USER MOD reduce.3.24.130724 H: found=0, std=0, add=371, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 364 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 238 CYS SG : rot -86:sc= 0.219 USER MOD Set 1.2: A 243 CYS SG : rot -141:sc= 0.258 USER MOD Set 1.3: A 265 CYS SG : rot 162:sc= -0.181 USER MOD Set 1.4: A 268 CYS SG : rot 80:sc= 0.261 USER MOD Set 2.1: A 262 THR OG1 : rot 30:sc= 0.321 USER MOD Set 2.2: A 264 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 245 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 225 CYS SG : rot 76:sc= 0.394 USER MOD Set 4.2: A 227 CYS SG : rot -67:sc= 0.274 USER MOD Set 4.3: A 231 SER OG : rot -43:sc= 1.12 USER MOD Set 4.4: A 249 HIS : no HD1:sc= 0.606 K(o=2.4,f=-2.9!) USER MOD Set 4.5: A 252 CYS SG : rot -159:sc= 0.0429 USER MOD Single : A 224 TYR OH : rot 180:sc= 0 USER MOD Single : A 228 GLN : amide:sc= -0.355 X(o=-0.36,f=-0.81) USER MOD Single : A 235 MET CE :methyl 179:sc= -0.433 (180deg=-0.438) USER MOD Single : A 242 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 250 TYR OH : rot 180:sc= -0.328 USER MOD Single : A 254 ASN : amide:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 256 LYS NZ :NH3+ 173:sc=-0.000386 (180deg=-0.051) USER MOD Single : A 260 LYS NZ :NH3+ 141:sc= -1.01 (180deg=-3.21!) USER MOD Single : A 269 LYS NZ :NH3+ -171:sc=-0.00472 (180deg=-0.0949) USER MOD ----------------------------------------------------------------- ATOM 17 N LEU A 223 1.793 -1.672 -3.551 1.00 0.00 N ATOM 18 CA LEU A 223 1.665 -2.799 -4.486 1.00 0.00 C ATOM 19 C LEU A 223 1.778 -2.220 -5.904 1.00 0.00 C ATOM 20 O LEU A 223 0.865 -1.525 -6.367 1.00 0.00 O ATOM 21 CB LEU A 223 0.287 -3.519 -4.243 1.00 0.00 C ATOM 22 CG LEU A 223 0.050 -4.937 -4.888 1.00 0.00 C ATOM 23 CD1 LEU A 223 -1.240 -5.598 -4.330 1.00 0.00 C ATOM 24 CD2 LEU A 223 -0.002 -4.887 -6.430 1.00 0.00 C ATOM 0 HA LEU A 223 2.444 -3.547 -4.341 1.00 0.00 H new ATOM 0 HB2 LEU A 223 0.152 -3.619 -3.166 1.00 0.00 H new ATOM 0 HB3 LEU A 223 -0.500 -2.856 -4.603 1.00 0.00 H new ATOM 0 HG LEU A 223 0.910 -5.547 -4.611 1.00 0.00 H new ATOM 0 HD11 LEU A 223 -1.378 -6.575 -4.793 1.00 0.00 H new ATOM 0 HD12 LEU A 223 -1.150 -5.718 -3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 223 -2.099 -4.966 -4.554 1.00 0.00 H new ATOM 0 HD21 LEU A 223 -0.167 -5.891 -6.821 1.00 0.00 H new ATOM 0 HD22 LEU A 223 -0.817 -4.236 -6.746 1.00 0.00 H new ATOM 0 HD23 LEU A 223 0.942 -4.499 -6.813 1.00 0.00 H new ATOM 36 N TYR A 224 2.909 -2.488 -6.584 1.00 0.00 N ATOM 37 CA TYR A 224 3.134 -2.068 -7.981 1.00 0.00 C ATOM 38 C TYR A 224 3.848 -3.199 -8.741 1.00 0.00 C ATOM 39 O TYR A 224 4.899 -3.677 -8.300 1.00 0.00 O ATOM 40 CB TYR A 224 3.974 -0.764 -8.062 1.00 0.00 C ATOM 41 CG TYR A 224 3.308 0.467 -7.431 1.00 0.00 C ATOM 42 CD1 TYR A 224 2.124 0.997 -7.956 1.00 0.00 C ATOM 43 CD2 TYR A 224 3.854 1.096 -6.310 1.00 0.00 C ATOM 44 CE1 TYR A 224 1.520 2.105 -7.388 1.00 0.00 C ATOM 45 CE2 TYR A 224 3.250 2.205 -5.742 1.00 0.00 C ATOM 46 CZ TYR A 224 2.087 2.704 -6.283 1.00 0.00 C ATOM 47 OH TYR A 224 1.473 3.802 -5.718 1.00 0.00 O ATOM 0 H TYR A 224 3.693 -3.002 -6.181 1.00 0.00 H new ATOM 0 HA TYR A 224 2.165 -1.863 -8.436 1.00 0.00 H new ATOM 0 HB2 TYR A 224 4.932 -0.934 -7.571 1.00 0.00 H new ATOM 0 HB3 TYR A 224 4.186 -0.549 -9.109 1.00 0.00 H new ATOM 0 HD1 TYR A 224 1.673 0.533 -8.821 1.00 0.00 H new ATOM 0 HD2 TYR A 224 4.765 0.710 -5.878 1.00 0.00 H new ATOM 0 HE1 TYR A 224 0.607 2.499 -7.809 1.00 0.00 H new ATOM 0 HE2 TYR A 224 3.691 2.677 -4.876 1.00 0.00 H new ATOM 0 HH TYR A 224 1.995 4.108 -4.947 1.00 0.00 H new ATOM 57 N CYS A 225 3.225 -3.630 -9.850 1.00 0.00 N ATOM 58 CA CYS A 225 3.767 -4.619 -10.814 1.00 0.00 C ATOM 59 C CYS A 225 2.648 -4.984 -11.803 1.00 0.00 C ATOM 60 O CYS A 225 1.480 -4.906 -11.426 1.00 0.00 O ATOM 61 CB CYS A 225 4.286 -5.895 -10.126 1.00 0.00 C ATOM 62 SG CYS A 225 5.100 -7.052 -11.251 1.00 0.00 S ATOM 0 H CYS A 225 2.300 -3.292 -10.115 1.00 0.00 H new ATOM 0 HA CYS A 225 4.619 -4.169 -11.324 1.00 0.00 H new ATOM 0 HB2 CYS A 225 4.987 -5.613 -9.340 1.00 0.00 H new ATOM 0 HB3 CYS A 225 3.451 -6.401 -9.642 1.00 0.00 H new ATOM 0 HG CYS A 225 6.289 -6.613 -11.539 1.00 0.00 H new ATOM 67 N PHE A 226 2.979 -5.383 -13.058 1.00 0.00 N ATOM 68 CA PHE A 226 1.936 -5.730 -14.058 1.00 0.00 C ATOM 69 C PHE A 226 1.145 -6.986 -13.620 1.00 0.00 C ATOM 70 O PHE A 226 -0.079 -7.030 -13.787 1.00 0.00 O ATOM 71 CB PHE A 226 2.524 -5.921 -15.484 1.00 0.00 C ATOM 72 CG PHE A 226 1.454 -6.022 -16.581 1.00 0.00 C ATOM 73 CD1 PHE A 226 0.905 -4.871 -17.151 1.00 0.00 C ATOM 74 CD2 PHE A 226 0.977 -7.261 -17.020 1.00 0.00 C ATOM 75 CE1 PHE A 226 -0.073 -4.957 -18.127 1.00 0.00 C ATOM 76 CE2 PHE A 226 -0.002 -7.344 -17.993 1.00 0.00 C ATOM 77 CZ PHE A 226 -0.528 -6.193 -18.544 1.00 0.00 C ATOM 0 H PHE A 226 3.937 -5.471 -13.396 1.00 0.00 H new ATOM 0 HA PHE A 226 1.250 -4.885 -14.104 1.00 0.00 H new ATOM 0 HB2 PHE A 226 3.186 -5.085 -15.710 1.00 0.00 H new ATOM 0 HB3 PHE A 226 3.134 -6.824 -15.499 1.00 0.00 H new ATOM 0 HD1 PHE A 226 1.248 -3.900 -16.826 1.00 0.00 H new ATOM 0 HD2 PHE A 226 1.380 -8.167 -16.592 1.00 0.00 H new ATOM 0 HE1 PHE A 226 -0.481 -4.057 -18.563 1.00 0.00 H new ATOM 0 HE2 PHE A 226 -0.355 -8.310 -18.322 1.00 0.00 H new ATOM 0 HZ PHE A 226 -1.295 -6.259 -19.301 1.00 0.00 H new ATOM 87 N CYS A 227 1.850 -7.989 -13.026 1.00 0.00 N ATOM 88 CA CYS A 227 1.192 -9.228 -12.509 1.00 0.00 C ATOM 89 C CYS A 227 0.304 -8.915 -11.277 1.00 0.00 C ATOM 90 O CYS A 227 -0.529 -9.741 -10.884 1.00 0.00 O ATOM 91 CB CYS A 227 2.229 -10.344 -12.159 1.00 0.00 C ATOM 92 SG CYS A 227 3.046 -10.183 -10.527 1.00 0.00 S ATOM 0 H CYS A 227 2.861 -7.967 -12.893 1.00 0.00 H new ATOM 0 HA CYS A 227 0.559 -9.606 -13.312 1.00 0.00 H new ATOM 0 HB2 CYS A 227 1.724 -11.309 -12.199 1.00 0.00 H new ATOM 0 HB3 CYS A 227 2.999 -10.355 -12.931 1.00 0.00 H new ATOM 0 HG CYS A 227 3.812 -9.133 -10.527 1.00 0.00 H new ATOM 97 N GLN A 228 0.499 -7.694 -10.700 1.00 0.00 N ATOM 98 CA GLN A 228 -0.244 -7.174 -9.532 1.00 0.00 C ATOM 99 C GLN A 228 -0.123 -8.107 -8.315 1.00 0.00 C ATOM 100 O GLN A 228 -0.948 -9.004 -8.104 1.00 0.00 O ATOM 101 CB GLN A 228 -1.724 -6.845 -9.891 1.00 0.00 C ATOM 102 CG GLN A 228 -1.880 -5.671 -10.892 1.00 0.00 C ATOM 103 CD GLN A 228 -1.454 -4.305 -10.326 1.00 0.00 C ATOM 104 OE1 GLN A 228 -1.595 -4.039 -9.134 1.00 0.00 O ATOM 105 NE2 GLN A 228 -0.887 -3.445 -11.164 1.00 0.00 N ATOM 0 H GLN A 228 1.195 -7.035 -11.049 1.00 0.00 H new ATOM 0 HA GLN A 228 0.221 -6.232 -9.243 1.00 0.00 H new ATOM 0 HB2 GLN A 228 -2.192 -7.734 -10.313 1.00 0.00 H new ATOM 0 HB3 GLN A 228 -2.265 -6.604 -8.976 1.00 0.00 H new ATOM 0 HG2 GLN A 228 -1.288 -5.885 -11.782 1.00 0.00 H new ATOM 0 HG3 GLN A 228 -2.921 -5.613 -11.208 1.00 0.00 H new ATOM 0 HE21 GLN A 228 -0.781 -3.688 -12.149 1.00 0.00 H new ATOM 0 HE22 GLN A 228 -0.558 -2.542 -10.823 1.00 0.00 H new ATOM 114 N ARG A 229 0.964 -7.901 -7.555 1.00 0.00 N ATOM 115 CA ARG A 229 1.266 -8.659 -6.335 1.00 0.00 C ATOM 116 C ARG A 229 2.264 -7.854 -5.489 1.00 0.00 C ATOM 117 O ARG A 229 3.060 -7.076 -6.041 1.00 0.00 O ATOM 118 CB ARG A 229 1.820 -10.076 -6.688 1.00 0.00 C ATOM 119 CG ARG A 229 1.691 -11.152 -5.567 1.00 0.00 C ATOM 120 CD ARG A 229 0.220 -11.566 -5.278 1.00 0.00 C ATOM 121 NE ARG A 229 -0.537 -10.550 -4.497 1.00 0.00 N ATOM 122 CZ ARG A 229 -1.717 -9.986 -4.851 1.00 0.00 C ATOM 123 NH1 ARG A 229 -2.334 -10.330 -5.977 1.00 0.00 N ATOM 124 NH2 ARG A 229 -2.276 -9.096 -4.060 1.00 0.00 N ATOM 0 H ARG A 229 1.665 -7.194 -7.775 1.00 0.00 H new ATOM 0 HA ARG A 229 0.355 -8.811 -5.757 1.00 0.00 H new ATOM 0 HB2 ARG A 229 1.300 -10.438 -7.575 1.00 0.00 H new ATOM 0 HB3 ARG A 229 2.873 -9.978 -6.953 1.00 0.00 H new ATOM 0 HG2 ARG A 229 2.260 -12.036 -5.854 1.00 0.00 H new ATOM 0 HG3 ARG A 229 2.140 -10.768 -4.651 1.00 0.00 H new ATOM 0 HD2 ARG A 229 -0.293 -11.742 -6.224 1.00 0.00 H new ATOM 0 HD3 ARG A 229 0.216 -12.510 -4.732 1.00 0.00 H new ATOM 0 HE ARG A 229 -0.129 -10.250 -3.612 1.00 0.00 H new ATOM 0 HH11 ARG A 229 -1.920 -11.030 -6.592 1.00 0.00 H new ATOM 0 HH12 ARG A 229 -3.222 -9.894 -6.226 1.00 0.00 H new ATOM 0 HH21 ARG A 229 -1.821 -8.834 -3.185 1.00 0.00 H new ATOM 0 HH22 ARG A 229 -3.164 -8.668 -4.321 1.00 0.00 H new ATOM 138 N VAL A 230 2.186 -8.004 -4.155 1.00 0.00 N ATOM 139 CA VAL A 230 3.097 -7.315 -3.218 1.00 0.00 C ATOM 140 C VAL A 230 4.517 -7.909 -3.284 1.00 0.00 C ATOM 141 O VAL A 230 4.697 -9.101 -3.587 1.00 0.00 O ATOM 142 CB VAL A 230 2.559 -7.361 -1.736 1.00 0.00 C ATOM 143 CG1 VAL A 230 1.206 -6.607 -1.611 1.00 0.00 C ATOM 144 CG2 VAL A 230 2.449 -8.822 -1.222 1.00 0.00 C ATOM 0 H VAL A 230 1.497 -8.600 -3.697 1.00 0.00 H new ATOM 0 HA VAL A 230 3.140 -6.271 -3.529 1.00 0.00 H new ATOM 0 HB VAL A 230 3.281 -6.848 -1.101 1.00 0.00 H new ATOM 0 HG11 VAL A 230 0.857 -6.654 -0.579 1.00 0.00 H new ATOM 0 HG12 VAL A 230 1.342 -5.565 -1.901 1.00 0.00 H new ATOM 0 HG13 VAL A 230 0.468 -7.072 -2.265 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.076 -8.820 -0.198 1.00 0.00 H new ATOM 0 HG22 VAL A 230 1.762 -9.381 -1.858 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.432 -9.292 -1.249 1.00 0.00 H new ATOM 154 N SER A 231 5.513 -7.061 -3.014 1.00 0.00 N ATOM 155 CA SER A 231 6.924 -7.455 -2.978 1.00 0.00 C ATOM 156 C SER A 231 7.319 -7.797 -1.527 1.00 0.00 C ATOM 157 O SER A 231 8.080 -7.073 -0.871 1.00 0.00 O ATOM 158 CB SER A 231 7.774 -6.315 -3.569 1.00 0.00 C ATOM 159 OG SER A 231 7.281 -5.923 -4.844 1.00 0.00 O ATOM 0 H SER A 231 5.361 -6.073 -2.812 1.00 0.00 H new ATOM 0 HA SER A 231 7.099 -8.346 -3.581 1.00 0.00 H new ATOM 0 HB2 SER A 231 7.764 -5.460 -2.892 1.00 0.00 H new ATOM 0 HB3 SER A 231 8.811 -6.638 -3.659 1.00 0.00 H new ATOM 0 HG SER A 231 7.055 -6.721 -5.366 1.00 0.00 H new ATOM 165 N PHE A 232 6.749 -8.907 -1.033 1.00 0.00 N ATOM 166 CA PHE A 232 6.842 -9.318 0.378 1.00 0.00 C ATOM 167 C PHE A 232 8.166 -10.071 0.635 1.00 0.00 C ATOM 168 O PHE A 232 8.252 -11.284 0.431 1.00 0.00 O ATOM 169 CB PHE A 232 5.596 -10.190 0.729 1.00 0.00 C ATOM 170 CG PHE A 232 5.394 -10.487 2.218 1.00 0.00 C ATOM 171 CD1 PHE A 232 4.693 -9.599 3.032 1.00 0.00 C ATOM 172 CD2 PHE A 232 5.890 -11.658 2.801 1.00 0.00 C ATOM 173 CE1 PHE A 232 4.500 -9.865 4.377 1.00 0.00 C ATOM 174 CE2 PHE A 232 5.699 -11.921 4.146 1.00 0.00 C ATOM 175 CZ PHE A 232 5.002 -11.026 4.933 1.00 0.00 C ATOM 0 H PHE A 232 6.205 -9.551 -1.607 1.00 0.00 H new ATOM 0 HA PHE A 232 6.847 -8.441 1.026 1.00 0.00 H new ATOM 0 HB2 PHE A 232 4.705 -9.687 0.353 1.00 0.00 H new ATOM 0 HB3 PHE A 232 5.676 -11.137 0.196 1.00 0.00 H new ATOM 0 HD1 PHE A 232 4.294 -8.690 2.607 1.00 0.00 H new ATOM 0 HD2 PHE A 232 6.430 -12.368 2.192 1.00 0.00 H new ATOM 0 HE1 PHE A 232 3.956 -9.164 4.993 1.00 0.00 H new ATOM 0 HE2 PHE A 232 6.095 -12.827 4.580 1.00 0.00 H new ATOM 0 HZ PHE A 232 4.849 -11.233 5.982 1.00 0.00 H new ATOM 185 N GLY A 233 9.205 -9.319 1.030 1.00 0.00 N ATOM 186 CA GLY A 233 10.511 -9.886 1.419 1.00 0.00 C ATOM 187 C GLY A 233 11.595 -9.719 0.354 1.00 0.00 C ATOM 188 O GLY A 233 12.795 -9.789 0.671 1.00 0.00 O ATOM 0 H GLY A 233 9.166 -8.301 1.090 1.00 0.00 H new ATOM 0 HA2 GLY A 233 10.844 -9.410 2.341 1.00 0.00 H new ATOM 0 HA3 GLY A 233 10.387 -10.947 1.635 1.00 0.00 H new ATOM 192 N GLU A 234 11.184 -9.480 -0.911 1.00 0.00 N ATOM 193 CA GLU A 234 12.119 -9.271 -2.041 1.00 0.00 C ATOM 194 C GLU A 234 11.704 -8.023 -2.850 1.00 0.00 C ATOM 195 O GLU A 234 11.371 -8.085 -4.033 1.00 0.00 O ATOM 196 CB GLU A 234 12.260 -10.572 -2.924 1.00 0.00 C ATOM 197 CG GLU A 234 11.023 -11.038 -3.758 1.00 0.00 C ATOM 198 CD GLU A 234 9.795 -11.444 -2.927 1.00 0.00 C ATOM 199 OE1 GLU A 234 8.951 -10.567 -2.611 1.00 0.00 O ATOM 200 OE2 GLU A 234 9.667 -12.633 -2.591 1.00 0.00 O ATOM 0 H GLU A 234 10.201 -9.427 -1.177 1.00 0.00 H new ATOM 0 HA GLU A 234 13.117 -9.078 -1.647 1.00 0.00 H new ATOM 0 HB2 GLU A 234 13.088 -10.416 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU A 234 12.545 -11.392 -2.265 1.00 0.00 H new ATOM 0 HG2 GLU A 234 10.735 -10.233 -4.434 1.00 0.00 H new ATOM 0 HG3 GLU A 234 11.319 -11.884 -4.378 1.00 0.00 H new ATOM 207 N MET A 235 11.780 -6.853 -2.197 1.00 0.00 N ATOM 208 CA MET A 235 11.344 -5.567 -2.792 1.00 0.00 C ATOM 209 C MET A 235 12.542 -4.752 -3.338 1.00 0.00 C ATOM 210 O MET A 235 13.562 -4.577 -2.659 1.00 0.00 O ATOM 211 CB MET A 235 10.513 -4.762 -1.749 1.00 0.00 C ATOM 212 CG MET A 235 11.192 -4.505 -0.404 1.00 0.00 C ATOM 213 SD MET A 235 10.040 -3.844 0.828 1.00 0.00 S ATOM 214 CE MET A 235 9.457 -2.338 0.043 1.00 0.00 C ATOM 0 H MET A 235 12.142 -6.765 -1.247 1.00 0.00 H new ATOM 0 HA MET A 235 10.706 -5.777 -3.650 1.00 0.00 H new ATOM 0 HB2 MET A 235 10.248 -3.801 -2.189 1.00 0.00 H new ATOM 0 HB3 MET A 235 9.581 -5.297 -1.566 1.00 0.00 H new ATOM 0 HG2 MET A 235 11.624 -5.435 -0.033 1.00 0.00 H new ATOM 0 HG3 MET A 235 12.015 -3.804 -0.542 1.00 0.00 H new ATOM 0 HE1 MET A 235 8.730 -1.848 0.691 1.00 0.00 H new ATOM 0 HE2 MET A 235 10.299 -1.668 -0.129 1.00 0.00 H new ATOM 0 HE3 MET A 235 8.987 -2.583 -0.910 1.00 0.00 H new ATOM 224 N VAL A 236 12.403 -4.283 -4.594 1.00 0.00 N ATOM 225 CA VAL A 236 13.392 -3.448 -5.285 1.00 0.00 C ATOM 226 C VAL A 236 12.702 -2.149 -5.772 1.00 0.00 C ATOM 227 O VAL A 236 11.642 -2.191 -6.412 1.00 0.00 O ATOM 228 CB VAL A 236 14.086 -4.237 -6.474 1.00 0.00 C ATOM 229 CG1 VAL A 236 13.070 -4.804 -7.502 1.00 0.00 C ATOM 230 CG2 VAL A 236 15.175 -3.377 -7.157 1.00 0.00 C ATOM 0 H VAL A 236 11.581 -4.481 -5.164 1.00 0.00 H new ATOM 0 HA VAL A 236 14.190 -3.181 -4.592 1.00 0.00 H new ATOM 0 HB VAL A 236 14.574 -5.103 -6.028 1.00 0.00 H new ATOM 0 HG11 VAL A 236 13.606 -5.332 -8.290 1.00 0.00 H new ATOM 0 HG12 VAL A 236 12.391 -5.493 -7.000 1.00 0.00 H new ATOM 0 HG13 VAL A 236 12.498 -3.985 -7.938 1.00 0.00 H new ATOM 0 HG21 VAL A 236 15.632 -3.945 -7.967 1.00 0.00 H new ATOM 0 HG22 VAL A 236 14.723 -2.470 -7.559 1.00 0.00 H new ATOM 0 HG23 VAL A 236 15.938 -3.109 -6.426 1.00 0.00 H new ATOM 240 N ALA A 237 13.283 -0.993 -5.407 1.00 0.00 N ATOM 241 CA ALA A 237 12.751 0.339 -5.751 1.00 0.00 C ATOM 242 C ALA A 237 13.352 0.857 -7.063 1.00 0.00 C ATOM 243 O ALA A 237 14.460 0.481 -7.438 1.00 0.00 O ATOM 244 CB ALA A 237 13.048 1.321 -4.611 1.00 0.00 C ATOM 0 H ALA A 237 14.143 -0.956 -4.860 1.00 0.00 H new ATOM 0 HA ALA A 237 11.673 0.253 -5.889 1.00 0.00 H new ATOM 0 HB1 ALA A 237 12.654 2.305 -4.866 1.00 0.00 H new ATOM 0 HB2 ALA A 237 12.576 0.968 -3.694 1.00 0.00 H new ATOM 0 HB3 ALA A 237 14.125 1.389 -4.461 1.00 0.00 H new ATOM 250 N CYS A 238 12.605 1.734 -7.734 1.00 0.00 N ATOM 251 CA CYS A 238 13.022 2.431 -8.965 1.00 0.00 C ATOM 252 C CYS A 238 13.075 3.935 -8.708 1.00 0.00 C ATOM 253 O CYS A 238 12.421 4.428 -7.784 1.00 0.00 O ATOM 254 CB CYS A 238 12.054 2.138 -10.136 1.00 0.00 C ATOM 255 SG CYS A 238 12.296 3.214 -11.598 1.00 0.00 S ATOM 0 H CYS A 238 11.665 1.991 -7.433 1.00 0.00 H new ATOM 0 HA CYS A 238 14.010 2.065 -9.244 1.00 0.00 H new ATOM 0 HB2 CYS A 238 12.174 1.098 -10.440 1.00 0.00 H new ATOM 0 HB3 CYS A 238 11.029 2.250 -9.782 1.00 0.00 H new ATOM 0 HG CYS A 238 11.620 4.313 -11.444 1.00 0.00 H new ATOM 260 N ASP A 239 13.883 4.657 -9.495 1.00 0.00 N ATOM 261 CA ASP A 239 13.937 6.129 -9.482 1.00 0.00 C ATOM 262 C ASP A 239 13.521 6.665 -10.853 1.00 0.00 C ATOM 263 O ASP A 239 14.260 6.526 -11.835 1.00 0.00 O ATOM 264 CB ASP A 239 15.352 6.622 -9.097 1.00 0.00 C ATOM 265 CG ASP A 239 15.721 6.223 -7.660 1.00 0.00 C ATOM 266 OD1 ASP A 239 16.125 5.062 -7.440 1.00 0.00 O ATOM 267 OD2 ASP A 239 15.568 7.052 -6.735 1.00 0.00 O ATOM 0 H ASP A 239 14.525 4.234 -10.166 1.00 0.00 H new ATOM 0 HA ASP A 239 13.243 6.507 -8.731 1.00 0.00 H new ATOM 0 HB2 ASP A 239 16.083 6.206 -9.790 1.00 0.00 H new ATOM 0 HB3 ASP A 239 15.399 7.706 -9.197 1.00 0.00 H new ATOM 272 N GLY A 240 12.298 7.207 -10.928 1.00 0.00 N ATOM 273 CA GLY A 240 11.799 7.886 -12.130 1.00 0.00 C ATOM 274 C GLY A 240 10.977 9.123 -11.771 1.00 0.00 C ATOM 275 O GLY A 240 10.274 9.091 -10.751 1.00 0.00 O ATOM 0 H GLY A 240 11.629 7.187 -10.159 1.00 0.00 H new ATOM 0 HA2 GLY A 240 12.639 8.176 -12.761 1.00 0.00 H new ATOM 0 HA3 GLY A 240 11.187 7.197 -12.711 1.00 0.00 H new ATOM 279 N PRO A 241 11.035 10.235 -12.583 1.00 0.00 N ATOM 280 CA PRO A 241 10.284 11.489 -12.294 1.00 0.00 C ATOM 281 C PRO A 241 8.753 11.258 -12.276 1.00 0.00 C ATOM 282 O PRO A 241 8.061 11.685 -11.344 1.00 0.00 O ATOM 283 CB PRO A 241 10.720 12.448 -13.436 1.00 0.00 C ATOM 284 CG PRO A 241 11.236 11.553 -14.529 1.00 0.00 C ATOM 285 CD PRO A 241 11.849 10.361 -13.827 1.00 0.00 C ATOM 0 HA PRO A 241 10.504 11.892 -11.305 1.00 0.00 H new ATOM 0 HB2 PRO A 241 9.882 13.052 -13.784 1.00 0.00 H new ATOM 0 HB3 PRO A 241 11.491 13.139 -13.096 1.00 0.00 H new ATOM 0 HG2 PRO A 241 10.430 11.244 -15.195 1.00 0.00 H new ATOM 0 HG3 PRO A 241 11.975 12.069 -15.142 1.00 0.00 H new ATOM 0 HD2 PRO A 241 11.790 9.461 -14.439 1.00 0.00 H new ATOM 0 HD3 PRO A 241 12.903 10.525 -13.602 1.00 0.00 H new ATOM 293 N ASN A 242 8.251 10.569 -13.306 1.00 0.00 N ATOM 294 CA ASN A 242 6.863 10.085 -13.371 1.00 0.00 C ATOM 295 C ASN A 242 6.918 8.571 -13.609 1.00 0.00 C ATOM 296 O ASN A 242 7.283 8.118 -14.702 1.00 0.00 O ATOM 297 CB ASN A 242 6.080 10.802 -14.503 1.00 0.00 C ATOM 298 CG ASN A 242 4.620 10.340 -14.642 1.00 0.00 C ATOM 299 OD1 ASN A 242 3.951 10.027 -13.654 1.00 0.00 O ATOM 300 ND2 ASN A 242 4.131 10.268 -15.872 1.00 0.00 N ATOM 0 H ASN A 242 8.802 10.327 -14.130 1.00 0.00 H new ATOM 0 HA ASN A 242 6.338 10.302 -12.441 1.00 0.00 H new ATOM 0 HB2 ASN A 242 6.095 11.876 -14.317 1.00 0.00 H new ATOM 0 HB3 ASN A 242 6.595 10.635 -15.449 1.00 0.00 H new ATOM 0 HD21 ASN A 242 3.175 9.946 -16.023 1.00 0.00 H new ATOM 0 HD22 ASN A 242 4.711 10.534 -16.668 1.00 0.00 H new ATOM 307 N CYS A 243 6.590 7.794 -12.573 1.00 0.00 N ATOM 308 CA CYS A 243 6.707 6.331 -12.588 1.00 0.00 C ATOM 309 C CYS A 243 5.766 5.735 -11.536 1.00 0.00 C ATOM 310 O CYS A 243 5.895 6.026 -10.340 1.00 0.00 O ATOM 311 CB CYS A 243 8.176 5.930 -12.315 1.00 0.00 C ATOM 312 SG CYS A 243 8.500 4.137 -12.190 1.00 0.00 S ATOM 0 H CYS A 243 6.233 8.165 -11.692 1.00 0.00 H new ATOM 0 HA CYS A 243 6.421 5.941 -13.565 1.00 0.00 H new ATOM 0 HB2 CYS A 243 8.798 6.338 -13.112 1.00 0.00 H new ATOM 0 HB3 CYS A 243 8.496 6.403 -11.387 1.00 0.00 H new ATOM 0 HG CYS A 243 9.366 3.917 -11.246 1.00 0.00 H new ATOM 317 N LYS A 244 4.783 4.945 -11.997 1.00 0.00 N ATOM 318 CA LYS A 244 3.832 4.238 -11.122 1.00 0.00 C ATOM 319 C LYS A 244 4.482 2.957 -10.571 1.00 0.00 C ATOM 320 O LYS A 244 4.432 2.690 -9.374 1.00 0.00 O ATOM 321 CB LYS A 244 2.537 3.893 -11.909 1.00 0.00 C ATOM 322 CG LYS A 244 1.455 3.141 -11.086 1.00 0.00 C ATOM 323 CD LYS A 244 0.220 2.757 -11.930 1.00 0.00 C ATOM 324 CE LYS A 244 0.587 1.835 -13.099 1.00 0.00 C ATOM 325 NZ LYS A 244 -0.588 1.465 -13.917 1.00 0.00 N ATOM 0 H LYS A 244 4.624 4.778 -12.991 1.00 0.00 H new ATOM 0 HA LYS A 244 3.567 4.885 -10.286 1.00 0.00 H new ATOM 0 HB2 LYS A 244 2.105 4.817 -12.292 1.00 0.00 H new ATOM 0 HB3 LYS A 244 2.805 3.284 -12.773 1.00 0.00 H new ATOM 0 HG2 LYS A 244 1.892 2.239 -10.659 1.00 0.00 H new ATOM 0 HG3 LYS A 244 1.139 3.768 -10.252 1.00 0.00 H new ATOM 0 HD2 LYS A 244 -0.514 2.262 -11.294 1.00 0.00 H new ATOM 0 HD3 LYS A 244 -0.251 3.661 -12.316 1.00 0.00 H new ATOM 0 HE2 LYS A 244 1.324 2.330 -13.731 1.00 0.00 H new ATOM 0 HE3 LYS A 244 1.055 0.930 -12.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 244 -0.288 0.842 -14.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 244 -1.282 0.968 -13.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 244 -1.021 2.324 -14.311 1.00 0.00 H new ATOM 339 N TYR A 245 5.162 2.212 -11.464 1.00 0.00 N ATOM 340 CA TYR A 245 5.773 0.901 -11.158 1.00 0.00 C ATOM 341 C TYR A 245 7.167 1.040 -10.487 1.00 0.00 C ATOM 342 O TYR A 245 8.058 0.206 -10.718 1.00 0.00 O ATOM 343 CB TYR A 245 5.824 0.000 -12.425 1.00 0.00 C ATOM 344 CG TYR A 245 4.447 -0.436 -12.978 1.00 0.00 C ATOM 345 CD1 TYR A 245 3.540 -1.152 -12.182 1.00 0.00 C ATOM 346 CD2 TYR A 245 4.067 -0.166 -14.296 1.00 0.00 C ATOM 347 CE1 TYR A 245 2.320 -1.573 -12.683 1.00 0.00 C ATOM 348 CE2 TYR A 245 2.846 -0.588 -14.797 1.00 0.00 C ATOM 349 CZ TYR A 245 1.978 -1.293 -13.986 1.00 0.00 C ATOM 350 OH TYR A 245 0.750 -1.705 -14.474 1.00 0.00 O ATOM 0 H TYR A 245 5.305 2.506 -12.430 1.00 0.00 H new ATOM 0 HA TYR A 245 5.132 0.409 -10.427 1.00 0.00 H new ATOM 0 HB2 TYR A 245 6.360 0.534 -13.210 1.00 0.00 H new ATOM 0 HB3 TYR A 245 6.404 -0.893 -12.193 1.00 0.00 H new ATOM 0 HD1 TYR A 245 3.799 -1.379 -11.158 1.00 0.00 H new ATOM 0 HD2 TYR A 245 4.740 0.383 -14.938 1.00 0.00 H new ATOM 0 HE1 TYR A 245 1.637 -2.121 -12.051 1.00 0.00 H new ATOM 0 HE2 TYR A 245 2.574 -0.366 -15.818 1.00 0.00 H new ATOM 0 HH TYR A 245 0.661 -1.429 -15.410 1.00 0.00 H new ATOM 360 N GLU A 246 7.368 2.137 -9.702 1.00 0.00 N ATOM 361 CA GLU A 246 8.586 2.353 -8.878 1.00 0.00 C ATOM 362 C GLU A 246 8.952 1.091 -8.065 1.00 0.00 C ATOM 363 O GLU A 246 10.118 0.700 -8.007 1.00 0.00 O ATOM 364 CB GLU A 246 8.400 3.566 -7.912 1.00 0.00 C ATOM 365 CG GLU A 246 8.368 4.960 -8.588 1.00 0.00 C ATOM 366 CD GLU A 246 9.750 5.475 -9.051 1.00 0.00 C ATOM 367 OE1 GLU A 246 10.290 4.978 -10.061 1.00 0.00 O ATOM 368 OE2 GLU A 246 10.307 6.382 -8.407 1.00 0.00 O ATOM 0 H GLU A 246 6.688 2.894 -9.625 1.00 0.00 H new ATOM 0 HA GLU A 246 9.404 2.569 -9.566 1.00 0.00 H new ATOM 0 HB2 GLU A 246 7.471 3.428 -7.359 1.00 0.00 H new ATOM 0 HB3 GLU A 246 9.210 3.554 -7.182 1.00 0.00 H new ATOM 0 HG2 GLU A 246 7.702 4.918 -9.450 1.00 0.00 H new ATOM 0 HG3 GLU A 246 7.941 5.680 -7.890 1.00 0.00 H new ATOM 375 N TRP A 247 7.944 0.443 -7.476 1.00 0.00 N ATOM 376 CA TRP A 247 8.143 -0.797 -6.719 1.00 0.00 C ATOM 377 C TRP A 247 8.002 -2.028 -7.626 1.00 0.00 C ATOM 378 O TRP A 247 7.147 -2.068 -8.519 1.00 0.00 O ATOM 379 CB TRP A 247 7.174 -0.852 -5.511 1.00 0.00 C ATOM 380 CG TRP A 247 7.470 0.226 -4.492 1.00 0.00 C ATOM 381 CD1 TRP A 247 6.749 1.357 -4.237 1.00 0.00 C ATOM 382 CD2 TRP A 247 8.611 0.278 -3.624 1.00 0.00 C ATOM 383 NE1 TRP A 247 7.352 2.086 -3.248 1.00 0.00 N ATOM 384 CE2 TRP A 247 8.502 1.451 -2.861 1.00 0.00 C ATOM 385 CE3 TRP A 247 9.708 -0.567 -3.417 1.00 0.00 C ATOM 386 CZ2 TRP A 247 9.449 1.812 -1.909 1.00 0.00 C ATOM 387 CZ3 TRP A 247 10.647 -0.209 -2.472 1.00 0.00 C ATOM 388 CH2 TRP A 247 10.514 0.973 -1.727 1.00 0.00 C ATOM 0 H TRP A 247 6.975 0.759 -7.509 1.00 0.00 H new ATOM 0 HA TRP A 247 9.161 -0.807 -6.328 1.00 0.00 H new ATOM 0 HB2 TRP A 247 6.149 -0.744 -5.865 1.00 0.00 H new ATOM 0 HB3 TRP A 247 7.245 -1.830 -5.034 1.00 0.00 H new ATOM 0 HD1 TRP A 247 5.836 1.636 -4.742 1.00 0.00 H new ATOM 0 HE1 TRP A 247 7.001 2.962 -2.861 1.00 0.00 H new ATOM 0 HE3 TRP A 247 9.817 -1.479 -3.985 1.00 0.00 H new ATOM 0 HZ2 TRP A 247 9.347 2.721 -1.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 247 11.500 -0.850 -2.302 1.00 0.00 H new ATOM 0 HH2 TRP A 247 11.267 1.225 -0.995 1.00 0.00 H new ATOM 399 N PHE A 248 8.895 -3.000 -7.402 1.00 0.00 N ATOM 400 CA PHE A 248 8.898 -4.312 -8.063 1.00 0.00 C ATOM 401 C PHE A 248 9.433 -5.368 -7.094 1.00 0.00 C ATOM 402 O PHE A 248 9.887 -5.046 -5.988 1.00 0.00 O ATOM 403 CB PHE A 248 9.750 -4.301 -9.382 1.00 0.00 C ATOM 404 CG PHE A 248 8.957 -3.946 -10.634 1.00 0.00 C ATOM 405 CD1 PHE A 248 7.936 -4.784 -11.071 1.00 0.00 C ATOM 406 CD2 PHE A 248 9.224 -2.798 -11.370 1.00 0.00 C ATOM 407 CE1 PHE A 248 7.209 -4.482 -12.201 1.00 0.00 C ATOM 408 CE2 PHE A 248 8.494 -2.504 -12.505 1.00 0.00 C ATOM 409 CZ PHE A 248 7.490 -3.344 -12.920 1.00 0.00 C ATOM 0 H PHE A 248 9.659 -2.892 -6.735 1.00 0.00 H new ATOM 0 HA PHE A 248 7.873 -4.554 -8.343 1.00 0.00 H new ATOM 0 HB2 PHE A 248 10.566 -3.588 -9.268 1.00 0.00 H new ATOM 0 HB3 PHE A 248 10.202 -5.284 -9.518 1.00 0.00 H new ATOM 0 HD1 PHE A 248 7.711 -5.683 -10.517 1.00 0.00 H new ATOM 0 HD2 PHE A 248 10.010 -2.129 -11.051 1.00 0.00 H new ATOM 0 HE1 PHE A 248 6.416 -5.141 -12.523 1.00 0.00 H new ATOM 0 HE2 PHE A 248 8.714 -1.609 -13.069 1.00 0.00 H new ATOM 0 HZ PHE A 248 6.922 -3.111 -13.809 1.00 0.00 H new ATOM 419 N HIS A 249 9.358 -6.640 -7.514 1.00 0.00 N ATOM 420 CA HIS A 249 9.934 -7.775 -6.772 1.00 0.00 C ATOM 421 C HIS A 249 11.020 -8.454 -7.612 1.00 0.00 C ATOM 422 O HIS A 249 10.866 -8.620 -8.831 1.00 0.00 O ATOM 423 CB HIS A 249 8.843 -8.798 -6.287 1.00 0.00 C ATOM 424 CG HIS A 249 7.560 -8.803 -7.066 1.00 0.00 C ATOM 425 ND1 HIS A 249 6.477 -8.025 -6.736 1.00 0.00 N ATOM 426 CD2 HIS A 249 7.196 -9.501 -8.163 1.00 0.00 C ATOM 427 CE1 HIS A 249 5.514 -8.266 -7.625 1.00 0.00 C ATOM 428 NE2 HIS A 249 5.895 -9.151 -8.533 1.00 0.00 N ATOM 0 H HIS A 249 8.895 -6.913 -8.381 1.00 0.00 H new ATOM 0 HA HIS A 249 10.392 -7.380 -5.865 1.00 0.00 H new ATOM 0 HB2 HIS A 249 9.271 -9.800 -6.321 1.00 0.00 H new ATOM 0 HB3 HIS A 249 8.611 -8.586 -5.243 1.00 0.00 H new ATOM 0 HD2 HIS A 249 7.816 -10.221 -8.676 1.00 0.00 H new ATOM 0 HE1 HIS A 249 4.541 -7.797 -7.607 1.00 0.00 H new ATOM 0 HE2 HIS A 249 5.358 -9.500 -9.327 1.00 0.00 H new ATOM 436 N TYR A 250 12.108 -8.851 -6.913 1.00 0.00 N ATOM 437 CA TYR A 250 13.297 -9.521 -7.488 1.00 0.00 C ATOM 438 C TYR A 250 12.928 -10.790 -8.284 1.00 0.00 C ATOM 439 O TYR A 250 13.643 -11.176 -9.210 1.00 0.00 O ATOM 440 CB TYR A 250 14.305 -9.870 -6.357 1.00 0.00 C ATOM 441 CG TYR A 250 15.094 -8.663 -5.812 1.00 0.00 C ATOM 442 CD1 TYR A 250 16.212 -8.181 -6.490 1.00 0.00 C ATOM 443 CD2 TYR A 250 14.718 -7.999 -4.643 1.00 0.00 C ATOM 444 CE1 TYR A 250 16.922 -7.102 -6.027 1.00 0.00 C ATOM 445 CE2 TYR A 250 15.432 -6.913 -4.178 1.00 0.00 C ATOM 446 CZ TYR A 250 16.530 -6.472 -4.872 1.00 0.00 C ATOM 447 OH TYR A 250 17.235 -5.386 -4.422 1.00 0.00 O ATOM 0 H TYR A 250 12.185 -8.710 -5.906 1.00 0.00 H new ATOM 0 HA TYR A 250 13.757 -8.825 -8.190 1.00 0.00 H new ATOM 0 HB2 TYR A 250 13.762 -10.335 -5.534 1.00 0.00 H new ATOM 0 HB3 TYR A 250 15.011 -10.611 -6.732 1.00 0.00 H new ATOM 0 HD1 TYR A 250 16.527 -8.668 -7.401 1.00 0.00 H new ATOM 0 HD2 TYR A 250 13.854 -8.341 -4.093 1.00 0.00 H new ATOM 0 HE1 TYR A 250 17.787 -6.749 -6.570 1.00 0.00 H new ATOM 0 HE2 TYR A 250 15.127 -6.412 -3.271 1.00 0.00 H new ATOM 0 HH TYR A 250 16.830 -5.054 -3.594 1.00 0.00 H new ATOM 457 N ASP A 251 11.816 -11.422 -7.896 1.00 0.00 N ATOM 458 CA ASP A 251 11.278 -12.611 -8.580 1.00 0.00 C ATOM 459 C ASP A 251 10.924 -12.295 -10.061 1.00 0.00 C ATOM 460 O ASP A 251 11.419 -12.963 -10.982 1.00 0.00 O ATOM 461 CB ASP A 251 10.026 -13.111 -7.811 1.00 0.00 C ATOM 462 CG ASP A 251 9.376 -14.371 -8.420 1.00 0.00 C ATOM 463 OD1 ASP A 251 9.761 -15.499 -8.042 1.00 0.00 O ATOM 464 OD2 ASP A 251 8.470 -14.242 -9.277 1.00 0.00 O ATOM 0 H ASP A 251 11.258 -11.125 -7.095 1.00 0.00 H new ATOM 0 HA ASP A 251 12.038 -13.392 -8.588 1.00 0.00 H new ATOM 0 HB2 ASP A 251 10.307 -13.322 -6.779 1.00 0.00 H new ATOM 0 HB3 ASP A 251 9.286 -12.311 -7.783 1.00 0.00 H new ATOM 469 N CYS A 252 10.087 -11.259 -10.266 1.00 0.00 N ATOM 470 CA CYS A 252 9.601 -10.842 -11.608 1.00 0.00 C ATOM 471 C CYS A 252 10.745 -10.305 -12.482 1.00 0.00 C ATOM 472 O CYS A 252 10.851 -10.657 -13.662 1.00 0.00 O ATOM 473 CB CYS A 252 8.473 -9.781 -11.481 1.00 0.00 C ATOM 474 SG CYS A 252 6.794 -10.454 -11.652 1.00 0.00 S ATOM 0 H CYS A 252 9.724 -10.682 -9.507 1.00 0.00 H new ATOM 0 HA CYS A 252 9.194 -11.727 -12.097 1.00 0.00 H new ATOM 0 HB2 CYS A 252 8.559 -9.290 -10.511 1.00 0.00 H new ATOM 0 HB3 CYS A 252 8.624 -9.014 -12.241 1.00 0.00 H new ATOM 0 HG CYS A 252 5.974 -9.498 -11.973 1.00 0.00 H new ATOM 479 N VAL A 253 11.603 -9.454 -11.891 1.00 0.00 N ATOM 480 CA VAL A 253 12.713 -8.808 -12.626 1.00 0.00 C ATOM 481 C VAL A 253 13.960 -9.722 -12.694 1.00 0.00 C ATOM 482 O VAL A 253 14.981 -9.342 -13.279 1.00 0.00 O ATOM 483 CB VAL A 253 13.065 -7.400 -12.014 1.00 0.00 C ATOM 484 CG1 VAL A 253 11.841 -6.452 -12.093 1.00 0.00 C ATOM 485 CG2 VAL A 253 13.581 -7.521 -10.560 1.00 0.00 C ATOM 0 H VAL A 253 11.551 -9.195 -10.906 1.00 0.00 H new ATOM 0 HA VAL A 253 12.374 -8.646 -13.649 1.00 0.00 H new ATOM 0 HB VAL A 253 13.872 -6.972 -12.608 1.00 0.00 H new ATOM 0 HG11 VAL A 253 12.102 -5.484 -11.666 1.00 0.00 H new ATOM 0 HG12 VAL A 253 11.548 -6.322 -13.135 1.00 0.00 H new ATOM 0 HG13 VAL A 253 11.010 -6.883 -11.534 1.00 0.00 H new ATOM 0 HG21 VAL A 253 13.813 -6.529 -10.173 1.00 0.00 H new ATOM 0 HG22 VAL A 253 12.814 -7.983 -9.939 1.00 0.00 H new ATOM 0 HG23 VAL A 253 14.480 -8.137 -10.543 1.00 0.00 H new ATOM 495 N ASN A 254 13.848 -10.928 -12.075 1.00 0.00 N ATOM 496 CA ASN A 254 14.853 -12.027 -12.153 1.00 0.00 C ATOM 497 C ASN A 254 16.241 -11.626 -11.602 1.00 0.00 C ATOM 498 O ASN A 254 17.245 -12.304 -11.863 1.00 0.00 O ATOM 499 CB ASN A 254 14.953 -12.590 -13.605 1.00 0.00 C ATOM 500 CG ASN A 254 13.641 -13.215 -14.100 1.00 0.00 C ATOM 501 OD1 ASN A 254 12.822 -12.550 -14.732 1.00 0.00 O ATOM 502 ND2 ASN A 254 13.423 -14.495 -13.806 1.00 0.00 N ATOM 0 H ASN A 254 13.043 -11.169 -11.497 1.00 0.00 H new ATOM 0 HA ASN A 254 14.493 -12.822 -11.500 1.00 0.00 H new ATOM 0 HB2 ASN A 254 15.243 -11.786 -14.281 1.00 0.00 H new ATOM 0 HB3 ASN A 254 15.743 -13.340 -13.644 1.00 0.00 H new ATOM 0 HD21 ASN A 254 12.560 -14.947 -14.106 1.00 0.00 H new ATOM 0 HD22 ASN A 254 14.119 -15.023 -13.280 1.00 0.00 H new ATOM 509 N LEU A 255 16.279 -10.558 -10.791 1.00 0.00 N ATOM 510 CA LEU A 255 17.519 -10.083 -10.154 1.00 0.00 C ATOM 511 C LEU A 255 17.732 -10.887 -8.867 1.00 0.00 C ATOM 512 O LEU A 255 16.861 -10.912 -8.004 1.00 0.00 O ATOM 513 CB LEU A 255 17.448 -8.555 -9.853 1.00 0.00 C ATOM 514 CG LEU A 255 17.375 -7.600 -11.090 1.00 0.00 C ATOM 515 CD1 LEU A 255 17.255 -6.121 -10.640 1.00 0.00 C ATOM 516 CD2 LEU A 255 18.576 -7.813 -12.049 1.00 0.00 C ATOM 0 H LEU A 255 15.457 -10.001 -10.558 1.00 0.00 H new ATOM 0 HA LEU A 255 18.361 -10.233 -10.830 1.00 0.00 H new ATOM 0 HB2 LEU A 255 16.574 -8.371 -9.229 1.00 0.00 H new ATOM 0 HB3 LEU A 255 18.324 -8.283 -9.264 1.00 0.00 H new ATOM 0 HG LEU A 255 16.474 -7.850 -11.651 1.00 0.00 H new ATOM 0 HD11 LEU A 255 17.206 -5.476 -11.518 1.00 0.00 H new ATOM 0 HD12 LEU A 255 16.350 -5.994 -10.045 1.00 0.00 H new ATOM 0 HD13 LEU A 255 18.124 -5.852 -10.040 1.00 0.00 H new ATOM 0 HD21 LEU A 255 18.490 -7.132 -12.896 1.00 0.00 H new ATOM 0 HD22 LEU A 255 19.506 -7.615 -11.517 1.00 0.00 H new ATOM 0 HD23 LEU A 255 18.576 -8.842 -12.409 1.00 0.00 H new ATOM 528 N LYS A 256 18.867 -11.588 -8.771 1.00 0.00 N ATOM 529 CA LYS A 256 19.193 -12.450 -7.606 1.00 0.00 C ATOM 530 C LYS A 256 20.225 -11.753 -6.707 1.00 0.00 C ATOM 531 O LYS A 256 20.902 -12.390 -5.893 1.00 0.00 O ATOM 532 CB LYS A 256 19.715 -13.822 -8.116 1.00 0.00 C ATOM 533 CG LYS A 256 18.796 -14.490 -9.165 1.00 0.00 C ATOM 534 CD LYS A 256 17.336 -14.643 -8.671 1.00 0.00 C ATOM 535 CE LYS A 256 16.408 -15.239 -9.735 1.00 0.00 C ATOM 536 NZ LYS A 256 16.851 -16.593 -10.158 1.00 0.00 N ATOM 0 H LYS A 256 19.590 -11.581 -9.491 1.00 0.00 H new ATOM 0 HA LYS A 256 18.298 -12.622 -7.008 1.00 0.00 H new ATOM 0 HB2 LYS A 256 20.706 -13.685 -8.550 1.00 0.00 H new ATOM 0 HB3 LYS A 256 19.830 -14.495 -7.266 1.00 0.00 H new ATOM 0 HG2 LYS A 256 18.805 -13.897 -10.080 1.00 0.00 H new ATOM 0 HG3 LYS A 256 19.194 -15.473 -9.418 1.00 0.00 H new ATOM 0 HD2 LYS A 256 17.322 -15.279 -7.786 1.00 0.00 H new ATOM 0 HD3 LYS A 256 16.955 -13.667 -8.369 1.00 0.00 H new ATOM 0 HE2 LYS A 256 15.393 -15.295 -9.342 1.00 0.00 H new ATOM 0 HE3 LYS A 256 16.378 -14.579 -10.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 256 16.137 -17.011 -10.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 256 17.757 -16.520 -10.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 256 16.970 -17.197 -9.320 1.00 0.00 H new ATOM 550 N GLU A 257 20.289 -10.427 -6.850 1.00 0.00 N ATOM 551 CA GLU A 257 21.265 -9.567 -6.186 1.00 0.00 C ATOM 552 C GLU A 257 20.715 -8.129 -6.133 1.00 0.00 C ATOM 553 O GLU A 257 20.072 -7.685 -7.102 1.00 0.00 O ATOM 554 CB GLU A 257 22.622 -9.630 -6.948 1.00 0.00 C ATOM 555 CG GLU A 257 22.536 -9.313 -8.461 1.00 0.00 C ATOM 556 CD GLU A 257 23.843 -9.618 -9.207 1.00 0.00 C ATOM 557 OE1 GLU A 257 24.103 -10.811 -9.487 1.00 0.00 O ATOM 558 OE2 GLU A 257 24.618 -8.685 -9.507 1.00 0.00 O ATOM 0 H GLU A 257 19.644 -9.910 -7.448 1.00 0.00 H new ATOM 0 HA GLU A 257 21.438 -9.908 -5.165 1.00 0.00 H new ATOM 0 HB2 GLU A 257 23.316 -8.929 -6.484 1.00 0.00 H new ATOM 0 HB3 GLU A 257 23.046 -10.627 -6.824 1.00 0.00 H new ATOM 0 HG2 GLU A 257 21.726 -9.893 -8.904 1.00 0.00 H new ATOM 0 HG3 GLU A 257 22.284 -8.261 -8.594 1.00 0.00 H new ATOM 565 N PRO A 258 20.909 -7.395 -4.989 1.00 0.00 N ATOM 566 CA PRO A 258 20.489 -5.981 -4.857 1.00 0.00 C ATOM 567 C PRO A 258 21.326 -5.049 -5.766 1.00 0.00 C ATOM 568 O PRO A 258 22.545 -4.943 -5.572 1.00 0.00 O ATOM 569 CB PRO A 258 20.703 -5.665 -3.341 1.00 0.00 C ATOM 570 CG PRO A 258 20.863 -7.007 -2.690 1.00 0.00 C ATOM 571 CD PRO A 258 21.512 -7.885 -3.729 1.00 0.00 C ATOM 0 HA PRO A 258 19.458 -5.820 -5.172 1.00 0.00 H new ATOM 0 HB2 PRO A 258 21.585 -5.043 -3.187 1.00 0.00 H new ATOM 0 HB3 PRO A 258 19.854 -5.123 -2.926 1.00 0.00 H new ATOM 0 HG2 PRO A 258 21.480 -6.937 -1.794 1.00 0.00 H new ATOM 0 HG3 PRO A 258 19.899 -7.411 -2.382 1.00 0.00 H new ATOM 0 HD2 PRO A 258 22.597 -7.777 -3.730 1.00 0.00 H new ATOM 0 HD3 PRO A 258 21.296 -8.940 -3.560 1.00 0.00 H new ATOM 579 N PRO A 259 20.698 -4.383 -6.794 1.00 0.00 N ATOM 580 CA PRO A 259 21.416 -3.447 -7.687 1.00 0.00 C ATOM 581 C PRO A 259 21.851 -2.167 -6.927 1.00 0.00 C ATOM 582 O PRO A 259 21.013 -1.472 -6.340 1.00 0.00 O ATOM 583 CB PRO A 259 20.374 -3.145 -8.804 1.00 0.00 C ATOM 584 CG PRO A 259 19.042 -3.373 -8.153 1.00 0.00 C ATOM 585 CD PRO A 259 19.253 -4.499 -7.163 1.00 0.00 C ATOM 0 HA PRO A 259 22.344 -3.857 -8.086 1.00 0.00 H new ATOM 0 HB2 PRO A 259 20.468 -2.121 -9.167 1.00 0.00 H new ATOM 0 HB3 PRO A 259 20.513 -3.801 -9.663 1.00 0.00 H new ATOM 0 HG2 PRO A 259 18.693 -2.471 -7.650 1.00 0.00 H new ATOM 0 HG3 PRO A 259 18.286 -3.639 -8.892 1.00 0.00 H new ATOM 0 HD2 PRO A 259 18.608 -4.391 -6.291 1.00 0.00 H new ATOM 0 HD3 PRO A 259 19.030 -5.469 -7.607 1.00 0.00 H new ATOM 593 N LYS A 260 23.169 -1.899 -6.907 1.00 0.00 N ATOM 594 CA LYS A 260 23.737 -0.706 -6.260 1.00 0.00 C ATOM 595 C LYS A 260 23.421 0.552 -7.086 1.00 0.00 C ATOM 596 O LYS A 260 23.704 0.598 -8.289 1.00 0.00 O ATOM 597 CB LYS A 260 25.271 -0.847 -6.089 1.00 0.00 C ATOM 598 CG LYS A 260 25.721 -2.026 -5.209 1.00 0.00 C ATOM 599 CD LYS A 260 27.265 -2.103 -5.027 1.00 0.00 C ATOM 600 CE LYS A 260 28.041 -2.543 -6.295 1.00 0.00 C ATOM 601 NZ LYS A 260 28.017 -1.551 -7.405 1.00 0.00 N ATOM 0 H LYS A 260 23.868 -2.503 -7.339 1.00 0.00 H new ATOM 0 HA LYS A 260 23.284 -0.611 -5.273 1.00 0.00 H new ATOM 0 HB2 LYS A 260 25.723 -0.956 -7.075 1.00 0.00 H new ATOM 0 HB3 LYS A 260 25.660 0.076 -5.660 1.00 0.00 H new ATOM 0 HG2 LYS A 260 25.250 -1.940 -4.230 1.00 0.00 H new ATOM 0 HG3 LYS A 260 25.367 -2.957 -5.652 1.00 0.00 H new ATOM 0 HD2 LYS A 260 27.630 -1.125 -4.714 1.00 0.00 H new ATOM 0 HD3 LYS A 260 27.489 -2.800 -4.219 1.00 0.00 H new ATOM 0 HE2 LYS A 260 29.078 -2.740 -6.022 1.00 0.00 H new ATOM 0 HE3 LYS A 260 27.622 -3.483 -6.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 260 28.948 -1.525 -7.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 260 27.293 -1.824 -8.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 260 27.794 -0.609 -7.024 1.00 0.00 H new ATOM 615 N GLY A 261 22.789 1.539 -6.442 1.00 0.00 N ATOM 616 CA GLY A 261 22.535 2.841 -7.057 1.00 0.00 C ATOM 617 C GLY A 261 21.052 3.099 -7.217 1.00 0.00 C ATOM 618 O GLY A 261 20.235 2.484 -6.534 1.00 0.00 O ATOM 0 H GLY A 261 22.442 1.457 -5.486 1.00 0.00 H new ATOM 0 HA2 GLY A 261 22.978 3.626 -6.445 1.00 0.00 H new ATOM 0 HA3 GLY A 261 23.020 2.885 -8.032 1.00 0.00 H new ATOM 622 N THR A 262 20.706 4.024 -8.116 1.00 0.00 N ATOM 623 CA THR A 262 19.324 4.284 -8.505 1.00 0.00 C ATOM 624 C THR A 262 18.907 3.273 -9.593 1.00 0.00 C ATOM 625 O THR A 262 19.395 3.343 -10.725 1.00 0.00 O ATOM 626 CB THR A 262 19.170 5.770 -9.004 1.00 0.00 C ATOM 627 OG1 THR A 262 20.096 6.055 -10.068 1.00 0.00 O ATOM 628 CG2 THR A 262 19.412 6.776 -7.864 1.00 0.00 C ATOM 0 H THR A 262 21.384 4.616 -8.596 1.00 0.00 H new ATOM 0 HA THR A 262 18.665 4.159 -7.646 1.00 0.00 H new ATOM 0 HB THR A 262 18.147 5.875 -9.366 1.00 0.00 H new ATOM 0 HG1 THR A 262 20.270 5.236 -10.578 1.00 0.00 H new ATOM 0 HG21 THR A 262 19.298 7.791 -8.244 1.00 0.00 H new ATOM 0 HG22 THR A 262 18.689 6.603 -7.067 1.00 0.00 H new ATOM 0 HG23 THR A 262 20.421 6.647 -7.473 1.00 0.00 H new ATOM 636 N TRP A 263 18.053 2.295 -9.223 1.00 0.00 N ATOM 637 CA TRP A 263 17.565 1.267 -10.163 1.00 0.00 C ATOM 638 C TRP A 263 16.478 1.855 -11.071 1.00 0.00 C ATOM 639 O TRP A 263 15.720 2.739 -10.667 1.00 0.00 O ATOM 640 CB TRP A 263 17.036 0.016 -9.406 1.00 0.00 C ATOM 641 CG TRP A 263 16.590 -1.126 -10.312 1.00 0.00 C ATOM 642 CD1 TRP A 263 17.393 -1.903 -11.103 1.00 0.00 C ATOM 643 CD2 TRP A 263 15.247 -1.607 -10.519 1.00 0.00 C ATOM 644 NE1 TRP A 263 16.639 -2.832 -11.768 1.00 0.00 N ATOM 645 CE2 TRP A 263 15.327 -2.674 -11.428 1.00 0.00 C ATOM 646 CE3 TRP A 263 13.989 -1.244 -10.018 1.00 0.00 C ATOM 647 CZ2 TRP A 263 14.202 -3.374 -11.850 1.00 0.00 C ATOM 648 CZ3 TRP A 263 12.874 -1.940 -10.433 1.00 0.00 C ATOM 649 CH2 TRP A 263 12.987 -2.998 -11.338 1.00 0.00 C ATOM 0 H TRP A 263 17.687 2.197 -8.276 1.00 0.00 H new ATOM 0 HA TRP A 263 18.402 0.946 -10.783 1.00 0.00 H new ATOM 0 HB2 TRP A 263 17.818 -0.349 -8.740 1.00 0.00 H new ATOM 0 HB3 TRP A 263 16.197 0.314 -8.778 1.00 0.00 H new ATOM 0 HD1 TRP A 263 18.464 -1.798 -11.190 1.00 0.00 H new ATOM 0 HE1 TRP A 263 17.001 -3.532 -12.416 1.00 0.00 H new ATOM 0 HE3 TRP A 263 13.895 -0.429 -9.316 1.00 0.00 H new ATOM 0 HZ2 TRP A 263 14.283 -4.186 -12.557 1.00 0.00 H new ATOM 0 HZ3 TRP A 263 11.901 -1.664 -10.054 1.00 0.00 H new ATOM 0 HH2 TRP A 263 12.098 -3.531 -11.641 1.00 0.00 H new ATOM 660 N TYR A 264 16.422 1.368 -12.312 1.00 0.00 N ATOM 661 CA TYR A 264 15.432 1.787 -13.306 1.00 0.00 C ATOM 662 C TYR A 264 14.614 0.569 -13.737 1.00 0.00 C ATOM 663 O TYR A 264 15.166 -0.422 -14.214 1.00 0.00 O ATOM 664 CB TYR A 264 16.129 2.466 -14.518 1.00 0.00 C ATOM 665 CG TYR A 264 16.782 3.808 -14.163 1.00 0.00 C ATOM 666 CD1 TYR A 264 16.063 4.998 -14.253 1.00 0.00 C ATOM 667 CD2 TYR A 264 18.101 3.878 -13.716 1.00 0.00 C ATOM 668 CE1 TYR A 264 16.635 6.207 -13.917 1.00 0.00 C ATOM 669 CE2 TYR A 264 18.678 5.086 -13.377 1.00 0.00 C ATOM 670 CZ TYR A 264 17.941 6.249 -13.480 1.00 0.00 C ATOM 671 OH TYR A 264 18.508 7.463 -13.148 1.00 0.00 O ATOM 0 H TYR A 264 17.071 0.662 -12.659 1.00 0.00 H new ATOM 0 HA TYR A 264 14.759 2.524 -12.869 1.00 0.00 H new ATOM 0 HB2 TYR A 264 16.889 1.793 -14.916 1.00 0.00 H new ATOM 0 HB3 TYR A 264 15.396 2.623 -15.309 1.00 0.00 H new ATOM 0 HD1 TYR A 264 15.038 4.973 -14.592 1.00 0.00 H new ATOM 0 HD2 TYR A 264 18.682 2.971 -13.633 1.00 0.00 H new ATOM 0 HE1 TYR A 264 16.061 7.118 -13.996 1.00 0.00 H new ATOM 0 HE2 TYR A 264 19.701 5.121 -13.033 1.00 0.00 H new ATOM 0 HH TYR A 264 19.433 7.323 -12.857 1.00 0.00 H new ATOM 681 N CYS A 265 13.293 0.645 -13.526 1.00 0.00 N ATOM 682 CA CYS A 265 12.339 -0.400 -13.945 1.00 0.00 C ATOM 683 C CYS A 265 12.247 -0.468 -15.491 1.00 0.00 C ATOM 684 O CYS A 265 12.633 0.504 -16.150 1.00 0.00 O ATOM 685 CB CYS A 265 10.963 -0.075 -13.340 1.00 0.00 C ATOM 686 SG CYS A 265 10.158 1.339 -14.125 1.00 0.00 S ATOM 0 H CYS A 265 12.850 1.436 -13.058 1.00 0.00 H new ATOM 0 HA CYS A 265 12.681 -1.372 -13.590 1.00 0.00 H new ATOM 0 HB2 CYS A 265 10.318 -0.949 -13.430 1.00 0.00 H new ATOM 0 HB3 CYS A 265 11.080 0.126 -12.275 1.00 0.00 H new ATOM 0 HG CYS A 265 8.886 1.319 -13.856 1.00 0.00 H new ATOM 691 N PRO A 266 11.734 -1.604 -16.091 1.00 0.00 N ATOM 692 CA PRO A 266 11.520 -1.748 -17.566 1.00 0.00 C ATOM 693 C PRO A 266 10.930 -0.496 -18.287 1.00 0.00 C ATOM 694 O PRO A 266 11.227 -0.265 -19.462 1.00 0.00 O ATOM 695 CB PRO A 266 10.540 -2.942 -17.637 1.00 0.00 C ATOM 696 CG PRO A 266 10.961 -3.823 -16.500 1.00 0.00 C ATOM 697 CD PRO A 266 11.384 -2.881 -15.385 1.00 0.00 C ATOM 0 HA PRO A 266 12.468 -1.886 -18.086 1.00 0.00 H new ATOM 0 HB2 PRO A 266 9.505 -2.617 -17.528 1.00 0.00 H new ATOM 0 HB3 PRO A 266 10.612 -3.461 -18.593 1.00 0.00 H new ATOM 0 HG2 PRO A 266 10.142 -4.467 -16.179 1.00 0.00 H new ATOM 0 HG3 PRO A 266 11.783 -4.476 -16.794 1.00 0.00 H new ATOM 0 HD2 PRO A 266 10.579 -2.730 -14.665 1.00 0.00 H new ATOM 0 HD3 PRO A 266 12.236 -3.276 -14.832 1.00 0.00 H new ATOM 705 N GLU A 267 10.119 0.307 -17.566 1.00 0.00 N ATOM 706 CA GLU A 267 9.602 1.596 -18.086 1.00 0.00 C ATOM 707 C GLU A 267 10.782 2.571 -18.342 1.00 0.00 C ATOM 708 O GLU A 267 11.148 2.854 -19.480 1.00 0.00 O ATOM 709 CB GLU A 267 8.642 2.273 -17.059 1.00 0.00 C ATOM 710 CG GLU A 267 7.515 1.401 -16.479 1.00 0.00 C ATOM 711 CD GLU A 267 6.725 2.146 -15.377 1.00 0.00 C ATOM 712 OE1 GLU A 267 7.282 2.365 -14.277 1.00 0.00 O ATOM 713 OE2 GLU A 267 5.565 2.524 -15.612 1.00 0.00 O ATOM 0 H GLU A 267 9.806 0.087 -16.620 1.00 0.00 H new ATOM 0 HA GLU A 267 9.062 1.385 -19.009 1.00 0.00 H new ATOM 0 HB2 GLU A 267 9.242 2.647 -16.230 1.00 0.00 H new ATOM 0 HB3 GLU A 267 8.187 3.139 -17.540 1.00 0.00 H new ATOM 0 HG2 GLU A 267 6.835 1.106 -17.278 1.00 0.00 H new ATOM 0 HG3 GLU A 267 7.939 0.485 -16.067 1.00 0.00 H new ATOM 720 N CYS A 268 11.427 2.974 -17.232 1.00 0.00 N ATOM 721 CA CYS A 268 12.403 4.082 -17.190 1.00 0.00 C ATOM 722 C CYS A 268 13.720 3.713 -17.886 1.00 0.00 C ATOM 723 O CYS A 268 14.423 4.588 -18.398 1.00 0.00 O ATOM 724 CB CYS A 268 12.659 4.495 -15.722 1.00 0.00 C ATOM 725 SG CYS A 268 11.149 4.919 -14.804 1.00 0.00 S ATOM 0 H CYS A 268 11.283 2.533 -16.324 1.00 0.00 H new ATOM 0 HA CYS A 268 11.980 4.926 -17.735 1.00 0.00 H new ATOM 0 HB2 CYS A 268 13.168 3.679 -15.209 1.00 0.00 H new ATOM 0 HB3 CYS A 268 13.334 5.351 -15.708 1.00 0.00 H new ATOM 0 HG CYS A 268 10.554 3.829 -14.420 1.00 0.00 H new ATOM 730 N LYS A 269 14.049 2.415 -17.882 1.00 0.00 N ATOM 731 CA LYS A 269 15.290 1.894 -18.471 1.00 0.00 C ATOM 732 C LYS A 269 15.148 1.762 -20.000 1.00 0.00 C ATOM 733 O LYS A 269 15.930 2.355 -20.755 1.00 0.00 O ATOM 734 CB LYS A 269 15.645 0.523 -17.831 1.00 0.00 C ATOM 735 CG LYS A 269 16.932 -0.149 -18.373 1.00 0.00 C ATOM 736 CD LYS A 269 17.305 -1.440 -17.599 1.00 0.00 C ATOM 737 CE LYS A 269 17.714 -1.163 -16.139 1.00 0.00 C ATOM 738 NZ LYS A 269 18.930 -0.305 -16.043 1.00 0.00 N ATOM 0 H LYS A 269 13.459 1.693 -17.468 1.00 0.00 H new ATOM 0 HA LYS A 269 16.099 2.595 -18.266 1.00 0.00 H new ATOM 0 HB2 LYS A 269 15.752 0.660 -16.755 1.00 0.00 H new ATOM 0 HB3 LYS A 269 14.808 -0.158 -17.984 1.00 0.00 H new ATOM 0 HG2 LYS A 269 16.795 -0.389 -19.427 1.00 0.00 H new ATOM 0 HG3 LYS A 269 17.759 0.558 -18.312 1.00 0.00 H new ATOM 0 HD2 LYS A 269 16.456 -2.123 -17.610 1.00 0.00 H new ATOM 0 HD3 LYS A 269 18.125 -1.942 -18.112 1.00 0.00 H new ATOM 0 HE2 LYS A 269 16.888 -0.678 -15.619 1.00 0.00 H new ATOM 0 HE3 LYS A 269 17.899 -2.109 -15.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 19.254 -0.272 -15.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 19.683 -0.701 -16.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 18.702 0.657 -16.365 1.00 0.00 H new ATOM 752 N ILE A 270 14.122 1.007 -20.444 1.00 0.00 N ATOM 753 CA ILE A 270 13.996 0.577 -21.853 1.00 0.00 C ATOM 754 C ILE A 270 13.372 1.683 -22.735 1.00 0.00 C ATOM 755 O ILE A 270 14.010 2.168 -23.677 1.00 0.00 O ATOM 756 CB ILE A 270 13.153 -0.758 -21.973 1.00 0.00 C ATOM 757 CG1 ILE A 270 13.757 -1.885 -21.060 1.00 0.00 C ATOM 758 CG2 ILE A 270 13.024 -1.226 -23.446 1.00 0.00 C ATOM 759 CD1 ILE A 270 15.201 -2.263 -21.366 1.00 0.00 C ATOM 0 H ILE A 270 13.365 0.681 -19.844 1.00 0.00 H new ATOM 0 HA ILE A 270 15.005 0.384 -22.217 1.00 0.00 H new ATOM 0 HB ILE A 270 12.144 -0.545 -21.619 1.00 0.00 H new ATOM 0 HG12 ILE A 270 13.695 -1.561 -20.021 1.00 0.00 H new ATOM 0 HG13 ILE A 270 13.137 -2.777 -21.153 1.00 0.00 H new ATOM 0 HG21 ILE A 270 12.439 -2.145 -23.486 1.00 0.00 H new ATOM 0 HG22 ILE A 270 12.526 -0.453 -24.031 1.00 0.00 H new ATOM 0 HG23 ILE A 270 14.016 -1.410 -23.858 1.00 0.00 H new ATOM 0 HD11 ILE A 270 15.524 -3.048 -20.682 1.00 0.00 H new ATOM 0 HD12 ILE A 270 15.273 -2.623 -22.392 1.00 0.00 H new ATOM 0 HD13 ILE A 270 15.840 -1.389 -21.243 1.00 0.00 H new ATOM 771 N GLU A 271 12.141 2.105 -22.391 1.00 0.00 N ATOM 772 CA GLU A 271 11.312 2.972 -23.259 1.00 0.00 C ATOM 773 C GLU A 271 10.815 4.196 -22.445 1.00 0.00 C ATOM 774 O GLU A 271 11.420 5.281 -22.555 1.00 0.00 O ATOM 775 CB GLU A 271 10.135 2.122 -23.852 1.00 0.00 C ATOM 776 CG GLU A 271 9.414 2.713 -25.094 1.00 0.00 C ATOM 777 CD GLU A 271 8.510 3.929 -24.810 1.00 0.00 C ATOM 778 OE1 GLU A 271 7.473 3.765 -24.129 1.00 0.00 O ATOM 779 OE2 GLU A 271 8.834 5.055 -25.252 1.00 0.00 O ATOM 780 OXT GLU A 271 9.833 4.069 -21.688 1.00 0.00 O ATOM 0 H GLU A 271 11.692 1.858 -21.509 1.00 0.00 H new ATOM 0 HA GLU A 271 11.895 3.358 -24.095 1.00 0.00 H new ATOM 0 HB2 GLU A 271 10.524 1.139 -24.118 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.394 1.970 -23.067 1.00 0.00 H new ATOM 0 HG2 GLU A 271 10.166 3.003 -25.827 1.00 0.00 H new ATOM 0 HG3 GLU A 271 8.809 1.929 -25.550 1.00 0.00 H new