689 1.00 63.13 C ATOM 495 O ASN A 204 -13.402 4.715 -26.137 1.00 34.55 O ATOM 496 CB ASN A 204 -13.537 6.824 -28.081 1.00 43.13 C ATOM 497 CG ASN A 204 -14.790 6.241 -28.715 1.00 52.12 C ATOM 498 OD1 ASN A 204 -15.437 5.355 -28.164 1.00 12.14 O ATOM 499 ND2 ASN A 204 -15.164 6.716 -29.888 1.00 65.03 N ATOM 0 H ASN A 204 -12.122 7.994 -25.678 1.00 33.34 H new ATOM 0 HA ASN A 204 -14.826 7.280 -26.449 1.00 23.22 H new ATOM 0 HB2 ASN A 204 -13.269 7.755 -28.581 1.00 43.13 H new ATOM 0 HB3 ASN A 204 -12.701 6.137 -28.216 1.00 43.13 H new ATOM 0 HD21 ASN A 204 -15.998 6.347 -30.345 1.00 65.03 H new ATOM 0 HD22 ASN A 204 -14.619 7.452 -30.337 1.00 65.03 H new ATOM 506 N LYS A 205 -13.146 6.106 -24.406 1.00 32.23 N ATOM 507 CA LYS A 205 -13.030 5.085 -23.363 1.00 5.31 C ATOM 508 C LYS A 205 -14.447 4.657 -23.000 1.00 74.31 C ATOM 509 O LYS A 205 -15.149 5.432 -22.339 1.00 44.22 O ATOM 510 CB LYS A 205 -12.333 5.650 -22.123 1.00 4.33 C ATOM 511 CG LYS A 205 -10.846 5.910 -22.386 1.00 24.12 C ATOM 512 CD LYS A 205 -10.360 7.045 -21.492 1.00 43.10 C ATOM 513 CE LYS A 205 -10.358 6.634 -20.018 1.00 53.42 C ATOM 514 NZ LYS A 205 -10.015 7.764 -19.136 1.00 41.42 N1+ ATOM 0 H LYS A 205 -12.976 7.049 -24.057 1.00 32.23 H new ATOM 0 HA LYS A 205 -12.437 4.244 -23.723 1.00 5.31 H new ATOM 0 HB2 LYS A 205 -12.818 6.578 -21.822 1.00 4.33 H new ATOM 0 HB3 LYS A 205 -12.440 4.951 -21.293 1.00 4.33 H new ATOM 0 HG2 LYS A 205 -10.268 5.007 -22.191 1.00 24.12 H new ATOM 0 HG3 LYS A 205 -10.691 6.167 -23.434 1.00 24.12 H new ATOM 0 HD2 LYS A 205 -9.354 7.340 -21.790 1.00 43.10 H new ATOM 0 HD3 LYS A 205 -11.001 7.916 -21.627 1.00 43.10 H new ATOM 0 HE2 LYS A 205 -11.340 6.246 -19.747 1.00 53.42 H new ATOM 0 HE3 LYS A 205 -9.643 5.825 -19.867 1.00 53.42 H new ATOM 0 HZ1 LYS A 205 -10.024 7.447 -18.146 1.00 41.42 H new ATOM 0 HZ2 LYS A 205 -9.067 8.118 -19.378 1.00 41.42 H new ATOM 0 HZ3 LYS A 205 -10.711 8.526 -19.261 1.00 41.42 H new ATOM 528 N ARG A 206 -14.910 3.498 -23.475 1.00 72.04 N ATOM 529 CA ARG A 206 -16.278 3.029 -23.243 1.00 44.22 C ATOM 530 C ARG A 206 -16.265 1.521 -22.993 1.00 14.02 C ATOM 531 O ARG A 206 -16.640 0.758 -23.888 1.00 71.11 O ATOM 532 CB ARG A 206 -17.183 3.411 -24.441 1.00 34.22 C ATOM 533 CG ARG A 206 -17.298 4.928 -24.675 1.00 44.22 C ATOM 534 CD ARG A 206 -18.132 5.278 -25.909 1.00 73.05 C ATOM 535 NE ARG A 206 -19.571 5.032 -25.712 1.00 44.20 N ATOM 536 CZ ARG A 206 -20.571 5.635 -26.364 1.00 1.34 C ATOM 537 NH1 ARG A 206 -20.305 6.634 -27.203 1.00 3.11 N1+ ATOM 538 NH2 ARG A 206 -21.822 5.229 -26.162 1.00 20.34 N ATOM 0 H ARG A 206 -14.345 2.857 -24.033 1.00 72.04 H new ATOM 0 HA ARG A 206 -16.691 3.513 -22.358 1.00 44.22 H new ATOM 0 HB2 ARG A 206 -16.791 2.942 -25.344 1.00 34.22 H new ATOM 0 HB3 ARG A 206 -18.180 3.002 -24.276 1.00 34.22 H new ATOM 0 HG2 ARG A 206 -17.745 5.393 -23.797 1.00 44.22 H new ATOM 0 HG3 ARG A 206 -16.299 5.350 -24.786 1.00 44.22 H new ATOM 0 HD2 ARG A 206 -17.978 6.327 -26.160 1.00 73.05 H new ATOM 0 HD3 ARG A 206 -17.780 4.692 -26.758 1.00 73.05 H new ATOM 0 HE ARG A 206 -19.829 4.336 -25.012 1.00 44.20 H new ATOM 0 HH11 ARG A 206 -19.342 6.937 -27.346 1.00 3.11 H new ATOM 0 HH12 ARG A 206 -21.065 7.097 -27.702 1.00 3.11 H new ATOM 0 HH21 ARG A 206 -22.012 4.464 -25.514 1.00 20.34 H new ATOM 0 HH22 ARG A 206 -22.591 5.683 -26.655 1.00 20.34 H new ATOM 552 N LYS A 207 -15.853 1.059 -21.809 1.00 13.45 N ATOM 553 CA LYS A 207 -15.900 -0.342 -21.411 1.00 44.04 C ATOM 554 C LYS A 207 -16.608 -0.483 -20.073 1.00 62.01 C ATOM 555 O LYS A 207 -16.312 0.263 -19.141 1.00 42.43 O ATOM 556 CB LYS A 207 -14.498 -0.965 -21.364 1.00 24.21 C ATOM 557 CG LYS A 207 -13.848 -1.004 -22.754 1.00 43.43 C ATOM 558 CD LYS A 207 -12.740 -2.058 -22.879 1.00 14.11 C ATOM 559 CE LYS A 207 -13.286 -3.469 -23.159 1.00 12.52 C ATOM 560 NZ LYS A 207 -13.274 -4.346 -21.969 1.00 13.51 N1+ ATOM 0 H LYS A 207 -15.469 1.668 -21.086 1.00 13.45 H new ATOM 0 HA LYS A 207 -16.467 -0.889 -22.164 1.00 44.04 H new ATOM 0 HB2 LYS A 207 -13.868 -0.392 -20.683 1.00 24.21 H new ATOM 0 HB3 LYS A 207 -14.562 -1.977 -20.964 1.00 24.21 H new ATOM 0 HG2 LYS A 207 -14.616 -1.205 -23.501 1.00 43.43 H new ATOM 0 HG3 LYS A 207 -13.432 -0.022 -22.980 1.00 43.43 H new ATOM 0 HD2 LYS A 207 -12.061 -1.771 -23.682 1.00 14.11 H new ATOM 0 HD3 LYS A 207 -12.156 -2.076 -21.959 1.00 14.11 H new ATOM 0 HE2 LYS A 207 -14.307 -3.389 -23.533 1.00 12.52 H new ATOM 0 HE3 LYS A 207 -12.693 -3.931 -23.948 1.00 12.52 H new ATOM 0 HZ1 LYS A 207 -14.074 -5.009 -22.018 1.00 13.51 H new ATOM 0 HZ2 LYS A 207 -12.382 -4.880 -21.941 1.00 13.51 H new ATOM 0 HZ3 LYS A 207 -13.358 -3.766 -21.110 1.00 13.51 H new ATOM 574 N ILE A 208 -17.559 -1.411 -19.981 1.00 1.30 N ATOM 575 CA ILE A 208 -18.364 -1.647 -18.803 1.00 11.50 C ATOM 576 C ILE A 208 -17.563 -2.285 -17.692 1.00 21.22 C ATOM 577 O ILE A 208 -16.665 -3.103 -17.915 1.00 5.12 O ATOM 578 CB ILE A 208 -19.584 -2.509 -19.206 1.00 32.34 C ATOM 579 CG1 ILE A 208 -20.662 -2.360 -18.133 1.00 21.11 C ATOM 580 CG2 ILE A 208 -19.251 -3.993 -19.443 1.00 34.12 C ATOM 581 CD1 ILE A 208 -22.044 -2.830 -18.564 1.00 64.43 C ATOM 0 H ILE A 208 -17.791 -2.035 -20.754 1.00 1.30 H new ATOM 0 HA ILE A 208 -18.712 -0.693 -18.406 1.00 11.50 H new ATOM 0 HB ILE A 208 -19.940 -2.141 -20.168 1.00 32.34 H new ATOM 0 HG12 ILE A 208 -20.359 -2.922 -17.250 1.00 21.11 H new ATOM 0 HG13 ILE A 208 -20.723 -1.312 -17.839 1.00 21.11 H new ATOM 0 HG21 ILE A 208 -20.158 -4.529 -19.722 1.00 34.12 H new ATOM 0 HG22 ILE A 208 -18.518 -4.078 -20.246 1.00 34.12 H new ATOM 0 HG23 ILE A 208 -18.840 -4.424 -18.530 1.00 34.12 H new ATOM 0 HD11 ILE A 208 -22.748 -2.689 -17.744 1.00 64.43 H new ATOM 0 HD12 ILE A 208 -22.372 -2.252 -19.428 1.00 64.43 H new ATOM 0 HD13 ILE A 208 -22.003 -3.886 -18.829 1.00 64.43 H new ATOM 593 N HIS A 209 -17.981 -1.930 -16.488 1.00 41.32 N ATOM 594 CA HIS A 209 -17.594 -2.518 -15.241 1.00 63.01 C ATOM 595 C HIS A 209 -18.915 -2.706 -14.486 1.00 55.52 C ATOM 596 O HIS A 209 -19.407 -1.808 -13.803 1.00 14.34 O ATOM 597 CB HIS A 209 -16.635 -1.575 -14.524 1.00 3.24 C ATOM 598 CG HIS A 209 -15.331 -1.228 -15.219 1.00 14.44 C ATOM 599 ND1 HIS A 209 -14.759 -1.880 -16.290 1.00 43.42 N ATOM 600 CD2 HIS A 209 -14.543 -0.142 -14.940 1.00 41.34 C ATOM 601 CE1 HIS A 209 -13.673 -1.189 -16.669 1.00 35.43 C ATOM 602 NE2 HIS A 209 -13.493 -0.124 -15.871 1.00 2.45 N ATOM 0 H HIS A 209 -18.647 -1.168 -16.361 1.00 41.32 H new ATOM 0 HA HIS A 209 -17.068 -3.468 -15.337 1.00 63.01 H new ATOM 0 HB2 HIS A 209 -17.167 -0.644 -14.325 1.00 3.24 H new ATOM 0 HB3 HIS A 209 -16.392 -2.016 -13.557 1.00 3.24 H new ATOM 0 HD1 HIS A 209 -15.102 -2.739 -16.720 1.00 43.42 H new ATOM 0 HD2 HIS A 209 -14.702 0.572 -14.146 1.00 41.34 H new ATOM 0 HE1 HIS A 209 -13.034 -1.452 -17.499 1.00 35.43 H new ATOM 610 N LEU A 210 -19.581 -3.838 -14.697 1.00 24.30 N ATOM 611 CA LEU A 210 -20.547 -4.357 -13.730 1.00 74.33 C ATOM 612 C LEU A 210 -19.795 -5.045 -12.587 1.00 64.15 C ATOM 613 O LEU A 210 -20.295 -5.118 -11.469 1.00 4.22 O ATOM 614 CB LEU A 210 -21.572 -5.252 -14.428 1.00 35.43 C ATOM 615 CG LEU A 210 -22.458 -6.103 -13.484 1.00 23.31 C ATOM 616 CD1 LEU A 210 -23.917 -6.158 -13.947 1.00 42.23 C ATOM 617 CD2 LEU A 210 -21.901 -7.529 -13.397 1.00 61.45 C ATOM 0 H LEU A 210 -19.470 -4.415 -15.530 1.00 24.30 H new ATOM 0 HA LEU A 210 -21.123 -3.545 -13.286 1.00 74.33 H new ATOM 0 HB2 LEU A 210 -22.220 -4.625 -15.041 1.00 35.43 H new ATOM 0 HB3 LEU A 210 -21.043 -5.922 -15.106 1.00 35.43 H new ATOM 0 HG LEU A 210 -22.438 -5.626 -12.504 1.00 23.31 H new ATOM 0 HD11 LEU A 210 -24.496 -6.766 -13.252 1.00 42.23 H new ATOM 0 HD12 LEU A 210 -24.328 -5.149 -13.976 1.00 42.23 H new ATOM 0 HD13 LEU A 210 -23.966 -6.598 -14.943 1.00 42.23 H new ATOM 0 HD21 LEU A 210 -22.527 -8.124 -12.732 1.00 61.45 H new ATOM 0 HD22 LEU A 210 -21.896 -7.979 -14.390 1.00 61.45 H new ATOM 0 HD23 LEU A 210 -20.884 -7.499 -13.007 1.00 61.45 H new ATOM 629 N SER A 211 -18.580 -5.519 -12.846 1.00 3.02 N ATOM 630 CA SER A 211 -17.753 -6.192 -11.854 1.00 64.31 C ATOM 631 C SER A 211 -16.270 -6.183 -12.236 1.00 54.04 C ATOM 632 O SER A 211 -15.446 -6.655 -11.446 1.00 2.11 O ATOM 633 CB SER A 211 -18.284 -7.624 -11.656 1.00 73.53 C ATOM 634 OG SER A 211 -18.349 -8.358 -12.870 1.00 23.32 O ATOM 0 H SER A 211 -18.138 -5.445 -13.762 1.00 3.02 H new ATOM 0 HA SER A 211 -17.819 -5.649 -10.911 1.00 64.31 H new ATOM 0 HB2 SER A 211 -17.641 -8.151 -10.952 1.00 73.53 H new ATOM 0 HB3 SER A 211 -19.277 -7.580 -11.209 1.00 73.53 H new ATOM 0 HG SER A 211 -18.690 -9.259 -12.690 1.00 23.32 H new ATOM 640 N GLU A 212 -15.915 -5.680 -13.429 1.00 61.43 N ATOM 641 CA GLU A 212 -14.519 -5.632 -13.824 1.00 71.32 C ATOM 642 C GLU A 212 -13.847 -4.479 -13.088 1.00 51.54 C ATOM 643 O GLU A 212 -14.511 -3.520 -12.688 1.00 40.14 O ATOM 644 CB GLU A 212 -14.360 -5.447 -15.344 1.00 52.21 C ATOM 645 CG GLU A 212 -14.485 -6.770 -16.113 1.00 41.53 C ATOM 646 CD GLU A 212 -13.754 -6.743 -17.461 1.00 31.35 C ATOM 647 OE1 GLU A 212 -13.632 -5.675 -18.105 1.00 43.43 O ATOM 648 OE2 GLU A 212 -13.293 -7.824 -17.898 1.00 24.25 O1- ATOM 0 H GLU A 212 -16.570 -5.310 -14.118 1.00 61.43 H new ATOM 0 HA GLU A 212 -14.050 -6.580 -13.563 1.00 71.32 H new ATOM 0 HB2 GLU A 212 -15.116 -4.749 -15.703 1.00 52.21 H new ATOM 0 HB3 GLU A 212 -13.388 -4.999 -15.553 1.00 52.21 H new ATOM 0 HG2 GLU A 212 -14.084 -7.579 -15.503 1.00 41.53 H new ATOM 0 HG3 GLU A 212 -15.539 -6.990 -16.281 1.00 41.53 H new ATOM 655 N LEU A 213 -12.516 -4.544 -13.045 1.00 24.44 N ATOM 656 CA LEU A 213 -11.582 -3.542 -12.542 1.00 44.23 C ATOM 657 C LEU A 213 -11.557 -3.484 -11.022 1.00 32.50 C ATOM 658 O LEU A 213 -12.493 -3.881 -10.328 1.00 52.31 O ATOM 659 CB LEU A 213 -11.809 -2.136 -13.157 1.00 53.53 C ATOM 660 CG LEU A 213 -10.738 -1.687 -14.161 1.00 40.33 C ATOM 661 CD1 LEU A 213 -9.362 -1.518 -13.508 1.00 1.01 C ATOM 662 CD2 LEU A 213 -10.662 -2.646 -15.358 1.00 32.21 C ATOM 0 H LEU A 213 -12.025 -5.369 -13.390 1.00 24.44 H new ATOM 0 HA LEU A 213 -10.597 -3.872 -12.872 1.00 44.23 H new ATOM 0 HB2 LEU A 213 -12.779 -2.126 -13.654 1.00 53.53 H new ATOM 0 HB3 LEU A 213 -11.857 -1.406 -12.349 1.00 53.53 H new ATOM 0 HG LEU A 213 -11.042 -0.706 -14.527 1.00 40.33 H new ATOM 0 HD11 LEU A 213 -8.639 -1.200 -14.259 1.00 1.01 H new ATOM 0 HD12 LEU A 213 -9.423 -0.766 -12.721 1.00 1.01 H new ATOM 0 HD13 LEU A 213 -9.044 -2.468 -13.078 1.00 1.01 H new ATOM 0 HD21 LEU A 213 -9.895 -2.302 -16.052 1.00 32.21 H new ATOM 0 HD22 LEU A 213 -10.411 -3.647 -15.007 1.00 32.21 H new ATOM 0 HD23 LEU A 213 -11.626 -2.671 -15.866 1.00 32.21 H new ATOM 674 N MET A 214 -10.428 -3.000 -10.517 1.00 0.24 N ATOM 675 CA MET A 214 -10.162 -2.792 -9.126 1.00 32.05 C ATOM 676 C MET A 214 -11.063 -1.699 -8.586 1.00 23.33 C ATOM 677 O MET A 214 -11.453 -0.743 -9.265 1.00 53.34 O ATOM 678 CB MET A 214 -8.676 -2.452 -8.951 1.00 13.22 C ATOM 679 CG MET A 214 -8.278 -1.060 -9.457 1.00 41.51 C ATOM 680 SD MET A 214 -6.487 -0.820 -9.564 1.00 21.51 S ATOM 681 CE MET A 214 -6.442 0.914 -10.086 1.00 63.42 C ATOM 0 H MET A 214 -9.642 -2.733 -11.110 1.00 0.24 H new ATOM 0 HA MET A 214 -10.376 -3.697 -8.557 1.00 32.05 H new ATOM 0 HB2 MET A 214 -8.421 -2.527 -7.894 1.00 13.22 H new ATOM 0 HB3 MET A 214 -8.081 -3.199 -9.476 1.00 13.22 H new ATOM 0 HG2 MET A 214 -8.718 -0.900 -10.441 1.00 41.51 H new ATOM 0 HG3 MET A 214 -8.699 -0.306 -8.793 1.00 41.51 H new ATOM 0 HE1 MET A 214 -5.406 1.232 -10.202 1.00 63.42 H new ATOM 0 HE2 MET A 214 -6.963 1.021 -11.037 1.00 63.42 H new ATOM 0 HE3 MET A 214 -6.930 1.533 -9.333 1.00 63.42 H new ATOM 691 N LEU A 215 -11.312 -1.852 -7.305 1.00 34.21 N ATOM 692 CA LEU A 215 -12.089 -0.981 -6.445 1.00 73.12 C ATOM 693 C LEU A 215 -11.296 -0.751 -5.164 1.00 63.53 C ATOM 694 O LEU A 215 -10.226 -1.344 -5.002 1.00 4.22 O ATOM 695 CB LEU A 215 -13.482 -1.606 -6.228 1.00 11.32 C ATOM 696 CG LEU A 215 -13.703 -2.552 -5.025 1.00 5.51 C ATOM 697 CD1 LEU A 215 -15.111 -3.144 -5.118 1.00 20.01 C ATOM 698 CD2 LEU A 215 -12.682 -3.685 -4.891 1.00 75.40 C ATOM 0 H LEU A 215 -10.947 -2.655 -6.793 1.00 34.21 H new ATOM 0 HA LEU A 215 -12.264 -0.001 -6.890 1.00 73.12 H new ATOM 0 HB2 LEU A 215 -14.198 -0.789 -6.140 1.00 11.32 H new ATOM 0 HB3 LEU A 215 -13.739 -2.159 -7.132 1.00 11.32 H new ATOM 0 HG LEU A 215 -13.572 -1.940 -4.133 1.00 5.51 H new ATOM 0 HD11 LEU A 215 -15.280 -3.814 -4.275 1.00 20.01 H new ATOM 0 HD12 LEU A 215 -15.846 -2.340 -5.096 1.00 20.01 H new ATOM 0 HD13 LEU A 215 -15.211 -3.701 -6.050 1.00 20.01 H new ATOM 0 HD21 LEU A 215 -12.924 -4.291 -4.018 1.00 75.40 H new ATOM 0 HD22 LEU A 215 -12.711 -4.308 -5.785 1.00 75.40 H new ATOM 0 HD23 LEU A 215 -11.684 -3.263 -4.775 1.00 75.40 H new ATOM 710 N GLU A 216 -11.811 0.068 -4.247 1.00 42.34 N ATOM 711 CA GLU A 216 -11.351 0.109 -2.861 1.00 21.22 C ATOM 712 C GLU A 216 -12.510 0.239 -1.867 1.00 61.20 C ATOM 713 O GLU A 216 -12.315 0.672 -0.732 1.00 11.33 O ATOM 714 CB GLU A 216 -10.282 1.194 -2.641 1.00 25.21 C ATOM 715 CG GLU A 216 -8.978 0.837 -3.351 1.00 54.02 C ATOM 716 CD GLU A 216 -7.799 1.647 -2.845 1.00 1.13 C ATOM 717 OE1 GLU A 216 -7.715 2.847 -3.188 1.00 13.22 O ATOM 718 OE2 GLU A 216 -6.901 1.069 -2.179 1.00 44.35 O1- ATOM 0 H GLU A 216 -12.564 0.726 -4.448 1.00 42.34 H new ATOM 0 HA GLU A 216 -10.876 -0.852 -2.663 1.00 21.22 H new ATOM 0 HB2 GLU A 216 -10.650 2.151 -3.011 1.00 25.21 H new ATOM 0 HB3 GLU A 216 -10.097 1.314 -1.574 1.00 25.21 H new ATOM 0 HG2 GLU A 216 -8.772 -0.224 -3.212 1.00 54.02 H new ATOM 0 HG3 GLU A 216 -9.095 1.002 -4.422 1.00 54.02 H new ATOM 725 N LYS A 217 -13.728 -0.139 -2.258 1.00 71.23 N ATOM 726 CA LYS A 217 -14.830 -0.350 -1.324 1.00 24.12 C ATOM 727 C LYS A 217 -15.296 -1.790 -1.483 1.00 41.53 C ATOM 728 O LYS A 217 -16.421 -2.085 -1.886 1.00 65.12 O ATOM 729 CB LYS A 217 -15.907 0.738 -1.479 1.00 63.53 C ATOM 730 CG LYS A 217 -16.435 1.109 -0.090 1.00 33.31 C ATOM 731 CD LYS A 217 -17.434 2.262 -0.153 1.00 21.23 C ATOM 732 CE LYS A 217 -17.647 2.790 1.266 1.00 11.23 C ATOM 733 NZ LYS A 217 -18.564 3.942 1.282 1.00 34.23 N1+ ATOM 0 H LYS A 217 -13.976 -0.307 -3.233 1.00 71.23 H new ATOM 0 HA LYS A 217 -14.521 -0.234 -0.285 1.00 24.12 H new ATOM 0 HB2 LYS A 217 -15.489 1.616 -1.971 1.00 63.53 H new ATOM 0 HB3 LYS A 217 -16.721 0.377 -2.108 1.00 63.53 H new ATOM 0 HG2 LYS A 217 -16.912 0.239 0.362 1.00 33.31 H new ATOM 0 HG3 LYS A 217 -15.600 1.386 0.554 1.00 33.31 H new ATOM 0 HD2 LYS A 217 -17.059 3.054 -0.801 1.00 21.23 H new ATOM 0 HD3 LYS A 217 -18.379 1.923 -0.578 1.00 21.23 H new ATOM 0 HE2 LYS A 217 -18.049 1.995 1.894 1.00 11.23 H new ATOM 0 HE3 LYS A 217 -16.688 3.081 1.695 1.00 11.23 H new ATOM 0 HZ1 LYS A 217 -18.686 4.275 2.260 1.00 34.23 H new ATOM 0 HZ2 LYS A 217 -18.168 4.709 0.702 1.00 34.23 H new ATOM 0 HZ3 LYS A 217 -19.486 3.657 0.896 1.00 34.23 H new ATOM 747 N CYS A 218 -14.358 -2.702 -1.246 1.00 72.34 N ATOM 748 CA CYS A 218 -14.610 -4.130 -1.183 1.00 52.25 C ATOM 749 C CYS A 218 -15.508 -4.392 0.045 1.00 53.24 C ATOM 750 O CYS A 218 -15.437 -3.636 1.015 1.00 3.44 O ATOM 751 CB CYS A 218 -13.231 -4.797 -1.082 1.00 41.44 C ATOM 752 SG CYS A 218 -13.229 -6.530 -1.605 1.00 24.22 S ATOM 0 H CYS A 218 -13.380 -2.458 -1.089 1.00 72.34 H new ATOM 0 HA CYS A 218 -15.131 -4.533 -2.052 1.00 52.25 H new ATOM 0 HB2 CYS A 218 -12.521 -4.240 -1.693 1.00 41.44 H new ATOM 0 HB3 CYS A 218 -12.881 -4.736 -0.052 1.00 41.44 H new ATOM 0 HG CYS A 218 -12.083 -6.818 -2.148 1.00 24.22 H new ATOM 758 N PRO A 219 -16.347 -5.442 0.059 1.00 2.24 N ATOM 759 CA PRO A 219 -17.231 -5.739 1.192 1.00 23.03 C ATOM 760 C PRO A 219 -16.514 -6.195 2.473 1.00 53.55 C ATOM 761 O PRO A 219 -17.187 -6.417 3.483 1.00 51.44 O ATOM 762 CB PRO A 219 -18.203 -6.806 0.677 1.00 13.32 C ATOM 763 CG PRO A 219 -17.437 -7.470 -0.459 1.00 34.20 C ATOM 764 CD PRO A 219 -16.686 -6.298 -1.068 1.00 63.34 C ATOM 0 HA PRO A 219 -17.733 -4.825 1.510 1.00 23.03 H new ATOM 0 HB2 PRO A 219 -18.463 -7.521 1.457 1.00 13.32 H new ATOM 0 HB3 PRO A 219 -19.135 -6.363 0.327 1.00 13.32 H new ATOM 0 HG2 PRO A 219 -16.760 -8.243 -0.096 1.00 34.20 H new ATOM 0 HG3 PRO A 219 -18.105 -7.944 -1.178 1.00 34.20 H new ATOM 0 HD2 PRO A 219 -15.791 -6.632 -1.593 1.00 63.34 H new ATOM 0 HD3 PRO A 219 -17.303 -5.769 -1.794 1.00 63.34 H new ATOM 772 N PHE A 220 -15.187 -6.382 2.448 1.00 52.33 N ATOM 773 CA PHE A 220 -14.431 -6.988 3.546 1.00 13.33 C ATOM 774 C PHE A 220 -14.680 -6.369 4.942 1.00 31.11 C ATOM 775 O PHE A 220 -14.970 -5.174 5.054 1.00 61.21 O ATOM 776 CB PHE A 220 -12.943 -7.212 3.219 1.00 12.53 C ATOM 777 CG PHE A 220 -12.264 -6.103 2.477 1.00 53.04 C ATOM 778 CD1 PHE A 220 -12.595 -4.789 2.785 1.00 11.32 C ATOM 779 CD2 PHE A 220 -11.287 -6.384 1.521 1.00 43.24 C ATOM 780 CE1 PHE A 220 -11.867 -3.720 2.239 1.00 35.04 C ATOM 781 CE2 PHE A 220 -10.534 -5.327 0.974 1.00 24.41 C ATOM 782 CZ PHE A 220 -10.803 -3.999 1.360 1.00 24.35 C ATOM 0 H PHE A 220 -14.605 -6.113 1.655 1.00 52.33 H new ATOM 0 HA PHE A 220 -14.862 -7.985 3.635 1.00 13.33 H new ATOM 0 HB2 PHE A 220 -12.407 -7.380 4.153 1.00 12.53 H new ATOM 0 HB3 PHE A 220 -12.853 -8.125 2.631 1.00 12.53 H new ATOM 0 HD1 PHE A 220 -13.421 -4.588 3.451 1.00 11.32 H new ATOM 0 HD2 PHE A 220 -11.110 -7.401 1.204 1.00 43.24 H new ATOM 0 HE1 PHE A 220 -12.119 -2.700 2.489 1.00 35.04 H new ATOM 0 HE2 PHE A 220 -9.751 -5.534 0.259 1.00 24.41 H new ATOM 0 HZ PHE A 220 -10.192 -3.193 0.981 1.00 24.35 H new ATOM 792 N PRO A 221 -14.510 -7.149 6.023 1.00 52.42 N ATOM 793 CA PRO A 221 -14.357 -6.600 7.364 1.00 64.02 C ATOM 794 C PRO A 221 -13.007 -5.869 7.496 1.00 52.52 C ATOM 795 O PRO A 221 -12.144 -5.939 6.612 1.00 61.24 O ATOM 796 CB PRO A 221 -14.475 -7.807 8.304 1.00 3.32 C ATOM 797 CG PRO A 221 -13.967 -8.970 7.455 1.00 31.34 C ATOM 798 CD PRO A 221 -14.409 -8.600 6.041 1.00 13.23 C ATOM 0 HA PRO A 221 -15.111 -5.851 7.605 1.00 64.02 H new ATOM 0 HB2 PRO A 221 -13.875 -7.675 9.204 1.00 3.32 H new ATOM 0 HB3 PRO A 221 -15.504 -7.965 8.627 1.00 3.32 H new ATOM 0 HG2 PRO A 221 -12.884 -9.073 7.523 1.00 31.34 H new ATOM 0 HG3 PRO A 221 -14.398 -9.919 7.775 1.00 31.34 H new ATOM 0 HD2 PRO A 221 -13.689 -8.951 5.302 1.00 13.23 H new ATOM 0 HD3 PRO A 221 -15.366 -9.061 5.797 1.00 13.23 H new ATOM 806 N ALA A 222 -12.817 -5.163 8.612 1.00 15.10 N ATOM 807 CA ALA A 222 -11.556 -4.529 8.976 1.00 33.50 C ATOM 808 C ALA A 222 -10.513 -5.571 9.385 1.00 45.31 C ATOM 809 O ALA A 222 -10.857 -6.611 9.951 1.00 5.14 O ATOM 810 CB ALA A 222 -11.814 -3.599 10.167 1.00 54.51 C ATOM 0 H ALA A 222 -13.554 -5.015 9.301 1.00 15.10 H new ATOM 0 HA ALA A 222 -11.175 -3.978 8.116 1.00 33.50 H new ATOM 0 HB1 ALA A 222 -10.883 -3.113 10.457 1.00 54.51 H new ATOM 0 HB2 ALA A 222 -12.546 -2.842 9.886 1.00 54.51 H new ATOM 0 HB3 ALA A 222 -12.197 -4.180 11.006 1.00 54.51 H new ATOM 816 N GLY A 223 -9.242 -5.234 9.176 1.00 72.54 N ATOM 817 CA GLY A 223 -8.081 -5.833 9.820 1.00 54.34 C ATOM 818 C GLY A 223 -7.900 -7.319 9.514 1.00 13.20 C ATOM 819 O GLY A 223 -7.237 -8.024 10.271 1.00 13.51 O ATOM 0 H GLY A 223 -8.984 -4.498 8.519 1.00 72.54 H new ATOM 0 HA2 GLY A 223 -7.186 -5.296 9.506 1.00 54.34 H new ATOM 0 HA3 GLY A 223 -8.169 -5.702 10.899 1.00 54.34 H new ATOM 823 N SER A 224 -8.512 -7.812 8.438 1.00 12.10 N ATOM 824 CA SER A 224 -8.705 -9.232 8.203 1.00 32.34 C ATOM 825 C SER A 224 -7.928 -9.668 6.966 1.00 62.33 C ATOM 826 O SER A 224 -7.825 -8.924 5.993 1.00 52.54 O ATOM 827 CB SER A 224 -10.200 -9.487 8.033 1.00 2.20 C ATOM 828 OG SER A 224 -10.910 -9.249 9.234 1.00 61.34 O ATOM 0 H SER A 224 -8.891 -7.222 7.697 1.00 12.10 H new ATOM 0 HA SER A 224 -8.332 -9.813 9.046 1.00 32.34 H new ATOM 0 HB2 SER A 224 -10.592 -8.844 7.245 1.00 2.20 H new ATOM 0 HB3 SER A 224 -10.360 -10.517 7.713 1.00 2.20 H new ATOM 0 HG SER A 224 -10.893 -8.291 9.440 1.00 61.34 H new ATOM 834 N ASP A 225 -7.456 -10.917 6.951 1.00 61.25 N ATOM 835 CA ASP A 225 -6.698 -11.497 5.835 1.00 53.22 C ATOM 836 C ASP A 225 -7.485 -11.485 4.523 1.00 11.51 C ATOM 837 O ASP A 225 -6.899 -11.469 3.443 1.00 20.21 O ATOM 838 CB ASP A 225 -6.341 -12.942 6.169 1.00 65.42 C ATOM 839 CG ASP A 225 -5.361 -13.572 5.172 1.00 1.12 C ATOM 840 OD1 ASP A 225 -4.421 -12.913 4.668 1.00 54.24 O1- ATOM 841 OD2 ASP A 225 -5.514 -14.777 4.898 1.00 40.32 O ATOM 0 H ASP A 225 -7.591 -11.566 7.726 1.00 61.25 H new ATOM 0 HA ASP A 225 -5.805 -10.887 5.699 1.00 53.22 H new ATOM 0 HB2 ASP A 225 -5.906 -12.980 7.168 1.00 65.42 H new ATOM 0 HB3 ASP A 225 -7.254 -13.537 6.196 1.00 65.42 H new ATOM 846 N LEU A 226 -8.821 -11.420 4.597 1.00 65.13 N ATOM 847 CA LEU A 226 -9.666 -11.266 3.418 1.00 13.44 C ATOM 848 C LEU A 226 -9.260 -10.038 2.602 1.00 72.23 C ATOM 849 O LEU A 226 -9.341 -10.062 1.374 1.00 44.25 O ATOM 850 CB LEU A 226 -11.146 -11.099 3.800 1.00 21.33 C ATOM 851 CG LEU A 226 -11.875 -12.372 4.256 1.00 42.04 C ATOM 852 CD1 LEU A 226 -13.290 -11.966 4.683 1.00 2.14 C ATOM 853 CD2 LEU A 226 -11.959 -13.429 3.148 1.00 31.03 C ATOM 0 H LEU A 226 -9.339 -11.473 5.474 1.00 65.13 H new ATOM 0 HA LEU A 226 -9.533 -12.174 2.829 1.00 13.44 H new ATOM 0 HB2 LEU A 226 -11.213 -10.361 4.599 1.00 21.33 H new ATOM 0 HB3 LEU A 226 -11.677 -10.688 2.942 1.00 21.33 H new ATOM 0 HG LEU A 226 -11.317 -12.821 5.078 1.00 42.04 H new ATOM 0 HD11 LEU A 226 -13.838 -12.849 5.014 1.00 2.14 H new ATOM 0 HD12 LEU A 226 -13.231 -11.248 5.501 1.00 2.14 H new ATOM 0 HD13 LEU A 226 -13.809 -11.513 3.838 1.00 2.14 H new ATOM 0 HD21 LEU A 226 -12.483 -14.308 3.523 1.00 31.03 H new ATOM 0 HD22 LEU A 226 -12.500 -13.020 2.295 1.00 31.03 H new ATOM 0 HD23 LEU A 226 -10.953 -13.712 2.838 1.00 31.03 H new ATOM 865 N ALA A 227 -8.838 -8.966 3.271 1.00 33.13 N ATOM 866 CA ALA A 227 -8.361 -7.752 2.641 1.00 31.51 C ATOM 867 C ALA A 227 -7.074 -8.005 1.847 1.00 61.32 C ATOM 868 O ALA A 227 -6.953 -7.538 0.712 1.00 1.22 O ATOM 869 CB ALA A 227 -8.225 -6.673 3.719 1.00 20.11 C ATOM 0 H ALA A 227 -8.821 -8.924 4.290 1.00 33.13 H new ATOM 0 HA ALA A 227 -9.076 -7.396 1.900 1.00 31.51 H new ATOM 0 HB1 ALA A 227 -7.866 -5.749 3.266 1.00 20.11 H new ATOM 0 HB2 ALA A 227 -9.196 -6.497 4.182 1.00 20.11 H new ATOM 0 HB3 ALA A 227 -7.516 -7.004 4.478 1.00 20.11 H new ATOM 875 N GLN A 228 -6.149 -8.808 2.377 1.00 2.11 N ATOM 876 CA GLN A 228 -4.947 -9.225 1.671 1.00 62.54 C ATOM 877 C GLN A 228 -5.306 -10.157 0.503 1.00 60.13 C ATOM 878 O GLN A 228 -4.764 -9.995 -0.591 1.00 43.54 O ATOM 879 CB GLN A 228 -3.974 -9.848 2.687 1.00 74.33 C ATOM 880 CG GLN A 228 -2.842 -10.646 2.036 1.00 13.33 C ATOM 881 CD GLN A 228 -1.709 -10.952 3.011 1.00 64.54 C ATOM 882 OE1 GLN A 228 -0.587 -10.486 2.820 1.00 5.12 O ATOM 883 NE2 GLN A 228 -1.961 -11.700 4.077 1.00 5.01 N ATOM 0 H GLN A 228 -6.219 -9.189 3.321 1.00 2.11 H new ATOM 0 HA GLN A 228 -4.444 -8.371 1.217 1.00 62.54 H new ATOM 0 HB2 GLN A 228 -3.544 -9.056 3.300 1.00 74.33 H new ATOM 0 HB3 GLN A 228 -4.531 -10.503 3.357 1.00 74.33 H new ATOM 0 HG2 GLN A 228 -3.241 -11.581 1.642 1.00 13.33 H new ATOM 0 HG3 GLN A 228 -2.447 -10.085 1.189 1.00 13.33 H new ATOM 0 HE21 GLN A 228 -2.896 -12.080 4.224 1.00 5.01 H new ATOM 0 HE22 GLN A 228 -1.220 -11.895 4.750 1.00 5.01 H new ATOM 892 N LYS A 229 -6.221 -11.115 0.695 1.00 14.24 N ATOM 893 CA LYS A 229 -6.640 -12.020 -0.381 1.00 61.11 C ATOM 894 C LYS A 229 -7.357 -11.272 -1.496 1.00 50.14 C ATOM 895 O LYS A 229 -7.201 -11.656 -2.656 1.00 20.33 O ATOM 896 CB LYS A 229 -7.507 -13.177 0.150 1.00 43.15 C ATOM 897 CG LYS A 229 -6.671 -14.426 0.470 1.00 65.30 C ATOM 898 CD LYS A 229 -5.690 -14.186 1.620 1.00 2.11 C ATOM 899 CE LYS A 229 -4.948 -15.467 2.003 1.00 22.04 C ATOM 900 NZ LYS A 229 -3.801 -15.151 2.872 1.00 4.21 N1+ ATOM 0 H LYS A 229 -6.686 -11.283 1.587 1.00 14.24 H new ATOM 0 HA LYS A 229 -5.732 -12.453 -0.800 1.00 61.11 H new ATOM 0 HB2 LYS A 229 -8.032 -12.853 1.048 1.00 43.15 H new ATOM 0 HB3 LYS A 229 -8.267 -13.429 -0.590 1.00 43.15 H new ATOM 0 HG2 LYS A 229 -7.336 -15.250 0.728 1.00 65.30 H new ATOM 0 HG3 LYS A 229 -6.118 -14.729 -0.419 1.00 65.30 H new ATOM 0 HD2 LYS A 229 -4.970 -13.420 1.331 1.00 2.11 H new ATOM 0 HD3 LYS A 229 -6.230 -13.805 2.486 1.00 2.11 H new ATOM 0 HE2 LYS A 229 -5.626 -16.149 2.517 1.00 22.04 H new ATOM 0 HE3 LYS A 229 -4.603 -15.978 1.104 1.00 22.04 H new ATOM 0 HZ1 LYS A 229 -3.012 -15.791 2.652 1.00 4.21 H new ATOM 0 HZ2 LYS A 229 -3.504 -14.167 2.711 1.00 4.21 H new ATOM 0 HZ3 LYS A 229 -4.076 -15.271 3.868 1.00 4.21 H new ATOM 914 N TRP A 230 -8.105 -10.211 -1.192 1.00 13.20 N ATOM 915 CA TRP A 230 -8.614 -9.328 -2.227 1.00 72.33 C ATOM 916 C TRP A 230 -7.426 -8.692 -2.955 1.00 31.00 C ATOM 917 O TRP A 230 -7.343 -8.764 -4.179 1.00 23.12 O ATOM 918 CB TRP A 230 -9.560 -8.266 -1.654 1.00 34.15 C ATOM 919 CG TRP A 230 -9.872 -7.221 -2.673 1.00 61.20 C ATOM 920 CD1 TRP A 230 -10.717 -7.375 -3.714 1.00 14.12 C ATOM 921 CD2 TRP A 230 -9.171 -5.968 -2.914 1.00 53.24 C ATOM 922 NE1 TRP A 230 -10.577 -6.317 -4.584 1.00 24.03 N ATOM 923 CE2 TRP A 230 -9.609 -5.437 -4.159 1.00 13.24 C ATOM 924 CE3 TRP A 230 -8.150 -5.272 -2.237 1.00 35.03 C ATOM 925 CZ2 TRP A 230 -9.051 -4.276 -4.708 1.00 2.33 C ATOM 926 CZ3 TRP A 230 -7.582 -4.110 -2.782 1.00 33.44 C ATOM 927 CH2 TRP A 230 -8.030 -3.613 -4.014 1.00 4.35 C ATOM 0 H TRP A 230 -8.367 -9.948 -0.242 1.00 13.20 H new ATOM 0 HA TRP A 230 -9.205 -9.908 -2.936 1.00 72.33 H new ATOM 0 HB2 TRP A 230 -10.483 -8.739 -1.319 1.00 34.15 H new ATOM 0 HB3 TRP A 230 -9.104 -7.802 -0.780 1.00 34.15 H new ATOM 0 HD1 TRP A 230 -11.399 -8.202 -3.845 1.00 14.12 H new ATOM 0 HE1 TRP A 230 -11.123 -6.200 -5.438 1.00 24.03 H new ATOM 0 HE3 TRP A 230 -7.799 -5.638 -1.284 1.00 35.03 H new ATOM 0 HZ2 TRP A 230 -9.403 -3.896 -5.655 1.00 2.33 H new ATOM 0 HZ3 TRP A 230 -6.796 -3.596 -2.249 1.00 33.44 H new ATOM 0 HH2 TRP A 230 -7.588 -2.719 -4.428 1.00 4.35 H new ATOM 938 N HIS A 231 -6.498 -8.095 -2.201 1.00 41.52 N ATOM 939 CA HIS A 231 -5.388 -7.309 -2.730 1.00 44.11 C ATOM 940 C HIS A 231 -4.473 -8.119 -3.657 1.00 62.42 C ATOM 941 O HIS A 231 -3.870 -7.549 -4.564 1.00 2.10 O ATOM 942 CB HIS A 231 -4.607 -6.717 -1.546 1.00 73.30 C ATOM 943 CG HIS A 231 -3.643 -5.634 -1.937 1.00 1.23 C ATOM 944 ND1 HIS A 231 -2.354 -5.482 -1.483 1.00 54.43 N ATOM 945 CD2 HIS A 231 -3.925 -4.582 -2.757 1.00 54.44 C ATOM 946 CE1 HIS A 231 -1.863 -4.355 -2.028 1.00 44.02 C ATOM 947 NE2 HIS A 231 -2.790 -3.763 -2.807 1.00 72.12 N ATOM 0 H HIS A 231 -6.501 -8.148 -1.182 1.00 41.52 H new ATOM 0 HA HIS A 231 -5.792 -6.509 -3.350 1.00 44.11 H new ATOM 0 HB2 HIS A 231 -5.314 -6.316 -0.820 1.00 73.30 H new ATOM 0 HB3 HIS A 231 -4.058 -7.517 -1.048 1.00 73.30 H new ATOM 0 HD2 HIS A 231 -4.857 -4.411 -3.275 1.00 54.44 H new ATOM 0 HE1 HIS A 231 -0.865 -3.977 -1.864 1.00 44.02 H new ATOM 0 HE2 HIS A 231 -2.686 -2.893 -3.329 1.00 72.12 H new ATOM 955 N LEU A 232 -4.391 -9.439 -3.458 1.00 43.21 N ATOM 956 CA LEU A 232 -3.761 -10.390 -4.372 1.00 54.14 C ATOM 957 C LEU A 232 -4.317 -10.198 -5.791 1.00 63.01 C ATOM 958 O LEU A 232 -3.577 -9.970 -6.746 1.00 33.14 O ATOM 959 CB LEU A 232 -4.016 -11.816 -3.843 1.00 63.34 C ATOM 960 CG LEU A 232 -3.254 -12.925 -4.594 1.00 62.14 C ATOM 961 CD1 LEU A 232 -1.780 -12.969 -4.179 1.00 23.25 C ATOM 962 CD2 LEU A 232 -3.899 -14.280 -4.275 1.00 64.32 C ATOM 0 H LEU A 232 -4.776 -9.887 -2.626 1.00 43.21 H new ATOM 0 HA LEU A 232 -2.685 -10.223 -4.422 1.00 54.14 H new ATOM 0 HB2 LEU A 232 -3.740 -11.853 -2.789 1.00 63.34 H new ATOM 0 HB3 LEU A 232 -5.084 -12.025 -3.900 1.00 63.34 H new ATOM 0 HG LEU A 232 -3.306 -12.713 -5.662 1.00 62.14 H new ATOM 0 HD11 LEU A 232 -1.271 -13.762 -4.727 1.00 23.25 H new ATOM 0 HD12 LEU A 232 -1.310 -12.012 -4.405 1.00 23.25 H new ATOM 0 HD13 LEU A 232 -1.709 -13.164 -3.109 1.00 23.25 H new ATOM 0 HD21 LEU A 232 -3.365 -15.070 -4.803 1.00 64.32 H new ATOM 0 HD22 LEU A 232 -3.849 -14.463 -3.202 1.00 64.32 H new ATOM 0 HD23 LEU A 232 -4.941 -14.271 -4.594 1.00 64.32 H new ATOM 974 N ILE A 233 -5.640 -10.279 -5.921 1.00 20.31 N ATOM 975 CA ILE A 233 -6.337 -10.220 -7.197 1.00 12.23 C ATOM 976 C ILE A 233 -6.371 -8.774 -7.702 1.00 33.40 C ATOM 977 O ILE A 233 -6.086 -8.551 -8.878 1.00 73.01 O ATOM 978 CB ILE A 233 -7.734 -10.870 -7.055 1.00 31.24 C ATOM 979 CG1 ILE A 233 -7.658 -12.305 -6.470 1.00 41.21 C ATOM 980 CG2 ILE A 233 -8.488 -10.896 -8.395 1.00 11.11 C ATOM 981 CD1 ILE A 233 -6.648 -13.244 -7.148 1.00 1.50 C ATOM 0 H ILE A 233 -6.267 -10.390 -5.124 1.00 20.31 H new ATOM 0 HA ILE A 233 -5.807 -10.794 -7.957 1.00 12.23 H new ATOM 0 HB ILE A 233 -8.287 -10.245 -6.353 1.00 31.24 H new ATOM 0 HG12 ILE A 233 -7.408 -12.234 -5.412 1.00 41.21 H new ATOM 0 HG13 ILE A 233 -8.648 -12.757 -6.534 1.00 41.21 H new ATOM 0 HG21 ILE A 233 -9.464 -11.360 -8.254 1.00 11.11 H new ATOM 0 HG22 ILE A 233 -8.619 -9.877 -8.758 1.00 11.11 H new ATOM 0 HG23 ILE A 233 -7.915 -11.470 -9.124 1.00 11.11 H new ATOM 0 HD11 ILE A 233 -6.676 -14.220 -6.663 1.00 1.50 H new ATOM 0 HD12 ILE A 233 -6.905 -13.355 -8.201 1.00 1.50 H new ATOM 0 HD13 ILE A 233 -5.646 -12.824 -7.062 1.00 1.50 H new ATOM 993 N LYS A 234 -6.642 -7.786 -6.837 1.00 35.12 N ATOM 994 CA LYS A 234 -6.802 -6.362 -7.155 1.00 65.43 C ATOM 995 C LYS A 234 -7.994 -6.105 -8.085 1.00 71.04 C ATOM 996 O LYS A 234 -8.966 -5.483 -7.668 1.00 11.24 O ATOM 997 CB LYS A 234 -5.474 -5.749 -7.656 1.00 41.01 C ATOM 998 CG LYS A 234 -5.586 -4.225 -7.809 1.00 40.11 C ATOM 999 CD LYS A 234 -4.386 -3.561 -8.500 1.00 52.01 C ATOM 1000 CE LYS A 234 -4.368 -3.849 -10.006 1.00 24.13 C ATOM 1001 NZ LYS A 234 -3.345 -3.053 -10.719 1.00 64.53 N1+ ATOM 0 H LYS A 234 -6.762 -7.971 -5.841 1.00 35.12 H new ATOM 0 HA LYS A 234 -7.049 -5.837 -6.232 1.00 65.43 H new ATOM 0 HB2 LYS A 234 -4.673 -5.989 -6.956 1.00 41.01 H new ATOM 0 HB3 LYS A 234 -5.204 -6.194 -8.614 1.00 41.01 H new ATOM 0 HG2 LYS A 234 -6.488 -3.996 -8.377 1.00 40.11 H new ATOM 0 HG3 LYS A 234 -5.710 -3.782 -6.821 1.00 40.11 H new ATOM 0 HD2 LYS A 234 -4.422 -2.484 -8.336 1.00 52.01 H new ATOM 0 HD3 LYS A 234 -3.461 -3.922 -8.049 1.00 52.01 H new ATOM 0 HE2 LYS A 234 -4.177 -4.910 -10.168 1.00 24.13 H new ATOM 0 HE3 LYS A 234 -5.350 -3.634 -10.426 1.00 24.13 H new ATOM 0 HZ1 LYS A 234 -3.371 -3.282 -11.733 1.00 64.53 H new ATOM 0 HZ2 LYS A 234 -3.540 -2.040 -10.588 1.00 64.53 H new ATOM 0 HZ3 LYS A 234 -2.403 -3.276 -10.338 1.00 64.53 H new ATOM 1015 N GLN A 235 -7.921 -6.539 -9.337 1.00 72.02 N ATOM 1016 CA GLN A 235 -8.945 -6.407 -10.361 1.00 11.35 C ATOM 1017 C GLN A 235 -9.421 -7.813 -10.708 1.00 33.24 C ATOM 1018 O GLN A 235 -8.683 -8.567 -11.349 1.00 30.21 O ATOM 1019 CB GLN A 235 -8.401 -5.677 -11.602 1.00 22.32 C ATOM 1020 CG GLN A 235 -7.021 -6.151 -12.108 1.00 50.13 C ATOM 1021 CD GLN A 235 -7.055 -6.560 -13.577 1.00 24.00 C ATOM 1022 OE1 GLN A 235 -7.332 -5.754 -14.465 1.00 23.03 O ATOM 1023 NE2 GLN A 235 -6.762 -7.818 -13.860 1.00 43.20 N ATOM 0 H GLN A 235 -7.093 -7.022 -9.684 1.00 72.02 H new ATOM 0 HA GLN A 235 -9.777 -5.806 -9.993 1.00 11.35 H new ATOM 0 HB2 GLN A 235 -9.122 -5.789 -12.412 1.00 22.32 H new ATOM 0 HB3 GLN A 235 -8.338 -4.613 -11.376 1.00 22.32 H new ATOM 0 HG2 GLN A 235 -6.292 -5.352 -11.972 1.00 50.13 H new ATOM 0 HG3 GLN A 235 -6.685 -6.995 -11.505 1.00 50.13 H new ATOM 0 HE21 GLN A 235 -6.535 -8.470 -13.109 1.00 43.20 H new ATOM 0 HE22 GLN A 235 -6.763 -8.136 -14.829 1.00 43.20 H new ATOM 1032 N HIS A 236 -10.630 -8.190 -10.287 1.00 22.23 N ATOM 1033 CA HIS A 236 -11.260 -9.361 -10.874 1.00 73.33 C ATOM 1034 C HIS A 236 -11.688 -8.987 -12.299 1.00 63.54 C ATOM 1035 O HIS A 236 -12.105 -7.854 -12.566 1.00 34.42 O ATOM 1036 CB HIS A 236 -12.425 -9.877 -10.017 1.00 2.44 C ATOM 1037 CG HIS A 236 -12.735 -11.358 -10.137 1.00 4.45 C ATOM 1038 ND1 HIS A 236 -13.818 -11.982 -9.553 1.00 31.54 N ATOM 1039 CD2 HIS A 236 -11.983 -12.337 -10.738 1.00 72.22 C ATOM 1040 CE1 HIS A 236 -13.724 -13.297 -9.790 1.00 31.30 C ATOM 1041 NE2 HIS A 236 -12.601 -13.569 -10.479 1.00 63.23 N ATOM 0 H HIS A 236 -11.173 -7.716 -9.565 1.00 22.23 H new ATOM 0 HA HIS A 236 -10.556 -10.192 -10.913 1.00 73.33 H new ATOM 0 HB2 HIS A 236 -12.207 -9.655 -8.972 1.00 2.44 H new ATOM 0 HB3 HIS A 236 -13.321 -9.316 -10.282 1.00 2.44 H new ATOM 0 HD2 HIS A 236 -11.078 -12.186 -11.308 1.00 72.22 H new ATOM 0 HE1 HIS A 236 -14.447 -14.034 -9.473 1.00 31.30 H new ATOM 0 HE2 HIS A 236 -12.265 -14.491 -10.758 1.00 63.23 H new ATOM 1049 N THR A 237 -11.551 -9.938 -13.210 1.00 74.12 N ATOM 1050 CA THR A 237 -11.969 -9.907 -14.600 1.00 64.12 C ATOM 1051 C THR A 237 -12.123 -11.378 -15.014 1.00 22.14 C ATOM 1052 O THR A 237 -11.639 -12.261 -14.302 1.00 63.42 O ATOM 1053 CB THR A 237 -10.918 -9.118 -15.423 1.00 1.11 C ATOM 1054 OG1 THR A 237 -11.158 -9.125 -16.824 1.00 61.40 O ATOM 1055 CG2 THR A 237 -9.488 -9.645 -15.217 1.00 50.03 C ATOM 0 H THR A 237 -11.107 -10.825 -12.974 1.00 74.12 H new ATOM 0 HA THR A 237 -12.915 -9.393 -14.772 1.00 64.12 H new ATOM 0 HB THR A 237 -11.017 -8.102 -15.042 1.00 1.11 H new ATOM 0 HG1 THR A 237 -12.024 -8.706 -17.010 1.00 61.40 H new ATOM 0 HG21 THR A 237 -8.793 -9.056 -15.816 1.00 50.03 H new ATOM 0 HG22 THR A 237 -9.218 -9.563 -14.164 1.00 50.03 H new ATOM 0 HG23 THR A 237 -9.437 -10.690 -15.524 1.00 50.03 H new ATOM 1063 N ALA A 238 -12.777 -11.637 -16.152 1.00 64.25 N ATOM 1064 CA ALA A 238 -13.095 -12.964 -16.673 1.00 34.41 C ATOM 1065 C ALA A 238 -13.637 -13.883 -15.563 1.00 70.53 C ATOM 1066 O ALA A 238 -12.948 -14.819 -15.150 1.00 41.40 O ATOM 1067 CB ALA A 238 -11.879 -13.544 -17.403 1.00 14.52 C ATOM 0 H ALA A 238 -13.113 -10.890 -16.760 1.00 64.25 H new ATOM 0 HA ALA A 238 -13.898 -12.882 -17.405 1.00 34.41 H new ATOM 0 HB1 ALA A 238 -12.124 -14.534 -17.789 1.00 14.52 H new ATOM 0 HB2 ALA A 238 -11.605 -12.890 -18.231 1.00 14.52 H new ATOM 0 HB3 ALA A 238 -11.041 -13.622 -16.710 1.00 14.52 H new ATOM 1073 N PRO A 239 -14.854 -13.617 -15.055 1.00 61.40 N ATOM 1074 CA PRO A 239 -15.456 -14.411 -13.998 1.00 14.44 C ATOM 1075 C PRO A 239 -15.828 -15.795 -14.544 1.00 74.14 C ATOM 1076 O PRO A 239 -16.668 -15.903 -15.442 1.00 42.52 O ATOM 1077 CB PRO A 239 -16.663 -13.598 -13.518 1.00 51.21 C ATOM 1078 CG PRO A 239 -17.061 -12.773 -14.734 1.00 20.31 C ATOM 1079 CD PRO A 239 -15.729 -12.516 -15.431 1.00 1.53 C ATOM 0 HA PRO A 239 -14.786 -14.601 -13.160 1.00 14.44 H new ATOM 0 HB2 PRO A 239 -17.476 -14.246 -13.192 1.00 51.21 H new ATOM 0 HB3 PRO A 239 -16.404 -12.962 -12.672 1.00 51.21 H new ATOM 0 HG2 PRO A 239 -17.755 -13.313 -15.378 1.00 20.31 H new ATOM 0 HG3 PRO A 239 -17.551 -11.843 -14.447 1.00 20.31 H new ATOM 0 HD2 PRO A 239 -15.858 -12.473 -16.513 1.00 1.53 H new ATOM 0 HD3 PRO A 239 -15.306 -11.560 -15.122 1.00 1.53 H new ATOM 1087 N VAL A 240 -15.220 -16.854 -14.016 1.00 55.30 N ATOM 1088 CA VAL A 240 -15.419 -18.238 -14.432 1.00 73.31 C ATOM 1089 C VAL A 240 -16.360 -18.905 -13.425 1.00 73.24 C ATOM 1090 O VAL A 240 -15.996 -19.065 -12.255 1.00 4.41 O ATOM 1091 CB VAL A 240 -14.048 -18.945 -14.531 1.00 1.54 C ATOM 1092 CG1 VAL A 240 -14.179 -20.442 -14.839 1.00 2.11 C ATOM 1093 CG2 VAL A 240 -13.172 -18.300 -15.613 1.00 62.34 C ATOM 0 H VAL A 240 -14.547 -16.767 -13.255 1.00 55.30 H new ATOM 0 HA VAL A 240 -15.878 -18.301 -15.419 1.00 73.31 H new ATOM 0 HB VAL A 240 -13.581 -18.831 -13.553 1.00 1.54 H new ATOM 0 HG11 VAL A 240 -13.187 -20.890 -14.898 1.00 2.11 H new ATOM 0 HG12 VAL A 240 -14.750 -20.928 -14.048 1.00 2.11 H new ATOM 0 HG13 VAL A 240 -14.693 -20.574 -15.791 1.00 2.11 H new ATOM 0 HG21 VAL A 240 -12.214 -18.817 -15.661 1.00 62.34 H new ATOM 0 HG22 VAL A 240 -13.673 -18.374 -16.578 1.00 62.34 H new ATOM 0 HG23 VAL A 240 -13.006 -17.251 -15.369 1.00 62.34 H new ATOM 1103 N SER A 241 -17.564 -19.282 -13.860 1.00 23.54 N ATOM 1104 CA SER A 241 -18.486 -20.146 -13.125 1.00 33.20 C ATOM 1105 C SER A 241 -19.451 -20.767 -14.146 1.00 22.33 C ATOM 1106 O SER A 241 -20.645 -20.454 -14.123 1.00 4.10 O ATOM 1107 CB SER A 241 -19.204 -19.345 -12.020 1.00 73.01 C ATOM 1108 OG SER A 241 -20.039 -20.148 -11.196 1.00 42.03 O ATOM 0 H SER A 241 -17.935 -18.984 -14.762 1.00 23.54 H new ATOM 0 HA SER A 241 -17.959 -20.950 -12.612 1.00 33.20 H new ATOM 0 HB2 SER A 241 -18.459 -18.850 -11.397 1.00 73.01 H new ATOM 0 HB3 SER A 241 -19.806 -18.562 -12.481 1.00 73.01 H new ATOM 0 HG SER A 241 -20.674 -20.642 -11.756 1.00 42.03 H new ATOM 1114 N PRO A 242 -18.965 -21.621 -15.066 1.00 54.33 N ATOM 1115 CA PRO A 242 -19.797 -22.171 -16.123 1.00 33.53 C ATOM 1116 C PRO A 242 -20.890 -23.047 -15.514 1.00 62.22 C ATOM 1117 O PRO A 242 -20.645 -23.804 -14.571 1.00 3.45 O ATOM 1118 CB PRO A 242 -18.852 -22.951 -17.035 1.00 40.15 C ATOM 1119 CG PRO A 242 -17.709 -23.342 -16.109 1.00 23.42 C ATOM 1120 CD PRO A 242 -17.608 -22.137 -15.175 1.00 33.01 C ATOM 0 HA PRO A 242 -20.314 -21.403 -16.698 1.00 33.53 H new ATOM 0 HB2 PRO A 242 -19.339 -23.827 -17.463 1.00 40.15 H new ATOM 0 HB3 PRO A 242 -18.503 -22.341 -17.868 1.00 40.15 H new ATOM 0 HG2 PRO A 242 -17.926 -24.260 -15.563 1.00 23.42 H new ATOM 0 HG3 PRO A 242 -16.782 -23.508 -16.658 1.00 23.42 H new ATOM 0 HD2 PRO A 242 -17.218 -22.427 -14.199 1.00 33.01 H new ATOM 0 HD3 PRO A 242 -16.932 -21.383 -15.577 1.00 33.01 H new ATOM 1128 N HIS A 243 -22.092 -22.923 -16.063 1.00 45.13 N ATOM 1129 CA HIS A 243 -23.344 -23.394 -15.479 1.00 20.32 C ATOM 1130 C HIS A 243 -24.247 -24.018 -16.557 1.00 25.15 C ATOM 1131 O HIS A 243 -25.474 -24.025 -16.425 1.00 54.22 O ATOM 1132 CB HIS A 243 -23.975 -22.202 -14.740 1.00 51.05 C ATOM 1133 CG HIS A 243 -24.053 -20.915 -15.534 1.00 23.30 C ATOM 1134 ND1 HIS A 243 -23.136 -19.889 -15.473 1.00 43.14 N ATOM 1135 CD2 HIS A 243 -25.025 -20.550 -16.431 1.00 22.02 C ATOM 1136 CE1 HIS A 243 -23.554 -18.917 -16.297 1.00 63.04 C ATOM 1137 NE2 HIS A 243 -24.693 -19.276 -16.919 1.00 1.40 N ATOM 0 H HIS A 243 -22.228 -22.472 -16.968 1.00 45.13 H new ATOM 0 HA HIS A 243 -23.182 -24.197 -14.760 1.00 20.32 H new ATOM 0 HB2 HIS A 243 -24.982 -22.480 -14.430 1.00 51.05 H new ATOM 0 HB3 HIS A 243 -23.403 -22.015 -13.832 1.00 51.05 H new ATOM 0 HD1 HIS A 243 -22.290 -19.872 -14.903 1.00 43.14 H new ATOM 0 HD2 HIS A 243 -25.888 -21.136 -16.711 1.00 22.02 H new ATOM 0 HE1 HIS A 243 -23.046 -17.975 -16.442 1.00 63.04 H new ATOM 1145 N SER A 244 -23.614 -24.477 -17.641 1.00 53.22 N ATOM 1146 CA SER A 244 -24.194 -25.068 -18.832 1.00 22.22 C ATOM 1147 C SER A 244 -24.770 -26.428 -18.484 1.00 53.24 C ATOM 1148 O SER A 244 -23.962 -27.349 -18.253 1.00 34.02 O ATOM 1149 CB SER A 244 -23.065 -25.174 -19.871 1.00 24.31 C ATOM 1150 OG SER A 244 -23.487 -25.720 -21.109 1.00 51.22 O ATOM 0 H SER A 244 -22.597 -24.437 -17.704 1.00 53.22 H new ATOM 0 HA SER A 244 -25.008 -24.466 -19.236 1.00 22.22 H new ATOM 0 HB2 SER A 244 -22.646 -24.183 -20.044 1.00 24.31 H new ATOM 0 HB3 SER A 244 -22.264 -25.792 -19.464 1.00 24.31 H new ATOM 0 HG SER A 244 -22.726 -25.760 -21.725 1.00 51.22 H new TER 1156 SER A 244