USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 653 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 213 THR OG1 : rot 180:sc= 0.041 USER MOD Set 1.2: A 214 THR OG1 : rot 180:sc= -0.0914 USER MOD Single : A 173 TYR OH : rot 180:sc= -2.64! USER MOD Single : A 175 LYS NZ :NH3+ 165:sc= -0.111 (180deg=-0.506) USER MOD Single : A 177 GLN : amide:sc= -4.67! C(o=-4.7!,f=-6.5!) USER MOD Single : A 184 TYR OH : rot 172:sc= -2.61! USER MOD Single : A 188 HIS : no HD1:sc= -0.051 X(o=-0.051,f=0) USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 180:sc= 0.00369 USER MOD Single : A 193 GLN : amide:sc= -1.4 K(o=-1.4,f=-0.017) USER MOD Single : A 196 HIS : no HD1:sc= -1.5 K(o=-1.5,f=0) USER MOD Single : A 202 MET CE :methyl 177:sc= -2.58! (180deg=-2.59) USER MOD Single : A 203 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0758) USER MOD Single : A 206 SER OG : rot 180:sc= -0.499 USER MOD Single : A 207 MET CE :methyl 157:sc= -0.403 (180deg=-0.972) USER MOD Single : A 216 ASN : amide:sc= 0 X(o=0,f=0.087) USER MOD Single : A 218 SER OG : rot 180:sc= 0.00451 USER MOD Single : A 223 CYS SG : rot -27:sc= -0.367 USER MOD Single : A 224 SER OG : rot -25:sc= 0.439 USER MOD Single : A 226 ASN : amide:sc= -0.0331 X(o=-0.033,f=-0.0067) USER MOD Single : A 227 GLN : amide:sc= -1.36 K(o=-1.4,f=-0.43) USER MOD Single : A 232 GLN : amide:sc= -0.457 X(o=-0.46,f=-0.14) USER MOD Single : A 242 SER OG : rot 180:sc= 0 USER MOD Single : A 243 HIS : no HE2:sc= -4.39! C(o=-4.4!,f=-7!) USER MOD Single : A 249 LYS NZ :NH3+ -162:sc= -0.0842 (180deg=-0.381) USER MOD ----------------------------------------------------------------- ATOM 55 N ALA A 168 -10.385 -7.700 -5.256 1.00 0.41 N ATOM 56 CA ALA A 168 -10.412 -8.498 -4.030 1.00 0.40 C ATOM 57 C ALA A 168 -9.609 -7.830 -2.919 1.00 0.31 C ATOM 58 O ALA A 168 -10.068 -7.730 -1.782 1.00 0.35 O ATOM 59 CB ALA A 168 -9.878 -9.896 -4.303 1.00 0.53 C ATOM 0 HA ALA A 168 -11.447 -8.572 -3.696 1.00 0.40 H new ATOM 0 HB1 ALA A 168 -9.903 -10.481 -3.384 1.00 0.53 H new ATOM 0 HB2 ALA A 168 -10.497 -10.381 -5.058 1.00 0.53 H new ATOM 0 HB3 ALA A 168 -8.851 -9.829 -4.663 1.00 0.53 H new ATOM 65 N ALA A 169 -8.419 -7.351 -3.260 1.00 0.28 N ATOM 66 CA ALA A 169 -7.575 -6.666 -2.293 1.00 0.24 C ATOM 67 C ALA A 169 -8.098 -5.261 -2.028 1.00 0.20 C ATOM 68 O ALA A 169 -7.999 -4.744 -0.913 1.00 0.19 O ATOM 69 CB ALA A 169 -6.137 -6.610 -2.786 1.00 0.31 C ATOM 0 H ALA A 169 -8.019 -7.424 -4.195 1.00 0.28 H new ATOM 0 HA ALA A 169 -7.600 -7.227 -1.359 1.00 0.24 H new ATOM 0 HB1 ALA A 169 -5.520 -6.094 -2.050 1.00 0.31 H new ATOM 0 HB2 ALA A 169 -5.761 -7.623 -2.928 1.00 0.31 H new ATOM 0 HB3 ALA A 169 -6.098 -6.072 -3.733 1.00 0.31 H new ATOM 75 N LEU A 170 -8.682 -4.657 -3.057 1.00 0.21 N ATOM 76 CA LEU A 170 -9.160 -3.286 -2.963 1.00 0.19 C ATOM 77 C LEU A 170 -10.365 -3.180 -2.043 1.00 0.16 C ATOM 78 O LEU A 170 -10.375 -2.362 -1.126 1.00 0.17 O ATOM 79 CB LEU A 170 -9.539 -2.736 -4.336 1.00 0.23 C ATOM 80 CG LEU A 170 -9.837 -1.239 -4.347 1.00 0.26 C ATOM 81 CD1 LEU A 170 -8.546 -0.441 -4.335 1.00 0.29 C ATOM 82 CD2 LEU A 170 -10.701 -0.862 -5.536 1.00 0.29 C ATOM 0 H LEU A 170 -8.835 -5.096 -3.965 1.00 0.21 H new ATOM 0 HA LEU A 170 -8.341 -2.697 -2.551 1.00 0.19 H new ATOM 0 HB2 LEU A 170 -8.727 -2.939 -5.034 1.00 0.23 H new ATOM 0 HB3 LEU A 170 -10.415 -3.273 -4.701 1.00 0.23 H new ATOM 0 HG LEU A 170 -10.397 -0.996 -3.444 1.00 0.26 H new ATOM 0 HD11 LEU A 170 -8.777 0.624 -4.343 1.00 0.29 H new ATOM 0 HD12 LEU A 170 -7.977 -0.682 -3.437 1.00 0.29 H new ATOM 0 HD13 LEU A 170 -7.955 -0.691 -5.216 1.00 0.29 H new ATOM 0 HD21 LEU A 170 -10.897 0.210 -5.518 1.00 0.29 H new ATOM 0 HD22 LEU A 170 -10.182 -1.120 -6.459 1.00 0.29 H new ATOM 0 HD23 LEU A 170 -11.645 -1.404 -5.486 1.00 0.29 H new ATOM 94 N GLU A 171 -11.381 -4.003 -2.295 1.00 0.19 N ATOM 95 CA GLU A 171 -12.611 -3.962 -1.513 1.00 0.24 C ATOM 96 C GLU A 171 -12.316 -4.244 -0.046 1.00 0.22 C ATOM 97 O GLU A 171 -12.945 -3.674 0.847 1.00 0.26 O ATOM 98 CB GLU A 171 -13.636 -4.969 -2.048 1.00 0.36 C ATOM 99 CG GLU A 171 -13.180 -6.415 -1.963 1.00 1.00 C ATOM 100 CD GLU A 171 -14.297 -7.395 -2.248 1.00 1.16 C ATOM 101 OE1 GLU A 171 -15.270 -7.433 -1.467 1.00 1.46 O ATOM 102 OE2 GLU A 171 -14.207 -8.137 -3.246 1.00 1.10 O ATOM 0 H GLU A 171 -11.375 -4.705 -3.035 1.00 0.19 H new ATOM 0 HA GLU A 171 -13.035 -2.962 -1.603 1.00 0.24 H new ATOM 0 HB2 GLU A 171 -14.565 -4.858 -1.490 1.00 0.36 H new ATOM 0 HB3 GLU A 171 -13.858 -4.729 -3.088 1.00 0.36 H new ATOM 0 HG2 GLU A 171 -12.368 -6.578 -2.672 1.00 1.00 H new ATOM 0 HG3 GLU A 171 -12.778 -6.607 -0.968 1.00 1.00 H new ATOM 109 N GLY A 172 -11.355 -5.129 0.190 1.00 0.19 N ATOM 110 CA GLY A 172 -10.924 -5.413 1.535 1.00 0.22 C ATOM 111 C GLY A 172 -10.289 -4.210 2.202 1.00 0.19 C ATOM 112 O GLY A 172 -10.731 -3.783 3.268 1.00 0.22 O ATOM 0 H GLY A 172 -10.867 -5.655 -0.535 1.00 0.19 H new ATOM 0 HA2 GLY A 172 -11.778 -5.744 2.125 1.00 0.22 H new ATOM 0 HA3 GLY A 172 -10.209 -6.236 1.519 1.00 0.22 H new ATOM 116 N TYR A 173 -9.259 -3.644 1.573 1.00 0.17 N ATOM 117 CA TYR A 173 -8.519 -2.550 2.182 1.00 0.16 C ATOM 118 C TYR A 173 -9.367 -1.286 2.271 1.00 0.16 C ATOM 119 O TYR A 173 -9.298 -0.580 3.264 1.00 0.18 O ATOM 120 CB TYR A 173 -7.219 -2.269 1.431 1.00 0.17 C ATOM 121 CG TYR A 173 -6.360 -1.232 2.110 1.00 0.16 C ATOM 122 CD1 TYR A 173 -6.006 -1.361 3.445 1.00 0.19 C ATOM 123 CD2 TYR A 173 -5.888 -0.131 1.406 1.00 0.17 C ATOM 124 CE1 TYR A 173 -5.205 -0.423 4.061 1.00 0.20 C ATOM 125 CE2 TYR A 173 -5.088 0.813 2.017 1.00 0.20 C ATOM 126 CZ TYR A 173 -4.812 0.691 3.378 1.00 0.19 C ATOM 127 OH TYR A 173 -3.941 1.594 3.953 1.00 0.24 O ATOM 0 H TYR A 173 -8.924 -3.925 0.651 1.00 0.17 H new ATOM 0 HA TYR A 173 -8.265 -2.860 3.195 1.00 0.16 H new ATOM 0 HB2 TYR A 173 -6.653 -3.196 1.335 1.00 0.17 H new ATOM 0 HB3 TYR A 173 -7.454 -1.934 0.421 1.00 0.17 H new ATOM 0 HD1 TYR A 173 -6.363 -2.209 4.010 1.00 0.19 H new ATOM 0 HD2 TYR A 173 -6.151 -0.012 0.365 1.00 0.17 H new ATOM 0 HE1 TYR A 173 -4.889 -0.570 5.083 1.00 0.20 H new ATOM 0 HE2 TYR A 173 -4.681 1.636 1.448 1.00 0.20 H new ATOM 0 HH TYR A 173 -3.768 2.327 3.326 1.00 0.24 H new ATOM 137 N ARG A 174 -10.164 -0.994 1.247 1.00 0.18 N ATOM 138 CA ARG A 174 -11.074 0.153 1.291 1.00 0.23 C ATOM 139 C ARG A 174 -12.070 0.013 2.434 1.00 0.23 C ATOM 140 O ARG A 174 -12.464 1.018 3.024 1.00 0.25 O ATOM 141 CB ARG A 174 -11.822 0.352 -0.032 1.00 0.31 C ATOM 142 CG ARG A 174 -12.923 -0.660 -0.302 1.00 0.93 C ATOM 143 CD ARG A 174 -13.780 -0.238 -1.486 1.00 0.74 C ATOM 144 NE ARG A 174 -14.499 1.009 -1.220 1.00 1.05 N ATOM 145 CZ ARG A 174 -15.406 1.542 -2.039 1.00 1.35 C ATOM 146 NH1 ARG A 174 -15.698 0.957 -3.191 1.00 1.31 N ATOM 147 NH2 ARG A 174 -16.014 2.670 -1.699 1.00 2.09 N ATOM 0 H ARG A 174 -10.201 -1.530 0.380 1.00 0.18 H new ATOM 0 HA ARG A 174 -10.457 1.036 1.460 1.00 0.23 H new ATOM 0 HB2 ARG A 174 -12.257 1.351 -0.040 1.00 0.31 H new ATOM 0 HB3 ARG A 174 -11.102 0.311 -0.849 1.00 0.31 H new ATOM 0 HG2 ARG A 174 -12.482 -1.637 -0.499 1.00 0.93 H new ATOM 0 HG3 ARG A 174 -13.549 -0.765 0.584 1.00 0.93 H new ATOM 0 HD2 ARG A 174 -13.148 -0.113 -2.365 1.00 0.74 H new ATOM 0 HD3 ARG A 174 -14.495 -1.028 -1.717 1.00 0.74 H new ATOM 0 HE ARG A 174 -14.293 1.502 -0.351 1.00 1.05 H new ATOM 0 HH11 ARG A 174 -15.228 0.092 -3.457 1.00 1.31 H new ATOM 0 HH12 ARG A 174 -16.393 1.372 -3.812 1.00 1.31 H new ATOM 0 HH21 ARG A 174 -15.787 3.125 -0.815 1.00 2.09 H new ATOM 0 HH22 ARG A 174 -16.709 3.083 -2.321 1.00 2.09 H new ATOM 161 N LYS A 175 -12.467 -1.207 2.769 1.00 0.22 N ATOM 162 CA LYS A 175 -13.324 -1.406 3.929 1.00 0.25 C ATOM 163 C LYS A 175 -12.559 -1.085 5.219 1.00 0.24 C ATOM 164 O LYS A 175 -13.161 -0.734 6.238 1.00 0.29 O ATOM 165 CB LYS A 175 -13.901 -2.823 3.956 1.00 0.26 C ATOM 166 CG LYS A 175 -14.794 -3.085 5.152 1.00 0.89 C ATOM 167 CD LYS A 175 -15.550 -4.393 5.030 1.00 0.84 C ATOM 168 CE LYS A 175 -16.423 -4.636 6.252 1.00 1.71 C ATOM 169 NZ LYS A 175 -17.296 -3.468 6.554 1.00 2.34 N ATOM 0 H LYS A 175 -12.216 -2.058 2.266 1.00 0.22 H new ATOM 0 HA LYS A 175 -14.166 -0.718 3.856 1.00 0.25 H new ATOM 0 HB2 LYS A 175 -14.470 -2.993 3.042 1.00 0.26 H new ATOM 0 HB3 LYS A 175 -13.081 -3.541 3.959 1.00 0.26 H new ATOM 0 HG2 LYS A 175 -14.188 -3.101 6.058 1.00 0.89 H new ATOM 0 HG3 LYS A 175 -15.505 -2.266 5.258 1.00 0.89 H new ATOM 0 HD2 LYS A 175 -16.170 -4.376 4.134 1.00 0.84 H new ATOM 0 HD3 LYS A 175 -14.844 -5.215 4.914 1.00 0.84 H new ATOM 0 HE2 LYS A 175 -17.042 -5.518 6.086 1.00 1.71 H new ATOM 0 HE3 LYS A 175 -15.790 -4.848 7.114 1.00 1.71 H new ATOM 0 HZ1 LYS A 175 -18.043 -3.755 7.218 1.00 2.34 H new ATOM 0 HZ2 LYS A 175 -16.726 -2.710 6.981 1.00 2.34 H new ATOM 0 HZ3 LYS A 175 -17.730 -3.122 5.674 1.00 2.34 H new ATOM 183 N GLU A 176 -11.235 -1.184 5.158 1.00 0.20 N ATOM 184 CA GLU A 176 -10.388 -0.828 6.284 1.00 0.18 C ATOM 185 C GLU A 176 -10.170 0.688 6.307 1.00 0.20 C ATOM 186 O GLU A 176 -10.360 1.342 7.333 1.00 0.44 O ATOM 187 CB GLU A 176 -9.039 -1.554 6.191 1.00 0.19 C ATOM 188 CG GLU A 176 -8.116 -1.289 7.371 1.00 0.24 C ATOM 189 CD GLU A 176 -8.619 -1.906 8.659 1.00 0.34 C ATOM 190 OE1 GLU A 176 -9.576 -1.363 9.249 1.00 0.69 O ATOM 191 OE2 GLU A 176 -8.063 -2.935 9.089 1.00 0.70 O ATOM 0 H GLU A 176 -10.727 -1.510 4.336 1.00 0.20 H new ATOM 0 HA GLU A 176 -10.881 -1.134 7.207 1.00 0.18 H new ATOM 0 HB2 GLU A 176 -9.219 -2.626 6.116 1.00 0.19 H new ATOM 0 HB3 GLU A 176 -8.536 -1.250 5.273 1.00 0.19 H new ATOM 0 HG2 GLU A 176 -7.125 -1.684 7.147 1.00 0.24 H new ATOM 0 HG3 GLU A 176 -8.007 -0.213 7.507 1.00 0.24 H new ATOM 198 N GLN A 177 -9.776 1.231 5.151 1.00 0.29 N ATOM 199 CA GLN A 177 -9.525 2.665 4.975 1.00 0.22 C ATOM 200 C GLN A 177 -10.647 3.523 5.537 1.00 0.25 C ATOM 201 O GLN A 177 -10.409 4.384 6.378 1.00 0.25 O ATOM 202 CB GLN A 177 -9.352 2.996 3.491 1.00 0.21 C ATOM 203 CG GLN A 177 -8.279 2.180 2.801 1.00 0.20 C ATOM 204 CD GLN A 177 -8.096 2.561 1.346 1.00 0.22 C ATOM 205 OE1 GLN A 177 -8.745 2.009 0.461 1.00 0.24 O ATOM 206 NE2 GLN A 177 -7.204 3.499 1.087 1.00 0.24 N ATOM 0 H GLN A 177 -9.621 0.684 4.304 1.00 0.29 H new ATOM 0 HA GLN A 177 -8.612 2.891 5.526 1.00 0.22 H new ATOM 0 HB2 GLN A 177 -10.301 2.836 2.980 1.00 0.21 H new ATOM 0 HB3 GLN A 177 -9.111 4.054 3.391 1.00 0.21 H new ATOM 0 HG2 GLN A 177 -7.334 2.312 3.328 1.00 0.20 H new ATOM 0 HG3 GLN A 177 -8.535 1.123 2.865 1.00 0.20 H new ATOM 0 HE21 GLN A 177 -6.685 3.934 1.850 1.00 0.24 H new ATOM 0 HE22 GLN A 177 -7.034 3.789 0.124 1.00 0.24 H new ATOM 215 N GLU A 178 -11.865 3.274 5.084 1.00 0.27 N ATOM 216 CA GLU A 178 -13.003 4.095 5.490 1.00 0.31 C ATOM 217 C GLU A 178 -13.237 4.015 7.001 1.00 0.33 C ATOM 218 O GLU A 178 -13.721 4.965 7.615 1.00 0.36 O ATOM 219 CB GLU A 178 -14.269 3.687 4.731 1.00 0.35 C ATOM 220 CG GLU A 178 -14.622 2.216 4.871 1.00 0.39 C ATOM 221 CD GLU A 178 -15.913 1.857 4.168 1.00 0.46 C ATOM 222 OE1 GLU A 178 -15.881 1.668 2.935 1.00 0.41 O ATOM 223 OE2 GLU A 178 -16.963 1.758 4.840 1.00 0.71 O ATOM 0 H GLU A 178 -12.094 2.517 4.440 1.00 0.27 H new ATOM 0 HA GLU A 178 -12.768 5.129 5.239 1.00 0.31 H new ATOM 0 HB2 GLU A 178 -15.105 4.287 5.089 1.00 0.35 H new ATOM 0 HB3 GLU A 178 -14.139 3.921 3.674 1.00 0.35 H new ATOM 0 HG2 GLU A 178 -13.811 1.611 4.464 1.00 0.39 H new ATOM 0 HG3 GLU A 178 -14.707 1.966 5.928 1.00 0.39 H new ATOM 230 N ARG A 179 -12.870 2.886 7.592 1.00 0.34 N ATOM 231 CA ARG A 179 -13.069 2.659 9.019 1.00 0.40 C ATOM 232 C ARG A 179 -11.988 3.364 9.853 1.00 0.35 C ATOM 233 O ARG A 179 -12.134 3.531 11.063 1.00 0.38 O ATOM 234 CB ARG A 179 -13.052 1.152 9.302 1.00 0.48 C ATOM 235 CG ARG A 179 -13.587 0.764 10.671 1.00 0.65 C ATOM 236 CD ARG A 179 -13.442 -0.730 10.914 1.00 0.83 C ATOM 237 NE ARG A 179 -14.235 -1.182 12.053 1.00 1.03 N ATOM 238 CZ ARG A 179 -13.806 -2.053 12.966 1.00 1.80 C ATOM 239 NH1 ARG A 179 -12.556 -2.503 12.937 1.00 2.15 N ATOM 240 NH2 ARG A 179 -14.628 -2.454 13.927 1.00 2.55 N ATOM 0 H ARG A 179 -12.430 2.107 7.102 1.00 0.34 H new ATOM 0 HA ARG A 179 -14.035 3.077 9.304 1.00 0.40 H new ATOM 0 HB2 ARG A 179 -13.641 0.645 8.538 1.00 0.48 H new ATOM 0 HB3 ARG A 179 -12.029 0.789 9.209 1.00 0.48 H new ATOM 0 HG2 ARG A 179 -13.050 1.315 11.444 1.00 0.65 H new ATOM 0 HG3 ARG A 179 -14.637 1.048 10.748 1.00 0.65 H new ATOM 0 HD2 ARG A 179 -13.750 -1.273 10.021 1.00 0.83 H new ATOM 0 HD3 ARG A 179 -12.392 -0.968 11.086 1.00 0.83 H new ATOM 0 HE ARG A 179 -15.178 -0.807 12.157 1.00 1.03 H new ATOM 0 HH11 ARG A 179 -11.915 -2.182 12.211 1.00 2.15 H new ATOM 0 HH12 ARG A 179 -12.237 -3.169 13.640 1.00 2.15 H new ATOM 0 HH21 ARG A 179 -15.582 -2.096 13.964 1.00 2.55 H new ATOM 0 HH22 ARG A 179 -14.306 -3.120 14.629 1.00 2.55 H new ATOM 254 N LEU A 180 -10.915 3.789 9.197 1.00 0.30 N ATOM 255 CA LEU A 180 -9.762 4.371 9.887 1.00 0.28 C ATOM 256 C LEU A 180 -9.450 5.786 9.398 1.00 0.25 C ATOM 257 O LEU A 180 -8.702 6.517 10.049 1.00 0.24 O ATOM 258 CB LEU A 180 -8.527 3.485 9.692 1.00 0.28 C ATOM 259 CG LEU A 180 -8.628 2.069 10.265 1.00 0.33 C ATOM 260 CD1 LEU A 180 -7.340 1.307 10.011 1.00 0.35 C ATOM 261 CD2 LEU A 180 -8.931 2.118 11.754 1.00 0.38 C ATOM 0 H LEU A 180 -10.816 3.743 8.183 1.00 0.30 H new ATOM 0 HA LEU A 180 -10.018 4.429 10.945 1.00 0.28 H new ATOM 0 HB2 LEU A 180 -8.321 3.411 8.624 1.00 0.28 H new ATOM 0 HB3 LEU A 180 -7.671 3.982 10.148 1.00 0.28 H new ATOM 0 HG LEU A 180 -9.445 1.549 9.765 1.00 0.33 H new ATOM 0 HD11 LEU A 180 -7.425 0.302 10.423 1.00 0.35 H new ATOM 0 HD12 LEU A 180 -7.159 1.245 8.938 1.00 0.35 H new ATOM 0 HD13 LEU A 180 -6.510 1.826 10.489 1.00 0.35 H new ATOM 0 HD21 LEU A 180 -8.999 1.103 12.145 1.00 0.38 H new ATOM 0 HD22 LEU A 180 -8.134 2.653 12.270 1.00 0.38 H new ATOM 0 HD23 LEU A 180 -9.878 2.634 11.916 1.00 0.38 H new ATOM 273 N GLY A 181 -10.016 6.175 8.267 1.00 0.24 N ATOM 274 CA GLY A 181 -9.768 7.504 7.745 1.00 0.22 C ATOM 275 C GLY A 181 -8.641 7.514 6.732 1.00 0.18 C ATOM 276 O GLY A 181 -8.286 8.561 6.192 1.00 0.18 O ATOM 0 H GLY A 181 -10.640 5.599 7.702 1.00 0.24 H new ATOM 0 HA2 GLY A 181 -10.677 7.887 7.280 1.00 0.22 H new ATOM 0 HA3 GLY A 181 -9.523 8.177 8.567 1.00 0.22 H new ATOM 280 N ILE A 182 -8.078 6.337 6.483 1.00 0.17 N ATOM 281 CA ILE A 182 -6.972 6.188 5.543 1.00 0.16 C ATOM 282 C ILE A 182 -7.389 6.626 4.139 1.00 0.15 C ATOM 283 O ILE A 182 -8.433 6.205 3.635 1.00 0.17 O ATOM 284 CB ILE A 182 -6.482 4.724 5.487 1.00 0.17 C ATOM 285 CG1 ILE A 182 -6.139 4.217 6.889 1.00 0.20 C ATOM 286 CG2 ILE A 182 -5.274 4.599 4.570 1.00 0.19 C ATOM 287 CD1 ILE A 182 -5.784 2.745 6.932 1.00 0.22 C ATOM 0 H ILE A 182 -8.372 5.465 6.923 1.00 0.17 H new ATOM 0 HA ILE A 182 -6.160 6.824 5.896 1.00 0.16 H new ATOM 0 HB ILE A 182 -7.288 4.110 5.085 1.00 0.17 H new ATOM 0 HG12 ILE A 182 -5.302 4.795 7.281 1.00 0.20 H new ATOM 0 HG13 ILE A 182 -6.988 4.397 7.549 1.00 0.20 H new ATOM 0 HG21 ILE A 182 -4.943 3.561 4.543 1.00 0.19 H new ATOM 0 HG22 ILE A 182 -5.546 4.919 3.564 1.00 0.19 H new ATOM 0 HG23 ILE A 182 -4.466 5.228 4.945 1.00 0.19 H new ATOM 0 HD11 ILE A 182 -5.553 2.456 7.957 1.00 0.22 H new ATOM 0 HD12 ILE A 182 -6.628 2.157 6.571 1.00 0.22 H new ATOM 0 HD13 ILE A 182 -4.916 2.561 6.299 1.00 0.22 H new ATOM 299 N PRO A 183 -6.591 7.499 3.503 1.00 0.14 N ATOM 300 CA PRO A 183 -6.832 7.926 2.129 1.00 0.15 C ATOM 301 C PRO A 183 -6.455 6.845 1.122 1.00 0.14 C ATOM 302 O PRO A 183 -5.622 5.974 1.393 1.00 0.16 O ATOM 303 CB PRO A 183 -5.924 9.144 1.972 1.00 0.20 C ATOM 304 CG PRO A 183 -4.805 8.904 2.922 1.00 0.24 C ATOM 305 CD PRO A 183 -5.400 8.146 4.079 1.00 0.15 C ATOM 0 HA PRO A 183 -7.884 8.139 1.942 1.00 0.15 H new ATOM 0 HB2 PRO A 183 -5.561 9.239 0.948 1.00 0.20 H new ATOM 0 HB3 PRO A 183 -6.454 10.067 2.209 1.00 0.20 H new ATOM 0 HG2 PRO A 183 -4.007 8.331 2.449 1.00 0.24 H new ATOM 0 HG3 PRO A 183 -4.367 9.845 3.255 1.00 0.24 H new ATOM 0 HD2 PRO A 183 -4.700 7.412 4.478 1.00 0.15 H new ATOM 0 HD3 PRO A 183 -5.665 8.813 4.900 1.00 0.15 H new ATOM 313 N TYR A 184 -7.080 6.921 -0.037 1.00 0.15 N ATOM 314 CA TYR A 184 -6.855 5.984 -1.125 1.00 0.16 C ATOM 315 C TYR A 184 -5.525 6.257 -1.825 1.00 0.16 C ATOM 316 O TYR A 184 -4.850 5.339 -2.283 1.00 0.19 O ATOM 317 CB TYR A 184 -7.983 6.121 -2.139 1.00 0.17 C ATOM 318 CG TYR A 184 -8.880 4.908 -2.267 1.00 0.10 C ATOM 319 CD1 TYR A 184 -9.926 4.709 -1.378 1.00 0.30 C ATOM 320 CD2 TYR A 184 -8.662 3.945 -3.247 1.00 0.23 C ATOM 321 CE1 TYR A 184 -10.732 3.596 -1.458 1.00 0.42 C ATOM 322 CE2 TYR A 184 -9.464 2.821 -3.327 1.00 0.27 C ATOM 323 CZ TYR A 184 -10.552 2.712 -2.577 1.00 0.36 C ATOM 324 OH TYR A 184 -11.296 1.541 -2.491 1.00 0.50 O ATOM 0 H TYR A 184 -7.767 7.643 -0.254 1.00 0.15 H new ATOM 0 HA TYR A 184 -6.828 4.976 -0.711 1.00 0.16 H new ATOM 0 HB2 TYR A 184 -8.596 6.980 -1.864 1.00 0.17 H new ATOM 0 HB3 TYR A 184 -7.549 6.338 -3.115 1.00 0.17 H new ATOM 0 HD1 TYR A 184 -10.112 5.442 -0.607 1.00 0.30 H new ATOM 0 HD2 TYR A 184 -7.856 4.077 -3.954 1.00 0.23 H new ATOM 0 HE1 TYR A 184 -11.477 3.393 -0.703 1.00 0.42 H new ATOM 0 HE2 TYR A 184 -9.201 2.024 -4.007 1.00 0.27 H new ATOM 0 HH TYR A 184 -11.226 1.046 -3.334 1.00 0.50 H new ATOM 334 N ASP A 185 -5.171 7.536 -1.916 1.00 0.16 N ATOM 335 CA ASP A 185 -3.977 7.957 -2.643 1.00 0.17 C ATOM 336 C ASP A 185 -2.756 7.921 -1.723 1.00 0.14 C ATOM 337 O ASP A 185 -2.754 8.528 -0.650 1.00 0.17 O ATOM 338 CB ASP A 185 -4.180 9.364 -3.218 1.00 0.27 C ATOM 339 CG ASP A 185 -3.082 9.781 -4.178 1.00 0.33 C ATOM 340 OD1 ASP A 185 -2.806 9.034 -5.137 1.00 0.74 O ATOM 341 OD2 ASP A 185 -2.477 10.850 -3.969 1.00 0.58 O ATOM 0 H ASP A 185 -5.696 8.302 -1.494 1.00 0.16 H new ATOM 0 HA ASP A 185 -3.804 7.267 -3.469 1.00 0.17 H new ATOM 0 HB2 ASP A 185 -5.139 9.404 -3.734 1.00 0.27 H new ATOM 0 HB3 ASP A 185 -4.229 10.081 -2.398 1.00 0.27 H new ATOM 346 N PRO A 186 -1.703 7.205 -2.155 1.00 0.13 N ATOM 347 CA PRO A 186 -0.531 6.881 -1.323 1.00 0.11 C ATOM 348 C PRO A 186 0.205 8.090 -0.762 1.00 0.12 C ATOM 349 O PRO A 186 0.712 8.045 0.356 1.00 0.13 O ATOM 350 CB PRO A 186 0.394 6.120 -2.278 1.00 0.13 C ATOM 351 CG PRO A 186 -0.088 6.466 -3.643 1.00 0.20 C ATOM 352 CD PRO A 186 -1.568 6.653 -3.510 1.00 0.18 C ATOM 0 HA PRO A 186 -0.845 6.324 -0.440 1.00 0.11 H new ATOM 0 HB2 PRO A 186 1.434 6.417 -2.140 1.00 0.13 H new ATOM 0 HB3 PRO A 186 0.344 5.045 -2.103 1.00 0.13 H new ATOM 0 HG2 PRO A 186 0.391 7.374 -4.010 1.00 0.20 H new ATOM 0 HG3 PRO A 186 0.145 5.673 -4.354 1.00 0.20 H new ATOM 0 HD2 PRO A 186 -1.960 7.334 -4.266 1.00 0.18 H new ATOM 0 HD3 PRO A 186 -2.107 5.712 -3.619 1.00 0.18 H new ATOM 360 N ILE A 187 0.265 9.161 -1.529 1.00 0.13 N ATOM 361 CA ILE A 187 1.075 10.307 -1.153 1.00 0.17 C ATOM 362 C ILE A 187 0.540 11.002 0.102 1.00 0.19 C ATOM 363 O ILE A 187 1.299 11.658 0.818 1.00 0.22 O ATOM 364 CB ILE A 187 1.202 11.321 -2.312 1.00 0.25 C ATOM 365 CG1 ILE A 187 2.336 12.312 -2.028 1.00 0.42 C ATOM 366 CG2 ILE A 187 -0.108 12.058 -2.525 1.00 0.29 C ATOM 367 CD1 ILE A 187 2.609 13.275 -3.162 1.00 0.55 C ATOM 0 H ILE A 187 -0.234 9.263 -2.413 1.00 0.13 H new ATOM 0 HA ILE A 187 2.068 9.920 -0.925 1.00 0.17 H new ATOM 0 HB ILE A 187 1.438 10.774 -3.225 1.00 0.25 H new ATOM 0 HG12 ILE A 187 2.091 12.882 -1.132 1.00 0.42 H new ATOM 0 HG13 ILE A 187 3.247 11.754 -1.811 1.00 0.42 H new ATOM 0 HG21 ILE A 187 0.003 12.767 -3.345 1.00 0.29 H new ATOM 0 HG22 ILE A 187 -0.893 11.342 -2.768 1.00 0.29 H new ATOM 0 HG23 ILE A 187 -0.376 12.595 -1.615 1.00 0.29 H new ATOM 0 HD11 ILE A 187 3.424 13.943 -2.884 1.00 0.55 H new ATOM 0 HD12 ILE A 187 2.887 12.716 -4.055 1.00 0.55 H new ATOM 0 HD13 ILE A 187 1.713 13.861 -3.365 1.00 0.55 H new ATOM 379 N HIS A 188 -0.753 10.861 0.396 1.00 0.18 N ATOM 380 CA HIS A 188 -1.312 11.523 1.568 1.00 0.20 C ATOM 381 C HIS A 188 -1.316 10.610 2.799 1.00 0.19 C ATOM 382 O HIS A 188 -1.885 10.971 3.830 1.00 0.22 O ATOM 383 CB HIS A 188 -2.736 12.027 1.301 1.00 0.25 C ATOM 384 CG HIS A 188 -2.845 13.035 0.199 1.00 0.32 C ATOM 385 ND1 HIS A 188 -2.684 14.377 0.434 1.00 0.39 N ATOM 386 CD2 HIS A 188 -3.121 12.846 -1.113 1.00 0.42 C ATOM 387 CE1 HIS A 188 -2.861 14.974 -0.732 1.00 0.48 C ATOM 388 NE2 HIS A 188 -3.130 14.086 -1.701 1.00 0.50 N ATOM 0 H HIS A 188 -1.416 10.308 -0.147 1.00 0.18 H new ATOM 0 HA HIS A 188 -0.665 12.376 1.775 1.00 0.20 H new ATOM 0 HB2 HIS A 188 -3.370 11.174 1.059 1.00 0.25 H new ATOM 0 HB3 HIS A 188 -3.129 12.466 2.218 1.00 0.25 H new ATOM 0 HD2 HIS A 188 -3.300 11.900 -1.603 1.00 0.42 H new ATOM 0 HE1 HIS A 188 -2.797 16.041 -0.885 1.00 0.48 H new ATOM 0 HE2 HIS A 188 -3.307 14.292 -2.684 1.00 0.50 H new ATOM 396 N TRP A 189 -0.708 9.425 2.706 1.00 0.18 N ATOM 397 CA TRP A 189 -0.658 8.531 3.863 1.00 0.19 C ATOM 398 C TRP A 189 0.251 9.107 4.942 1.00 0.20 C ATOM 399 O TRP A 189 1.248 9.765 4.648 1.00 0.20 O ATOM 400 CB TRP A 189 -0.121 7.137 3.520 1.00 0.18 C ATOM 401 CG TRP A 189 -0.973 6.288 2.636 1.00 0.15 C ATOM 402 CD1 TRP A 189 -2.334 6.257 2.564 1.00 0.18 C ATOM 403 CD2 TRP A 189 -0.492 5.294 1.725 1.00 0.12 C ATOM 404 NE1 TRP A 189 -2.731 5.324 1.632 1.00 0.15 N ATOM 405 CE2 TRP A 189 -1.613 4.715 1.106 1.00 0.12 C ATOM 406 CE3 TRP A 189 0.790 4.850 1.365 1.00 0.11 C ATOM 407 CZ2 TRP A 189 -1.491 3.710 0.146 1.00 0.12 C ATOM 408 CZ3 TRP A 189 0.911 3.851 0.415 1.00 0.12 C ATOM 409 CH2 TRP A 189 -0.223 3.292 -0.185 1.00 0.12 C ATOM 0 H TRP A 189 -0.255 9.069 1.864 1.00 0.18 H new ATOM 0 HA TRP A 189 -1.688 8.441 4.209 1.00 0.19 H new ATOM 0 HB2 TRP A 189 0.852 7.255 3.043 1.00 0.18 H new ATOM 0 HB3 TRP A 189 0.045 6.598 4.453 1.00 0.18 H new ATOM 0 HD1 TRP A 189 -3.001 6.872 3.150 1.00 0.18 H new ATOM 0 HE1 TRP A 189 -3.696 5.118 1.373 1.00 0.15 H new ATOM 0 HE3 TRP A 189 1.668 5.281 1.822 1.00 0.11 H new ATOM 0 HZ2 TRP A 189 -2.362 3.275 -0.321 1.00 0.12 H new ATOM 0 HZ3 TRP A 189 1.892 3.499 0.133 1.00 0.12 H new ATOM 0 HH2 TRP A 189 -0.100 2.515 -0.925 1.00 0.12 H new ATOM 420 N SER A 190 -0.101 8.860 6.190 1.00 0.23 N ATOM 421 CA SER A 190 0.793 9.146 7.295 1.00 0.25 C ATOM 422 C SER A 190 1.544 7.871 7.656 1.00 0.25 C ATOM 423 O SER A 190 1.089 6.785 7.301 1.00 0.25 O ATOM 424 CB SER A 190 0.000 9.679 8.488 1.00 0.29 C ATOM 425 OG SER A 190 -0.854 10.741 8.092 1.00 1.18 O ATOM 0 H SER A 190 -1.000 8.462 6.463 1.00 0.23 H new ATOM 0 HA SER A 190 1.512 9.914 7.009 1.00 0.25 H new ATOM 0 HB2 SER A 190 -0.591 8.875 8.926 1.00 0.29 H new ATOM 0 HB3 SER A 190 0.686 10.027 9.260 1.00 0.29 H new ATOM 0 HG SER A 190 -1.354 11.066 8.870 1.00 1.18 H new ATOM 431 N THR A 191 2.675 8.004 8.351 1.00 0.26 N ATOM 432 CA THR A 191 3.584 6.882 8.615 1.00 0.28 C ATOM 433 C THR A 191 2.853 5.619 9.089 1.00 0.25 C ATOM 434 O THR A 191 3.170 4.509 8.656 1.00 0.25 O ATOM 435 CB THR A 191 4.645 7.284 9.657 1.00 0.31 C ATOM 436 OG1 THR A 191 5.254 8.521 9.266 1.00 0.74 O ATOM 437 CG2 THR A 191 5.718 6.211 9.797 1.00 0.62 C ATOM 0 H THR A 191 2.988 8.890 8.747 1.00 0.26 H new ATOM 0 HA THR A 191 4.064 6.644 7.666 1.00 0.28 H new ATOM 0 HB THR A 191 4.150 7.399 10.621 1.00 0.31 H new ATOM 0 HG1 THR A 191 5.928 8.778 9.930 1.00 0.74 H new ATOM 0 HG21 THR A 191 6.452 6.525 10.540 1.00 0.62 H new ATOM 0 HG22 THR A 191 5.258 5.275 10.114 1.00 0.62 H new ATOM 0 HG23 THR A 191 6.213 6.064 8.837 1.00 0.62 H new ATOM 445 N ASP A 192 1.871 5.789 9.968 1.00 0.24 N ATOM 446 CA ASP A 192 1.077 4.661 10.454 1.00 0.24 C ATOM 447 C ASP A 192 0.305 4.022 9.314 1.00 0.23 C ATOM 448 O ASP A 192 0.426 2.836 9.057 1.00 0.25 O ATOM 449 CB ASP A 192 0.084 5.108 11.536 1.00 0.29 C ATOM 450 CG ASP A 192 0.737 5.414 12.867 1.00 1.06 C ATOM 451 OD1 ASP A 192 1.332 6.504 13.001 1.00 1.75 O ATOM 452 OD2 ASP A 192 0.685 4.559 13.775 1.00 1.37 O ATOM 0 H ASP A 192 1.605 6.693 10.359 1.00 0.24 H new ATOM 0 HA ASP A 192 1.769 3.936 10.882 1.00 0.24 H new ATOM 0 HB2 ASP A 192 -0.445 5.995 11.188 1.00 0.29 H new ATOM 0 HB3 ASP A 192 -0.662 4.326 11.678 1.00 0.29 H new ATOM 457 N GLN A 193 -0.467 4.843 8.623 1.00 0.22 N ATOM 458 CA GLN A 193 -1.353 4.395 7.550 1.00 0.21 C ATOM 459 C GLN A 193 -0.582 3.867 6.344 1.00 0.17 C ATOM 460 O GLN A 193 -1.079 2.990 5.635 1.00 0.14 O ATOM 461 CB GLN A 193 -2.278 5.540 7.149 1.00 0.24 C ATOM 462 CG GLN A 193 -3.147 6.019 8.300 1.00 0.30 C ATOM 463 CD GLN A 193 -3.718 7.405 8.088 1.00 0.41 C ATOM 464 OE1 GLN A 193 -3.970 8.134 9.043 1.00 1.34 O ATOM 465 NE2 GLN A 193 -3.910 7.785 6.838 1.00 0.85 N ATOM 0 H GLN A 193 -0.500 5.849 8.789 1.00 0.22 H new ATOM 0 HA GLN A 193 -1.946 3.561 7.925 1.00 0.21 H new ATOM 0 HB2 GLN A 193 -1.680 6.373 6.779 1.00 0.24 H new ATOM 0 HB3 GLN A 193 -2.916 5.216 6.327 1.00 0.24 H new ATOM 0 HG2 GLN A 193 -3.967 5.315 8.444 1.00 0.30 H new ATOM 0 HG3 GLN A 193 -2.558 6.014 9.217 1.00 0.30 H new ATOM 0 HE21 GLN A 193 -3.688 7.149 6.072 1.00 0.85 H new ATOM 0 HE22 GLN A 193 -4.280 8.714 6.639 1.00 0.85 H new ATOM 474 N VAL A 194 0.609 4.386 6.112 1.00 0.16 N ATOM 475 CA VAL A 194 1.503 3.806 5.109 1.00 0.14 C ATOM 476 C VAL A 194 1.696 2.313 5.389 1.00 0.13 C ATOM 477 O VAL A 194 1.603 1.476 4.493 1.00 0.13 O ATOM 478 CB VAL A 194 2.884 4.505 5.102 1.00 0.16 C ATOM 479 CG1 VAL A 194 3.805 3.883 4.067 1.00 0.17 C ATOM 480 CG2 VAL A 194 2.742 5.994 4.846 1.00 0.17 C ATOM 0 H VAL A 194 0.984 5.202 6.596 1.00 0.16 H new ATOM 0 HA VAL A 194 1.042 3.950 4.132 1.00 0.14 H new ATOM 0 HB VAL A 194 3.326 4.365 6.088 1.00 0.16 H new ATOM 0 HG11 VAL A 194 4.768 4.393 4.084 1.00 0.17 H new ATOM 0 HG12 VAL A 194 3.950 2.827 4.296 1.00 0.17 H new ATOM 0 HG13 VAL A 194 3.359 3.982 3.077 1.00 0.17 H new ATOM 0 HG21 VAL A 194 3.728 6.459 4.847 1.00 0.17 H new ATOM 0 HG22 VAL A 194 2.266 6.153 3.878 1.00 0.17 H new ATOM 0 HG23 VAL A 194 2.130 6.441 5.629 1.00 0.17 H new ATOM 490 N LEU A 195 1.911 1.995 6.654 1.00 0.14 N ATOM 491 CA LEU A 195 2.110 0.618 7.091 1.00 0.14 C ATOM 492 C LEU A 195 0.808 -0.019 7.582 1.00 0.12 C ATOM 493 O LEU A 195 0.783 -1.220 7.821 1.00 0.14 O ATOM 494 CB LEU A 195 3.204 0.521 8.154 1.00 0.16 C ATOM 495 CG LEU A 195 4.576 1.036 7.728 1.00 0.18 C ATOM 496 CD1 LEU A 195 5.491 1.147 8.932 1.00 0.23 C ATOM 497 CD2 LEU A 195 5.189 0.121 6.680 1.00 0.18 C ATOM 0 H LEU A 195 1.953 2.680 7.408 1.00 0.14 H new ATOM 0 HA LEU A 195 2.440 0.053 6.219 1.00 0.14 H new ATOM 0 HB2 LEU A 195 2.883 1.078 9.034 1.00 0.16 H new ATOM 0 HB3 LEU A 195 3.303 -0.522 8.455 1.00 0.16 H new ATOM 0 HG LEU A 195 4.453 2.026 7.289 1.00 0.18 H new ATOM 0 HD11 LEU A 195 6.467 1.515 8.615 1.00 0.23 H new ATOM 0 HD12 LEU A 195 5.059 1.839 9.655 1.00 0.23 H new ATOM 0 HD13 LEU A 195 5.606 0.166 9.393 1.00 0.23 H new ATOM 0 HD21 LEU A 195 6.167 0.505 6.389 1.00 0.18 H new ATOM 0 HD22 LEU A 195 5.301 -0.882 7.093 1.00 0.18 H new ATOM 0 HD23 LEU A 195 4.539 0.083 5.806 1.00 0.18 H new ATOM 509 N HIS A 196 -0.271 0.737 7.714 1.00 0.11 N ATOM 510 CA HIS A 196 -1.581 0.101 7.845 1.00 0.10 C ATOM 511 C HIS A 196 -1.870 -0.652 6.552 1.00 0.09 C ATOM 512 O HIS A 196 -2.299 -1.804 6.558 1.00 0.12 O ATOM 513 CB HIS A 196 -2.695 1.115 8.135 1.00 0.13 C ATOM 514 CG HIS A 196 -2.907 1.387 9.596 1.00 0.16 C ATOM 515 ND1 HIS A 196 -3.754 0.611 10.349 1.00 0.30 N ATOM 516 CD2 HIS A 196 -2.368 2.344 10.387 1.00 0.30 C ATOM 517 CE1 HIS A 196 -3.711 1.109 11.572 1.00 0.30 C ATOM 518 NE2 HIS A 196 -2.884 2.162 11.645 1.00 0.28 N ATOM 0 H HIS A 196 -0.274 1.757 7.734 1.00 0.11 H new ATOM 0 HA HIS A 196 -1.558 -0.582 8.694 1.00 0.10 H new ATOM 0 HB2 HIS A 196 -2.459 2.053 7.632 1.00 0.13 H new ATOM 0 HB3 HIS A 196 -3.627 0.748 7.705 1.00 0.13 H new ATOM 0 HD2 HIS A 196 -1.665 3.106 10.085 1.00 0.30 H new ATOM 0 HE1 HIS A 196 -4.272 0.717 12.408 1.00 0.30 H new ATOM 0 HE2 HIS A 196 -2.679 2.719 12.474 1.00 0.28 H new ATOM 526 N TRP A 197 -1.602 0.035 5.452 1.00 0.10 N ATOM 527 CA TRP A 197 -1.627 -0.563 4.121 1.00 0.09 C ATOM 528 C TRP A 197 -0.663 -1.739 4.031 1.00 0.10 C ATOM 529 O TRP A 197 -1.084 -2.839 3.683 1.00 0.13 O ATOM 530 CB TRP A 197 -1.293 0.500 3.066 1.00 0.09 C ATOM 531 CG TRP A 197 -1.190 -0.017 1.661 1.00 0.07 C ATOM 532 CD1 TRP A 197 -2.197 -0.525 0.898 1.00 0.09 C ATOM 533 CD2 TRP A 197 -0.012 -0.045 0.842 1.00 0.07 C ATOM 534 NE1 TRP A 197 -1.717 -0.888 -0.339 1.00 0.08 N ATOM 535 CE2 TRP A 197 -0.380 -0.599 -0.399 1.00 0.07 C ATOM 536 CE3 TRP A 197 1.316 0.340 1.039 1.00 0.12 C ATOM 537 CZ2 TRP A 197 0.533 -0.774 -1.437 1.00 0.10 C ATOM 538 CZ3 TRP A 197 2.222 0.166 0.008 1.00 0.16 C ATOM 539 CH2 TRP A 197 1.828 -0.387 -1.217 1.00 0.14 C ATOM 0 H TRP A 197 -1.360 1.026 5.455 1.00 0.10 H new ATOM 0 HA TRP A 197 -2.630 -0.945 3.930 1.00 0.09 H new ATOM 0 HB2 TRP A 197 -2.058 1.276 3.097 1.00 0.09 H new ATOM 0 HB3 TRP A 197 -0.348 0.973 3.334 1.00 0.09 H new ATOM 0 HD1 TRP A 197 -3.223 -0.628 1.218 1.00 0.09 H new ATOM 0 HE1 TRP A 197 -2.268 -1.305 -1.090 1.00 0.08 H new ATOM 0 HE3 TRP A 197 1.630 0.766 1.980 1.00 0.12 H new ATOM 0 HZ2 TRP A 197 0.230 -1.200 -2.382 1.00 0.10 H new ATOM 0 HZ3 TRP A 197 3.251 0.462 0.150 1.00 0.16 H new ATOM 0 HH2 TRP A 197 2.559 -0.510 -2.002 1.00 0.14 H new ATOM 550 N VAL A 198 0.603 -1.543 4.360 1.00 0.10 N ATOM 551 CA VAL A 198 1.575 -2.623 4.236 1.00 0.12 C ATOM 552 C VAL A 198 1.232 -3.826 5.131 1.00 0.13 C ATOM 553 O VAL A 198 1.409 -4.962 4.704 1.00 0.15 O ATOM 554 CB VAL A 198 3.015 -2.133 4.501 1.00 0.14 C ATOM 555 CG1 VAL A 198 4.016 -3.256 4.311 1.00 0.23 C ATOM 556 CG2 VAL A 198 3.362 -0.964 3.595 1.00 0.13 C ATOM 0 H VAL A 198 0.980 -0.662 4.710 1.00 0.10 H new ATOM 0 HA VAL A 198 1.522 -2.963 3.202 1.00 0.12 H new ATOM 0 HB VAL A 198 3.066 -1.798 5.537 1.00 0.14 H new ATOM 0 HG11 VAL A 198 5.022 -2.883 4.504 1.00 0.23 H new ATOM 0 HG12 VAL A 198 3.790 -4.066 5.004 1.00 0.23 H new ATOM 0 HG13 VAL A 198 3.957 -3.627 3.288 1.00 0.23 H new ATOM 0 HG21 VAL A 198 4.381 -0.635 3.799 1.00 0.13 H new ATOM 0 HG22 VAL A 198 3.283 -1.275 2.553 1.00 0.13 H new ATOM 0 HG23 VAL A 198 2.671 -0.142 3.781 1.00 0.13 H new ATOM 566 N VAL A 199 0.709 -3.607 6.332 1.00 0.13 N ATOM 567 CA VAL A 199 0.317 -4.727 7.198 1.00 0.14 C ATOM 568 C VAL A 199 -0.913 -5.457 6.642 1.00 0.13 C ATOM 569 O VAL A 199 -0.899 -6.676 6.456 1.00 0.15 O ATOM 570 CB VAL A 199 0.031 -4.260 8.646 1.00 0.18 C ATOM 571 CG1 VAL A 199 -0.591 -5.378 9.471 1.00 0.21 C ATOM 572 CG2 VAL A 199 1.309 -3.774 9.310 1.00 0.20 C ATOM 0 H VAL A 199 0.546 -2.682 6.729 1.00 0.13 H new ATOM 0 HA VAL A 199 1.161 -5.417 7.217 1.00 0.14 H new ATOM 0 HB VAL A 199 -0.680 -3.435 8.596 1.00 0.18 H new ATOM 0 HG11 VAL A 199 -0.781 -5.021 10.483 1.00 0.21 H new ATOM 0 HG12 VAL A 199 -1.530 -5.688 9.014 1.00 0.21 H new ATOM 0 HG13 VAL A 199 0.092 -6.226 9.508 1.00 0.21 H new ATOM 0 HG21 VAL A 199 1.090 -3.449 10.327 1.00 0.20 H new ATOM 0 HG22 VAL A 199 2.036 -4.585 9.337 1.00 0.20 H new ATOM 0 HG23 VAL A 199 1.719 -2.938 8.743 1.00 0.20 H new ATOM 582 N TRP A 200 -1.958 -4.699 6.365 1.00 0.13 N ATOM 583 CA TRP A 200 -3.207 -5.262 5.850 1.00 0.13 C ATOM 584 C TRP A 200 -2.989 -5.946 4.501 1.00 0.13 C ATOM 585 O TRP A 200 -3.411 -7.079 4.297 1.00 0.13 O ATOM 586 CB TRP A 200 -4.271 -4.166 5.720 1.00 0.14 C ATOM 587 CG TRP A 200 -5.673 -4.687 5.566 1.00 0.14 C ATOM 588 CD1 TRP A 200 -6.666 -4.628 6.499 1.00 0.15 C ATOM 589 CD2 TRP A 200 -6.239 -5.350 4.423 1.00 0.13 C ATOM 590 NE1 TRP A 200 -7.812 -5.204 6.006 1.00 0.16 N ATOM 591 CE2 TRP A 200 -7.574 -5.654 4.737 1.00 0.15 C ATOM 592 CE3 TRP A 200 -5.745 -5.711 3.168 1.00 0.13 C ATOM 593 CZ2 TRP A 200 -8.418 -6.300 3.840 1.00 0.15 C ATOM 594 CZ3 TRP A 200 -6.577 -6.352 2.280 1.00 0.14 C ATOM 595 CH2 TRP A 200 -7.903 -6.642 2.617 1.00 0.15 C ATOM 0 H TRP A 200 -1.973 -3.686 6.486 1.00 0.13 H new ATOM 0 HA TRP A 200 -3.555 -6.013 6.559 1.00 0.13 H new ATOM 0 HB2 TRP A 200 -4.227 -3.526 6.601 1.00 0.14 H new ATOM 0 HB3 TRP A 200 -4.030 -3.541 4.860 1.00 0.14 H new ATOM 0 HD1 TRP A 200 -6.566 -4.192 7.482 1.00 0.15 H new ATOM 0 HE1 TRP A 200 -8.697 -5.283 6.506 1.00 0.16 H new ATOM 0 HE3 TRP A 200 -4.723 -5.490 2.898 1.00 0.13 H new ATOM 0 HZ2 TRP A 200 -9.443 -6.524 4.098 1.00 0.15 H new ATOM 0 HZ3 TRP A 200 -6.201 -6.636 1.308 1.00 0.14 H new ATOM 0 HH2 TRP A 200 -8.534 -7.145 1.899 1.00 0.15 H new ATOM 606 N VAL A 201 -2.327 -5.281 3.589 1.00 0.14 N ATOM 607 CA VAL A 201 -2.160 -5.828 2.250 1.00 0.16 C ATOM 608 C VAL A 201 -1.107 -6.942 2.204 1.00 0.16 C ATOM 609 O VAL A 201 -1.222 -7.851 1.388 1.00 0.18 O ATOM 610 CB VAL A 201 -1.872 -4.726 1.217 1.00 0.20 C ATOM 611 CG1 VAL A 201 -1.785 -5.297 -0.189 1.00 0.26 C ATOM 612 CG2 VAL A 201 -2.954 -3.661 1.293 1.00 0.22 C ATOM 0 H VAL A 201 -1.896 -4.369 3.738 1.00 0.14 H new ATOM 0 HA VAL A 201 -3.111 -6.286 1.977 1.00 0.16 H new ATOM 0 HB VAL A 201 -0.907 -4.277 1.450 1.00 0.20 H new ATOM 0 HG11 VAL A 201 -1.581 -4.493 -0.896 1.00 0.26 H new ATOM 0 HG12 VAL A 201 -0.982 -6.033 -0.234 1.00 0.26 H new ATOM 0 HG13 VAL A 201 -2.730 -5.775 -0.447 1.00 0.26 H new ATOM 0 HG21 VAL A 201 -2.749 -2.881 0.560 1.00 0.22 H new ATOM 0 HG22 VAL A 201 -3.924 -4.112 1.081 1.00 0.22 H new ATOM 0 HG23 VAL A 201 -2.967 -3.226 2.292 1.00 0.22 H new ATOM 622 N MET A 202 -0.118 -6.937 3.086 1.00 0.17 N ATOM 623 CA MET A 202 0.770 -8.103 3.146 1.00 0.20 C ATOM 624 C MET A 202 0.006 -9.310 3.703 1.00 0.19 C ATOM 625 O MET A 202 0.379 -10.459 3.467 1.00 0.22 O ATOM 626 CB MET A 202 2.042 -7.852 3.965 1.00 0.23 C ATOM 627 CG MET A 202 1.847 -7.861 5.470 1.00 0.23 C ATOM 628 SD MET A 202 3.403 -8.045 6.360 1.00 0.40 S ATOM 629 CE MET A 202 4.339 -6.660 5.717 1.00 0.56 C ATOM 0 H MET A 202 0.090 -6.184 3.742 1.00 0.17 H new ATOM 0 HA MET A 202 1.096 -8.307 2.126 1.00 0.20 H new ATOM 0 HB2 MET A 202 2.780 -8.611 3.705 1.00 0.23 H new ATOM 0 HB3 MET A 202 2.460 -6.888 3.673 1.00 0.23 H new ATOM 0 HG2 MET A 202 1.363 -6.934 5.777 1.00 0.23 H new ATOM 0 HG3 MET A 202 1.177 -8.676 5.742 1.00 0.23 H new ATOM 0 HE1 MET A 202 5.307 -6.612 6.216 1.00 0.56 H new ATOM 0 HE2 MET A 202 4.489 -6.789 4.645 1.00 0.56 H new ATOM 0 HE3 MET A 202 3.791 -5.735 5.898 1.00 0.56 H new ATOM 639 N LYS A 203 -1.067 -9.026 4.433 1.00 0.16 N ATOM 640 CA LYS A 203 -1.967 -10.056 4.956 1.00 0.18 C ATOM 641 C LYS A 203 -2.656 -10.847 3.834 1.00 0.18 C ATOM 642 O LYS A 203 -2.595 -12.074 3.818 1.00 0.20 O ATOM 643 CB LYS A 203 -3.026 -9.401 5.861 1.00 0.19 C ATOM 644 CG LYS A 203 -4.380 -10.102 5.866 1.00 0.36 C ATOM 645 CD LYS A 203 -4.327 -11.450 6.558 1.00 0.82 C ATOM 646 CE LYS A 203 -5.289 -12.441 5.913 1.00 1.61 C ATOM 647 NZ LYS A 203 -6.687 -11.937 5.878 1.00 2.35 N ATOM 0 H LYS A 203 -1.340 -8.075 4.681 1.00 0.16 H new ATOM 0 HA LYS A 203 -1.367 -10.762 5.530 1.00 0.18 H new ATOM 0 HB2 LYS A 203 -2.644 -9.371 6.881 1.00 0.19 H new ATOM 0 HB3 LYS A 203 -3.168 -8.368 5.543 1.00 0.19 H new ATOM 0 HG2 LYS A 203 -5.113 -9.468 6.365 1.00 0.36 H new ATOM 0 HG3 LYS A 203 -4.721 -10.236 4.839 1.00 0.36 H new ATOM 0 HD2 LYS A 203 -3.312 -11.844 6.514 1.00 0.82 H new ATOM 0 HD3 LYS A 203 -4.577 -11.330 7.612 1.00 0.82 H new ATOM 0 HE2 LYS A 203 -4.958 -12.655 4.897 1.00 1.61 H new ATOM 0 HE3 LYS A 203 -5.259 -13.382 6.463 1.00 1.61 H new ATOM 0 HZ1 LYS A 203 -7.322 -12.696 5.557 1.00 2.35 H new ATOM 0 HZ2 LYS A 203 -6.969 -11.630 6.831 1.00 2.35 H new ATOM 0 HZ3 LYS A 203 -6.750 -11.132 5.222 1.00 2.35 H new ATOM 661 N GLU A 204 -3.301 -10.152 2.900 1.00 0.18 N ATOM 662 CA GLU A 204 -4.208 -10.809 1.951 1.00 0.18 C ATOM 663 C GLU A 204 -3.461 -11.726 0.971 1.00 0.23 C ATOM 664 O GLU A 204 -4.074 -12.525 0.262 1.00 0.47 O ATOM 665 CB GLU A 204 -5.047 -9.772 1.197 1.00 0.23 C ATOM 666 CG GLU A 204 -6.384 -10.324 0.718 1.00 0.42 C ATOM 667 CD GLU A 204 -7.137 -11.031 1.834 1.00 0.93 C ATOM 668 OE1 GLU A 204 -7.442 -10.380 2.859 1.00 1.45 O ATOM 669 OE2 GLU A 204 -7.455 -12.228 1.681 1.00 1.72 O ATOM 0 H GLU A 204 -3.217 -9.143 2.777 1.00 0.18 H new ATOM 0 HA GLU A 204 -4.877 -11.443 2.533 1.00 0.18 H new ATOM 0 HB2 GLU A 204 -5.225 -8.915 1.847 1.00 0.23 H new ATOM 0 HB3 GLU A 204 -4.481 -9.409 0.339 1.00 0.23 H new ATOM 0 HG2 GLU A 204 -6.994 -9.510 0.327 1.00 0.42 H new ATOM 0 HG3 GLU A 204 -6.216 -11.019 -0.104 1.00 0.42 H new ATOM 676 N PHE A 205 -2.142 -11.612 0.930 1.00 0.18 N ATOM 677 CA PHE A 205 -1.320 -12.507 0.117 1.00 0.19 C ATOM 678 C PHE A 205 -0.302 -13.225 0.989 1.00 0.22 C ATOM 679 O PHE A 205 0.649 -13.829 0.485 1.00 0.25 O ATOM 680 CB PHE A 205 -0.601 -11.737 -0.988 1.00 0.19 C ATOM 681 CG PHE A 205 -1.418 -10.621 -1.552 1.00 0.18 C ATOM 682 CD1 PHE A 205 -2.412 -10.855 -2.486 1.00 0.24 C ATOM 683 CD2 PHE A 205 -1.196 -9.331 -1.126 1.00 0.21 C ATOM 684 CE1 PHE A 205 -3.169 -9.811 -2.982 1.00 0.29 C ATOM 685 CE2 PHE A 205 -1.938 -8.285 -1.614 1.00 0.25 C ATOM 686 CZ PHE A 205 -2.931 -8.521 -2.546 1.00 0.29 C ATOM 0 H PHE A 205 -1.614 -10.910 1.449 1.00 0.18 H new ATOM 0 HA PHE A 205 -1.979 -13.242 -0.346 1.00 0.19 H new ATOM 0 HB2 PHE A 205 0.331 -11.333 -0.594 1.00 0.19 H new ATOM 0 HB3 PHE A 205 -0.336 -12.426 -1.790 1.00 0.19 H new ATOM 0 HD1 PHE A 205 -2.598 -11.862 -2.830 1.00 0.24 H new ATOM 0 HD2 PHE A 205 -0.424 -9.139 -0.395 1.00 0.21 H new ATOM 0 HE1 PHE A 205 -3.945 -10.002 -3.709 1.00 0.29 H new ATOM 0 HE2 PHE A 205 -1.746 -7.279 -1.270 1.00 0.25 H new ATOM 0 HZ PHE A 205 -3.518 -7.701 -2.932 1.00 0.29 H new ATOM 696 N SER A 206 -0.518 -13.138 2.306 1.00 0.21 N ATOM 697 CA SER A 206 0.273 -13.873 3.302 1.00 0.23 C ATOM 698 C SER A 206 1.773 -13.679 3.084 1.00 0.24 C ATOM 699 O SER A 206 2.577 -14.593 3.278 1.00 0.28 O ATOM 700 CB SER A 206 -0.107 -15.367 3.332 1.00 0.26 C ATOM 701 OG SER A 206 -0.491 -15.849 2.054 1.00 1.14 O ATOM 0 H SER A 206 -1.248 -12.554 2.714 1.00 0.21 H new ATOM 0 HA SER A 206 0.033 -13.456 4.280 1.00 0.23 H new ATOM 0 HB2 SER A 206 0.740 -15.948 3.698 1.00 0.26 H new ATOM 0 HB3 SER A 206 -0.925 -15.518 4.036 1.00 0.26 H new ATOM 0 HG SER A 206 -0.722 -16.799 2.119 1.00 1.14 H new ATOM 707 N MET A 207 2.138 -12.448 2.719 1.00 0.25 N ATOM 708 CA MET A 207 3.513 -12.087 2.412 1.00 0.27 C ATOM 709 C MET A 207 4.363 -12.120 3.667 1.00 0.52 C ATOM 710 O MET A 207 5.333 -12.870 3.744 1.00 1.36 O ATOM 711 CB MET A 207 3.564 -10.696 1.784 1.00 0.32 C ATOM 712 CG MET A 207 2.605 -10.513 0.621 1.00 0.52 C ATOM 713 SD MET A 207 2.509 -8.801 0.071 1.00 0.95 S ATOM 714 CE MET A 207 4.132 -8.574 -0.645 1.00 0.94 C ATOM 0 H MET A 207 1.480 -11.674 2.629 1.00 0.25 H new ATOM 0 HA MET A 207 3.911 -12.812 1.702 1.00 0.27 H new ATOM 0 HB2 MET A 207 3.338 -9.954 2.549 1.00 0.32 H new ATOM 0 HB3 MET A 207 4.579 -10.500 1.440 1.00 0.32 H new ATOM 0 HG2 MET A 207 2.923 -11.141 -0.211 1.00 0.52 H new ATOM 0 HG3 MET A 207 1.612 -10.853 0.916 1.00 0.52 H new ATOM 0 HE1 MET A 207 4.101 -7.757 -1.366 1.00 0.94 H new ATOM 0 HE2 MET A 207 4.847 -8.336 0.142 1.00 0.94 H new ATOM 0 HE3 MET A 207 4.439 -9.491 -1.149 1.00 0.94 H new ATOM 769 N ASP A 211 8.991 -5.521 4.123 1.00 0.28 N ATOM 770 CA ASP A 211 9.621 -4.730 5.178 1.00 0.28 C ATOM 771 C ASP A 211 8.703 -3.672 5.774 1.00 0.27 C ATOM 772 O ASP A 211 8.372 -2.676 5.133 1.00 0.33 O ATOM 773 CB ASP A 211 10.892 -4.073 4.644 1.00 0.34 C ATOM 774 CG ASP A 211 11.961 -5.098 4.335 1.00 0.65 C ATOM 775 OD1 ASP A 211 11.867 -5.767 3.281 1.00 0.91 O ATOM 776 OD2 ASP A 211 12.911 -5.220 5.134 1.00 0.88 O ATOM 0 HA ASP A 211 9.860 -5.423 5.985 1.00 0.28 H new ATOM 0 HB2 ASP A 211 10.658 -3.507 3.742 1.00 0.34 H new ATOM 0 HB3 ASP A 211 11.271 -3.362 5.378 1.00 0.34 H new ATOM 781 N LEU A 212 8.314 -3.898 7.023 1.00 0.30 N ATOM 782 CA LEU A 212 7.565 -2.916 7.797 1.00 0.36 C ATOM 783 C LEU A 212 8.530 -1.943 8.463 1.00 0.42 C ATOM 784 O LEU A 212 8.169 -0.822 8.819 1.00 0.56 O ATOM 785 CB LEU A 212 6.723 -3.618 8.866 1.00 0.43 C ATOM 786 CG LEU A 212 5.571 -4.467 8.337 1.00 0.48 C ATOM 787 CD1 LEU A 212 4.969 -5.299 9.458 1.00 0.56 C ATOM 788 CD2 LEU A 212 4.511 -3.577 7.713 1.00 0.52 C ATOM 0 H LEU A 212 8.508 -4.764 7.526 1.00 0.30 H new ATOM 0 HA LEU A 212 6.902 -2.368 7.127 1.00 0.36 H new ATOM 0 HB2 LEU A 212 7.378 -4.255 9.461 1.00 0.43 H new ATOM 0 HB3 LEU A 212 6.317 -2.863 9.538 1.00 0.43 H new ATOM 0 HG LEU A 212 5.956 -5.143 7.573 1.00 0.48 H new ATOM 0 HD11 LEU A 212 4.148 -5.899 9.065 1.00 0.56 H new ATOM 0 HD12 LEU A 212 5.733 -5.956 9.874 1.00 0.56 H new ATOM 0 HD13 LEU A 212 4.594 -4.639 10.240 1.00 0.56 H new ATOM 0 HD21 LEU A 212 3.693 -4.193 7.339 1.00 0.52 H new ATOM 0 HD22 LEU A 212 4.130 -2.884 8.463 1.00 0.52 H new ATOM 0 HD23 LEU A 212 4.948 -3.014 6.888 1.00 0.52 H new ATOM 800 N THR A 213 9.764 -2.389 8.623 1.00 0.44 N ATOM 801 CA THR A 213 10.792 -1.601 9.273 1.00 0.51 C ATOM 802 C THR A 213 11.362 -0.545 8.332 1.00 0.46 C ATOM 803 O THR A 213 11.547 0.610 8.717 1.00 0.52 O ATOM 804 CB THR A 213 11.924 -2.518 9.772 1.00 0.71 C ATOM 805 OG1 THR A 213 12.226 -3.498 8.768 1.00 1.56 O ATOM 806 CG2 THR A 213 11.524 -3.213 11.065 1.00 1.34 C ATOM 0 H THR A 213 10.079 -3.306 8.306 1.00 0.44 H new ATOM 0 HA THR A 213 10.335 -1.090 10.121 1.00 0.51 H new ATOM 0 HB THR A 213 12.806 -1.908 9.967 1.00 0.71 H new ATOM 0 HG1 THR A 213 12.948 -4.080 9.086 1.00 1.56 H new ATOM 0 HG21 THR A 213 12.338 -3.856 11.400 1.00 1.34 H new ATOM 0 HG22 THR A 213 11.314 -2.465 11.830 1.00 1.34 H new ATOM 0 HG23 THR A 213 10.633 -3.816 10.893 1.00 1.34 H new ATOM 814 N THR A 214 11.628 -0.942 7.096 1.00 0.45 N ATOM 815 CA THR A 214 12.232 -0.052 6.121 1.00 0.47 C ATOM 816 C THR A 214 11.256 1.038 5.669 1.00 0.42 C ATOM 817 O THR A 214 11.649 2.185 5.464 1.00 0.60 O ATOM 818 CB THR A 214 12.728 -0.842 4.896 1.00 0.57 C ATOM 819 OG1 THR A 214 13.366 -2.054 5.327 1.00 1.18 O ATOM 820 CG2 THR A 214 13.711 -0.017 4.086 1.00 0.40 C ATOM 0 H THR A 214 11.433 -1.880 6.746 1.00 0.45 H new ATOM 0 HA THR A 214 13.081 0.429 6.607 1.00 0.47 H new ATOM 0 HB THR A 214 11.869 -1.079 4.269 1.00 0.57 H new ATOM 0 HG1 THR A 214 13.679 -2.555 4.545 1.00 1.18 H new ATOM 0 HG21 THR A 214 14.048 -0.595 3.225 1.00 0.40 H new ATOM 0 HG22 THR A 214 13.224 0.895 3.742 1.00 0.40 H new ATOM 0 HG23 THR A 214 14.568 0.242 4.708 1.00 0.40 H new ATOM 828 N LEU A 215 9.982 0.689 5.545 1.00 0.30 N ATOM 829 CA LEU A 215 8.979 1.624 5.038 1.00 0.27 C ATOM 830 C LEU A 215 8.407 2.500 6.151 1.00 0.25 C ATOM 831 O LEU A 215 7.206 2.758 6.196 1.00 0.29 O ATOM 832 CB LEU A 215 7.847 0.863 4.348 1.00 0.25 C ATOM 833 CG LEU A 215 8.246 0.107 3.080 1.00 0.23 C ATOM 834 CD1 LEU A 215 7.059 -0.665 2.531 1.00 0.25 C ATOM 835 CD2 LEU A 215 8.789 1.069 2.031 1.00 0.24 C ATOM 0 H LEU A 215 9.617 -0.232 5.787 1.00 0.30 H new ATOM 0 HA LEU A 215 9.474 2.275 4.318 1.00 0.27 H new ATOM 0 HB2 LEU A 215 7.424 0.152 5.057 1.00 0.25 H new ATOM 0 HB3 LEU A 215 7.057 1.570 4.096 1.00 0.25 H new ATOM 0 HG LEU A 215 9.034 -0.602 3.334 1.00 0.23 H new ATOM 0 HD11 LEU A 215 7.358 -1.198 1.628 1.00 0.25 H new ATOM 0 HD12 LEU A 215 6.713 -1.380 3.277 1.00 0.25 H new ATOM 0 HD13 LEU A 215 6.253 0.029 2.292 1.00 0.25 H new ATOM 0 HD21 LEU A 215 9.067 0.512 1.136 1.00 0.24 H new ATOM 0 HD22 LEU A 215 8.023 1.802 1.778 1.00 0.24 H new ATOM 0 HD23 LEU A 215 9.666 1.582 2.427 1.00 0.24 H new ATOM 847 N ASN A 216 9.269 2.971 7.037 1.00 0.24 N ATOM 848 CA ASN A 216 8.837 3.845 8.119 1.00 0.26 C ATOM 849 C ASN A 216 8.939 5.303 7.673 1.00 0.22 C ATOM 850 O ASN A 216 9.793 6.059 8.141 1.00 0.29 O ATOM 851 CB ASN A 216 9.676 3.602 9.379 1.00 0.34 C ATOM 852 CG ASN A 216 9.105 4.291 10.609 1.00 0.69 C ATOM 853 OD1 ASN A 216 9.425 5.445 10.899 1.00 1.34 O ATOM 854 ND2 ASN A 216 8.267 3.583 11.355 1.00 0.64 N ATOM 0 H ASN A 216 10.268 2.765 7.030 1.00 0.24 H new ATOM 0 HA ASN A 216 7.798 3.622 8.362 1.00 0.26 H new ATOM 0 HB2 ASN A 216 9.741 2.530 9.566 1.00 0.34 H new ATOM 0 HB3 ASN A 216 10.692 3.958 9.208 1.00 0.34 H new ATOM 0 HD21 ASN A 216 7.866 3.992 12.199 1.00 0.64 H new ATOM 0 HD22 ASN A 216 8.024 2.630 11.085 1.00 0.64 H new ATOM 861 N ILE A 217 8.077 5.678 6.738 1.00 0.19 N ATOM 862 CA ILE A 217 8.060 7.027 6.188 1.00 0.19 C ATOM 863 C ILE A 217 6.633 7.473 5.904 1.00 0.18 C ATOM 864 O ILE A 217 5.691 6.709 6.110 1.00 0.19 O ATOM 865 CB ILE A 217 8.909 7.140 4.894 1.00 0.20 C ATOM 866 CG1 ILE A 217 8.865 5.839 4.074 1.00 0.27 C ATOM 867 CG2 ILE A 217 10.344 7.509 5.229 1.00 0.32 C ATOM 868 CD1 ILE A 217 7.525 5.550 3.431 1.00 0.89 C ATOM 0 H ILE A 217 7.372 5.058 6.340 1.00 0.19 H new ATOM 0 HA ILE A 217 8.503 7.681 6.939 1.00 0.19 H new ATOM 0 HB ILE A 217 8.476 7.932 4.283 1.00 0.20 H new ATOM 0 HG12 ILE A 217 9.625 5.889 3.294 1.00 0.27 H new ATOM 0 HG13 ILE A 217 9.130 5.005 4.724 1.00 0.27 H new ATOM 0 HG21 ILE A 217 10.925 7.584 4.310 1.00 0.32 H new ATOM 0 HG22 ILE A 217 10.362 8.467 5.748 1.00 0.32 H new ATOM 0 HG23 ILE A 217 10.777 6.741 5.870 1.00 0.32 H new ATOM 0 HD11 ILE A 217 7.583 4.615 2.873 1.00 0.89 H new ATOM 0 HD12 ILE A 217 6.761 5.464 4.204 1.00 0.89 H new ATOM 0 HD13 ILE A 217 7.264 6.362 2.752 1.00 0.89 H new ATOM 880 N SER A 218 6.472 8.701 5.433 1.00 0.19 N ATOM 881 CA SER A 218 5.152 9.221 5.124 1.00 0.20 C ATOM 882 C SER A 218 4.804 8.992 3.652 1.00 0.20 C ATOM 883 O SER A 218 5.651 8.540 2.873 1.00 0.21 O ATOM 884 CB SER A 218 5.075 10.703 5.482 1.00 0.23 C ATOM 885 OG SER A 218 6.161 11.415 4.907 1.00 1.10 O ATOM 0 H SER A 218 7.237 9.352 5.258 1.00 0.19 H new ATOM 0 HA SER A 218 4.418 8.682 5.723 1.00 0.20 H new ATOM 0 HB2 SER A 218 4.132 11.119 5.127 1.00 0.23 H new ATOM 0 HB3 SER A 218 5.089 10.822 6.565 1.00 0.23 H new ATOM 0 HG SER A 218 6.094 12.363 5.146 1.00 1.10 H new ATOM 891 N GLY A 219 3.574 9.313 3.268 1.00 0.21 N ATOM 892 CA GLY A 219 3.115 9.041 1.920 1.00 0.23 C ATOM 893 C GLY A 219 3.937 9.735 0.852 1.00 0.22 C ATOM 894 O GLY A 219 4.263 9.130 -0.172 1.00 0.22 O ATOM 0 H GLY A 219 2.883 9.760 3.871 1.00 0.21 H new ATOM 0 HA2 GLY A 219 3.140 7.965 1.746 1.00 0.23 H new ATOM 0 HA3 GLY A 219 2.075 9.354 1.828 1.00 0.23 H new ATOM 898 N ARG A 220 4.285 10.998 1.082 1.00 0.24 N ATOM 899 CA ARG A 220 5.023 11.776 0.107 1.00 0.25 C ATOM 900 C ARG A 220 6.425 11.213 -0.133 1.00 0.25 C ATOM 901 O ARG A 220 7.075 11.564 -1.112 1.00 0.32 O ATOM 902 CB ARG A 220 5.077 13.239 0.555 1.00 0.26 C ATOM 903 CG ARG A 220 5.745 13.457 1.906 1.00 1.23 C ATOM 904 CD ARG A 220 7.259 13.540 1.785 1.00 2.30 C ATOM 905 NE ARG A 220 7.921 13.322 3.066 1.00 3.08 N ATOM 906 CZ ARG A 220 9.207 13.007 3.191 1.00 4.20 C ATOM 907 NH1 ARG A 220 9.983 12.927 2.115 1.00 4.78 N ATOM 908 NH2 ARG A 220 9.713 12.767 4.391 1.00 5.01 N ATOM 0 H ARG A 220 4.064 11.501 1.941 1.00 0.24 H new ATOM 0 HA ARG A 220 4.500 11.716 -0.848 1.00 0.25 H new ATOM 0 HB2 ARG A 220 5.611 13.818 -0.199 1.00 0.26 H new ATOM 0 HB3 ARG A 220 4.061 13.631 0.598 1.00 0.26 H new ATOM 0 HG2 ARG A 220 5.366 14.376 2.354 1.00 1.23 H new ATOM 0 HG3 ARG A 220 5.479 12.641 2.578 1.00 1.23 H new ATOM 0 HD2 ARG A 220 7.607 12.798 1.066 1.00 2.30 H new ATOM 0 HD3 ARG A 220 7.539 14.518 1.394 1.00 2.30 H new ATOM 0 HE ARG A 220 7.365 13.417 3.916 1.00 3.08 H new ATOM 0 HH11 ARG A 220 9.593 13.107 1.190 1.00 4.78 H new ATOM 0 HH12 ARG A 220 10.969 12.685 2.214 1.00 4.78 H new ATOM 0 HH21 ARG A 220 9.117 12.824 5.217 1.00 5.01 H new ATOM 0 HH22 ARG A 220 10.699 12.525 4.490 1.00 5.01 H new ATOM 922 N GLU A 221 6.897 10.360 0.766 1.00 0.24 N ATOM 923 CA GLU A 221 8.167 9.673 0.572 1.00 0.27 C ATOM 924 C GLU A 221 7.912 8.343 -0.131 1.00 0.23 C ATOM 925 O GLU A 221 8.594 8.004 -1.094 1.00 0.23 O ATOM 926 CB GLU A 221 8.860 9.453 1.922 1.00 0.34 C ATOM 927 CG GLU A 221 10.377 9.620 1.895 1.00 0.84 C ATOM 928 CD GLU A 221 11.123 8.424 1.330 1.00 1.60 C ATOM 929 OE1 GLU A 221 11.138 7.367 1.989 1.00 2.45 O ATOM 930 OE2 GLU A 221 11.744 8.551 0.253 1.00 2.07 O ATOM 0 H GLU A 221 6.420 10.127 1.637 1.00 0.24 H new ATOM 0 HA GLU A 221 8.825 10.282 -0.048 1.00 0.27 H new ATOM 0 HB2 GLU A 221 8.444 10.153 2.647 1.00 0.34 H new ATOM 0 HB3 GLU A 221 8.625 8.449 2.276 1.00 0.34 H new ATOM 0 HG2 GLU A 221 10.624 10.501 1.303 1.00 0.84 H new ATOM 0 HG3 GLU A 221 10.729 9.808 2.909 1.00 0.84 H new ATOM 937 N LEU A 222 6.891 7.625 0.332 1.00 0.21 N ATOM 938 CA LEU A 222 6.517 6.331 -0.237 1.00 0.20 C ATOM 939 C LEU A 222 6.157 6.470 -1.720 1.00 0.18 C ATOM 940 O LEU A 222 6.687 5.755 -2.567 1.00 0.20 O ATOM 941 CB LEU A 222 5.330 5.755 0.559 1.00 0.21 C ATOM 942 CG LEU A 222 4.976 4.278 0.314 1.00 0.21 C ATOM 943 CD1 LEU A 222 4.180 4.102 -0.970 1.00 0.19 C ATOM 944 CD2 LEU A 222 6.235 3.421 0.279 1.00 0.26 C ATOM 0 H LEU A 222 6.301 7.922 1.109 1.00 0.21 H new ATOM 0 HA LEU A 222 7.365 5.650 -0.167 1.00 0.20 H new ATOM 0 HB2 LEU A 222 5.541 5.881 1.621 1.00 0.21 H new ATOM 0 HB3 LEU A 222 4.449 6.356 0.336 1.00 0.21 H new ATOM 0 HG LEU A 222 4.351 3.948 1.144 1.00 0.21 H new ATOM 0 HD11 LEU A 222 3.947 3.047 -1.112 1.00 0.19 H new ATOM 0 HD12 LEU A 222 3.254 4.673 -0.905 1.00 0.19 H new ATOM 0 HD13 LEU A 222 4.768 4.460 -1.815 1.00 0.19 H new ATOM 0 HD21 LEU A 222 5.962 2.380 0.105 1.00 0.26 H new ATOM 0 HD22 LEU A 222 6.887 3.765 -0.524 1.00 0.26 H new ATOM 0 HD23 LEU A 222 6.758 3.504 1.232 1.00 0.26 H new ATOM 956 N CYS A 223 5.257 7.391 -2.032 1.00 0.18 N ATOM 957 CA CYS A 223 4.790 7.553 -3.403 1.00 0.18 C ATOM 958 C CYS A 223 5.843 8.225 -4.286 1.00 0.18 C ATOM 959 O CYS A 223 5.792 8.118 -5.511 1.00 0.21 O ATOM 960 CB CYS A 223 3.487 8.359 -3.423 1.00 0.21 C ATOM 961 SG CYS A 223 2.705 8.476 -5.049 1.00 0.71 S ATOM 0 H CYS A 223 4.837 8.034 -1.360 1.00 0.18 H new ATOM 0 HA CYS A 223 4.606 6.559 -3.811 1.00 0.18 H new ATOM 0 HB2 CYS A 223 2.782 7.905 -2.726 1.00 0.21 H new ATOM 0 HB3 CYS A 223 3.691 9.366 -3.058 1.00 0.21 H new ATOM 0 HG CYS A 223 3.610 8.363 -5.975 1.00 0.71 H new ATOM 967 N SER A 224 6.795 8.919 -3.677 1.00 0.17 N ATOM 968 CA SER A 224 7.810 9.621 -4.445 1.00 0.21 C ATOM 969 C SER A 224 8.991 8.715 -4.788 1.00 0.17 C ATOM 970 O SER A 224 9.876 9.116 -5.546 1.00 0.19 O ATOM 971 CB SER A 224 8.293 10.861 -3.692 1.00 0.30 C ATOM 972 OG SER A 224 9.174 11.644 -4.482 1.00 1.10 O ATOM 0 H SER A 224 6.884 9.010 -2.665 1.00 0.17 H new ATOM 0 HA SER A 224 7.350 9.933 -5.383 1.00 0.21 H new ATOM 0 HB2 SER A 224 7.435 11.465 -3.397 1.00 0.30 H new ATOM 0 HB3 SER A 224 8.799 10.556 -2.776 1.00 0.30 H new ATOM 0 HG SER A 224 9.602 11.075 -5.156 1.00 1.10 H new ATOM 978 N LEU A 225 9.016 7.499 -4.261 1.00 0.17 N ATOM 979 CA LEU A 225 10.073 6.576 -4.622 1.00 0.18 C ATOM 980 C LEU A 225 9.562 5.631 -5.700 1.00 0.19 C ATOM 981 O LEU A 225 8.433 5.143 -5.624 1.00 0.19 O ATOM 982 CB LEU A 225 10.594 5.812 -3.392 1.00 0.19 C ATOM 983 CG LEU A 225 9.550 5.032 -2.583 1.00 0.16 C ATOM 984 CD1 LEU A 225 9.408 3.612 -3.096 1.00 0.39 C ATOM 985 CD2 LEU A 225 9.909 5.026 -1.107 1.00 0.27 C ATOM 0 H LEU A 225 8.331 7.138 -3.597 1.00 0.17 H new ATOM 0 HA LEU A 225 10.920 7.136 -5.018 1.00 0.18 H new ATOM 0 HB2 LEU A 225 11.362 5.113 -3.724 1.00 0.19 H new ATOM 0 HB3 LEU A 225 11.079 6.526 -2.726 1.00 0.19 H new ATOM 0 HG LEU A 225 8.591 5.535 -2.706 1.00 0.16 H new ATOM 0 HD11 LEU A 225 8.661 3.084 -2.503 1.00 0.39 H new ATOM 0 HD12 LEU A 225 9.095 3.632 -4.140 1.00 0.39 H new ATOM 0 HD13 LEU A 225 10.366 3.098 -3.014 1.00 0.39 H new ATOM 0 HD21 LEU A 225 9.156 4.468 -0.552 1.00 0.27 H new ATOM 0 HD22 LEU A 225 10.883 4.555 -0.971 1.00 0.27 H new ATOM 0 HD23 LEU A 225 9.947 6.051 -0.738 1.00 0.27 H new ATOM 997 N ASN A 226 10.367 5.402 -6.718 1.00 0.22 N ATOM 998 CA ASN A 226 9.972 4.515 -7.806 1.00 0.25 C ATOM 999 C ASN A 226 10.275 3.085 -7.413 1.00 0.21 C ATOM 1000 O ASN A 226 10.953 2.857 -6.409 1.00 0.23 O ATOM 1001 CB ASN A 226 10.695 4.856 -9.107 1.00 0.40 C ATOM 1002 CG ASN A 226 10.879 6.341 -9.309 1.00 1.04 C ATOM 1003 OD1 ASN A 226 9.985 7.031 -9.796 1.00 2.01 O ATOM 1004 ND2 ASN A 226 12.052 6.836 -8.956 1.00 1.31 N ATOM 0 H ASN A 226 11.295 5.813 -6.819 1.00 0.22 H new ATOM 0 HA ASN A 226 8.904 4.643 -7.980 1.00 0.25 H new ATOM 0 HB2 ASN A 226 11.671 4.371 -9.112 1.00 0.40 H new ATOM 0 HB3 ASN A 226 10.132 4.448 -9.947 1.00 0.40 H new ATOM 0 HD21 ASN A 226 12.246 7.829 -9.084 1.00 1.31 H new ATOM 0 HD22 ASN A 226 12.764 6.225 -8.556 1.00 1.31 H new ATOM 1011 N GLN A 227 9.738 2.126 -8.180 1.00 0.20 N ATOM 1012 CA GLN A 227 9.803 0.707 -7.832 1.00 0.19 C ATOM 1013 C GLN A 227 11.177 0.280 -7.337 1.00 0.18 C ATOM 1014 O GLN A 227 11.294 -0.537 -6.435 1.00 0.19 O ATOM 1015 CB GLN A 227 9.404 -0.165 -9.023 1.00 0.22 C ATOM 1016 CG GLN A 227 8.230 -1.080 -8.722 1.00 0.29 C ATOM 1017 CD GLN A 227 6.967 -0.300 -8.432 1.00 0.52 C ATOM 1018 OE1 GLN A 227 6.197 0.023 -9.334 1.00 1.30 O ATOM 1019 NE2 GLN A 227 6.754 0.016 -7.171 1.00 1.13 N ATOM 0 H GLN A 227 9.249 2.315 -9.055 1.00 0.20 H new ATOM 0 HA GLN A 227 9.096 0.566 -7.014 1.00 0.19 H new ATOM 0 HB2 GLN A 227 9.150 0.476 -9.867 1.00 0.22 H new ATOM 0 HB3 GLN A 227 10.259 -0.769 -9.327 1.00 0.22 H new ATOM 0 HG2 GLN A 227 8.060 -1.744 -9.570 1.00 0.29 H new ATOM 0 HG3 GLN A 227 8.471 -1.711 -7.867 1.00 0.29 H new ATOM 0 HE21 GLN A 227 7.419 -0.272 -6.454 1.00 1.13 H new ATOM 0 HE22 GLN A 227 5.924 0.549 -6.912 1.00 1.13 H new ATOM 1028 N GLU A 228 12.215 0.885 -7.914 1.00 0.20 N ATOM 1029 CA GLU A 228 13.593 0.496 -7.665 1.00 0.23 C ATOM 1030 C GLU A 228 13.992 0.875 -6.251 1.00 0.18 C ATOM 1031 O GLU A 228 14.487 0.041 -5.493 1.00 0.19 O ATOM 1032 CB GLU A 228 14.529 1.197 -8.658 1.00 0.34 C ATOM 1033 CG GLU A 228 14.280 0.861 -10.127 1.00 1.14 C ATOM 1034 CD GLU A 228 12.962 1.395 -10.661 1.00 1.66 C ATOM 1035 OE1 GLU A 228 12.533 2.488 -10.230 1.00 2.29 O ATOM 1036 OE2 GLU A 228 12.351 0.726 -11.523 1.00 1.83 O ATOM 0 H GLU A 228 12.118 1.661 -8.569 1.00 0.20 H new ATOM 0 HA GLU A 228 13.676 -0.584 -7.791 1.00 0.23 H new ATOM 0 HB2 GLU A 228 14.433 2.275 -8.526 1.00 0.34 H new ATOM 0 HB3 GLU A 228 15.558 0.936 -8.411 1.00 0.34 H new ATOM 0 HG2 GLU A 228 15.095 1.266 -10.726 1.00 1.14 H new ATOM 0 HG3 GLU A 228 14.300 -0.222 -10.251 1.00 1.14 H new ATOM 1043 N ASP A 229 13.756 2.131 -5.900 1.00 0.18 N ATOM 1044 CA ASP A 229 14.044 2.590 -4.546 1.00 0.20 C ATOM 1045 C ASP A 229 13.280 1.746 -3.527 1.00 0.19 C ATOM 1046 O ASP A 229 13.780 1.476 -2.441 1.00 0.22 O ATOM 1047 CB ASP A 229 13.724 4.082 -4.389 1.00 0.25 C ATOM 1048 CG ASP A 229 14.357 4.712 -3.157 1.00 0.37 C ATOM 1049 OD1 ASP A 229 14.931 3.965 -2.332 1.00 0.71 O ATOM 1050 OD2 ASP A 229 14.281 5.944 -2.992 1.00 0.54 O ATOM 0 H ASP A 229 13.372 2.842 -6.522 1.00 0.18 H new ATOM 0 HA ASP A 229 15.111 2.466 -4.359 1.00 0.20 H new ATOM 0 HB2 ASP A 229 14.067 4.614 -5.276 1.00 0.25 H new ATOM 0 HB3 ASP A 229 12.643 4.210 -4.338 1.00 0.25 H new ATOM 1055 N PHE A 230 12.096 1.278 -3.897 1.00 0.17 N ATOM 1056 CA PHE A 230 11.365 0.367 -3.022 1.00 0.17 C ATOM 1057 C PHE A 230 12.043 -0.987 -3.014 1.00 0.18 C ATOM 1058 O PHE A 230 12.357 -1.509 -1.959 1.00 0.21 O ATOM 1059 CB PHE A 230 9.911 0.185 -3.449 1.00 0.17 C ATOM 1060 CG PHE A 230 9.180 -0.873 -2.652 1.00 0.17 C ATOM 1061 CD1 PHE A 230 8.635 -0.591 -1.403 1.00 0.19 C ATOM 1062 CD2 PHE A 230 9.017 -2.152 -3.166 1.00 0.19 C ATOM 1063 CE1 PHE A 230 7.943 -1.561 -0.697 1.00 0.23 C ATOM 1064 CE2 PHE A 230 8.334 -3.119 -2.459 1.00 0.21 C ATOM 1065 CZ PHE A 230 7.793 -2.823 -1.225 1.00 0.22 C ATOM 0 H PHE A 230 11.629 1.506 -4.775 1.00 0.17 H new ATOM 0 HA PHE A 230 11.370 0.810 -2.026 1.00 0.17 H new ATOM 0 HB2 PHE A 230 9.387 1.135 -3.344 1.00 0.17 H new ATOM 0 HB3 PHE A 230 9.881 -0.081 -4.506 1.00 0.17 H new ATOM 0 HD1 PHE A 230 8.753 0.395 -0.979 1.00 0.19 H new ATOM 0 HD2 PHE A 230 9.431 -2.393 -4.134 1.00 0.19 H new ATOM 0 HE1 PHE A 230 7.521 -1.327 0.269 1.00 0.23 H new ATOM 0 HE2 PHE A 230 8.222 -4.111 -2.872 1.00 0.21 H new ATOM 0 HZ PHE A 230 7.253 -3.580 -0.675 1.00 0.22 H new ATOM 1075 N PHE A 231 12.314 -1.530 -4.201 1.00 0.17 N ATOM 1076 CA PHE A 231 12.778 -2.905 -4.334 1.00 0.20 C ATOM 1077 C PHE A 231 14.169 -3.081 -3.741 1.00 0.25 C ATOM 1078 O PHE A 231 14.608 -4.203 -3.498 1.00 0.41 O ATOM 1079 CB PHE A 231 12.782 -3.338 -5.806 1.00 0.21 C ATOM 1080 CG PHE A 231 11.488 -3.937 -6.290 1.00 0.20 C ATOM 1081 CD1 PHE A 231 10.267 -3.407 -5.908 1.00 0.33 C ATOM 1082 CD2 PHE A 231 11.501 -5.032 -7.141 1.00 0.44 C ATOM 1083 CE1 PHE A 231 9.082 -3.956 -6.365 1.00 0.36 C ATOM 1084 CE2 PHE A 231 10.321 -5.585 -7.598 1.00 0.45 C ATOM 1085 CZ PHE A 231 9.110 -5.045 -7.211 1.00 0.27 C ATOM 0 H PHE A 231 12.219 -1.033 -5.087 1.00 0.17 H new ATOM 0 HA PHE A 231 12.085 -3.538 -3.779 1.00 0.20 H new ATOM 0 HB2 PHE A 231 13.019 -2.472 -6.424 1.00 0.21 H new ATOM 0 HB3 PHE A 231 13.581 -4.065 -5.955 1.00 0.21 H new ATOM 0 HD1 PHE A 231 10.239 -2.555 -5.245 1.00 0.33 H new ATOM 0 HD2 PHE A 231 12.445 -5.457 -7.450 1.00 0.44 H new ATOM 0 HE1 PHE A 231 8.137 -3.532 -6.060 1.00 0.36 H new ATOM 0 HE2 PHE A 231 10.345 -6.440 -8.258 1.00 0.45 H new ATOM 0 HZ PHE A 231 8.187 -5.475 -7.570 1.00 0.27 H new ATOM 1095 N GLN A 232 14.882 -1.989 -3.525 1.00 0.20 N ATOM 1096 CA GLN A 232 16.182 -2.091 -2.897 1.00 0.23 C ATOM 1097 C GLN A 232 16.027 -2.033 -1.383 1.00 0.25 C ATOM 1098 O GLN A 232 16.640 -2.817 -0.658 1.00 0.28 O ATOM 1099 CB GLN A 232 17.138 -1.004 -3.397 1.00 0.24 C ATOM 1100 CG GLN A 232 17.308 -0.984 -4.911 1.00 0.28 C ATOM 1101 CD GLN A 232 17.590 -2.356 -5.499 1.00 0.33 C ATOM 1102 OE1 GLN A 232 18.741 -2.778 -5.607 1.00 0.37 O ATOM 1103 NE2 GLN A 232 16.538 -3.053 -5.902 1.00 0.36 N ATOM 0 H GLN A 232 14.589 -1.043 -3.770 1.00 0.20 H new ATOM 0 HA GLN A 232 16.622 -3.050 -3.171 1.00 0.23 H new ATOM 0 HB2 GLN A 232 16.771 -0.031 -3.069 1.00 0.24 H new ATOM 0 HB3 GLN A 232 18.114 -1.150 -2.933 1.00 0.24 H new ATOM 0 HG2 GLN A 232 16.404 -0.579 -5.366 1.00 0.28 H new ATOM 0 HG3 GLN A 232 18.125 -0.310 -5.170 1.00 0.28 H new ATOM 0 HE21 GLN A 232 15.600 -2.668 -5.795 1.00 0.36 H new ATOM 0 HE22 GLN A 232 16.666 -3.975 -6.319 1.00 0.36 H new ATOM 1112 N ARG A 233 15.218 -1.088 -0.906 1.00 0.24 N ATOM 1113 CA ARG A 233 14.839 -1.024 0.504 1.00 0.27 C ATOM 1114 C ARG A 233 14.138 -2.319 0.930 1.00 0.29 C ATOM 1115 O ARG A 233 14.298 -2.789 2.059 1.00 0.33 O ATOM 1116 CB ARG A 233 13.863 0.136 0.731 1.00 0.27 C ATOM 1117 CG ARG A 233 14.429 1.513 0.441 1.00 0.27 C ATOM 1118 CD ARG A 233 13.411 2.589 0.779 1.00 0.40 C ATOM 1119 NE ARG A 233 13.603 3.823 0.015 1.00 0.69 N ATOM 1120 CZ ARG A 233 13.006 4.977 0.317 1.00 0.67 C ATOM 1121 NH1 ARG A 233 12.379 5.118 1.477 1.00 0.93 N ATOM 1122 NH2 ARG A 233 13.075 6.010 -0.519 1.00 1.39 N ATOM 0 H ARG A 233 14.810 -0.351 -1.481 1.00 0.24 H new ATOM 0 HA ARG A 233 15.747 -0.881 1.090 1.00 0.27 H new ATOM 0 HB2 ARG A 233 12.985 -0.019 0.104 1.00 0.27 H new ATOM 0 HB3 ARG A 233 13.524 0.109 1.767 1.00 0.27 H new ATOM 0 HG2 ARG A 233 15.338 1.669 1.022 1.00 0.27 H new ATOM 0 HG3 ARG A 233 14.707 1.584 -0.611 1.00 0.27 H new ATOM 0 HD2 ARG A 233 12.409 2.204 0.590 1.00 0.40 H new ATOM 0 HD3 ARG A 233 13.470 2.815 1.844 1.00 0.40 H new ATOM 0 HE ARG A 233 14.227 3.799 -0.792 1.00 0.69 H new ATOM 0 HH11 ARG A 233 12.353 4.343 2.140 1.00 0.93 H new ATOM 0 HH12 ARG A 233 11.923 6.001 1.706 1.00 0.93 H new ATOM 0 HH21 ARG A 233 13.587 5.922 -1.397 1.00 1.39 H new ATOM 0 HH22 ARG A 233 12.616 6.890 -0.282 1.00 1.39 H new ATOM 1136 N VAL A 234 13.378 -2.887 -0.008 1.00 0.27 N ATOM 1137 CA VAL A 234 12.468 -4.002 0.227 1.00 0.27 C ATOM 1138 C VAL A 234 11.970 -4.526 -1.127 1.00 0.25 C ATOM 1139 O VAL A 234 11.111 -3.928 -1.766 1.00 0.24 O ATOM 1140 CB VAL A 234 11.264 -3.585 1.127 1.00 0.27 C ATOM 1141 CG1 VAL A 234 10.876 -2.130 0.899 1.00 0.28 C ATOM 1142 CG2 VAL A 234 10.054 -4.476 0.885 1.00 0.26 C ATOM 0 H VAL A 234 13.381 -2.573 -0.978 1.00 0.27 H new ATOM 0 HA VAL A 234 13.005 -4.788 0.758 1.00 0.27 H new ATOM 0 HB VAL A 234 11.588 -3.705 2.161 1.00 0.27 H new ATOM 0 HG11 VAL A 234 10.034 -1.873 1.542 1.00 0.28 H new ATOM 0 HG12 VAL A 234 11.723 -1.486 1.136 1.00 0.28 H new ATOM 0 HG13 VAL A 234 10.593 -1.988 -0.144 1.00 0.28 H new ATOM 0 HG21 VAL A 234 9.233 -4.158 1.528 1.00 0.26 H new ATOM 0 HG22 VAL A 234 9.748 -4.399 -0.158 1.00 0.26 H new ATOM 0 HG23 VAL A 234 10.313 -5.510 1.112 1.00 0.26 H new ATOM 1152 N PRO A 235 12.529 -5.636 -1.602 1.00 0.27 N ATOM 1153 CA PRO A 235 12.251 -6.147 -2.941 1.00 0.27 C ATOM 1154 C PRO A 235 10.950 -6.934 -3.041 1.00 0.30 C ATOM 1155 O PRO A 235 10.315 -6.965 -4.096 1.00 0.32 O ATOM 1156 CB PRO A 235 13.442 -7.075 -3.233 1.00 0.30 C ATOM 1157 CG PRO A 235 14.311 -7.054 -2.009 1.00 0.34 C ATOM 1158 CD PRO A 235 13.488 -6.477 -0.893 1.00 0.33 C ATOM 0 HA PRO A 235 12.132 -5.325 -3.647 1.00 0.27 H new ATOM 0 HB2 PRO A 235 13.101 -8.087 -3.449 1.00 0.30 H new ATOM 0 HB3 PRO A 235 13.995 -6.732 -4.107 1.00 0.30 H new ATOM 0 HG2 PRO A 235 14.648 -8.060 -1.759 1.00 0.34 H new ATOM 0 HG3 PRO A 235 15.203 -6.452 -2.180 1.00 0.34 H new ATOM 0 HD2 PRO A 235 12.992 -7.255 -0.312 1.00 0.33 H new ATOM 0 HD3 PRO A 235 14.097 -5.899 -0.198 1.00 0.33 H new ATOM 1166 N ARG A 236 10.538 -7.551 -1.949 1.00 0.31 N ATOM 1167 CA ARG A 236 9.427 -8.492 -1.996 1.00 0.31 C ATOM 1168 C ARG A 236 8.062 -7.819 -1.794 1.00 0.28 C ATOM 1169 O ARG A 236 7.153 -8.429 -1.238 1.00 0.32 O ATOM 1170 CB ARG A 236 9.629 -9.611 -0.959 1.00 0.39 C ATOM 1171 CG ARG A 236 9.571 -9.151 0.502 1.00 0.67 C ATOM 1172 CD ARG A 236 10.762 -8.284 0.901 1.00 1.04 C ATOM 1173 NE ARG A 236 12.023 -9.025 0.835 1.00 1.78 N ATOM 1174 CZ ARG A 236 12.994 -8.945 1.751 1.00 2.75 C ATOM 1175 NH1 ARG A 236 12.912 -8.078 2.748 1.00 3.36 N ATOM 1176 NH2 ARG A 236 14.076 -9.705 1.642 1.00 3.49 N ATOM 0 H ARG A 236 10.950 -7.421 -1.025 1.00 0.31 H new ATOM 0 HA ARG A 236 9.421 -8.920 -2.999 1.00 0.31 H new ATOM 0 HB2 ARG A 236 8.867 -10.374 -1.116 1.00 0.39 H new ATOM 0 HB3 ARG A 236 10.595 -10.084 -1.138 1.00 0.39 H new ATOM 0 HG2 ARG A 236 8.650 -8.591 0.665 1.00 0.67 H new ATOM 0 HG3 ARG A 236 9.531 -10.026 1.151 1.00 0.67 H new ATOM 0 HD2 ARG A 236 10.816 -7.416 0.243 1.00 1.04 H new ATOM 0 HD3 ARG A 236 10.614 -7.908 1.913 1.00 1.04 H new ATOM 0 HE ARG A 236 12.171 -9.643 0.037 1.00 1.78 H new ATOM 0 HH11 ARG A 236 12.102 -7.462 2.823 1.00 3.36 H new ATOM 0 HH12 ARG A 236 13.659 -8.026 3.441 1.00 3.36 H new ATOM 0 HH21 ARG A 236 14.168 -10.352 0.859 1.00 3.49 H new ATOM 0 HH22 ARG A 236 14.816 -9.643 2.342 1.00 3.49 H new ATOM 1190 N GLY A 237 7.903 -6.573 -2.237 1.00 0.23 N ATOM 1191 CA GLY A 237 6.609 -5.917 -2.103 1.00 0.20 C ATOM 1192 C GLY A 237 5.962 -5.566 -3.436 1.00 0.15 C ATOM 1193 O GLY A 237 5.196 -4.611 -3.523 1.00 0.15 O ATOM 0 H GLY A 237 8.632 -6.013 -2.679 1.00 0.23 H new ATOM 0 HA2 GLY A 237 5.937 -6.568 -1.543 1.00 0.20 H new ATOM 0 HA3 GLY A 237 6.732 -5.006 -1.517 1.00 0.20 H new ATOM 1197 N GLU A 238 6.264 -6.347 -4.466 1.00 0.16 N ATOM 1198 CA GLU A 238 5.709 -6.152 -5.813 1.00 0.15 C ATOM 1199 C GLU A 238 4.171 -6.139 -5.834 1.00 0.13 C ATOM 1200 O GLU A 238 3.552 -5.290 -6.478 1.00 0.13 O ATOM 1201 CB GLU A 238 6.255 -7.256 -6.722 1.00 0.19 C ATOM 1202 CG GLU A 238 5.987 -8.655 -6.179 1.00 1.06 C ATOM 1203 CD GLU A 238 6.831 -9.723 -6.839 1.00 1.37 C ATOM 1204 OE1 GLU A 238 7.992 -9.912 -6.416 1.00 1.74 O ATOM 1205 OE2 GLU A 238 6.327 -10.392 -7.764 1.00 1.55 O ATOM 0 H GLU A 238 6.903 -7.139 -4.397 1.00 0.16 H new ATOM 0 HA GLU A 238 6.017 -5.170 -6.172 1.00 0.15 H new ATOM 0 HB2 GLU A 238 5.805 -7.162 -7.710 1.00 0.19 H new ATOM 0 HB3 GLU A 238 7.329 -7.119 -6.847 1.00 0.19 H new ATOM 0 HG2 GLU A 238 6.176 -8.663 -5.106 1.00 1.06 H new ATOM 0 HG3 GLU A 238 4.933 -8.896 -6.319 1.00 1.06 H new ATOM 1212 N ILE A 239 3.576 -7.065 -5.101 1.00 0.12 N ATOM 1213 CA ILE A 239 2.120 -7.221 -5.095 1.00 0.12 C ATOM 1214 C ILE A 239 1.463 -6.014 -4.404 1.00 0.12 C ATOM 1215 O ILE A 239 0.354 -5.595 -4.762 1.00 0.12 O ATOM 1216 CB ILE A 239 1.709 -8.559 -4.423 1.00 0.13 C ATOM 1217 CG1 ILE A 239 0.574 -9.243 -5.200 1.00 0.18 C ATOM 1218 CG2 ILE A 239 1.313 -8.357 -2.975 1.00 0.25 C ATOM 1219 CD1 ILE A 239 -0.695 -8.426 -5.314 1.00 0.26 C ATOM 0 H ILE A 239 4.073 -7.723 -4.501 1.00 0.12 H new ATOM 0 HA ILE A 239 1.765 -7.256 -6.125 1.00 0.12 H new ATOM 0 HB ILE A 239 2.582 -9.211 -4.444 1.00 0.13 H new ATOM 0 HG12 ILE A 239 0.929 -9.479 -6.203 1.00 0.18 H new ATOM 0 HG13 ILE A 239 0.338 -10.190 -4.714 1.00 0.18 H new ATOM 0 HG21 ILE A 239 1.032 -9.315 -2.538 1.00 0.25 H new ATOM 0 HG22 ILE A 239 2.155 -7.939 -2.423 1.00 0.25 H new ATOM 0 HG23 ILE A 239 0.467 -7.671 -2.921 1.00 0.25 H new ATOM 0 HD11 ILE A 239 -1.440 -8.988 -5.878 1.00 0.26 H new ATOM 0 HD12 ILE A 239 -1.080 -8.211 -4.317 1.00 0.26 H new ATOM 0 HD13 ILE A 239 -0.480 -7.490 -5.829 1.00 0.26 H new ATOM 1231 N LEU A 240 2.185 -5.434 -3.454 1.00 0.13 N ATOM 1232 CA LEU A 240 1.714 -4.263 -2.726 1.00 0.14 C ATOM 1233 C LEU A 240 1.389 -3.131 -3.694 1.00 0.14 C ATOM 1234 O LEU A 240 0.274 -2.613 -3.723 1.00 0.14 O ATOM 1235 CB LEU A 240 2.776 -3.800 -1.725 1.00 0.18 C ATOM 1236 CG LEU A 240 2.627 -4.345 -0.307 1.00 0.24 C ATOM 1237 CD1 LEU A 240 3.777 -3.867 0.553 1.00 0.45 C ATOM 1238 CD2 LEU A 240 1.308 -3.900 0.301 1.00 0.25 C ATOM 0 H LEU A 240 3.108 -5.760 -3.168 1.00 0.13 H new ATOM 0 HA LEU A 240 0.808 -4.535 -2.184 1.00 0.14 H new ATOM 0 HB2 LEU A 240 3.757 -4.087 -2.104 1.00 0.18 H new ATOM 0 HB3 LEU A 240 2.758 -2.711 -1.680 1.00 0.18 H new ATOM 0 HG LEU A 240 2.639 -5.434 -0.352 1.00 0.24 H new ATOM 0 HD11 LEU A 240 3.664 -4.260 1.563 1.00 0.45 H new ATOM 0 HD12 LEU A 240 4.718 -4.219 0.130 1.00 0.45 H new ATOM 0 HD13 LEU A 240 3.779 -2.777 0.586 1.00 0.45 H new ATOM 0 HD21 LEU A 240 1.220 -4.299 1.312 1.00 0.25 H new ATOM 0 HD22 LEU A 240 1.272 -2.811 0.336 1.00 0.25 H new ATOM 0 HD23 LEU A 240 0.483 -4.271 -0.308 1.00 0.25 H new ATOM 1250 N TRP A 241 2.373 -2.787 -4.499 1.00 0.14 N ATOM 1251 CA TRP A 241 2.268 -1.698 -5.456 1.00 0.15 C ATOM 1252 C TRP A 241 1.118 -1.862 -6.434 1.00 0.15 C ATOM 1253 O TRP A 241 0.481 -0.891 -6.830 1.00 0.16 O ATOM 1254 CB TRP A 241 3.583 -1.607 -6.193 1.00 0.17 C ATOM 1255 CG TRP A 241 4.613 -1.091 -5.252 1.00 0.16 C ATOM 1256 CD1 TRP A 241 5.522 -1.821 -4.557 1.00 0.17 C ATOM 1257 CD2 TRP A 241 4.792 0.274 -4.845 1.00 0.16 C ATOM 1258 NE1 TRP A 241 6.257 -1.000 -3.748 1.00 0.17 N ATOM 1259 CE2 TRP A 241 5.839 0.290 -3.912 1.00 0.17 C ATOM 1260 CE3 TRP A 241 4.177 1.485 -5.185 1.00 0.18 C ATOM 1261 CZ2 TRP A 241 6.285 1.460 -3.311 1.00 0.18 C ATOM 1262 CZ3 TRP A 241 4.626 2.649 -4.592 1.00 0.19 C ATOM 1263 CH2 TRP A 241 5.672 2.628 -3.664 1.00 0.19 C ATOM 0 H TRP A 241 3.278 -3.258 -4.510 1.00 0.14 H new ATOM 0 HA TRP A 241 2.054 -0.779 -4.910 1.00 0.15 H new ATOM 0 HB2 TRP A 241 3.873 -2.586 -6.573 1.00 0.17 H new ATOM 0 HB3 TRP A 241 3.490 -0.945 -7.054 1.00 0.17 H new ATOM 0 HD1 TRP A 241 5.646 -2.891 -4.632 1.00 0.17 H new ATOM 0 HE1 TRP A 241 7.001 -1.303 -3.120 1.00 0.17 H new ATOM 0 HE3 TRP A 241 3.366 1.509 -5.898 1.00 0.18 H new ATOM 0 HZ2 TRP A 241 7.089 1.446 -2.590 1.00 0.18 H new ATOM 0 HZ3 TRP A 241 4.162 3.590 -4.849 1.00 0.19 H new ATOM 0 HH2 TRP A 241 6.002 3.554 -3.217 1.00 0.19 H new ATOM 1274 N SER A 242 0.872 -3.105 -6.810 1.00 0.15 N ATOM 1275 CA SER A 242 -0.186 -3.432 -7.753 1.00 0.15 C ATOM 1276 C SER A 242 -1.536 -2.987 -7.202 1.00 0.14 C ATOM 1277 O SER A 242 -2.332 -2.347 -7.893 1.00 0.14 O ATOM 1278 CB SER A 242 -0.191 -4.938 -8.011 1.00 0.16 C ATOM 1279 OG SER A 242 -1.160 -5.298 -8.983 1.00 0.24 O ATOM 0 H SER A 242 1.396 -3.913 -6.473 1.00 0.15 H new ATOM 0 HA SER A 242 -0.006 -2.908 -8.692 1.00 0.15 H new ATOM 0 HB2 SER A 242 0.797 -5.253 -8.347 1.00 0.16 H new ATOM 0 HB3 SER A 242 -0.395 -5.467 -7.080 1.00 0.16 H new ATOM 0 HG SER A 242 -1.136 -6.267 -9.126 1.00 0.24 H new ATOM 1285 N HIS A 243 -1.775 -3.308 -5.937 1.00 0.13 N ATOM 1286 CA HIS A 243 -2.992 -2.879 -5.265 1.00 0.13 C ATOM 1287 C HIS A 243 -2.967 -1.365 -5.081 1.00 0.13 C ATOM 1288 O HIS A 243 -4.000 -0.702 -5.096 1.00 0.13 O ATOM 1289 CB HIS A 243 -3.133 -3.589 -3.912 1.00 0.15 C ATOM 1290 CG HIS A 243 -4.279 -3.099 -3.074 1.00 0.15 C ATOM 1291 ND1 HIS A 243 -4.168 -3.014 -1.711 1.00 0.17 N ATOM 1292 CD2 HIS A 243 -5.516 -2.680 -3.444 1.00 0.15 C ATOM 1293 CE1 HIS A 243 -5.325 -2.551 -1.282 1.00 0.17 C ATOM 1294 NE2 HIS A 243 -6.175 -2.332 -2.293 1.00 0.17 N ATOM 0 H HIS A 243 -1.144 -3.862 -5.358 1.00 0.13 H new ATOM 0 HA HIS A 243 -3.854 -3.145 -5.877 1.00 0.13 H new ATOM 0 HB2 HIS A 243 -3.257 -4.658 -4.087 1.00 0.15 H new ATOM 0 HB3 HIS A 243 -2.207 -3.463 -3.350 1.00 0.15 H new ATOM 0 HD1 HIS A 243 -3.356 -3.259 -1.144 1.00 0.17 H new ATOM 0 HD2 HIS A 243 -5.906 -2.630 -4.450 1.00 0.15 H new ATOM 0 HE1 HIS A 243 -5.559 -2.371 -0.243 1.00 0.17 H new ATOM 1302 N LEU A 244 -1.769 -0.827 -4.951 1.00 0.13 N ATOM 1303 CA LEU A 244 -1.608 0.599 -4.735 1.00 0.12 C ATOM 1304 C LEU A 244 -1.958 1.376 -6.002 1.00 0.13 C ATOM 1305 O LEU A 244 -2.595 2.432 -5.932 1.00 0.12 O ATOM 1306 CB LEU A 244 -0.199 0.937 -4.248 1.00 0.13 C ATOM 1307 CG LEU A 244 0.079 2.430 -4.100 1.00 0.15 C ATOM 1308 CD1 LEU A 244 -1.035 3.092 -3.309 1.00 0.17 C ATOM 1309 CD2 LEU A 244 1.417 2.657 -3.422 1.00 0.17 C ATOM 0 H LEU A 244 -0.896 -1.353 -4.991 1.00 0.13 H new ATOM 0 HA LEU A 244 -2.301 0.900 -3.949 1.00 0.12 H new ATOM 0 HB2 LEU A 244 -0.035 0.453 -3.285 1.00 0.13 H new ATOM 0 HB3 LEU A 244 0.524 0.513 -4.945 1.00 0.13 H new ATOM 0 HG LEU A 244 0.118 2.878 -5.093 1.00 0.15 H new ATOM 0 HD11 LEU A 244 -0.827 4.157 -3.209 1.00 0.17 H new ATOM 0 HD12 LEU A 244 -1.982 2.955 -3.830 1.00 0.17 H new ATOM 0 HD13 LEU A 244 -1.097 2.640 -2.319 1.00 0.17 H new ATOM 0 HD21 LEU A 244 1.599 3.727 -3.325 1.00 0.17 H new ATOM 0 HD22 LEU A 244 1.406 2.200 -2.433 1.00 0.17 H new ATOM 0 HD23 LEU A 244 2.209 2.207 -4.021 1.00 0.17 H new ATOM 1321 N GLU A 245 -1.537 0.863 -7.155 1.00 0.15 N ATOM 1322 CA GLU A 245 -1.964 1.435 -8.426 1.00 0.18 C ATOM 1323 C GLU A 245 -3.485 1.486 -8.465 1.00 0.17 C ATOM 1324 O GLU A 245 -4.078 2.517 -8.751 1.00 0.21 O ATOM 1325 CB GLU A 245 -1.436 0.620 -9.614 1.00 0.25 C ATOM 1326 CG GLU A 245 0.074 0.447 -9.638 1.00 0.34 C ATOM 1327 CD GLU A 245 0.543 -0.351 -10.840 1.00 0.59 C ATOM 1328 OE1 GLU A 245 0.807 0.267 -11.894 1.00 0.83 O ATOM 1329 OE2 GLU A 245 0.640 -1.594 -10.742 1.00 0.76 O ATOM 0 H GLU A 245 -0.909 0.063 -7.235 1.00 0.15 H new ATOM 0 HA GLU A 245 -1.554 2.442 -8.507 1.00 0.18 H new ATOM 0 HB2 GLU A 245 -1.902 -0.365 -9.598 1.00 0.25 H new ATOM 0 HB3 GLU A 245 -1.748 1.105 -10.539 1.00 0.25 H new ATOM 0 HG2 GLU A 245 0.550 1.428 -9.648 1.00 0.34 H new ATOM 0 HG3 GLU A 245 0.395 -0.054 -8.725 1.00 0.34 H new ATOM 1336 N LEU A 246 -4.094 0.373 -8.097 1.00 0.16 N ATOM 1337 CA LEU A 246 -5.546 0.240 -8.110 1.00 0.16 C ATOM 1338 C LEU A 246 -6.199 1.160 -7.078 1.00 0.16 C ATOM 1339 O LEU A 246 -7.300 1.656 -7.298 1.00 0.17 O ATOM 1340 CB LEU A 246 -5.941 -1.213 -7.856 1.00 0.17 C ATOM 1341 CG LEU A 246 -7.418 -1.536 -8.067 1.00 0.21 C ATOM 1342 CD1 LEU A 246 -7.750 -1.515 -9.548 1.00 0.30 C ATOM 1343 CD2 LEU A 246 -7.757 -2.887 -7.462 1.00 0.22 C ATOM 0 H LEU A 246 -3.602 -0.463 -7.781 1.00 0.16 H new ATOM 0 HA LEU A 246 -5.905 0.540 -9.095 1.00 0.16 H new ATOM 0 HB2 LEU A 246 -5.349 -1.853 -8.511 1.00 0.17 H new ATOM 0 HB3 LEU A 246 -5.673 -1.471 -6.832 1.00 0.17 H new ATOM 0 HG LEU A 246 -8.018 -0.777 -7.565 1.00 0.21 H new ATOM 0 HD11 LEU A 246 -8.806 -1.747 -9.687 1.00 0.30 H new ATOM 0 HD12 LEU A 246 -7.539 -0.526 -9.954 1.00 0.30 H new ATOM 0 HD13 LEU A 246 -7.144 -2.257 -10.067 1.00 0.30 H new ATOM 0 HD21 LEU A 246 -8.814 -3.102 -7.621 1.00 0.22 H new ATOM 0 HD22 LEU A 246 -7.154 -3.660 -7.937 1.00 0.22 H new ATOM 0 HD23 LEU A 246 -7.547 -2.870 -6.392 1.00 0.22 H new ATOM 1355 N LEU A 247 -5.520 1.390 -5.971 1.00 0.17 N ATOM 1356 CA LEU A 247 -5.959 2.379 -4.991 1.00 0.16 C ATOM 1357 C LEU A 247 -6.044 3.776 -5.612 1.00 0.17 C ATOM 1358 O LEU A 247 -7.128 4.351 -5.703 1.00 0.19 O ATOM 1359 CB LEU A 247 -5.014 2.406 -3.785 1.00 0.15 C ATOM 1360 CG LEU A 247 -5.121 1.211 -2.834 1.00 0.15 C ATOM 1361 CD1 LEU A 247 -3.994 1.242 -1.818 1.00 0.15 C ATOM 1362 CD2 LEU A 247 -6.465 1.212 -2.122 1.00 0.19 C ATOM 0 H LEU A 247 -4.657 0.906 -5.722 1.00 0.17 H new ATOM 0 HA LEU A 247 -6.954 2.087 -4.656 1.00 0.16 H new ATOM 0 HB2 LEU A 247 -3.989 2.466 -4.151 1.00 0.15 H new ATOM 0 HB3 LEU A 247 -5.204 3.317 -3.218 1.00 0.15 H new ATOM 0 HG LEU A 247 -5.040 0.297 -3.423 1.00 0.15 H new ATOM 0 HD11 LEU A 247 -4.084 0.386 -1.149 1.00 0.15 H new ATOM 0 HD12 LEU A 247 -3.036 1.199 -2.336 1.00 0.15 H new ATOM 0 HD13 LEU A 247 -4.052 2.163 -1.238 1.00 0.15 H new ATOM 0 HD21 LEU A 247 -6.522 0.355 -1.451 1.00 0.19 H new ATOM 0 HD22 LEU A 247 -6.571 2.132 -1.546 1.00 0.19 H new ATOM 0 HD23 LEU A 247 -7.267 1.150 -2.858 1.00 0.19 H new ATOM 1374 N ARG A 248 -4.931 4.310 -6.069 1.00 0.18 N ATOM 1375 CA ARG A 248 -4.925 5.702 -6.512 1.00 0.22 C ATOM 1376 C ARG A 248 -5.617 5.884 -7.870 1.00 0.23 C ATOM 1377 O ARG A 248 -6.029 6.986 -8.219 1.00 0.36 O ATOM 1378 CB ARG A 248 -3.508 6.274 -6.523 1.00 0.25 C ATOM 1379 CG ARG A 248 -2.611 5.766 -7.640 1.00 0.28 C ATOM 1380 CD ARG A 248 -1.242 6.432 -7.572 1.00 0.27 C ATOM 1381 NE ARG A 248 -1.332 7.803 -7.056 1.00 1.21 N ATOM 1382 CZ ARG A 248 -0.437 8.763 -7.283 1.00 1.50 C ATOM 1383 NH1 ARG A 248 0.637 8.526 -8.024 1.00 1.09 N ATOM 1384 NH2 ARG A 248 -0.617 9.960 -6.737 1.00 2.49 N ATOM 0 H ARG A 248 -4.038 3.824 -6.146 1.00 0.18 H new ATOM 0 HA ARG A 248 -5.508 6.269 -5.786 1.00 0.22 H new ATOM 0 HB2 ARG A 248 -3.573 7.360 -6.597 1.00 0.25 H new ATOM 0 HB3 ARG A 248 -3.035 6.047 -5.568 1.00 0.25 H new ATOM 0 HG2 ARG A 248 -2.500 4.685 -7.561 1.00 0.28 H new ATOM 0 HG3 ARG A 248 -3.073 5.969 -8.606 1.00 0.28 H new ATOM 0 HD2 ARG A 248 -0.583 5.845 -6.933 1.00 0.27 H new ATOM 0 HD3 ARG A 248 -0.794 6.445 -8.565 1.00 0.27 H new ATOM 0 HE ARG A 248 -2.141 8.038 -6.480 1.00 1.21 H new ATOM 0 HH11 ARG A 248 0.785 7.601 -8.427 1.00 1.09 H new ATOM 0 HH12 ARG A 248 1.316 9.269 -8.191 1.00 1.09 H new ATOM 0 HH21 ARG A 248 -1.433 10.136 -6.151 1.00 2.49 H new ATOM 0 HH22 ARG A 248 0.061 10.704 -6.903 1.00 2.49 H new ATOM 1398 N LYS A 249 -5.764 4.804 -8.618 1.00 0.21 N ATOM 1399 CA LYS A 249 -6.537 4.823 -9.862 1.00 0.25 C ATOM 1400 C LYS A 249 -8.035 4.863 -9.581 1.00 0.20 C ATOM 1401 O LYS A 249 -8.813 5.412 -10.361 1.00 0.25 O ATOM 1402 CB LYS A 249 -6.223 3.588 -10.710 1.00 0.33 C ATOM 1403 CG LYS A 249 -4.832 3.615 -11.324 1.00 0.44 C ATOM 1404 CD LYS A 249 -4.640 4.809 -12.249 1.00 1.04 C ATOM 1405 CE LYS A 249 -5.525 4.715 -13.481 1.00 1.12 C ATOM 1406 NZ LYS A 249 -5.253 3.480 -14.261 1.00 1.32 N ATOM 0 H LYS A 249 -5.359 3.896 -8.390 1.00 0.21 H new ATOM 0 HA LYS A 249 -6.254 5.724 -10.406 1.00 0.25 H new ATOM 0 HB2 LYS A 249 -6.321 2.696 -10.091 1.00 0.33 H new ATOM 0 HB3 LYS A 249 -6.962 3.506 -11.507 1.00 0.33 H new ATOM 0 HG2 LYS A 249 -4.086 3.648 -10.530 1.00 0.44 H new ATOM 0 HG3 LYS A 249 -4.664 2.694 -11.882 1.00 0.44 H new ATOM 0 HD2 LYS A 249 -4.866 5.728 -11.708 1.00 1.04 H new ATOM 0 HD3 LYS A 249 -3.596 4.868 -12.555 1.00 1.04 H new ATOM 0 HE2 LYS A 249 -6.572 4.731 -13.179 1.00 1.12 H new ATOM 0 HE3 LYS A 249 -5.362 5.588 -14.113 1.00 1.12 H new ATOM 0 HZ1 LYS A 249 -5.633 3.586 -15.223 1.00 1.32 H new ATOM 0 HZ2 LYS A 249 -4.227 3.319 -14.310 1.00 1.32 H new ATOM 0 HZ3 LYS A 249 -5.709 2.669 -13.797 1.00 1.32 H new