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 190 SER OG : rot 180:sc= -0.0328 USER MOD Set 1.2: A 191 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 173 TYR OH : rot 0:sc= -1.4 USER MOD Single : A 175 LYS NZ :NH3+ -165:sc= -0.0176 (180deg=-0.191) USER MOD Single : A 177 GLN : amide:sc= -3.69! C(o=-3.7!,f=-3.3!) USER MOD Single : A 184 TYR OH : rot -99:sc= -3.45! USER MOD Single : A 188 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 193 GLN : amide:sc= -1.59 X(o=-1.6,f=-2.1) USER MOD Single : A 196 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-0.36) USER MOD Single : A 202 MET CE :methyl -132:sc= -2.96! (180deg=-3.24!) USER MOD Single : A 203 LYS NZ :NH3+ -161:sc= -0.0936 (180deg=-0.459) USER MOD Single : A 206 SER OG : rot 19:sc= 0.601 USER MOD Single : A 207 MET CE :methyl 132:sc= -1.49 (180deg=-1.8) USER MOD Single : A 213 THR OG1 : rot 180:sc= 0 USER MOD Single : A 214 THR OG1 : rot 180:sc= -0.374 USER MOD Single : A 216 ASN : amide:sc= -1.51! K(o=-1.5!,f=-0.12) USER MOD Single : A 218 SER OG : rot 180:sc= 0 USER MOD Single : A 223 CYS SG : rot -24:sc= -0.123 USER MOD Single : A 224 SER OG : rot 92:sc= 1.24 USER MOD Single : A 226 ASN : amide:sc= -1.63! C(o=-1.6!,f=-1.3!) USER MOD Single : A 227 GLN : amide:sc= 0.823 K(o=0.82,f=-0.47) USER MOD Single : A 232 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.015) USER MOD Single : A 242 SER OG : rot 180:sc= 0 USER MOD Single : A 243 HIS : no HE2:sc= -2.98! C(o=-3!,f=-6.1!) USER MOD Single : A 249 LYS NZ :NH3+ -165:sc= -0.016 (180deg=-0.233) USER MOD ----------------------------------------------------------------- ATOM 55 N ALA A 168 -10.534 -7.646 -5.160 1.00 0.41 N ATOM 56 CA ALA A 168 -10.273 -8.635 -4.110 1.00 0.40 C ATOM 57 C ALA A 168 -9.531 -8.010 -2.934 1.00 0.31 C ATOM 58 O ALA A 168 -9.969 -8.104 -1.787 1.00 0.35 O ATOM 59 CB ALA A 168 -9.479 -9.806 -4.671 1.00 0.53 C ATOM 0 HA ALA A 168 -11.234 -9.000 -3.747 1.00 0.40 H new ATOM 0 HB1 ALA A 168 -9.293 -10.532 -3.879 1.00 0.53 H new ATOM 0 HB2 ALA A 168 -10.046 -10.280 -5.472 1.00 0.53 H new ATOM 0 HB3 ALA A 168 -8.528 -9.446 -5.064 1.00 0.53 H new ATOM 65 N ALA A 169 -8.416 -7.359 -3.225 1.00 0.28 N ATOM 66 CA ALA A 169 -7.650 -6.678 -2.193 1.00 0.24 C ATOM 67 C ALA A 169 -8.191 -5.273 -1.961 1.00 0.20 C ATOM 68 O ALA A 169 -8.048 -4.709 -0.874 1.00 0.19 O ATOM 69 CB ALA A 169 -6.179 -6.621 -2.578 1.00 0.31 C ATOM 0 H ALA A 169 -8.022 -7.288 -4.163 1.00 0.28 H new ATOM 0 HA ALA A 169 -7.747 -7.241 -1.265 1.00 0.24 H new ATOM 0 HB1 ALA A 169 -5.618 -6.109 -1.796 1.00 0.31 H new ATOM 0 HB2 ALA A 169 -5.794 -7.634 -2.696 1.00 0.31 H new ATOM 0 HB3 ALA A 169 -6.070 -6.079 -3.518 1.00 0.31 H new ATOM 75 N LEU A 170 -8.846 -4.726 -2.979 1.00 0.21 N ATOM 76 CA LEU A 170 -9.272 -3.335 -2.948 1.00 0.19 C ATOM 77 C LEU A 170 -10.396 -3.106 -1.955 1.00 0.16 C ATOM 78 O LEU A 170 -10.233 -2.342 -1.007 1.00 0.17 O ATOM 79 CB LEU A 170 -9.719 -2.853 -4.324 1.00 0.23 C ATOM 80 CG LEU A 170 -9.962 -1.347 -4.404 1.00 0.26 C ATOM 81 CD1 LEU A 170 -8.646 -0.604 -4.550 1.00 0.29 C ATOM 82 CD2 LEU A 170 -10.910 -1.005 -5.539 1.00 0.29 C ATOM 0 H LEU A 170 -9.092 -5.225 -3.834 1.00 0.21 H new ATOM 0 HA LEU A 170 -8.401 -2.761 -2.632 1.00 0.19 H new ATOM 0 HB2 LEU A 170 -8.962 -3.128 -5.058 1.00 0.23 H new ATOM 0 HB3 LEU A 170 -10.636 -3.374 -4.601 1.00 0.23 H new ATOM 0 HG LEU A 170 -10.433 -1.028 -3.474 1.00 0.26 H new ATOM 0 HD11 LEU A 170 -8.837 0.468 -4.606 1.00 0.29 H new ATOM 0 HD12 LEU A 170 -8.012 -0.815 -3.689 1.00 0.29 H new ATOM 0 HD13 LEU A 170 -8.143 -0.930 -5.460 1.00 0.29 H new ATOM 0 HD21 LEU A 170 -11.064 0.074 -5.572 1.00 0.29 H new ATOM 0 HD22 LEU A 170 -10.482 -1.339 -6.484 1.00 0.29 H new ATOM 0 HD23 LEU A 170 -11.866 -1.504 -5.378 1.00 0.29 H new ATOM 94 N GLU A 171 -11.535 -3.762 -2.165 1.00 0.19 N ATOM 95 CA GLU A 171 -12.698 -3.539 -1.312 1.00 0.24 C ATOM 96 C GLU A 171 -12.391 -3.961 0.117 1.00 0.22 C ATOM 97 O GLU A 171 -12.951 -3.419 1.066 1.00 0.26 O ATOM 98 CB GLU A 171 -13.924 -4.292 -1.834 1.00 0.36 C ATOM 99 CG GLU A 171 -13.737 -5.793 -1.896 1.00 1.00 C ATOM 100 CD GLU A 171 -15.030 -6.526 -2.176 1.00 1.16 C ATOM 101 OE1 GLU A 171 -15.764 -6.833 -1.217 1.00 1.46 O ATOM 102 OE2 GLU A 171 -15.318 -6.802 -3.362 1.00 1.10 O ATOM 0 H GLU A 171 -11.676 -4.445 -2.910 1.00 0.19 H new ATOM 0 HA GLU A 171 -12.926 -2.473 -1.328 1.00 0.24 H new ATOM 0 HB2 GLU A 171 -14.777 -4.067 -1.194 1.00 0.36 H new ATOM 0 HB3 GLU A 171 -14.168 -3.924 -2.831 1.00 0.36 H new ATOM 0 HG2 GLU A 171 -13.011 -6.034 -2.673 1.00 1.00 H new ATOM 0 HG3 GLU A 171 -13.321 -6.144 -0.951 1.00 1.00 H new ATOM 109 N GLY A 172 -11.480 -4.916 0.256 1.00 0.19 N ATOM 110 CA GLY A 172 -11.040 -5.328 1.566 1.00 0.22 C ATOM 111 C GLY A 172 -10.334 -4.208 2.298 1.00 0.19 C ATOM 112 O GLY A 172 -10.680 -3.886 3.438 1.00 0.22 O ATOM 0 H GLY A 172 -11.040 -5.411 -0.520 1.00 0.19 H new ATOM 0 HA2 GLY A 172 -11.898 -5.660 2.150 1.00 0.22 H new ATOM 0 HA3 GLY A 172 -10.369 -6.181 1.472 1.00 0.22 H new ATOM 116 N TYR A 173 -9.344 -3.598 1.650 1.00 0.17 N ATOM 117 CA TYR A 173 -8.599 -2.520 2.273 1.00 0.16 C ATOM 118 C TYR A 173 -9.443 -1.253 2.343 1.00 0.16 C ATOM 119 O TYR A 173 -9.371 -0.529 3.322 1.00 0.18 O ATOM 120 CB TYR A 173 -7.284 -2.254 1.538 1.00 0.17 C ATOM 121 CG TYR A 173 -6.408 -1.243 2.244 1.00 0.16 C ATOM 122 CD1 TYR A 173 -6.169 -1.343 3.610 1.00 0.19 C ATOM 123 CD2 TYR A 173 -5.833 -0.185 1.553 1.00 0.17 C ATOM 124 CE1 TYR A 173 -5.389 -0.415 4.267 1.00 0.20 C ATOM 125 CE2 TYR A 173 -5.045 0.743 2.205 1.00 0.20 C ATOM 126 CZ TYR A 173 -4.829 0.624 3.562 1.00 0.19 C ATOM 127 OH TYR A 173 -4.061 1.556 4.217 1.00 0.24 O ATOM 0 H TYR A 173 -9.045 -3.833 0.703 1.00 0.17 H new ATOM 0 HA TYR A 173 -8.355 -2.829 3.289 1.00 0.16 H new ATOM 0 HB2 TYR A 173 -6.737 -3.191 1.433 1.00 0.17 H new ATOM 0 HB3 TYR A 173 -7.502 -1.898 0.531 1.00 0.17 H new ATOM 0 HD1 TYR A 173 -6.602 -2.162 4.166 1.00 0.19 H new ATOM 0 HD2 TYR A 173 -6.004 -0.086 0.491 1.00 0.17 H new ATOM 0 HE1 TYR A 173 -5.219 -0.504 5.330 1.00 0.20 H new ATOM 0 HE2 TYR A 173 -4.600 1.559 1.655 1.00 0.20 H new ATOM 0 HH TYR A 173 -4.017 1.332 5.170 1.00 0.24 H new ATOM 137 N ARG A 174 -10.241 -0.978 1.312 1.00 0.18 N ATOM 138 CA ARG A 174 -11.190 0.134 1.351 1.00 0.23 C ATOM 139 C ARG A 174 -12.143 -0.008 2.531 1.00 0.23 C ATOM 140 O ARG A 174 -12.433 0.984 3.200 1.00 0.25 O ATOM 141 CB ARG A 174 -11.994 0.245 0.054 1.00 0.31 C ATOM 142 CG ARG A 174 -13.068 1.321 0.122 1.00 0.93 C ATOM 143 CD ARG A 174 -13.901 1.392 -1.145 1.00 0.74 C ATOM 144 NE ARG A 174 -14.988 2.361 -1.009 1.00 1.05 N ATOM 145 CZ ARG A 174 -15.388 3.190 -1.974 1.00 1.35 C ATOM 146 NH1 ARG A 174 -14.801 3.169 -3.167 1.00 1.31 N ATOM 147 NH2 ARG A 174 -16.382 4.036 -1.742 1.00 2.09 N ATOM 0 H ARG A 174 -10.249 -1.509 0.441 1.00 0.18 H new ATOM 0 HA ARG A 174 -10.604 1.046 1.467 1.00 0.23 H new ATOM 0 HB2 ARG A 174 -11.317 0.464 -0.771 1.00 0.31 H new ATOM 0 HB3 ARG A 174 -12.461 -0.716 -0.163 1.00 0.31 H new ATOM 0 HG2 ARG A 174 -13.721 1.124 0.972 1.00 0.93 H new ATOM 0 HG3 ARG A 174 -12.598 2.288 0.299 1.00 0.93 H new ATOM 0 HD2 ARG A 174 -13.266 1.670 -1.986 1.00 0.74 H new ATOM 0 HD3 ARG A 174 -14.313 0.408 -1.368 1.00 0.74 H new ATOM 0 HE ARG A 174 -15.474 2.406 -0.113 1.00 1.05 H new ATOM 0 HH11 ARG A 174 -14.039 2.516 -3.349 1.00 1.31 H new ATOM 0 HH12 ARG A 174 -15.113 3.806 -3.900 1.00 1.31 H new ATOM 0 HH21 ARG A 174 -16.837 4.051 -0.829 1.00 2.09 H new ATOM 0 HH22 ARG A 174 -16.692 4.672 -2.476 1.00 2.09 H new ATOM 161 N LYS A 175 -12.604 -1.215 2.814 1.00 0.22 N ATOM 162 CA LYS A 175 -13.459 -1.429 3.977 1.00 0.25 C ATOM 163 C LYS A 175 -12.690 -1.123 5.267 1.00 0.24 C ATOM 164 O LYS A 175 -13.288 -0.830 6.305 1.00 0.29 O ATOM 165 CB LYS A 175 -14.021 -2.855 3.970 1.00 0.26 C ATOM 166 CG LYS A 175 -14.840 -3.223 5.196 1.00 0.89 C ATOM 167 CD LYS A 175 -15.599 -4.517 4.969 1.00 0.84 C ATOM 168 CE LYS A 175 -16.146 -5.083 6.266 1.00 1.71 C ATOM 169 NZ LYS A 175 -15.067 -5.610 7.141 1.00 2.34 N ATOM 0 H LYS A 175 -12.406 -2.052 2.266 1.00 0.22 H new ATOM 0 HA LYS A 175 -14.305 -0.744 3.930 1.00 0.25 H new ATOM 0 HB2 LYS A 175 -14.643 -2.981 3.084 1.00 0.26 H new ATOM 0 HB3 LYS A 175 -13.192 -3.557 3.880 1.00 0.26 H new ATOM 0 HG2 LYS A 175 -14.183 -3.328 6.059 1.00 0.89 H new ATOM 0 HG3 LYS A 175 -15.541 -2.420 5.425 1.00 0.89 H new ATOM 0 HD2 LYS A 175 -16.420 -4.340 4.275 1.00 0.84 H new ATOM 0 HD3 LYS A 175 -14.939 -5.249 4.503 1.00 0.84 H new ATOM 0 HE2 LYS A 175 -16.697 -4.306 6.797 1.00 1.71 H new ATOM 0 HE3 LYS A 175 -16.855 -5.881 6.043 1.00 1.71 H new ATOM 0 HZ1 LYS A 175 -15.483 -6.207 7.884 1.00 2.34 H new ATOM 0 HZ2 LYS A 175 -14.405 -6.176 6.573 1.00 2.34 H new ATOM 0 HZ3 LYS A 175 -14.557 -4.817 7.579 1.00 2.34 H new ATOM 183 N GLU A 176 -11.363 -1.163 5.184 1.00 0.20 N ATOM 184 CA GLU A 176 -10.516 -0.774 6.299 1.00 0.18 C ATOM 185 C GLU A 176 -10.358 0.748 6.310 1.00 0.20 C ATOM 186 O GLU A 176 -10.622 1.412 7.313 1.00 0.44 O ATOM 187 CB GLU A 176 -9.134 -1.435 6.185 1.00 0.19 C ATOM 188 CG GLU A 176 -8.316 -1.370 7.463 1.00 0.24 C ATOM 189 CD GLU A 176 -8.927 -2.201 8.573 1.00 0.34 C ATOM 190 OE1 GLU A 176 -9.170 -3.405 8.361 1.00 0.70 O ATOM 191 OE2 GLU A 176 -9.147 -1.655 9.676 1.00 0.69 O ATOM 0 H GLU A 176 -10.854 -1.462 4.353 1.00 0.20 H new ATOM 0 HA GLU A 176 -10.983 -1.104 7.227 1.00 0.18 H new ATOM 0 HB2 GLU A 176 -9.263 -2.479 5.900 1.00 0.19 H new ATOM 0 HB3 GLU A 176 -8.576 -0.953 5.383 1.00 0.19 H new ATOM 0 HG2 GLU A 176 -7.304 -1.721 7.263 1.00 0.24 H new ATOM 0 HG3 GLU A 176 -8.235 -0.333 7.789 1.00 0.24 H new ATOM 198 N GLN A 177 -9.937 1.280 5.161 1.00 0.29 N ATOM 199 CA GLN A 177 -9.686 2.708 4.975 1.00 0.22 C ATOM 200 C GLN A 177 -10.858 3.574 5.407 1.00 0.25 C ATOM 201 O GLN A 177 -10.706 4.421 6.276 1.00 0.25 O ATOM 202 CB GLN A 177 -9.381 3.006 3.506 1.00 0.21 C ATOM 203 CG GLN A 177 -8.245 2.185 2.931 1.00 0.20 C ATOM 204 CD GLN A 177 -7.937 2.546 1.492 1.00 0.22 C ATOM 205 OE1 GLN A 177 -8.516 1.988 0.564 1.00 0.24 O ATOM 206 NE2 GLN A 177 -7.013 3.471 1.296 1.00 0.24 N ATOM 0 H GLN A 177 -9.759 0.724 4.325 1.00 0.29 H new ATOM 0 HA GLN A 177 -8.831 2.952 5.606 1.00 0.22 H new ATOM 0 HB2 GLN A 177 -10.280 2.826 2.916 1.00 0.21 H new ATOM 0 HB3 GLN A 177 -9.139 4.064 3.404 1.00 0.21 H new ATOM 0 HG2 GLN A 177 -7.352 2.332 3.538 1.00 0.20 H new ATOM 0 HG3 GLN A 177 -8.500 1.127 2.990 1.00 0.20 H new ATOM 0 HE21 GLN A 177 -6.555 3.911 2.094 1.00 0.24 H new ATOM 0 HE22 GLN A 177 -6.758 3.744 0.347 1.00 0.24 H new ATOM 215 N GLU A 178 -12.021 3.359 4.807 1.00 0.27 N ATOM 216 CA GLU A 178 -13.158 4.252 5.028 1.00 0.31 C ATOM 217 C GLU A 178 -13.596 4.273 6.494 1.00 0.33 C ATOM 218 O GLU A 178 -14.152 5.263 6.969 1.00 0.36 O ATOM 219 CB GLU A 178 -14.334 3.881 4.117 1.00 0.35 C ATOM 220 CG GLU A 178 -14.832 2.457 4.281 1.00 0.39 C ATOM 221 CD GLU A 178 -15.986 2.145 3.353 1.00 0.46 C ATOM 222 OE1 GLU A 178 -15.747 1.981 2.141 1.00 0.41 O ATOM 223 OE2 GLU A 178 -17.136 2.051 3.831 1.00 0.71 O ATOM 0 H GLU A 178 -12.205 2.584 4.170 1.00 0.27 H new ATOM 0 HA GLU A 178 -12.827 5.259 4.773 1.00 0.31 H new ATOM 0 HB2 GLU A 178 -15.159 4.566 4.313 1.00 0.35 H new ATOM 0 HB3 GLU A 178 -14.035 4.031 3.080 1.00 0.35 H new ATOM 0 HG2 GLU A 178 -14.014 1.763 4.087 1.00 0.39 H new ATOM 0 HG3 GLU A 178 -15.145 2.300 5.313 1.00 0.39 H new ATOM 230 N ARG A 179 -13.336 3.184 7.206 1.00 0.34 N ATOM 231 CA ARG A 179 -13.703 3.083 8.614 1.00 0.40 C ATOM 232 C ARG A 179 -12.631 3.712 9.514 1.00 0.35 C ATOM 233 O ARG A 179 -12.819 3.850 10.723 1.00 0.38 O ATOM 234 CB ARG A 179 -13.901 1.613 8.990 1.00 0.48 C ATOM 235 CG ARG A 179 -14.496 1.410 10.371 1.00 0.65 C ATOM 236 CD ARG A 179 -14.500 -0.053 10.762 1.00 0.83 C ATOM 237 NE ARG A 179 -15.131 -0.266 12.062 1.00 1.03 N ATOM 238 CZ ARG A 179 -14.600 -1.005 13.036 1.00 1.80 C ATOM 239 NH1 ARG A 179 -13.407 -1.571 12.874 1.00 2.15 N ATOM 240 NH2 ARG A 179 -15.257 -1.166 14.178 1.00 2.55 N ATOM 0 H ARG A 179 -12.872 2.357 6.832 1.00 0.34 H new ATOM 0 HA ARG A 179 -14.634 3.629 8.765 1.00 0.40 H new ATOM 0 HB2 ARG A 179 -14.551 1.143 8.252 1.00 0.48 H new ATOM 0 HB3 ARG A 179 -12.940 1.102 8.940 1.00 0.48 H new ATOM 0 HG2 ARG A 179 -13.925 1.982 11.102 1.00 0.65 H new ATOM 0 HG3 ARG A 179 -15.515 1.796 10.390 1.00 0.65 H new ATOM 0 HD2 ARG A 179 -15.028 -0.630 10.003 1.00 0.83 H new ATOM 0 HD3 ARG A 179 -13.476 -0.424 10.790 1.00 0.83 H new ATOM 0 HE ARG A 179 -16.033 0.178 12.235 1.00 1.03 H new ATOM 0 HH11 ARG A 179 -12.895 -1.440 12.002 1.00 2.15 H new ATOM 0 HH12 ARG A 179 -13.005 -2.136 13.622 1.00 2.15 H new ATOM 0 HH21 ARG A 179 -16.167 -0.725 14.309 1.00 2.55 H new ATOM 0 HH22 ARG A 179 -14.852 -1.731 14.924 1.00 2.55 H new ATOM 254 N LEU A 180 -11.514 4.096 8.916 1.00 0.30 N ATOM 255 CA LEU A 180 -10.379 4.649 9.659 1.00 0.28 C ATOM 256 C LEU A 180 -9.960 6.011 9.108 1.00 0.25 C ATOM 257 O LEU A 180 -9.148 6.709 9.715 1.00 0.24 O ATOM 258 CB LEU A 180 -9.181 3.693 9.603 1.00 0.28 C ATOM 259 CG LEU A 180 -9.410 2.303 10.205 1.00 0.33 C ATOM 260 CD1 LEU A 180 -8.142 1.471 10.106 1.00 0.35 C ATOM 261 CD2 LEU A 180 -9.860 2.410 11.655 1.00 0.38 C ATOM 0 H LEU A 180 -11.363 4.036 7.909 1.00 0.30 H new ATOM 0 HA LEU A 180 -10.700 4.774 10.693 1.00 0.28 H new ATOM 0 HB2 LEU A 180 -8.884 3.573 8.561 1.00 0.28 H new ATOM 0 HB3 LEU A 180 -8.343 4.159 10.121 1.00 0.28 H new ATOM 0 HG LEU A 180 -10.199 1.810 9.638 1.00 0.33 H new ATOM 0 HD11 LEU A 180 -8.319 0.486 10.537 1.00 0.35 H new ATOM 0 HD12 LEU A 180 -7.858 1.363 9.059 1.00 0.35 H new ATOM 0 HD13 LEU A 180 -7.338 1.967 10.650 1.00 0.35 H new ATOM 0 HD21 LEU A 180 -10.017 1.411 12.062 1.00 0.38 H new ATOM 0 HD22 LEU A 180 -9.094 2.923 12.237 1.00 0.38 H new ATOM 0 HD23 LEU A 180 -10.792 2.973 11.706 1.00 0.38 H new ATOM 273 N GLY A 181 -10.497 6.380 7.956 1.00 0.24 N ATOM 274 CA GLY A 181 -10.182 7.667 7.372 1.00 0.22 C ATOM 275 C GLY A 181 -8.980 7.599 6.450 1.00 0.18 C ATOM 276 O GLY A 181 -8.574 8.606 5.875 1.00 0.18 O ATOM 0 H GLY A 181 -11.147 5.810 7.414 1.00 0.24 H new ATOM 0 HA2 GLY A 181 -11.045 8.032 6.815 1.00 0.22 H new ATOM 0 HA3 GLY A 181 -9.988 8.387 8.167 1.00 0.22 H new ATOM 280 N ILE A 182 -8.414 6.404 6.315 1.00 0.17 N ATOM 281 CA ILE A 182 -7.212 6.198 5.511 1.00 0.16 C ATOM 282 C ILE A 182 -7.455 6.601 4.057 1.00 0.15 C ATOM 283 O ILE A 182 -8.404 6.130 3.424 1.00 0.17 O ATOM 284 CB ILE A 182 -6.752 4.723 5.556 1.00 0.17 C ATOM 285 CG1 ILE A 182 -6.543 4.274 7.007 1.00 0.20 C ATOM 286 CG2 ILE A 182 -5.474 4.531 4.748 1.00 0.19 C ATOM 287 CD1 ILE A 182 -6.172 2.813 7.147 1.00 0.22 C ATOM 0 H ILE A 182 -8.771 5.556 6.756 1.00 0.17 H new ATOM 0 HA ILE A 182 -6.429 6.826 5.936 1.00 0.16 H new ATOM 0 HB ILE A 182 -7.532 4.106 5.110 1.00 0.17 H new ATOM 0 HG12 ILE A 182 -5.759 4.883 7.457 1.00 0.20 H new ATOM 0 HG13 ILE A 182 -7.456 4.463 7.571 1.00 0.20 H new ATOM 0 HG21 ILE A 182 -5.168 3.486 4.794 1.00 0.19 H new ATOM 0 HG22 ILE A 182 -5.654 4.812 3.710 1.00 0.19 H new ATOM 0 HG23 ILE A 182 -4.684 5.158 5.162 1.00 0.19 H new ATOM 0 HD11 ILE A 182 -6.041 2.570 8.202 1.00 0.22 H new ATOM 0 HD12 ILE A 182 -6.966 2.194 6.728 1.00 0.22 H new ATOM 0 HD13 ILE A 182 -5.242 2.621 6.612 1.00 0.22 H new ATOM 299 N PRO A 183 -6.604 7.484 3.513 1.00 0.14 N ATOM 300 CA PRO A 183 -6.728 7.941 2.134 1.00 0.15 C ATOM 301 C PRO A 183 -6.341 6.855 1.141 1.00 0.14 C ATOM 302 O PRO A 183 -5.410 6.077 1.364 1.00 0.16 O ATOM 303 CB PRO A 183 -5.762 9.125 2.050 1.00 0.20 C ATOM 304 CG PRO A 183 -4.751 8.874 3.114 1.00 0.24 C ATOM 305 CD PRO A 183 -5.453 8.099 4.200 1.00 0.15 C ATOM 0 HA PRO A 183 -7.754 8.209 1.882 1.00 0.15 H new ATOM 0 HB2 PRO A 183 -5.294 9.184 1.067 1.00 0.20 H new ATOM 0 HB3 PRO A 183 -6.281 10.070 2.213 1.00 0.20 H new ATOM 0 HG2 PRO A 183 -3.906 8.310 2.720 1.00 0.24 H new ATOM 0 HG3 PRO A 183 -4.355 9.813 3.502 1.00 0.24 H new ATOM 0 HD2 PRO A 183 -4.800 7.344 4.638 1.00 0.15 H new ATOM 0 HD3 PRO A 183 -5.775 8.752 5.012 1.00 0.15 H new ATOM 313 N TYR A 184 -7.091 6.812 0.054 1.00 0.15 N ATOM 314 CA TYR A 184 -6.879 5.860 -1.020 1.00 0.16 C ATOM 315 C TYR A 184 -5.554 6.108 -1.734 1.00 0.16 C ATOM 316 O TYR A 184 -4.885 5.175 -2.171 1.00 0.19 O ATOM 317 CB TYR A 184 -8.014 6.002 -2.022 1.00 0.17 C ATOM 318 CG TYR A 184 -8.845 4.752 -2.202 1.00 0.10 C ATOM 319 CD1 TYR A 184 -8.392 3.686 -2.970 1.00 0.23 C ATOM 320 CD2 TYR A 184 -10.075 4.628 -1.576 1.00 0.30 C ATOM 321 CE1 TYR A 184 -9.147 2.534 -3.104 1.00 0.27 C ATOM 322 CE2 TYR A 184 -10.834 3.488 -1.709 1.00 0.42 C ATOM 323 CZ TYR A 184 -10.375 2.467 -2.596 1.00 0.36 C ATOM 324 OH TYR A 184 -11.125 1.300 -2.587 1.00 0.50 O ATOM 0 H TYR A 184 -7.874 7.445 -0.109 1.00 0.15 H new ATOM 0 HA TYR A 184 -6.853 4.857 -0.595 1.00 0.16 H new ATOM 0 HB2 TYR A 184 -8.666 6.815 -1.702 1.00 0.17 H new ATOM 0 HB3 TYR A 184 -7.597 6.289 -2.987 1.00 0.17 H new ATOM 0 HD1 TYR A 184 -7.437 3.758 -3.469 1.00 0.23 H new ATOM 0 HD2 TYR A 184 -10.445 5.443 -0.971 1.00 0.30 H new ATOM 0 HE1 TYR A 184 -8.736 1.682 -3.625 1.00 0.27 H new ATOM 0 HE2 TYR A 184 -11.754 3.368 -1.156 1.00 0.42 H new ATOM 0 HH TYR A 184 -11.760 1.313 -3.334 1.00 0.50 H new ATOM 334 N ASP A 185 -5.197 7.381 -1.863 1.00 0.16 N ATOM 335 CA ASP A 185 -4.002 7.773 -2.606 1.00 0.17 C ATOM 336 C ASP A 185 -2.775 7.763 -1.693 1.00 0.14 C ATOM 337 O ASP A 185 -2.798 8.326 -0.594 1.00 0.17 O ATOM 338 CB ASP A 185 -4.198 9.159 -3.229 1.00 0.27 C ATOM 339 CG ASP A 185 -3.104 9.510 -4.218 1.00 0.33 C ATOM 340 OD1 ASP A 185 -3.202 9.107 -5.391 1.00 0.74 O ATOM 341 OD2 ASP A 185 -2.137 10.191 -3.822 1.00 0.58 O ATOM 0 H ASP A 185 -5.718 8.161 -1.463 1.00 0.16 H new ATOM 0 HA ASP A 185 -3.837 7.052 -3.407 1.00 0.17 H new ATOM 0 HB2 ASP A 185 -5.164 9.194 -3.733 1.00 0.27 H new ATOM 0 HB3 ASP A 185 -4.223 9.909 -2.438 1.00 0.27 H new ATOM 346 N PRO A 186 -1.690 7.119 -2.162 1.00 0.13 N ATOM 347 CA PRO A 186 -0.494 6.822 -1.355 1.00 0.11 C ATOM 348 C PRO A 186 0.208 8.043 -0.781 1.00 0.12 C ATOM 349 O PRO A 186 0.719 7.994 0.335 1.00 0.13 O ATOM 350 CB PRO A 186 0.445 6.113 -2.340 1.00 0.13 C ATOM 351 CG PRO A 186 -0.056 6.490 -3.689 1.00 0.20 C ATOM 352 CD PRO A 186 -1.541 6.621 -3.539 1.00 0.18 C ATOM 0 HA PRO A 186 -0.776 6.237 -0.479 1.00 0.11 H new ATOM 0 HB2 PRO A 186 1.478 6.432 -2.199 1.00 0.13 H new ATOM 0 HB3 PRO A 186 0.423 5.032 -2.198 1.00 0.13 H new ATOM 0 HG2 PRO A 186 0.389 7.426 -4.026 1.00 0.20 H new ATOM 0 HG3 PRO A 186 0.199 5.731 -4.429 1.00 0.20 H new ATOM 0 HD2 PRO A 186 -1.961 7.315 -4.267 1.00 0.18 H new ATOM 0 HD3 PRO A 186 -2.047 5.666 -3.680 1.00 0.18 H new ATOM 360 N ILE A 187 0.244 9.129 -1.532 1.00 0.13 N ATOM 361 CA ILE A 187 1.060 10.272 -1.152 1.00 0.17 C ATOM 362 C ILE A 187 0.558 10.950 0.129 1.00 0.19 C ATOM 363 O ILE A 187 1.333 11.607 0.825 1.00 0.22 O ATOM 364 CB ILE A 187 1.174 11.308 -2.299 1.00 0.25 C ATOM 365 CG1 ILE A 187 2.339 12.267 -2.032 1.00 0.42 C ATOM 366 CG2 ILE A 187 -0.123 12.084 -2.464 1.00 0.29 C ATOM 367 CD1 ILE A 187 2.623 13.221 -3.172 1.00 0.55 C ATOM 0 H ILE A 187 -0.277 9.245 -2.401 1.00 0.13 H new ATOM 0 HA ILE A 187 2.055 9.875 -0.949 1.00 0.17 H new ATOM 0 HB ILE A 187 1.366 10.769 -3.227 1.00 0.25 H new ATOM 0 HG12 ILE A 187 2.122 12.845 -1.133 1.00 0.42 H new ATOM 0 HG13 ILE A 187 3.237 11.684 -1.827 1.00 0.42 H new ATOM 0 HG21 ILE A 187 -0.016 12.804 -3.275 1.00 0.29 H new ATOM 0 HG22 ILE A 187 -0.933 11.393 -2.697 1.00 0.29 H new ATOM 0 HG23 ILE A 187 -0.351 12.612 -1.538 1.00 0.29 H new ATOM 0 HD11 ILE A 187 3.460 13.866 -2.906 1.00 0.55 H new ATOM 0 HD12 ILE A 187 2.873 12.653 -4.068 1.00 0.55 H new ATOM 0 HD13 ILE A 187 1.741 13.832 -3.364 1.00 0.55 H new ATOM 379 N HIS A 188 -0.719 10.786 0.467 1.00 0.18 N ATOM 380 CA HIS A 188 -1.256 11.445 1.654 1.00 0.20 C ATOM 381 C HIS A 188 -1.256 10.537 2.886 1.00 0.19 C ATOM 382 O HIS A 188 -1.837 10.897 3.915 1.00 0.22 O ATOM 383 CB HIS A 188 -2.674 11.960 1.400 1.00 0.25 C ATOM 384 CG HIS A 188 -2.753 13.032 0.360 1.00 0.32 C ATOM 385 ND1 HIS A 188 -2.367 14.321 0.633 1.00 0.39 N ATOM 386 CD2 HIS A 188 -3.184 12.960 -0.922 1.00 0.42 C ATOM 387 CE1 HIS A 188 -2.568 15.001 -0.481 1.00 0.48 C ATOM 388 NE2 HIS A 188 -3.062 14.219 -1.450 1.00 0.50 N ATOM 0 H HIS A 188 -1.388 10.216 -0.051 1.00 0.18 H new ATOM 0 HA HIS A 188 -0.593 12.285 1.860 1.00 0.20 H new ATOM 0 HB2 HIS A 188 -3.304 11.125 1.095 1.00 0.25 H new ATOM 0 HB3 HIS A 188 -3.083 12.343 2.335 1.00 0.25 H new ATOM 0 HD2 HIS A 188 -3.552 12.081 -1.430 1.00 0.42 H new ATOM 0 HE1 HIS A 188 -2.360 16.055 -0.596 1.00 0.48 H new ATOM 0 HE2 HIS A 188 -3.302 14.506 -2.399 1.00 0.50 H new ATOM 396 N TRP A 189 -0.630 9.364 2.802 1.00 0.18 N ATOM 397 CA TRP A 189 -0.559 8.484 3.969 1.00 0.19 C ATOM 398 C TRP A 189 0.353 9.096 5.032 1.00 0.20 C ATOM 399 O TRP A 189 1.315 9.796 4.710 1.00 0.20 O ATOM 400 CB TRP A 189 0.003 7.096 3.634 1.00 0.18 C ATOM 401 CG TRP A 189 -0.794 6.251 2.691 1.00 0.15 C ATOM 402 CD1 TRP A 189 -2.148 6.213 2.542 1.00 0.18 C ATOM 403 CD2 TRP A 189 -0.261 5.270 1.792 1.00 0.12 C ATOM 404 NE1 TRP A 189 -2.490 5.287 1.586 1.00 0.15 N ATOM 405 CE2 TRP A 189 -1.345 4.692 1.112 1.00 0.12 C ATOM 406 CE3 TRP A 189 1.040 4.835 1.489 1.00 0.11 C ATOM 407 CZ2 TRP A 189 -1.174 3.698 0.151 1.00 0.12 C ATOM 408 CZ3 TRP A 189 1.211 3.849 0.534 1.00 0.12 C ATOM 409 CH2 TRP A 189 0.109 3.292 -0.125 1.00 0.12 C ATOM 0 H TRP A 189 -0.175 9.007 1.962 1.00 0.18 H new ATOM 0 HA TRP A 189 -1.583 8.375 4.328 1.00 0.19 H new ATOM 0 HB2 TRP A 189 1.000 7.227 3.212 1.00 0.18 H new ATOM 0 HB3 TRP A 189 0.121 6.544 4.566 1.00 0.18 H new ATOM 0 HD1 TRP A 189 -2.849 6.821 3.094 1.00 0.18 H new ATOM 0 HE1 TRP A 189 -3.439 5.076 1.278 1.00 0.15 H new ATOM 0 HE3 TRP A 189 1.893 5.264 1.994 1.00 0.11 H new ATOM 0 HZ2 TRP A 189 -2.020 3.262 -0.359 1.00 0.12 H new ATOM 0 HZ3 TRP A 189 2.206 3.505 0.294 1.00 0.12 H new ATOM 0 HH2 TRP A 189 0.271 2.525 -0.868 1.00 0.12 H new ATOM 420 N SER A 190 0.046 8.840 6.292 1.00 0.23 N ATOM 421 CA SER A 190 0.969 9.156 7.370 1.00 0.25 C ATOM 422 C SER A 190 1.707 7.885 7.769 1.00 0.25 C ATOM 423 O SER A 190 1.285 6.795 7.387 1.00 0.25 O ATOM 424 CB SER A 190 0.224 9.753 8.570 1.00 0.29 C ATOM 425 OG SER A 190 1.125 10.149 9.589 1.00 1.18 O ATOM 0 H SER A 190 -0.831 8.416 6.594 1.00 0.23 H new ATOM 0 HA SER A 190 1.686 9.903 7.028 1.00 0.25 H new ATOM 0 HB2 SER A 190 -0.363 10.613 8.246 1.00 0.29 H new ATOM 0 HB3 SER A 190 -0.478 9.020 8.967 1.00 0.29 H new ATOM 0 HG SER A 190 0.623 10.527 10.341 1.00 1.18 H new ATOM 431 N THR A 191 2.785 8.031 8.538 1.00 0.26 N ATOM 432 CA THR A 191 3.666 6.918 8.896 1.00 0.28 C ATOM 433 C THR A 191 2.899 5.667 9.318 1.00 0.25 C ATOM 434 O THR A 191 3.218 4.557 8.887 1.00 0.25 O ATOM 435 CB THR A 191 4.616 7.337 10.031 1.00 0.31 C ATOM 436 OG1 THR A 191 4.142 8.552 10.633 1.00 0.74 O ATOM 437 CG2 THR A 191 6.032 7.541 9.512 1.00 0.62 C ATOM 0 H THR A 191 3.074 8.927 8.932 1.00 0.26 H new ATOM 0 HA THR A 191 4.233 6.669 7.999 1.00 0.28 H new ATOM 0 HB THR A 191 4.635 6.540 10.774 1.00 0.31 H new ATOM 0 HG1 THR A 191 4.747 8.816 11.357 1.00 0.74 H new ATOM 0 HG21 THR A 191 6.682 7.837 10.335 1.00 0.62 H new ATOM 0 HG22 THR A 191 6.398 6.611 9.077 1.00 0.62 H new ATOM 0 HG23 THR A 191 6.032 8.322 8.751 1.00 0.62 H new ATOM 445 N ASP A 192 1.879 5.854 10.144 1.00 0.24 N ATOM 446 CA ASP A 192 1.077 4.737 10.628 1.00 0.24 C ATOM 447 C ASP A 192 0.296 4.095 9.485 1.00 0.23 C ATOM 448 O ASP A 192 0.353 2.890 9.285 1.00 0.25 O ATOM 449 CB ASP A 192 0.101 5.202 11.712 1.00 0.29 C ATOM 450 CG ASP A 192 0.786 5.906 12.865 1.00 1.06 C ATOM 451 OD1 ASP A 192 0.995 7.132 12.775 1.00 1.75 O ATOM 452 OD2 ASP A 192 1.112 5.239 13.869 1.00 1.37 O ATOM 0 H ASP A 192 1.587 6.767 10.493 1.00 0.24 H new ATOM 0 HA ASP A 192 1.758 3.999 11.052 1.00 0.24 H new ATOM 0 HB2 ASP A 192 -0.633 5.874 11.268 1.00 0.29 H new ATOM 0 HB3 ASP A 192 -0.446 4.340 12.094 1.00 0.29 H new ATOM 457 N GLN A 193 -0.419 4.922 8.732 1.00 0.22 N ATOM 458 CA GLN A 193 -1.299 4.459 7.654 1.00 0.21 C ATOM 459 C GLN A 193 -0.508 3.900 6.474 1.00 0.17 C ATOM 460 O GLN A 193 -1.001 3.010 5.778 1.00 0.14 O ATOM 461 CB GLN A 193 -2.205 5.595 7.185 1.00 0.24 C ATOM 462 CG GLN A 193 -2.833 6.379 8.323 1.00 0.30 C ATOM 463 CD GLN A 193 -3.527 7.634 7.843 1.00 0.41 C ATOM 464 OE1 GLN A 193 -2.898 8.682 7.705 1.00 1.34 O ATOM 465 NE2 GLN A 193 -4.823 7.545 7.599 1.00 0.85 N ATOM 0 H GLN A 193 -0.408 5.935 8.848 1.00 0.22 H new ATOM 0 HA GLN A 193 -1.910 3.651 8.056 1.00 0.21 H new ATOM 0 HB2 GLN A 193 -1.626 6.276 6.561 1.00 0.24 H new ATOM 0 HB3 GLN A 193 -2.996 5.183 6.558 1.00 0.24 H new ATOM 0 HG2 GLN A 193 -3.552 5.746 8.844 1.00 0.30 H new ATOM 0 HG3 GLN A 193 -2.062 6.647 9.045 1.00 0.30 H new ATOM 0 HE21 GLN A 193 -5.306 6.656 7.726 1.00 0.85 H new ATOM 0 HE22 GLN A 193 -5.340 8.366 7.283 1.00 0.85 H new ATOM 474 N VAL A 194 0.688 4.405 6.247 1.00 0.16 N ATOM 475 CA VAL A 194 1.584 3.792 5.265 1.00 0.14 C ATOM 476 C VAL A 194 1.752 2.302 5.580 1.00 0.13 C ATOM 477 O VAL A 194 1.708 1.448 4.694 1.00 0.13 O ATOM 478 CB VAL A 194 2.975 4.471 5.248 1.00 0.16 C ATOM 479 CG1 VAL A 194 3.904 3.792 4.257 1.00 0.17 C ATOM 480 CG2 VAL A 194 2.851 5.945 4.915 1.00 0.17 C ATOM 0 H VAL A 194 1.066 5.227 6.718 1.00 0.16 H new ATOM 0 HA VAL A 194 1.134 3.923 4.281 1.00 0.14 H new ATOM 0 HB VAL A 194 3.402 4.371 6.246 1.00 0.16 H new ATOM 0 HG11 VAL A 194 4.873 4.290 4.267 1.00 0.17 H new ATOM 0 HG12 VAL A 194 4.031 2.746 4.535 1.00 0.17 H new ATOM 0 HG13 VAL A 194 3.475 3.852 3.257 1.00 0.17 H new ATOM 0 HG21 VAL A 194 3.841 6.401 4.909 1.00 0.17 H new ATOM 0 HG22 VAL A 194 2.393 6.059 3.933 1.00 0.17 H new ATOM 0 HG23 VAL A 194 2.230 6.436 5.664 1.00 0.17 H new ATOM 490 N LEU A 195 1.896 2.004 6.861 1.00 0.14 N ATOM 491 CA LEU A 195 2.043 0.633 7.330 1.00 0.14 C ATOM 492 C LEU A 195 0.710 0.028 7.783 1.00 0.12 C ATOM 493 O LEU A 195 0.662 -1.165 8.069 1.00 0.14 O ATOM 494 CB LEU A 195 3.103 0.523 8.426 1.00 0.16 C ATOM 495 CG LEU A 195 4.477 1.089 8.063 1.00 0.18 C ATOM 496 CD1 LEU A 195 5.399 1.057 9.272 1.00 0.23 C ATOM 497 CD2 LEU A 195 5.087 0.310 6.907 1.00 0.18 C ATOM 0 H LEU A 195 1.914 2.702 7.604 1.00 0.14 H new ATOM 0 HA LEU A 195 2.386 0.047 6.477 1.00 0.14 H new ATOM 0 HB2 LEU A 195 2.739 1.039 9.315 1.00 0.16 H new ATOM 0 HB3 LEU A 195 3.219 -0.528 8.692 1.00 0.16 H new ATOM 0 HG LEU A 195 4.352 2.126 7.750 1.00 0.18 H new ATOM 0 HD11 LEU A 195 6.373 1.463 8.998 1.00 0.23 H new ATOM 0 HD12 LEU A 195 4.969 1.657 10.074 1.00 0.23 H new ATOM 0 HD13 LEU A 195 5.517 0.028 9.612 1.00 0.23 H new ATOM 0 HD21 LEU A 195 6.064 0.727 6.663 1.00 0.18 H new ATOM 0 HD22 LEU A 195 5.200 -0.736 7.192 1.00 0.18 H new ATOM 0 HD23 LEU A 195 4.435 0.380 6.037 1.00 0.18 H new ATOM 509 N HIS A 196 -0.368 0.799 7.846 1.00 0.11 N ATOM 510 CA HIS A 196 -1.687 0.170 7.928 1.00 0.10 C ATOM 511 C HIS A 196 -1.929 -0.582 6.625 1.00 0.09 C ATOM 512 O HIS A 196 -2.325 -1.746 6.614 1.00 0.12 O ATOM 513 CB HIS A 196 -2.818 1.178 8.161 1.00 0.13 C ATOM 514 CG HIS A 196 -3.023 1.556 9.598 1.00 0.16 C ATOM 515 ND1 HIS A 196 -3.774 0.774 10.440 1.00 0.30 N ATOM 516 CD2 HIS A 196 -2.585 2.641 10.275 1.00 0.30 C ATOM 517 CE1 HIS A 196 -3.777 1.398 11.605 1.00 0.30 C ATOM 518 NE2 HIS A 196 -3.070 2.534 11.552 1.00 0.28 N ATOM 0 H HIS A 196 -0.364 1.819 7.843 1.00 0.11 H new ATOM 0 HA HIS A 196 -1.692 -0.502 8.787 1.00 0.10 H new ATOM 0 HB2 HIS A 196 -2.608 2.080 7.587 1.00 0.13 H new ATOM 0 HB3 HIS A 196 -3.747 0.761 7.771 1.00 0.13 H new ATOM 0 HD2 HIS A 196 -1.971 3.439 9.884 1.00 0.30 H new ATOM 0 HE1 HIS A 196 -4.285 1.038 12.487 1.00 0.30 H new ATOM 0 HE2 HIS A 196 -2.921 3.193 12.316 1.00 0.28 H new ATOM 526 N TRP A 197 -1.650 0.119 5.534 1.00 0.10 N ATOM 527 CA TRP A 197 -1.651 -0.470 4.199 1.00 0.09 C ATOM 528 C TRP A 197 -0.695 -1.648 4.122 1.00 0.10 C ATOM 529 O TRP A 197 -1.136 -2.755 3.836 1.00 0.13 O ATOM 530 CB TRP A 197 -1.289 0.585 3.147 1.00 0.09 C ATOM 531 CG TRP A 197 -1.165 0.052 1.746 1.00 0.07 C ATOM 532 CD1 TRP A 197 -2.166 -0.455 0.971 1.00 0.09 C ATOM 533 CD2 TRP A 197 0.025 -0.004 0.945 1.00 0.07 C ATOM 534 NE1 TRP A 197 -1.672 -0.844 -0.250 1.00 0.08 N ATOM 535 CE2 TRP A 197 -0.331 -0.571 -0.294 1.00 0.07 C ATOM 536 CE3 TRP A 197 1.359 0.366 1.154 1.00 0.12 C ATOM 537 CZ2 TRP A 197 0.594 -0.777 -1.316 1.00 0.10 C ATOM 538 CZ3 TRP A 197 2.275 0.166 0.137 1.00 0.16 C ATOM 539 CH2 TRP A 197 1.890 -0.401 -1.084 1.00 0.14 C ATOM 0 H TRP A 197 -1.417 1.112 5.548 1.00 0.10 H new ATOM 0 HA TRP A 197 -2.656 -0.837 3.992 1.00 0.09 H new ATOM 0 HB2 TRP A 197 -2.048 1.367 3.159 1.00 0.09 H new ATOM 0 HB3 TRP A 197 -0.346 1.052 3.429 1.00 0.09 H new ATOM 0 HD1 TRP A 197 -3.199 -0.539 1.274 1.00 0.09 H new ATOM 0 HE1 TRP A 197 -2.216 -1.267 -1.002 1.00 0.08 H new ATOM 0 HE3 TRP A 197 1.668 0.800 2.093 1.00 0.12 H new ATOM 0 HZ2 TRP A 197 0.299 -1.217 -2.257 1.00 0.10 H new ATOM 0 HZ3 TRP A 197 3.305 0.452 0.287 1.00 0.16 H new ATOM 0 HH2 TRP A 197 2.630 -0.545 -1.858 1.00 0.14 H new ATOM 550 N VAL A 198 0.588 -1.447 4.380 1.00 0.10 N ATOM 551 CA VAL A 198 1.537 -2.547 4.247 1.00 0.12 C ATOM 552 C VAL A 198 1.160 -3.751 5.111 1.00 0.13 C ATOM 553 O VAL A 198 1.214 -4.866 4.619 1.00 0.15 O ATOM 554 CB VAL A 198 2.993 -2.146 4.531 1.00 0.14 C ATOM 555 CG1 VAL A 198 3.896 -3.356 4.374 1.00 0.23 C ATOM 556 CG2 VAL A 198 3.436 -1.026 3.607 1.00 0.13 C ATOM 0 H VAL A 198 0.991 -0.558 4.675 1.00 0.10 H new ATOM 0 HA VAL A 198 1.474 -2.831 3.197 1.00 0.12 H new ATOM 0 HB VAL A 198 3.062 -1.780 5.555 1.00 0.14 H new ATOM 0 HG11 VAL A 198 4.928 -3.069 4.576 1.00 0.23 H new ATOM 0 HG12 VAL A 198 3.591 -4.131 5.077 1.00 0.23 H new ATOM 0 HG13 VAL A 198 3.818 -3.738 3.356 1.00 0.23 H new ATOM 0 HG21 VAL A 198 4.470 -0.760 3.827 1.00 0.13 H new ATOM 0 HG22 VAL A 198 3.359 -1.357 2.571 1.00 0.13 H new ATOM 0 HG23 VAL A 198 2.797 -0.156 3.758 1.00 0.13 H new ATOM 566 N VAL A 199 0.736 -3.556 6.354 1.00 0.13 N ATOM 567 CA VAL A 199 0.405 -4.698 7.212 1.00 0.14 C ATOM 568 C VAL A 199 -0.837 -5.432 6.696 1.00 0.13 C ATOM 569 O VAL A 199 -0.830 -6.655 6.528 1.00 0.15 O ATOM 570 CB VAL A 199 0.200 -4.271 8.685 1.00 0.18 C ATOM 571 CG1 VAL A 199 -0.421 -5.396 9.501 1.00 0.21 C ATOM 572 CG2 VAL A 199 1.528 -3.851 9.297 1.00 0.20 C ATOM 0 H VAL A 199 0.614 -2.641 6.788 1.00 0.13 H new ATOM 0 HA VAL A 199 1.255 -5.380 7.176 1.00 0.14 H new ATOM 0 HB VAL A 199 -0.485 -3.423 8.701 1.00 0.18 H new ATOM 0 HG11 VAL A 199 -0.553 -5.068 10.532 1.00 0.21 H new ATOM 0 HG12 VAL A 199 -1.390 -5.661 9.077 1.00 0.21 H new ATOM 0 HG13 VAL A 199 0.235 -6.266 9.479 1.00 0.21 H new ATOM 0 HG21 VAL A 199 1.373 -3.552 10.334 1.00 0.20 H new ATOM 0 HG22 VAL A 199 2.226 -4.687 9.261 1.00 0.20 H new ATOM 0 HG23 VAL A 199 1.938 -3.012 8.735 1.00 0.20 H new ATOM 582 N TRP A 200 -1.880 -4.674 6.415 1.00 0.13 N ATOM 583 CA TRP A 200 -3.123 -5.239 5.902 1.00 0.13 C ATOM 584 C TRP A 200 -2.892 -5.911 4.547 1.00 0.13 C ATOM 585 O TRP A 200 -3.303 -7.049 4.332 1.00 0.13 O ATOM 586 CB TRP A 200 -4.185 -4.140 5.774 1.00 0.14 C ATOM 587 CG TRP A 200 -5.584 -4.656 5.604 1.00 0.14 C ATOM 588 CD1 TRP A 200 -6.585 -4.611 6.528 1.00 0.15 C ATOM 589 CD2 TRP A 200 -6.138 -5.295 4.446 1.00 0.13 C ATOM 590 NE1 TRP A 200 -7.723 -5.186 6.020 1.00 0.16 N ATOM 591 CE2 TRP A 200 -7.473 -5.613 4.744 1.00 0.15 C ATOM 592 CE3 TRP A 200 -5.632 -5.630 3.189 1.00 0.13 C ATOM 593 CZ2 TRP A 200 -8.306 -6.248 3.832 1.00 0.15 C ATOM 594 CZ3 TRP A 200 -6.454 -6.263 2.285 1.00 0.14 C ATOM 595 CH2 TRP A 200 -7.782 -6.568 2.607 1.00 0.15 C ATOM 0 H TRP A 200 -1.895 -3.661 6.532 1.00 0.13 H new ATOM 0 HA TRP A 200 -3.476 -5.995 6.604 1.00 0.13 H new ATOM 0 HB2 TRP A 200 -4.148 -3.509 6.662 1.00 0.14 H new ATOM 0 HB3 TRP A 200 -3.937 -3.507 4.922 1.00 0.14 H new ATOM 0 HD1 TRP A 200 -6.496 -4.185 7.516 1.00 0.15 H new ATOM 0 HE1 TRP A 200 -8.611 -5.280 6.513 1.00 0.16 H new ATOM 0 HE3 TRP A 200 -4.610 -5.396 2.930 1.00 0.13 H new ATOM 0 HZ2 TRP A 200 -9.331 -6.481 4.080 1.00 0.15 H new ATOM 0 HZ3 TRP A 200 -6.069 -6.529 1.312 1.00 0.14 H new ATOM 0 HH2 TRP A 200 -8.404 -7.064 1.877 1.00 0.15 H new ATOM 606 N VAL A 201 -2.224 -5.225 3.654 1.00 0.14 N ATOM 607 CA VAL A 201 -2.038 -5.731 2.303 1.00 0.16 C ATOM 608 C VAL A 201 -0.971 -6.831 2.236 1.00 0.16 C ATOM 609 O VAL A 201 -1.100 -7.746 1.430 1.00 0.18 O ATOM 610 CB VAL A 201 -1.756 -4.590 1.306 1.00 0.20 C ATOM 611 CG1 VAL A 201 -1.612 -5.111 -0.113 1.00 0.26 C ATOM 612 CG2 VAL A 201 -2.876 -3.567 1.377 1.00 0.22 C ATOM 0 H VAL A 201 -1.798 -4.315 3.830 1.00 0.14 H new ATOM 0 HA VAL A 201 -2.978 -6.196 2.005 1.00 0.16 H new ATOM 0 HB VAL A 201 -0.811 -4.121 1.582 1.00 0.20 H new ATOM 0 HG11 VAL A 201 -1.414 -4.278 -0.788 1.00 0.26 H new ATOM 0 HG12 VAL A 201 -0.785 -5.820 -0.158 1.00 0.26 H new ATOM 0 HG13 VAL A 201 -2.534 -5.610 -0.413 1.00 0.26 H new ATOM 0 HG21 VAL A 201 -2.677 -2.760 0.672 1.00 0.22 H new ATOM 0 HG22 VAL A 201 -3.822 -4.045 1.123 1.00 0.22 H new ATOM 0 HG23 VAL A 201 -2.934 -3.161 2.387 1.00 0.22 H new ATOM 622 N MET A 202 0.043 -6.810 3.093 1.00 0.17 N ATOM 623 CA MET A 202 0.957 -7.957 3.129 1.00 0.20 C ATOM 624 C MET A 202 0.222 -9.190 3.669 1.00 0.19 C ATOM 625 O MET A 202 0.624 -10.324 3.424 1.00 0.22 O ATOM 626 CB MET A 202 2.241 -7.692 3.942 1.00 0.23 C ATOM 627 CG MET A 202 2.026 -7.468 5.428 1.00 0.23 C ATOM 628 SD MET A 202 3.500 -7.806 6.414 1.00 0.40 S ATOM 629 CE MET A 202 4.604 -6.515 5.850 1.00 0.56 C ATOM 0 H MET A 202 0.252 -6.054 3.745 1.00 0.17 H new ATOM 0 HA MET A 202 1.281 -8.137 2.104 1.00 0.20 H new ATOM 0 HB2 MET A 202 2.916 -8.538 3.812 1.00 0.23 H new ATOM 0 HB3 MET A 202 2.742 -6.817 3.527 1.00 0.23 H new ATOM 0 HG2 MET A 202 1.714 -6.437 5.593 1.00 0.23 H new ATOM 0 HG3 MET A 202 1.212 -8.106 5.772 1.00 0.23 H new ATOM 0 HE1 MET A 202 5.577 -6.946 5.613 1.00 0.56 H new ATOM 0 HE2 MET A 202 4.189 -6.045 4.959 1.00 0.56 H new ATOM 0 HE3 MET A 202 4.720 -5.767 6.634 1.00 0.56 H new ATOM 639 N LYS A 203 -0.860 -8.947 4.397 1.00 0.16 N ATOM 640 CA LYS A 203 -1.727 -10.011 4.903 1.00 0.18 C ATOM 641 C LYS A 203 -2.498 -10.718 3.782 1.00 0.18 C ATOM 642 O LYS A 203 -2.477 -11.947 3.714 1.00 0.20 O ATOM 643 CB LYS A 203 -2.705 -9.442 5.937 1.00 0.19 C ATOM 644 CG LYS A 203 -3.804 -10.409 6.346 1.00 0.36 C ATOM 645 CD LYS A 203 -4.574 -9.909 7.557 1.00 0.82 C ATOM 646 CE LYS A 203 -3.743 -10.005 8.828 1.00 1.61 C ATOM 647 NZ LYS A 203 -3.381 -11.413 9.148 1.00 2.35 N ATOM 0 H LYS A 203 -1.164 -8.008 4.655 1.00 0.16 H new ATOM 0 HA LYS A 203 -1.086 -10.756 5.374 1.00 0.18 H new ATOM 0 HB2 LYS A 203 -2.147 -9.146 6.825 1.00 0.19 H new ATOM 0 HB3 LYS A 203 -3.162 -8.539 5.532 1.00 0.19 H new ATOM 0 HG2 LYS A 203 -4.491 -10.552 5.512 1.00 0.36 H new ATOM 0 HG3 LYS A 203 -3.367 -11.382 6.570 1.00 0.36 H new ATOM 0 HD2 LYS A 203 -4.875 -8.874 7.396 1.00 0.82 H new ATOM 0 HD3 LYS A 203 -5.488 -10.492 7.674 1.00 0.82 H new ATOM 0 HE2 LYS A 203 -2.835 -9.413 8.714 1.00 1.61 H new ATOM 0 HE3 LYS A 203 -4.301 -9.575 9.660 1.00 1.61 H new ATOM 0 HZ1 LYS A 203 -3.109 -11.482 10.149 1.00 2.35 H new ATOM 0 HZ2 LYS A 203 -4.198 -12.031 8.968 1.00 2.35 H new ATOM 0 HZ3 LYS A 203 -2.583 -11.711 8.551 1.00 2.35 H new ATOM 661 N GLU A 204 -3.157 -9.961 2.900 1.00 0.18 N ATOM 662 CA GLU A 204 -4.050 -10.540 1.882 1.00 0.18 C ATOM 663 C GLU A 204 -3.343 -11.595 1.012 1.00 0.23 C ATOM 664 O GLU A 204 -3.974 -12.536 0.530 1.00 0.47 O ATOM 665 CB GLU A 204 -4.636 -9.428 0.999 1.00 0.23 C ATOM 666 CG GLU A 204 -5.702 -9.909 0.021 1.00 0.42 C ATOM 667 CD GLU A 204 -6.867 -10.596 0.709 1.00 0.93 C ATOM 668 OE1 GLU A 204 -7.793 -9.896 1.161 1.00 1.72 O ATOM 669 OE2 GLU A 204 -6.866 -11.845 0.794 1.00 1.45 O ATOM 0 H GLU A 204 -3.091 -8.944 2.867 1.00 0.18 H new ATOM 0 HA GLU A 204 -4.856 -11.049 2.411 1.00 0.18 H new ATOM 0 HB2 GLU A 204 -5.066 -8.658 1.640 1.00 0.23 H new ATOM 0 HB3 GLU A 204 -3.827 -8.960 0.438 1.00 0.23 H new ATOM 0 HG2 GLU A 204 -6.074 -9.059 -0.550 1.00 0.42 H new ATOM 0 HG3 GLU A 204 -5.250 -10.598 -0.692 1.00 0.42 H new ATOM 676 N PHE A 205 -2.040 -11.451 0.828 1.00 0.18 N ATOM 677 CA PHE A 205 -1.274 -12.379 -0.009 1.00 0.19 C ATOM 678 C PHE A 205 -0.197 -13.081 0.802 1.00 0.22 C ATOM 679 O PHE A 205 0.735 -13.659 0.242 1.00 0.25 O ATOM 680 CB PHE A 205 -0.618 -11.654 -1.184 1.00 0.19 C ATOM 681 CG PHE A 205 -1.329 -10.409 -1.601 1.00 0.18 C ATOM 682 CD1 PHE A 205 -2.415 -10.497 -2.441 1.00 0.24 C ATOM 683 CD2 PHE A 205 -0.920 -9.161 -1.161 1.00 0.21 C ATOM 684 CE1 PHE A 205 -3.092 -9.374 -2.842 1.00 0.29 C ATOM 685 CE2 PHE A 205 -1.593 -8.023 -1.561 1.00 0.25 C ATOM 686 CZ PHE A 205 -2.615 -8.069 -2.345 1.00 0.29 C ATOM 0 H PHE A 205 -1.485 -10.703 1.244 1.00 0.18 H new ATOM 0 HA PHE A 205 -1.978 -13.117 -0.393 1.00 0.19 H new ATOM 0 HB2 PHE A 205 0.408 -11.402 -0.915 1.00 0.19 H new ATOM 0 HB3 PHE A 205 -0.567 -12.334 -2.035 1.00 0.19 H new ATOM 0 HD1 PHE A 205 -2.740 -11.466 -2.790 1.00 0.24 H new ATOM 0 HD2 PHE A 205 -0.069 -9.077 -0.501 1.00 0.21 H new ATOM 0 HE1 PHE A 205 -3.946 -9.442 -3.500 1.00 0.29 H new ATOM 0 HE2 PHE A 205 -1.251 -7.062 -1.205 1.00 0.25 H new ATOM 0 HZ PHE A 205 -3.119 -7.159 -2.636 1.00 0.29 H new ATOM 696 N SER A 206 -0.339 -13.019 2.126 1.00 0.21 N ATOM 697 CA SER A 206 0.533 -13.739 3.060 1.00 0.23 C ATOM 698 C SER A 206 2.009 -13.462 2.774 1.00 0.24 C ATOM 699 O SER A 206 2.847 -14.363 2.786 1.00 0.28 O ATOM 700 CB SER A 206 0.236 -15.247 3.045 1.00 0.26 C ATOM 701 OG SER A 206 0.332 -15.796 1.740 1.00 1.14 O ATOM 0 H SER A 206 -1.064 -12.467 2.584 1.00 0.21 H new ATOM 0 HA SER A 206 0.319 -13.368 4.062 1.00 0.23 H new ATOM 0 HB2 SER A 206 0.934 -15.760 3.706 1.00 0.26 H new ATOM 0 HB3 SER A 206 -0.765 -15.423 3.439 1.00 0.26 H new ATOM 0 HG SER A 206 0.857 -15.196 1.170 1.00 1.14 H new ATOM 707 N MET A 207 2.311 -12.187 2.536 1.00 0.25 N ATOM 708 CA MET A 207 3.662 -11.737 2.244 1.00 0.27 C ATOM 709 C MET A 207 4.514 -11.774 3.497 1.00 0.52 C ATOM 710 O MET A 207 5.550 -12.432 3.515 1.00 1.36 O ATOM 711 CB MET A 207 3.649 -10.315 1.684 1.00 0.32 C ATOM 712 CG MET A 207 2.740 -10.130 0.483 1.00 0.52 C ATOM 713 SD MET A 207 2.622 -8.404 -0.019 1.00 0.95 S ATOM 714 CE MET A 207 4.309 -8.083 -0.521 1.00 0.94 C ATOM 0 H MET A 207 1.619 -11.437 2.541 1.00 0.25 H new ATOM 0 HA MET A 207 4.086 -12.410 1.498 1.00 0.27 H new ATOM 0 HB2 MET A 207 3.337 -9.629 2.471 1.00 0.32 H new ATOM 0 HB3 MET A 207 4.665 -10.037 1.403 1.00 0.32 H new ATOM 0 HG2 MET A 207 3.115 -10.724 -0.350 1.00 0.52 H new ATOM 0 HG3 MET A 207 1.745 -10.507 0.721 1.00 0.52 H new ATOM 0 HE1 MET A 207 4.312 -7.589 -1.493 1.00 0.94 H new ATOM 0 HE2 MET A 207 4.791 -7.439 0.215 1.00 0.94 H new ATOM 0 HE3 MET A 207 4.853 -9.025 -0.591 1.00 0.94 H new ATOM 769 N ASP A 211 9.551 -5.201 4.351 1.00 0.28 N ATOM 770 CA ASP A 211 10.178 -4.281 5.302 1.00 0.28 C ATOM 771 C ASP A 211 9.234 -3.185 5.785 1.00 0.27 C ATOM 772 O ASP A 211 9.026 -2.178 5.105 1.00 0.33 O ATOM 773 CB ASP A 211 11.425 -3.646 4.682 1.00 0.34 C ATOM 774 CG ASP A 211 12.581 -4.622 4.571 1.00 0.65 C ATOM 775 OD1 ASP A 211 12.663 -5.340 3.557 1.00 0.91 O ATOM 776 OD2 ASP A 211 13.413 -4.681 5.506 1.00 0.88 O ATOM 0 HA ASP A 211 10.452 -4.877 6.172 1.00 0.28 H new ATOM 0 HB2 ASP A 211 11.180 -3.264 3.691 1.00 0.34 H new ATOM 0 HB3 ASP A 211 11.732 -2.792 5.285 1.00 0.34 H new ATOM 781 N LEU A 212 8.691 -3.383 6.978 1.00 0.30 N ATOM 782 CA LEU A 212 7.867 -2.380 7.636 1.00 0.36 C ATOM 783 C LEU A 212 8.740 -1.242 8.147 1.00 0.42 C ATOM 784 O LEU A 212 8.400 -0.070 8.009 1.00 0.56 O ATOM 785 CB LEU A 212 7.110 -3.006 8.810 1.00 0.43 C ATOM 786 CG LEU A 212 6.061 -4.051 8.432 1.00 0.48 C ATOM 787 CD1 LEU A 212 5.563 -4.780 9.669 1.00 0.56 C ATOM 788 CD2 LEU A 212 4.900 -3.390 7.710 1.00 0.52 C ATOM 0 H LEU A 212 8.809 -4.242 7.516 1.00 0.30 H new ATOM 0 HA LEU A 212 7.150 -1.990 6.913 1.00 0.36 H new ATOM 0 HB2 LEU A 212 7.833 -3.469 9.481 1.00 0.43 H new ATOM 0 HB3 LEU A 212 6.620 -2.210 9.370 1.00 0.43 H new ATOM 0 HG LEU A 212 6.523 -4.779 7.765 1.00 0.48 H new ATOM 0 HD11 LEU A 212 4.817 -5.520 9.380 1.00 0.56 H new ATOM 0 HD12 LEU A 212 6.399 -5.280 10.158 1.00 0.56 H new ATOM 0 HD13 LEU A 212 5.115 -4.064 10.358 1.00 0.56 H new ATOM 0 HD21 LEU A 212 4.159 -4.144 7.446 1.00 0.52 H new ATOM 0 HD22 LEU A 212 4.443 -2.645 8.361 1.00 0.52 H new ATOM 0 HD23 LEU A 212 5.264 -2.905 6.804 1.00 0.52 H new ATOM 800 N THR A 213 9.884 -1.605 8.714 1.00 0.44 N ATOM 801 CA THR A 213 10.777 -0.634 9.330 1.00 0.51 C ATOM 802 C THR A 213 11.418 0.275 8.279 1.00 0.46 C ATOM 803 O THR A 213 11.783 1.415 8.567 1.00 0.52 O ATOM 804 CB THR A 213 11.876 -1.336 10.168 1.00 0.71 C ATOM 805 OG1 THR A 213 12.681 -0.365 10.852 1.00 1.56 O ATOM 806 CG2 THR A 213 12.767 -2.206 9.291 1.00 1.34 C ATOM 0 H THR A 213 10.215 -2.569 8.759 1.00 0.44 H new ATOM 0 HA THR A 213 10.174 -0.018 9.997 1.00 0.51 H new ATOM 0 HB THR A 213 11.377 -1.973 10.898 1.00 0.71 H new ATOM 0 HG1 THR A 213 13.369 -0.823 11.378 1.00 1.56 H new ATOM 0 HG21 THR A 213 13.528 -2.685 9.907 1.00 1.34 H new ATOM 0 HG22 THR A 213 12.162 -2.970 8.802 1.00 1.34 H new ATOM 0 HG23 THR A 213 13.250 -1.587 8.535 1.00 1.34 H new ATOM 814 N THR A 214 11.536 -0.219 7.054 1.00 0.45 N ATOM 815 CA THR A 214 12.150 0.555 5.990 1.00 0.47 C ATOM 816 C THR A 214 11.136 1.480 5.326 1.00 0.42 C ATOM 817 O THR A 214 11.490 2.541 4.809 1.00 0.60 O ATOM 818 CB THR A 214 12.786 -0.364 4.940 1.00 0.57 C ATOM 819 OG1 THR A 214 13.568 -1.363 5.604 1.00 1.18 O ATOM 820 CG2 THR A 214 13.676 0.429 3.999 1.00 0.40 C ATOM 0 H THR A 214 11.216 -1.147 6.776 1.00 0.45 H new ATOM 0 HA THR A 214 12.932 1.166 6.440 1.00 0.47 H new ATOM 0 HB THR A 214 11.994 -0.832 4.356 1.00 0.57 H new ATOM 0 HG1 THR A 214 13.976 -1.955 4.938 1.00 1.18 H new ATOM 0 HG21 THR A 214 14.117 -0.243 3.262 1.00 0.40 H new ATOM 0 HG22 THR A 214 13.082 1.187 3.489 1.00 0.40 H new ATOM 0 HG23 THR A 214 14.469 0.913 4.569 1.00 0.40 H new ATOM 828 N LEU A 215 9.872 1.087 5.357 1.00 0.30 N ATOM 829 CA LEU A 215 8.811 1.926 4.826 1.00 0.27 C ATOM 830 C LEU A 215 8.171 2.731 5.945 1.00 0.25 C ATOM 831 O LEU A 215 7.015 3.140 5.851 1.00 0.29 O ATOM 832 CB LEU A 215 7.748 1.091 4.107 1.00 0.25 C ATOM 833 CG LEU A 215 8.232 0.322 2.881 1.00 0.23 C ATOM 834 CD1 LEU A 215 7.066 -0.397 2.227 1.00 0.25 C ATOM 835 CD2 LEU A 215 8.907 1.258 1.888 1.00 0.24 C ATOM 0 H LEU A 215 9.558 0.197 5.742 1.00 0.30 H new ATOM 0 HA LEU A 215 9.254 2.608 4.100 1.00 0.27 H new ATOM 0 HB2 LEU A 215 7.329 0.379 4.818 1.00 0.25 H new ATOM 0 HB3 LEU A 215 6.937 1.752 3.802 1.00 0.25 H new ATOM 0 HG LEU A 215 8.967 -0.417 3.201 1.00 0.23 H new ATOM 0 HD11 LEU A 215 7.420 -0.943 1.353 1.00 0.25 H new ATOM 0 HD12 LEU A 215 6.625 -1.096 2.938 1.00 0.25 H new ATOM 0 HD13 LEU A 215 6.315 0.331 1.920 1.00 0.25 H new ATOM 0 HD21 LEU A 215 9.244 0.688 1.022 1.00 0.24 H new ATOM 0 HD22 LEU A 215 8.198 2.021 1.567 1.00 0.24 H new ATOM 0 HD23 LEU A 215 9.763 1.736 2.363 1.00 0.24 H new ATOM 847 N ASN A 216 8.932 2.961 7.008 1.00 0.24 N ATOM 848 CA ASN A 216 8.450 3.741 8.137 1.00 0.26 C ATOM 849 C ASN A 216 8.575 5.232 7.830 1.00 0.22 C ATOM 850 O ASN A 216 9.224 5.991 8.550 1.00 0.29 O ATOM 851 CB ASN A 216 9.224 3.391 9.409 1.00 0.34 C ATOM 852 CG ASN A 216 8.570 3.951 10.658 1.00 0.69 C ATOM 853 OD1 ASN A 216 9.248 4.326 11.614 1.00 1.34 O ATOM 854 ND2 ASN A 216 7.244 3.991 10.666 1.00 0.64 N ATOM 0 H ASN A 216 9.887 2.617 7.110 1.00 0.24 H new ATOM 0 HA ASN A 216 7.400 3.500 8.303 1.00 0.26 H new ATOM 0 HB2 ASN A 216 9.301 2.307 9.497 1.00 0.34 H new ATOM 0 HB3 ASN A 216 10.240 3.777 9.330 1.00 0.34 H new ATOM 0 HD21 ASN A 216 6.749 4.342 11.486 1.00 0.64 H new ATOM 0 HD22 ASN A 216 6.719 3.670 9.852 1.00 0.64 H new ATOM 861 N ILE A 217 7.960 5.628 6.733 1.00 0.19 N ATOM 862 CA ILE A 217 7.947 7.011 6.296 1.00 0.19 C ATOM 863 C ILE A 217 6.522 7.429 5.978 1.00 0.18 C ATOM 864 O ILE A 217 5.591 6.664 6.219 1.00 0.19 O ATOM 865 CB ILE A 217 8.863 7.238 5.067 1.00 0.20 C ATOM 866 CG1 ILE A 217 8.870 6.019 4.128 1.00 0.27 C ATOM 867 CG2 ILE A 217 10.280 7.569 5.514 1.00 0.32 C ATOM 868 CD1 ILE A 217 7.559 5.764 3.413 1.00 0.89 C ATOM 0 H ILE A 217 7.452 4.995 6.115 1.00 0.19 H new ATOM 0 HA ILE A 217 8.338 7.626 7.107 1.00 0.19 H new ATOM 0 HB ILE A 217 8.460 8.083 4.509 1.00 0.20 H new ATOM 0 HG12 ILE A 217 9.654 6.156 3.383 1.00 0.27 H new ATOM 0 HG13 ILE A 217 9.131 5.133 4.707 1.00 0.27 H new ATOM 0 HG21 ILE A 217 10.910 7.725 4.639 1.00 0.32 H new ATOM 0 HG22 ILE A 217 10.268 8.475 6.119 1.00 0.32 H new ATOM 0 HG23 ILE A 217 10.677 6.743 6.104 1.00 0.32 H new ATOM 0 HD11 ILE A 217 7.658 4.886 2.774 1.00 0.89 H new ATOM 0 HD12 ILE A 217 6.772 5.592 4.147 1.00 0.89 H new ATOM 0 HD13 ILE A 217 7.303 6.630 2.803 1.00 0.89 H new ATOM 880 N SER A 218 6.333 8.628 5.461 1.00 0.19 N ATOM 881 CA SER A 218 4.998 9.082 5.132 1.00 0.20 C ATOM 882 C SER A 218 4.684 8.846 3.659 1.00 0.20 C ATOM 883 O SER A 218 5.538 8.378 2.901 1.00 0.21 O ATOM 884 CB SER A 218 4.837 10.554 5.494 1.00 0.23 C ATOM 885 OG SER A 218 5.128 10.765 6.863 1.00 1.10 O ATOM 0 H SER A 218 7.077 9.297 5.262 1.00 0.19 H new ATOM 0 HA SER A 218 4.285 8.501 5.718 1.00 0.20 H new ATOM 0 HB2 SER A 218 5.501 11.160 4.878 1.00 0.23 H new ATOM 0 HB3 SER A 218 3.819 10.878 5.279 1.00 0.23 H new ATOM 0 HG SER A 218 5.021 11.715 7.077 1.00 1.10 H new ATOM 891 N GLY A 219 3.469 9.181 3.254 1.00 0.21 N ATOM 892 CA GLY A 219 3.036 8.922 1.898 1.00 0.23 C ATOM 893 C GLY A 219 3.891 9.612 0.858 1.00 0.22 C ATOM 894 O GLY A 219 4.234 9.012 -0.161 1.00 0.22 O ATOM 0 H GLY A 219 2.771 9.631 3.846 1.00 0.21 H new ATOM 0 HA2 GLY A 219 3.052 7.847 1.717 1.00 0.23 H new ATOM 0 HA3 GLY A 219 2.002 9.249 1.785 1.00 0.23 H new ATOM 898 N ARG A 220 4.254 10.863 1.113 1.00 0.24 N ATOM 899 CA ARG A 220 5.027 11.635 0.163 1.00 0.25 C ATOM 900 C ARG A 220 6.422 11.046 -0.036 1.00 0.25 C ATOM 901 O ARG A 220 7.057 11.290 -1.049 1.00 0.32 O ATOM 902 CB ARG A 220 5.124 13.096 0.597 1.00 0.26 C ATOM 903 CG ARG A 220 5.990 13.343 1.820 1.00 1.23 C ATOM 904 CD ARG A 220 5.184 13.383 3.106 1.00 2.30 C ATOM 905 NE ARG A 220 6.051 13.424 4.278 1.00 3.08 N ATOM 906 CZ ARG A 220 5.720 13.990 5.437 1.00 4.20 C ATOM 907 NH1 ARG A 220 4.564 14.630 5.564 1.00 4.78 N ATOM 908 NH2 ARG A 220 6.552 13.930 6.466 1.00 5.01 N ATOM 0 H ARG A 220 4.022 11.360 1.973 1.00 0.24 H new ATOM 0 HA ARG A 220 4.504 11.590 -0.793 1.00 0.25 H new ATOM 0 HB2 ARG A 220 5.518 13.681 -0.234 1.00 0.26 H new ATOM 0 HB3 ARG A 220 4.119 13.467 0.800 1.00 0.26 H new ATOM 0 HG2 ARG A 220 6.744 12.559 1.892 1.00 1.23 H new ATOM 0 HG3 ARG A 220 6.522 14.286 1.699 1.00 1.23 H new ATOM 0 HD2 ARG A 220 4.534 14.258 3.102 1.00 2.30 H new ATOM 0 HD3 ARG A 220 4.539 12.506 3.160 1.00 2.30 H new ATOM 0 HE ARG A 220 6.971 12.991 4.205 1.00 3.08 H new ATOM 0 HH11 ARG A 220 3.925 14.690 4.772 1.00 4.78 H new ATOM 0 HH12 ARG A 220 4.315 15.062 6.454 1.00 4.78 H new ATOM 0 HH21 ARG A 220 7.447 13.450 6.371 1.00 5.01 H new ATOM 0 HH22 ARG A 220 6.298 14.364 7.353 1.00 5.01 H new ATOM 922 N GLU A 221 6.899 10.277 0.931 1.00 0.24 N ATOM 923 CA GLU A 221 8.139 9.535 0.753 1.00 0.27 C ATOM 924 C GLU A 221 7.872 8.262 -0.042 1.00 0.23 C ATOM 925 O GLU A 221 8.562 7.976 -1.019 1.00 0.23 O ATOM 926 CB GLU A 221 8.774 9.175 2.098 1.00 0.34 C ATOM 927 CG GLU A 221 9.466 10.328 2.812 1.00 0.84 C ATOM 928 CD GLU A 221 8.532 11.140 3.682 1.00 1.60 C ATOM 929 OE1 GLU A 221 8.012 10.594 4.677 1.00 2.45 O ATOM 930 OE2 GLU A 221 8.338 12.334 3.400 1.00 2.07 O ATOM 0 H GLU A 221 6.452 10.151 1.839 1.00 0.24 H new ATOM 0 HA GLU A 221 8.835 10.173 0.208 1.00 0.27 H new ATOM 0 HB2 GLU A 221 8.000 8.774 2.753 1.00 0.34 H new ATOM 0 HB3 GLU A 221 9.500 8.378 1.938 1.00 0.34 H new ATOM 0 HG2 GLU A 221 10.273 9.932 3.428 1.00 0.84 H new ATOM 0 HG3 GLU A 221 9.923 10.984 2.071 1.00 0.84 H new ATOM 937 N LEU A 222 6.854 7.523 0.375 1.00 0.21 N ATOM 938 CA LEU A 222 6.492 6.253 -0.252 1.00 0.20 C ATOM 939 C LEU A 222 6.176 6.440 -1.737 1.00 0.18 C ATOM 940 O LEU A 222 6.760 5.780 -2.592 1.00 0.20 O ATOM 941 CB LEU A 222 5.284 5.660 0.493 1.00 0.21 C ATOM 942 CG LEU A 222 4.961 4.181 0.224 1.00 0.21 C ATOM 943 CD1 LEU A 222 4.259 4.003 -1.115 1.00 0.19 C ATOM 944 CD2 LEU A 222 6.226 3.339 0.278 1.00 0.26 C ATOM 0 H LEU A 222 6.254 7.784 1.157 1.00 0.21 H new ATOM 0 HA LEU A 222 7.336 5.566 -0.187 1.00 0.20 H new ATOM 0 HB2 LEU A 222 5.452 5.782 1.563 1.00 0.21 H new ATOM 0 HB3 LEU A 222 4.404 6.251 0.239 1.00 0.21 H new ATOM 0 HG LEU A 222 4.282 3.841 1.006 1.00 0.21 H new ATOM 0 HD11 LEU A 222 4.044 2.946 -1.276 1.00 0.19 H new ATOM 0 HD12 LEU A 222 3.326 4.567 -1.115 1.00 0.19 H new ATOM 0 HD13 LEU A 222 4.903 4.368 -1.915 1.00 0.19 H new ATOM 0 HD21 LEU A 222 5.977 2.295 0.085 1.00 0.26 H new ATOM 0 HD22 LEU A 222 6.929 3.690 -0.477 1.00 0.26 H new ATOM 0 HD23 LEU A 222 6.680 3.427 1.265 1.00 0.26 H new ATOM 956 N CYS A 223 5.260 7.343 -2.040 1.00 0.18 N ATOM 957 CA CYS A 223 4.787 7.514 -3.408 1.00 0.18 C ATOM 958 C CYS A 223 5.841 8.155 -4.316 1.00 0.18 C ATOM 959 O CYS A 223 5.789 7.990 -5.538 1.00 0.21 O ATOM 960 CB CYS A 223 3.500 8.346 -3.413 1.00 0.21 C ATOM 961 SG CYS A 223 2.756 8.569 -5.045 1.00 0.71 S ATOM 0 H CYS A 223 4.828 7.969 -1.361 1.00 0.18 H new ATOM 0 HA CYS A 223 4.584 6.522 -3.811 1.00 0.18 H new ATOM 0 HB2 CYS A 223 2.771 7.868 -2.758 1.00 0.21 H new ATOM 0 HB3 CYS A 223 3.715 9.327 -2.989 1.00 0.21 H new ATOM 0 HG CYS A 223 3.669 8.432 -5.960 1.00 0.71 H new ATOM 967 N SER A 224 6.801 8.864 -3.735 1.00 0.17 N ATOM 968 CA SER A 224 7.788 9.584 -4.531 1.00 0.21 C ATOM 969 C SER A 224 8.988 8.718 -4.901 1.00 0.17 C ATOM 970 O SER A 224 9.837 9.147 -5.687 1.00 0.19 O ATOM 971 CB SER A 224 8.259 10.834 -3.795 1.00 0.30 C ATOM 972 OG SER A 224 7.188 11.735 -3.579 1.00 1.10 O ATOM 0 H SER A 224 6.917 8.956 -2.726 1.00 0.17 H new ATOM 0 HA SER A 224 7.293 9.870 -5.459 1.00 0.21 H new ATOM 0 HB2 SER A 224 8.699 10.552 -2.838 1.00 0.30 H new ATOM 0 HB3 SER A 224 9.041 11.326 -4.373 1.00 0.30 H new ATOM 0 HG SER A 224 6.780 11.555 -2.706 1.00 1.10 H new ATOM 978 N LEU A 225 9.075 7.510 -4.366 1.00 0.17 N ATOM 979 CA LEU A 225 10.152 6.621 -4.757 1.00 0.18 C ATOM 980 C LEU A 225 9.687 5.704 -5.873 1.00 0.19 C ATOM 981 O LEU A 225 8.547 5.238 -5.881 1.00 0.19 O ATOM 982 CB LEU A 225 10.710 5.825 -3.564 1.00 0.19 C ATOM 983 CG LEU A 225 9.695 5.058 -2.706 1.00 0.16 C ATOM 984 CD1 LEU A 225 9.394 3.691 -3.299 1.00 0.39 C ATOM 985 CD2 LEU A 225 10.210 4.915 -1.282 1.00 0.27 C ATOM 0 H LEU A 225 8.427 7.131 -3.675 1.00 0.17 H new ATOM 0 HA LEU A 225 10.976 7.231 -5.128 1.00 0.18 H new ATOM 0 HB2 LEU A 225 11.441 5.111 -3.944 1.00 0.19 H new ATOM 0 HB3 LEU A 225 11.248 6.517 -2.916 1.00 0.19 H new ATOM 0 HG LEU A 225 8.767 5.629 -2.691 1.00 0.16 H new ATOM 0 HD11 LEU A 225 8.672 3.172 -2.669 1.00 0.39 H new ATOM 0 HD12 LEU A 225 8.981 3.812 -4.300 1.00 0.39 H new ATOM 0 HD13 LEU A 225 10.313 3.108 -3.354 1.00 0.39 H new ATOM 0 HD21 LEU A 225 9.480 4.369 -0.684 1.00 0.27 H new ATOM 0 HD22 LEU A 225 11.154 4.370 -1.289 1.00 0.27 H new ATOM 0 HD23 LEU A 225 10.366 5.904 -0.850 1.00 0.27 H new ATOM 997 N ASN A 226 10.563 5.478 -6.832 1.00 0.22 N ATOM 998 CA ASN A 226 10.280 4.590 -7.944 1.00 0.25 C ATOM 999 C ASN A 226 10.485 3.148 -7.500 1.00 0.21 C ATOM 1000 O ASN A 226 11.172 2.903 -6.505 1.00 0.23 O ATOM 1001 CB ASN A 226 11.192 4.935 -9.121 1.00 0.40 C ATOM 1002 CG ASN A 226 12.645 5.081 -8.707 1.00 1.04 C ATOM 1003 OD1 ASN A 226 13.072 6.146 -8.261 1.00 2.01 O ATOM 1004 ND2 ASN A 226 13.415 4.026 -8.873 1.00 1.31 N ATOM 0 H ASN A 226 11.490 5.903 -6.863 1.00 0.22 H new ATOM 0 HA ASN A 226 9.246 4.712 -8.265 1.00 0.25 H new ATOM 0 HB2 ASN A 226 11.110 4.157 -9.880 1.00 0.40 H new ATOM 0 HB3 ASN A 226 10.853 5.864 -9.579 1.00 0.40 H new ATOM 0 HD21 ASN A 226 14.404 4.073 -8.629 1.00 1.31 H new ATOM 0 HD22 ASN A 226 13.022 3.162 -9.246 1.00 1.31 H new ATOM 1011 N GLN A 227 9.848 2.203 -8.217 1.00 0.20 N ATOM 1012 CA GLN A 227 9.807 0.790 -7.834 1.00 0.19 C ATOM 1013 C GLN A 227 11.135 0.264 -7.296 1.00 0.18 C ATOM 1014 O GLN A 227 11.165 -0.514 -6.351 1.00 0.19 O ATOM 1015 CB GLN A 227 9.388 -0.075 -9.017 1.00 0.22 C ATOM 1016 CG GLN A 227 8.972 -1.470 -8.588 1.00 0.29 C ATOM 1017 CD GLN A 227 7.728 -1.454 -7.723 1.00 0.52 C ATOM 1018 OE1 GLN A 227 6.607 -1.546 -8.220 1.00 1.30 O ATOM 1019 NE2 GLN A 227 7.922 -1.331 -6.419 1.00 1.13 N ATOM 0 H GLN A 227 9.347 2.405 -9.082 1.00 0.20 H new ATOM 0 HA GLN A 227 9.075 0.728 -7.029 1.00 0.19 H new ATOM 0 HB2 GLN A 227 8.561 0.404 -9.540 1.00 0.22 H new ATOM 0 HB3 GLN A 227 10.214 -0.145 -9.724 1.00 0.22 H new ATOM 0 HG2 GLN A 227 8.790 -2.081 -9.472 1.00 0.29 H new ATOM 0 HG3 GLN A 227 9.789 -1.938 -8.039 1.00 0.29 H new ATOM 0 HE21 GLN A 227 8.870 -1.258 -6.049 1.00 1.13 H new ATOM 0 HE22 GLN A 227 7.124 -1.310 -5.784 1.00 1.13 H new ATOM 1028 N GLU A 228 12.226 0.740 -7.888 1.00 0.20 N ATOM 1029 CA GLU A 228 13.567 0.267 -7.580 1.00 0.23 C ATOM 1030 C GLU A 228 13.988 0.725 -6.199 1.00 0.18 C ATOM 1031 O GLU A 228 14.507 -0.068 -5.419 1.00 0.19 O ATOM 1032 CB GLU A 228 14.569 0.795 -8.606 1.00 0.34 C ATOM 1033 CG GLU A 228 14.200 0.491 -10.050 1.00 1.14 C ATOM 1034 CD GLU A 228 13.437 1.625 -10.702 1.00 1.66 C ATOM 1035 OE1 GLU A 228 12.302 1.908 -10.268 1.00 2.29 O ATOM 1036 OE2 GLU A 228 13.944 2.213 -11.678 1.00 1.83 O ATOM 0 H GLU A 228 12.202 1.470 -8.600 1.00 0.20 H new ATOM 0 HA GLU A 228 13.554 -0.822 -7.612 1.00 0.23 H new ATOM 0 HB2 GLU A 228 14.661 1.874 -8.486 1.00 0.34 H new ATOM 0 HB3 GLU A 228 15.549 0.366 -8.395 1.00 0.34 H new ATOM 0 HG2 GLU A 228 15.108 0.292 -10.620 1.00 1.14 H new ATOM 0 HG3 GLU A 228 13.597 -0.416 -10.085 1.00 1.14 H new ATOM 1043 N ASP A 229 13.771 1.994 -5.899 1.00 0.18 N ATOM 1044 CA ASP A 229 14.081 2.488 -4.561 1.00 0.20 C ATOM 1045 C ASP A 229 13.330 1.684 -3.512 1.00 0.19 C ATOM 1046 O ASP A 229 13.830 1.466 -2.412 1.00 0.22 O ATOM 1047 CB ASP A 229 13.777 3.977 -4.421 1.00 0.25 C ATOM 1048 CG ASP A 229 14.433 4.577 -3.195 1.00 0.37 C ATOM 1049 OD1 ASP A 229 15.633 4.910 -3.248 1.00 0.71 O ATOM 1050 OD2 ASP A 229 13.747 4.704 -2.157 1.00 0.54 O ATOM 0 H ASP A 229 13.391 2.689 -6.542 1.00 0.18 H new ATOM 0 HA ASP A 229 15.152 2.360 -4.402 1.00 0.20 H new ATOM 0 HB2 ASP A 229 14.123 4.503 -5.311 1.00 0.25 H new ATOM 0 HB3 ASP A 229 12.698 4.123 -4.363 1.00 0.25 H new ATOM 1055 N PHE A 230 12.144 1.206 -3.869 1.00 0.17 N ATOM 1056 CA PHE A 230 11.423 0.290 -2.999 1.00 0.17 C ATOM 1057 C PHE A 230 12.087 -1.075 -3.031 1.00 0.18 C ATOM 1058 O PHE A 230 12.352 -1.657 -1.993 1.00 0.21 O ATOM 1059 CB PHE A 230 9.963 0.138 -3.417 1.00 0.17 C ATOM 1060 CG PHE A 230 9.227 -0.935 -2.650 1.00 0.17 C ATOM 1061 CD1 PHE A 230 8.678 -0.673 -1.401 1.00 0.19 C ATOM 1062 CD2 PHE A 230 9.068 -2.205 -3.188 1.00 0.19 C ATOM 1063 CE1 PHE A 230 7.986 -1.655 -0.713 1.00 0.23 C ATOM 1064 CE2 PHE A 230 8.380 -3.187 -2.498 1.00 0.21 C ATOM 1065 CZ PHE A 230 7.837 -2.911 -1.261 1.00 0.22 C ATOM 0 H PHE A 230 11.668 1.434 -4.742 1.00 0.17 H new ATOM 0 HA PHE A 230 11.450 0.706 -1.992 1.00 0.17 H new ATOM 0 HB2 PHE A 230 9.452 1.090 -3.276 1.00 0.17 H new ATOM 0 HB3 PHE A 230 9.920 -0.093 -4.481 1.00 0.17 H new ATOM 0 HD1 PHE A 230 8.792 0.307 -0.962 1.00 0.19 H new ATOM 0 HD2 PHE A 230 9.487 -2.429 -4.158 1.00 0.19 H new ATOM 0 HE1 PHE A 230 7.562 -1.436 0.256 1.00 0.23 H new ATOM 0 HE2 PHE A 230 8.268 -4.171 -2.929 1.00 0.21 H new ATOM 0 HZ PHE A 230 7.297 -3.676 -0.723 1.00 0.22 H new ATOM 1075 N PHE A 231 12.391 -1.561 -4.234 1.00 0.17 N ATOM 1076 CA PHE A 231 12.854 -2.935 -4.417 1.00 0.20 C ATOM 1077 C PHE A 231 14.240 -3.141 -3.822 1.00 0.25 C ATOM 1078 O PHE A 231 14.686 -4.274 -3.661 1.00 0.41 O ATOM 1079 CB PHE A 231 12.860 -3.314 -5.900 1.00 0.21 C ATOM 1080 CG PHE A 231 11.661 -4.109 -6.338 1.00 0.20 C ATOM 1081 CD1 PHE A 231 10.380 -3.720 -5.986 1.00 0.33 C ATOM 1082 CD2 PHE A 231 11.821 -5.249 -7.112 1.00 0.44 C ATOM 1083 CE1 PHE A 231 9.281 -4.452 -6.396 1.00 0.36 C ATOM 1084 CE2 PHE A 231 10.726 -5.984 -7.525 1.00 0.45 C ATOM 1085 CZ PHE A 231 9.455 -5.584 -7.166 1.00 0.27 C ATOM 0 H PHE A 231 12.325 -1.022 -5.097 1.00 0.17 H new ATOM 0 HA PHE A 231 12.157 -3.585 -3.889 1.00 0.20 H new ATOM 0 HB2 PHE A 231 12.915 -2.403 -6.496 1.00 0.21 H new ATOM 0 HB3 PHE A 231 13.761 -3.889 -6.113 1.00 0.21 H new ATOM 0 HD1 PHE A 231 10.237 -2.835 -5.384 1.00 0.33 H new ATOM 0 HD2 PHE A 231 12.814 -5.566 -7.395 1.00 0.44 H new ATOM 0 HE1 PHE A 231 8.287 -4.138 -6.114 1.00 0.36 H new ATOM 0 HE2 PHE A 231 10.865 -6.870 -8.127 1.00 0.45 H new ATOM 0 HZ PHE A 231 8.597 -6.156 -7.487 1.00 0.27 H new ATOM 1095 N GLN A 232 14.941 -2.062 -3.517 1.00 0.20 N ATOM 1096 CA GLN A 232 16.224 -2.198 -2.852 1.00 0.23 C ATOM 1097 C GLN A 232 15.993 -2.240 -1.350 1.00 0.25 C ATOM 1098 O GLN A 232 16.564 -3.073 -0.648 1.00 0.28 O ATOM 1099 CB GLN A 232 17.188 -1.064 -3.213 1.00 0.24 C ATOM 1100 CG GLN A 232 17.328 -0.798 -4.706 1.00 0.28 C ATOM 1101 CD GLN A 232 17.588 -2.048 -5.526 1.00 0.33 C ATOM 1102 OE1 GLN A 232 18.732 -2.461 -5.707 1.00 0.37 O ATOM 1103 NE2 GLN A 232 16.525 -2.637 -6.053 1.00 0.36 N ATOM 0 H GLN A 232 14.652 -1.104 -3.714 1.00 0.20 H new ATOM 0 HA GLN A 232 16.690 -3.124 -3.190 1.00 0.23 H new ATOM 0 HB2 GLN A 232 16.851 -0.150 -2.725 1.00 0.24 H new ATOM 0 HB3 GLN A 232 18.172 -1.298 -2.806 1.00 0.24 H new ATOM 0 HG2 GLN A 232 16.418 -0.319 -5.068 1.00 0.28 H new ATOM 0 HG3 GLN A 232 18.144 -0.093 -4.866 1.00 0.28 H new ATOM 0 HE21 GLN A 232 15.594 -2.260 -5.877 1.00 0.36 H new ATOM 0 HE22 GLN A 232 16.638 -3.467 -6.635 1.00 0.36 H new ATOM 1112 N ARG A 233 15.155 -1.324 -0.868 1.00 0.24 N ATOM 1113 CA ARG A 233 14.726 -1.308 0.526 1.00 0.27 C ATOM 1114 C ARG A 233 14.022 -2.619 0.887 1.00 0.29 C ATOM 1115 O ARG A 233 14.123 -3.104 2.012 1.00 0.33 O ATOM 1116 CB ARG A 233 13.743 -0.152 0.745 1.00 0.27 C ATOM 1117 CG ARG A 233 14.329 1.232 0.508 1.00 0.27 C ATOM 1118 CD ARG A 233 13.294 2.320 0.773 1.00 0.40 C ATOM 1119 NE ARG A 233 13.800 3.660 0.469 1.00 0.69 N ATOM 1120 CZ ARG A 233 13.874 4.650 1.361 1.00 0.67 C ATOM 1121 NH1 ARG A 233 13.462 4.458 2.611 1.00 0.93 N ATOM 1122 NH2 ARG A 233 14.354 5.835 0.998 1.00 1.39 N ATOM 0 H ARG A 233 14.756 -0.574 -1.433 1.00 0.24 H new ATOM 0 HA ARG A 233 15.607 -1.184 1.156 1.00 0.27 H new ATOM 0 HB2 ARG A 233 12.889 -0.289 0.082 1.00 0.27 H new ATOM 0 HB3 ARG A 233 13.365 -0.202 1.766 1.00 0.27 H new ATOM 0 HG2 ARG A 233 15.192 1.381 1.157 1.00 0.27 H new ATOM 0 HG3 ARG A 233 14.686 1.308 -0.519 1.00 0.27 H new ATOM 0 HD2 ARG A 233 12.405 2.126 0.173 1.00 0.40 H new ATOM 0 HD3 ARG A 233 12.988 2.279 1.818 1.00 0.40 H new ATOM 0 HE ARG A 233 14.115 3.848 -0.483 1.00 0.69 H new ATOM 0 HH11 ARG A 233 13.088 3.551 2.891 1.00 0.93 H new ATOM 0 HH12 ARG A 233 13.520 5.217 3.290 1.00 0.93 H new ATOM 0 HH21 ARG A 233 14.665 5.987 0.039 1.00 1.39 H new ATOM 0 HH22 ARG A 233 14.411 6.592 1.679 1.00 1.39 H new ATOM 1136 N VAL A 234 13.322 -3.186 -0.102 1.00 0.27 N ATOM 1137 CA VAL A 234 12.444 -4.343 0.057 1.00 0.27 C ATOM 1138 C VAL A 234 11.964 -4.797 -1.331 1.00 0.25 C ATOM 1139 O VAL A 234 11.098 -4.175 -1.940 1.00 0.24 O ATOM 1140 CB VAL A 234 11.228 -4.027 0.982 1.00 0.27 C ATOM 1141 CG1 VAL A 234 10.782 -2.579 0.837 1.00 0.28 C ATOM 1142 CG2 VAL A 234 10.052 -4.956 0.703 1.00 0.26 C ATOM 0 H VAL A 234 13.354 -2.840 -1.061 1.00 0.27 H new ATOM 0 HA VAL A 234 13.006 -5.144 0.537 1.00 0.27 H new ATOM 0 HB VAL A 234 11.563 -4.191 2.006 1.00 0.27 H new ATOM 0 HG11 VAL A 234 9.933 -2.392 1.495 1.00 0.28 H new ATOM 0 HG12 VAL A 234 11.604 -1.916 1.108 1.00 0.28 H new ATOM 0 HG13 VAL A 234 10.489 -2.390 -0.196 1.00 0.28 H new ATOM 0 HG21 VAL A 234 9.225 -4.705 1.367 1.00 0.26 H new ATOM 0 HG22 VAL A 234 9.734 -4.840 -0.333 1.00 0.26 H new ATOM 0 HG23 VAL A 234 10.355 -5.989 0.876 1.00 0.26 H new ATOM 1152 N PRO A 235 12.546 -5.872 -1.865 1.00 0.27 N ATOM 1153 CA PRO A 235 12.297 -6.316 -3.238 1.00 0.27 C ATOM 1154 C PRO A 235 11.027 -7.143 -3.414 1.00 0.30 C ATOM 1155 O PRO A 235 10.451 -7.175 -4.498 1.00 0.32 O ATOM 1156 CB PRO A 235 13.525 -7.179 -3.568 1.00 0.30 C ATOM 1157 CG PRO A 235 14.375 -7.207 -2.332 1.00 0.34 C ATOM 1158 CD PRO A 235 13.512 -6.737 -1.196 1.00 0.33 C ATOM 0 HA PRO A 235 12.150 -5.456 -3.891 1.00 0.27 H new ATOM 0 HB2 PRO A 235 13.224 -8.187 -3.854 1.00 0.30 H new ATOM 0 HB3 PRO A 235 14.078 -6.760 -4.409 1.00 0.30 H new ATOM 0 HG2 PRO A 235 14.747 -8.214 -2.143 1.00 0.34 H new ATOM 0 HG3 PRO A 235 15.246 -6.562 -2.448 1.00 0.34 H new ATOM 0 HD2 PRO A 235 13.026 -7.568 -0.686 1.00 0.33 H new ATOM 0 HD3 PRO A 235 14.089 -6.196 -0.446 1.00 0.33 H new ATOM 1166 N ARG A 236 10.577 -7.804 -2.365 1.00 0.31 N ATOM 1167 CA ARG A 236 9.457 -8.732 -2.495 1.00 0.31 C ATOM 1168 C ARG A 236 8.096 -8.049 -2.300 1.00 0.28 C ATOM 1169 O ARG A 236 7.139 -8.684 -1.861 1.00 0.32 O ATOM 1170 CB ARG A 236 9.609 -9.909 -1.511 1.00 0.39 C ATOM 1171 CG ARG A 236 9.308 -9.571 -0.052 1.00 0.67 C ATOM 1172 CD ARG A 236 10.289 -8.565 0.530 1.00 1.04 C ATOM 1173 NE ARG A 236 11.650 -9.092 0.601 1.00 1.78 N ATOM 1174 CZ ARG A 236 12.573 -8.647 1.451 1.00 2.75 C ATOM 1175 NH1 ARG A 236 12.266 -7.696 2.317 1.00 3.36 N ATOM 1176 NH2 ARG A 236 13.795 -9.164 1.446 1.00 3.49 N ATOM 0 H ARG A 236 10.960 -7.722 -1.423 1.00 0.31 H new ATOM 0 HA ARG A 236 9.482 -9.111 -3.517 1.00 0.31 H new ATOM 0 HB2 ARG A 236 8.946 -10.715 -1.826 1.00 0.39 H new ATOM 0 HB3 ARG A 236 10.628 -10.290 -1.578 1.00 0.39 H new ATOM 0 HG2 ARG A 236 8.297 -9.172 0.023 1.00 0.67 H new ATOM 0 HG3 ARG A 236 9.335 -10.485 0.542 1.00 0.67 H new ATOM 0 HD2 ARG A 236 10.283 -7.661 -0.080 1.00 1.04 H new ATOM 0 HD3 ARG A 236 9.961 -8.278 1.529 1.00 1.04 H new ATOM 0 HE ARG A 236 11.908 -9.844 -0.038 1.00 1.78 H new ATOM 0 HH11 ARG A 236 11.324 -7.305 2.333 1.00 3.36 H new ATOM 0 HH12 ARG A 236 12.971 -7.353 2.969 1.00 3.36 H new ATOM 0 HH21 ARG A 236 14.032 -9.907 0.788 1.00 3.49 H new ATOM 0 HH22 ARG A 236 14.498 -8.819 2.100 1.00 3.49 H new ATOM 1190 N GLY A 237 7.983 -6.765 -2.638 1.00 0.23 N ATOM 1191 CA GLY A 237 6.713 -6.080 -2.451 1.00 0.20 C ATOM 1192 C GLY A 237 6.030 -5.679 -3.749 1.00 0.15 C ATOM 1193 O GLY A 237 5.242 -4.740 -3.763 1.00 0.15 O ATOM 0 H GLY A 237 8.733 -6.196 -3.031 1.00 0.23 H new ATOM 0 HA2 GLY A 237 6.043 -6.727 -1.885 1.00 0.20 H new ATOM 0 HA3 GLY A 237 6.879 -5.187 -1.849 1.00 0.20 H new ATOM 1197 N GLU A 238 6.312 -6.401 -4.834 1.00 0.16 N ATOM 1198 CA GLU A 238 5.695 -6.137 -6.143 1.00 0.15 C ATOM 1199 C GLU A 238 4.160 -6.094 -6.075 1.00 0.13 C ATOM 1200 O GLU A 238 3.521 -5.232 -6.681 1.00 0.13 O ATOM 1201 CB GLU A 238 6.136 -7.204 -7.148 1.00 0.19 C ATOM 1202 CG GLU A 238 5.791 -8.622 -6.724 1.00 1.06 C ATOM 1203 CD GLU A 238 6.165 -9.650 -7.764 1.00 1.37 C ATOM 1204 OE1 GLU A 238 5.682 -9.548 -8.908 1.00 1.55 O ATOM 1205 OE2 GLU A 238 6.950 -10.566 -7.444 1.00 1.74 O ATOM 0 H GLU A 238 6.969 -7.181 -4.835 1.00 0.16 H new ATOM 0 HA GLU A 238 6.033 -5.152 -6.465 1.00 0.15 H new ATOM 0 HB2 GLU A 238 5.669 -6.998 -8.111 1.00 0.19 H new ATOM 0 HB3 GLU A 238 7.214 -7.130 -7.294 1.00 0.19 H new ATOM 0 HG2 GLU A 238 6.305 -8.852 -5.791 1.00 1.06 H new ATOM 0 HG3 GLU A 238 4.721 -8.687 -6.524 1.00 1.06 H new ATOM 1212 N ILE A 239 3.595 -7.015 -5.314 1.00 0.12 N ATOM 1213 CA ILE A 239 2.147 -7.178 -5.242 1.00 0.12 C ATOM 1214 C ILE A 239 1.508 -5.999 -4.481 1.00 0.12 C ATOM 1215 O ILE A 239 0.379 -5.592 -4.771 1.00 0.12 O ATOM 1216 CB ILE A 239 1.792 -8.544 -4.600 1.00 0.13 C ATOM 1217 CG1 ILE A 239 0.626 -9.220 -5.340 1.00 0.18 C ATOM 1218 CG2 ILE A 239 1.487 -8.405 -3.122 1.00 0.25 C ATOM 1219 CD1 ILE A 239 -0.663 -8.426 -5.354 1.00 0.26 C ATOM 0 H ILE A 239 4.119 -7.668 -4.731 1.00 0.12 H new ATOM 0 HA ILE A 239 1.736 -7.173 -6.252 1.00 0.12 H new ATOM 0 HB ILE A 239 2.669 -9.184 -4.696 1.00 0.13 H new ATOM 0 HG12 ILE A 239 0.930 -9.411 -6.369 1.00 0.18 H new ATOM 0 HG13 ILE A 239 0.434 -10.189 -4.879 1.00 0.18 H new ATOM 0 HG21 ILE A 239 1.243 -9.383 -2.707 1.00 0.25 H new ATOM 0 HG22 ILE A 239 2.358 -8.000 -2.607 1.00 0.25 H new ATOM 0 HG23 ILE A 239 0.640 -7.732 -2.987 1.00 0.25 H new ATOM 0 HD11 ILE A 239 -1.427 -8.982 -5.898 1.00 0.26 H new ATOM 0 HD12 ILE A 239 -0.997 -8.257 -4.330 1.00 0.26 H new ATOM 0 HD13 ILE A 239 -0.494 -7.467 -5.844 1.00 0.26 H new ATOM 1231 N LEU A 240 2.266 -5.430 -3.548 1.00 0.13 N ATOM 1232 CA LEU A 240 1.812 -4.275 -2.773 1.00 0.14 C ATOM 1233 C LEU A 240 1.476 -3.117 -3.707 1.00 0.14 C ATOM 1234 O LEU A 240 0.373 -2.576 -3.686 1.00 0.14 O ATOM 1235 CB LEU A 240 2.897 -3.851 -1.772 1.00 0.18 C ATOM 1236 CG LEU A 240 2.773 -4.445 -0.366 1.00 0.24 C ATOM 1237 CD1 LEU A 240 4.042 -4.180 0.427 1.00 0.45 C ATOM 1238 CD2 LEU A 240 1.569 -3.858 0.361 1.00 0.25 C ATOM 0 H LEU A 240 3.204 -5.751 -3.308 1.00 0.13 H new ATOM 0 HA LEU A 240 0.914 -4.552 -2.220 1.00 0.14 H new ATOM 0 HB2 LEU A 240 3.869 -4.129 -2.179 1.00 0.18 H new ATOM 0 HB3 LEU A 240 2.884 -2.764 -1.690 1.00 0.18 H new ATOM 0 HG LEU A 240 2.630 -5.522 -0.458 1.00 0.24 H new ATOM 0 HD11 LEU A 240 3.943 -4.607 1.425 1.00 0.45 H new ATOM 0 HD12 LEU A 240 4.891 -4.638 -0.081 1.00 0.45 H new ATOM 0 HD13 LEU A 240 4.204 -3.105 0.506 1.00 0.45 H new ATOM 0 HD21 LEU A 240 1.498 -4.293 1.358 1.00 0.25 H new ATOM 0 HD22 LEU A 240 1.685 -2.777 0.444 1.00 0.25 H new ATOM 0 HD23 LEU A 240 0.661 -4.083 -0.198 1.00 0.25 H new ATOM 1250 N TRP A 241 2.436 -2.784 -4.551 1.00 0.14 N ATOM 1251 CA TRP A 241 2.317 -1.685 -5.501 1.00 0.15 C ATOM 1252 C TRP A 241 1.156 -1.856 -6.462 1.00 0.15 C ATOM 1253 O TRP A 241 0.520 -0.891 -6.872 1.00 0.16 O ATOM 1254 CB TRP A 241 3.626 -1.591 -6.256 1.00 0.17 C ATOM 1255 CG TRP A 241 4.679 -1.157 -5.303 1.00 0.16 C ATOM 1256 CD1 TRP A 241 5.534 -1.956 -4.617 1.00 0.17 C ATOM 1257 CD2 TRP A 241 4.928 0.181 -4.856 1.00 0.16 C ATOM 1258 NE1 TRP A 241 6.307 -1.203 -3.781 1.00 0.17 N ATOM 1259 CE2 TRP A 241 5.962 0.112 -3.913 1.00 0.17 C ATOM 1260 CE3 TRP A 241 4.387 1.433 -5.169 1.00 0.18 C ATOM 1261 CZ2 TRP A 241 6.466 1.233 -3.273 1.00 0.18 C ATOM 1262 CZ3 TRP A 241 4.892 2.551 -4.533 1.00 0.19 C ATOM 1263 CH2 TRP A 241 5.923 2.445 -3.594 1.00 0.19 C ATOM 0 H TRP A 241 3.330 -3.272 -4.599 1.00 0.14 H new ATOM 0 HA TRP A 241 2.111 -0.766 -4.952 1.00 0.15 H new ATOM 0 HB2 TRP A 241 3.883 -2.556 -6.694 1.00 0.17 H new ATOM 0 HB3 TRP A 241 3.541 -0.881 -7.078 1.00 0.17 H new ATOM 0 HD1 TRP A 241 5.594 -3.030 -4.717 1.00 0.17 H new ATOM 0 HE1 TRP A 241 7.028 -1.565 -3.157 1.00 0.17 H new ATOM 0 HE3 TRP A 241 3.591 1.524 -5.893 1.00 0.18 H new ATOM 0 HZ2 TRP A 241 7.260 1.151 -2.546 1.00 0.18 H new ATOM 0 HZ3 TRP A 241 4.483 3.523 -4.765 1.00 0.19 H new ATOM 0 HH2 TRP A 241 6.297 3.337 -3.114 1.00 0.19 H new ATOM 1274 N SER A 242 0.900 -3.107 -6.805 1.00 0.15 N ATOM 1275 CA SER A 242 -0.168 -3.449 -7.725 1.00 0.15 C ATOM 1276 C SER A 242 -1.508 -2.991 -7.166 1.00 0.14 C ATOM 1277 O SER A 242 -2.305 -2.358 -7.862 1.00 0.14 O ATOM 1278 CB SER A 242 -0.185 -4.960 -7.947 1.00 0.16 C ATOM 1279 OG SER A 242 -1.208 -5.339 -8.851 1.00 0.24 O ATOM 0 H SER A 242 1.424 -3.909 -6.455 1.00 0.15 H new ATOM 0 HA SER A 242 0.004 -2.946 -8.676 1.00 0.15 H new ATOM 0 HB2 SER A 242 0.782 -5.283 -8.333 1.00 0.16 H new ATOM 0 HB3 SER A 242 -0.333 -5.468 -6.994 1.00 0.16 H new ATOM 0 HG SER A 242 -1.192 -6.311 -8.974 1.00 0.24 H new ATOM 1285 N HIS A 243 -1.738 -3.308 -5.899 1.00 0.13 N ATOM 1286 CA HIS A 243 -2.949 -2.880 -5.218 1.00 0.13 C ATOM 1287 C HIS A 243 -2.919 -1.369 -5.023 1.00 0.13 C ATOM 1288 O HIS A 243 -3.950 -0.706 -5.050 1.00 0.13 O ATOM 1289 CB HIS A 243 -3.088 -3.600 -3.870 1.00 0.15 C ATOM 1290 CG HIS A 243 -4.246 -3.133 -3.038 1.00 0.15 C ATOM 1291 ND1 HIS A 243 -4.128 -2.984 -1.681 1.00 0.17 N ATOM 1292 CD2 HIS A 243 -5.510 -2.807 -3.410 1.00 0.15 C ATOM 1293 CE1 HIS A 243 -5.307 -2.578 -1.257 1.00 0.17 C ATOM 1294 NE2 HIS A 243 -6.179 -2.456 -2.267 1.00 0.17 N ATOM 0 H HIS A 243 -1.102 -3.860 -5.324 1.00 0.13 H new ATOM 0 HA HIS A 243 -3.814 -3.139 -5.829 1.00 0.13 H new ATOM 0 HB2 HIS A 243 -3.194 -4.670 -4.052 1.00 0.15 H new ATOM 0 HB3 HIS A 243 -2.168 -3.463 -3.301 1.00 0.15 H new ATOM 0 HD1 HIS A 243 -3.297 -3.153 -1.115 1.00 0.17 H new ATOM 0 HD2 HIS A 243 -5.911 -2.821 -4.413 1.00 0.15 H new ATOM 0 HE1 HIS A 243 -5.542 -2.369 -0.224 1.00 0.17 H new ATOM 1302 N LEU A 244 -1.720 -0.836 -4.872 1.00 0.13 N ATOM 1303 CA LEU A 244 -1.553 0.588 -4.634 1.00 0.12 C ATOM 1304 C LEU A 244 -1.915 1.390 -5.880 1.00 0.13 C ATOM 1305 O LEU A 244 -2.592 2.417 -5.785 1.00 0.12 O ATOM 1306 CB LEU A 244 -0.137 0.916 -4.165 1.00 0.13 C ATOM 1307 CG LEU A 244 0.160 2.406 -4.040 1.00 0.15 C ATOM 1308 CD1 LEU A 244 -0.932 3.094 -3.238 1.00 0.17 C ATOM 1309 CD2 LEU A 244 1.517 2.626 -3.392 1.00 0.17 C ATOM 0 H LEU A 244 -0.849 -1.365 -4.910 1.00 0.13 H new ATOM 0 HA LEU A 244 -2.236 0.872 -3.834 1.00 0.12 H new ATOM 0 HB2 LEU A 244 0.030 0.443 -3.197 1.00 0.13 H new ATOM 0 HB3 LEU A 244 0.574 0.474 -4.863 1.00 0.13 H new ATOM 0 HG LEU A 244 0.184 2.841 -5.039 1.00 0.15 H new ATOM 0 HD11 LEU A 244 -0.708 4.158 -3.156 1.00 0.17 H new ATOM 0 HD12 LEU A 244 -1.890 2.963 -3.741 1.00 0.17 H new ATOM 0 HD13 LEU A 244 -0.982 2.656 -2.241 1.00 0.17 H new ATOM 0 HD21 LEU A 244 1.712 3.695 -3.311 1.00 0.17 H new ATOM 0 HD22 LEU A 244 1.522 2.180 -2.398 1.00 0.17 H new ATOM 0 HD23 LEU A 244 2.291 2.161 -4.002 1.00 0.17 H new ATOM 1321 N GLU A 245 -1.468 0.930 -7.042 1.00 0.15 N ATOM 1322 CA GLU A 245 -1.898 1.534 -8.294 1.00 0.18 C ATOM 1323 C GLU A 245 -3.420 1.532 -8.370 1.00 0.17 C ATOM 1324 O GLU A 245 -4.038 2.546 -8.660 1.00 0.21 O ATOM 1325 CB GLU A 245 -1.304 0.796 -9.494 1.00 0.25 C ATOM 1326 CG GLU A 245 0.209 0.907 -9.595 1.00 0.34 C ATOM 1327 CD GLU A 245 0.748 0.288 -10.867 1.00 0.59 C ATOM 1328 OE1 GLU A 245 0.379 0.763 -11.962 1.00 0.83 O ATOM 1329 OE2 GLU A 245 1.539 -0.673 -10.784 1.00 0.76 O ATOM 0 H GLU A 245 -0.817 0.151 -7.143 1.00 0.15 H new ATOM 0 HA GLU A 245 -1.538 2.562 -8.323 1.00 0.18 H new ATOM 0 HB2 GLU A 245 -1.578 -0.257 -9.433 1.00 0.25 H new ATOM 0 HB3 GLU A 245 -1.750 1.189 -10.408 1.00 0.25 H new ATOM 0 HG2 GLU A 245 0.497 1.957 -9.555 1.00 0.34 H new ATOM 0 HG3 GLU A 245 0.665 0.418 -8.734 1.00 0.34 H new ATOM 1336 N LEU A 246 -4.006 0.393 -8.036 1.00 0.16 N ATOM 1337 CA LEU A 246 -5.455 0.225 -8.068 1.00 0.16 C ATOM 1338 C LEU A 246 -6.135 1.120 -7.028 1.00 0.16 C ATOM 1339 O LEU A 246 -7.228 1.627 -7.267 1.00 0.17 O ATOM 1340 CB LEU A 246 -5.812 -1.242 -7.835 1.00 0.17 C ATOM 1341 CG LEU A 246 -7.278 -1.609 -8.044 1.00 0.21 C ATOM 1342 CD1 LEU A 246 -7.606 -1.653 -9.526 1.00 0.30 C ATOM 1343 CD2 LEU A 246 -7.587 -2.944 -7.385 1.00 0.22 C ATOM 0 H LEU A 246 -3.496 -0.438 -7.736 1.00 0.16 H new ATOM 0 HA LEU A 246 -5.818 0.525 -9.051 1.00 0.16 H new ATOM 0 HB2 LEU A 246 -5.205 -1.855 -8.502 1.00 0.17 H new ATOM 0 HB3 LEU A 246 -5.532 -1.507 -6.815 1.00 0.17 H new ATOM 0 HG LEU A 246 -7.900 -0.844 -7.579 1.00 0.21 H new ATOM 0 HD11 LEU A 246 -8.655 -1.916 -9.659 1.00 0.30 H new ATOM 0 HD12 LEU A 246 -7.418 -0.675 -9.969 1.00 0.30 H new ATOM 0 HD13 LEU A 246 -6.980 -2.399 -10.015 1.00 0.30 H new ATOM 0 HD21 LEU A 246 -8.636 -3.193 -7.542 1.00 0.22 H new ATOM 0 HD22 LEU A 246 -6.960 -3.720 -7.824 1.00 0.22 H new ATOM 0 HD23 LEU A 246 -7.386 -2.877 -6.316 1.00 0.22 H new ATOM 1355 N LEU A 247 -5.487 1.320 -5.895 1.00 0.17 N ATOM 1356 CA LEU A 247 -5.948 2.293 -4.909 1.00 0.16 C ATOM 1357 C LEU A 247 -6.065 3.687 -5.524 1.00 0.17 C ATOM 1358 O LEU A 247 -7.155 4.252 -5.588 1.00 0.19 O ATOM 1359 CB LEU A 247 -5.002 2.345 -3.704 1.00 0.15 C ATOM 1360 CG LEU A 247 -4.988 1.099 -2.816 1.00 0.15 C ATOM 1361 CD1 LEU A 247 -3.909 1.219 -1.756 1.00 0.15 C ATOM 1362 CD2 LEU A 247 -6.343 0.893 -2.160 1.00 0.19 C ATOM 0 H LEU A 247 -4.637 0.822 -5.630 1.00 0.17 H new ATOM 0 HA LEU A 247 -6.934 1.971 -4.573 1.00 0.16 H new ATOM 0 HB2 LEU A 247 -3.990 2.521 -4.068 1.00 0.15 H new ATOM 0 HB3 LEU A 247 -5.273 3.203 -3.089 1.00 0.15 H new ATOM 0 HG LEU A 247 -4.771 0.234 -3.443 1.00 0.15 H new ATOM 0 HD11 LEU A 247 -3.911 0.325 -1.132 1.00 0.15 H new ATOM 0 HD12 LEU A 247 -2.936 1.323 -2.237 1.00 0.15 H new ATOM 0 HD13 LEU A 247 -4.103 2.095 -1.137 1.00 0.15 H new ATOM 0 HD21 LEU A 247 -6.312 0.002 -1.533 1.00 0.19 H new ATOM 0 HD22 LEU A 247 -6.586 1.760 -1.546 1.00 0.19 H new ATOM 0 HD23 LEU A 247 -7.105 0.769 -2.930 1.00 0.19 H new ATOM 1374 N ARG A 248 -4.968 4.234 -6.008 1.00 0.18 N ATOM 1375 CA ARG A 248 -4.994 5.620 -6.464 1.00 0.22 C ATOM 1376 C ARG A 248 -5.702 5.760 -7.816 1.00 0.23 C ATOM 1377 O ARG A 248 -6.150 6.848 -8.180 1.00 0.36 O ATOM 1378 CB ARG A 248 -3.588 6.221 -6.500 1.00 0.25 C ATOM 1379 CG ARG A 248 -2.729 5.789 -7.674 1.00 0.28 C ATOM 1380 CD ARG A 248 -1.353 6.437 -7.598 1.00 0.27 C ATOM 1381 NE ARG A 248 -1.416 7.781 -7.010 1.00 1.21 N ATOM 1382 CZ ARG A 248 -0.433 8.678 -7.063 1.00 1.50 C ATOM 1383 NH1 ARG A 248 0.665 8.441 -7.770 1.00 1.09 N ATOM 1384 NH2 ARG A 248 -0.564 9.825 -6.411 1.00 2.49 N ATOM 0 H ARG A 248 -4.069 3.761 -6.097 1.00 0.18 H new ATOM 0 HA ARG A 248 -5.575 6.189 -5.738 1.00 0.22 H new ATOM 0 HB2 ARG A 248 -3.675 7.307 -6.515 1.00 0.25 H new ATOM 0 HB3 ARG A 248 -3.073 5.955 -5.577 1.00 0.25 H new ATOM 0 HG2 ARG A 248 -2.626 4.704 -7.677 1.00 0.28 H new ATOM 0 HG3 ARG A 248 -3.216 6.065 -8.609 1.00 0.28 H new ATOM 0 HD2 ARG A 248 -0.688 5.811 -7.003 1.00 0.27 H new ATOM 0 HD3 ARG A 248 -0.924 6.497 -8.598 1.00 0.27 H new ATOM 0 HE ARG A 248 -2.274 8.047 -6.526 1.00 1.21 H new ATOM 0 HH11 ARG A 248 0.763 7.564 -8.281 1.00 1.09 H new ATOM 0 HH12 ARG A 248 1.411 9.136 -7.802 1.00 1.09 H new ATOM 0 HH21 ARG A 248 -1.411 10.013 -5.876 1.00 2.49 H new ATOM 0 HH22 ARG A 248 0.183 10.519 -6.445 1.00 2.49 H new ATOM 1398 N LYS A 249 -5.829 4.656 -8.537 1.00 0.21 N ATOM 1399 CA LYS A 249 -6.579 4.633 -9.794 1.00 0.25 C ATOM 1400 C LYS A 249 -8.080 4.646 -9.529 1.00 0.20 C ATOM 1401 O LYS A 249 -8.837 5.322 -10.222 1.00 0.25 O ATOM 1402 CB LYS A 249 -6.223 3.387 -10.613 1.00 0.33 C ATOM 1403 CG LYS A 249 -4.869 3.467 -11.310 1.00 0.44 C ATOM 1404 CD LYS A 249 -4.892 4.427 -12.487 1.00 1.04 C ATOM 1405 CE LYS A 249 -5.787 3.914 -13.606 1.00 1.12 C ATOM 1406 NZ LYS A 249 -5.286 2.640 -14.188 1.00 1.32 N ATOM 0 H LYS A 249 -5.422 3.758 -8.275 1.00 0.21 H new ATOM 0 HA LYS A 249 -6.307 5.525 -10.358 1.00 0.25 H new ATOM 0 HB2 LYS A 249 -6.230 2.518 -9.955 1.00 0.33 H new ATOM 0 HB3 LYS A 249 -6.997 3.225 -11.363 1.00 0.33 H new ATOM 0 HG2 LYS A 249 -4.111 3.788 -10.595 1.00 0.44 H new ATOM 0 HG3 LYS A 249 -4.580 2.475 -11.657 1.00 0.44 H new ATOM 0 HD2 LYS A 249 -5.246 5.403 -12.155 1.00 1.04 H new ATOM 0 HD3 LYS A 249 -3.879 4.566 -12.864 1.00 1.04 H new ATOM 0 HE2 LYS A 249 -6.796 3.764 -13.222 1.00 1.12 H new ATOM 0 HE3 LYS A 249 -5.854 4.668 -14.390 1.00 1.12 H new ATOM 0 HZ1 LYS A 249 -5.764 2.460 -15.094 1.00 1.32 H new ATOM 0 HZ2 LYS A 249 -4.260 2.710 -14.346 1.00 1.32 H new ATOM 0 HZ3 LYS A 249 -5.482 1.858 -13.532 1.00 1.32 H new