USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 771 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 34 TYR OH : rot 154:sc= 0.822 USER MOD Set 1.2: A 71 ASN : amide:sc= -8.61! C(o=-7.8!,f=-8.4!) USER MOD Set 2.1: A 65 THR OG1 : rot -72:sc= 0.962 USER MOD Set 2.2: A 86 HIS : no HD1:sc= 0 X(o=0.96,f=0.96) USER MOD Single : A 12 TYR OH : rot 165:sc= -0.131 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -1.16 K(o=-1.2,f=-2.1!) USER MOD Single : A 19 ASN : amide:sc= -2.45! C(o=-2.4!,f=-11!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.019 USER MOD Single : A 29 THR OG1 : rot 81:sc= 0.0998 USER MOD Single : A 32 SER OG : rot 110:sc=-0.00389 USER MOD Single : A 43 SER OG : rot 149:sc= 1.68 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -161:sc= -0.0955 (180deg=-0.541) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 64 SER OG : rot 174:sc= 1.18 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 89 TYR OH : rot -84:sc= -1.86! USER MOD Single : B 314 MET CE :methyl -133:sc= -0.771 (180deg=-1.44) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= -3.84! K(o=-3.8!,f=0.019) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 159:sc= 1.45 (180deg=0.958) USER MOD Single : B 335 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 336 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.17) USER MOD Single : B 337 ASN : amide:sc= 0.624 K(o=0.62,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.194 -16.795 -2.700 1.00 0.00 N ATOM 143 CA ALA A 11 0.406 -17.560 -1.615 1.00 0.00 C ATOM 144 C ALA A 11 -0.346 -17.326 -0.309 1.00 0.00 C ATOM 145 O ALA A 11 -0.803 -16.216 -0.036 1.00 0.00 O ATOM 146 CB ALA A 11 1.871 -17.157 -1.441 1.00 0.00 C ATOM 0 HA ALA A 11 0.346 -18.619 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.313 -17.733 -0.628 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.415 -17.356 -2.364 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.931 -16.094 -1.207 1.00 0.00 H new ATOM 152 N TYR A 12 -0.472 -18.381 0.500 1.00 0.00 N ATOM 153 CA TYR A 12 -1.167 -18.282 1.787 1.00 0.00 C ATOM 154 C TYR A 12 -0.239 -18.690 2.929 1.00 0.00 C ATOM 155 O TYR A 12 0.599 -19.580 2.774 1.00 0.00 O ATOM 156 CB TYR A 12 -2.412 -19.178 1.784 1.00 0.00 C ATOM 157 CG TYR A 12 -3.491 -18.553 0.929 1.00 0.00 C ATOM 158 CD1 TYR A 12 -3.455 -18.694 -0.461 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.528 -17.830 1.533 1.00 0.00 C ATOM 160 CE1 TYR A 12 -4.455 -18.112 -1.249 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.529 -17.250 0.747 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.492 -17.390 -0.645 1.00 0.00 C ATOM 163 OH TYR A 12 -6.477 -16.816 -1.422 1.00 0.00 O ATOM 0 H TYR A 12 -0.104 -19.309 0.289 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.472 -17.246 1.936 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.159 -20.167 1.401 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.776 -19.314 2.802 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -2.656 -19.252 -0.927 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.554 -17.720 2.607 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -4.427 -18.220 -2.323 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.329 -16.695 1.214 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.235 -16.564 -0.855 1.00 0.00 H new ATOM 173 N ILE A 13 -0.389 -18.034 4.078 1.00 0.00 N ATOM 174 CA ILE A 13 0.448 -18.332 5.243 1.00 0.00 C ATOM 175 C ILE A 13 -0.297 -19.275 6.194 1.00 0.00 C ATOM 176 O ILE A 13 -1.332 -18.913 6.753 1.00 0.00 O ATOM 177 CB ILE A 13 0.824 -17.021 5.986 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.847 -15.851 4.994 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.217 -17.159 6.622 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.172 -14.552 5.736 1.00 0.00 C ATOM 0 H ILE A 13 -1.077 -17.297 4.229 1.00 0.00 H new ATOM 0 HA ILE A 13 1.363 -18.817 4.902 1.00 0.00 H new ATOM 0 HB ILE A 13 0.083 -16.834 6.763 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.591 -16.034 4.218 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.119 -15.765 4.496 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.473 -16.235 7.141 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.212 -17.985 7.333 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.955 -17.354 5.844 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.188 -13.723 5.028 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.412 -14.367 6.495 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.148 -14.640 6.213 1.00 0.00 H new ATOM 192 N TYR A 14 0.238 -20.480 6.373 1.00 0.00 N ATOM 193 CA TYR A 14 -0.387 -21.461 7.260 1.00 0.00 C ATOM 194 C TYR A 14 -0.058 -21.147 8.717 1.00 0.00 C ATOM 195 O TYR A 14 1.107 -21.158 9.114 1.00 0.00 O ATOM 196 CB TYR A 14 0.107 -22.868 6.911 1.00 0.00 C ATOM 197 CG TYR A 14 -0.434 -23.860 7.914 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.756 -24.306 7.814 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.388 -24.332 8.944 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.257 -25.225 8.745 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.113 -25.250 9.875 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.436 -25.695 9.776 1.00 0.00 C ATOM 203 OH TYR A 14 -1.931 -26.599 10.693 1.00 0.00 O ATOM 0 H TYR A 14 1.095 -20.800 5.921 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.468 -21.414 7.125 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.217 -23.139 5.906 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.197 -22.892 6.912 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.390 -23.942 7.019 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.409 -23.988 9.021 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.277 -25.571 8.667 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.521 -25.615 10.669 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.231 -26.824 11.341 1.00 0.00 H new ATOM 213 N ILE A 15 -1.096 -20.873 9.515 1.00 0.00 N ATOM 214 CA ILE A 15 -0.899 -20.556 10.935 1.00 0.00 C ATOM 215 C ILE A 15 -1.391 -21.704 11.815 1.00 0.00 C ATOM 216 O ILE A 15 -2.563 -22.079 11.764 1.00 0.00 O ATOM 217 CB ILE A 15 -1.661 -19.277 11.288 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.176 -18.137 10.392 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.400 -18.917 12.752 1.00 0.00 C ATOM 220 CD1 ILE A 15 -2.123 -16.945 10.529 1.00 0.00 C ATOM 0 H ILE A 15 -2.069 -20.864 9.208 1.00 0.00 H new ATOM 0 HA ILE A 15 0.166 -20.409 11.114 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.729 -19.434 11.136 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.164 -17.845 10.672 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.137 -18.467 9.354 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.942 -18.006 13.005 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.739 -19.731 13.393 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.332 -18.757 12.903 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.778 -16.131 9.891 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.128 -17.242 10.228 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.139 -16.610 11.566 1.00 0.00 H new ATOM 232 N GLY A 16 -0.489 -22.261 12.629 1.00 0.00 N ATOM 233 CA GLY A 16 -0.840 -23.372 13.523 1.00 0.00 C ATOM 234 C GLY A 16 -0.376 -23.098 14.952 1.00 0.00 C ATOM 235 O GLY A 16 0.184 -22.039 15.240 1.00 0.00 O ATOM 0 H GLY A 16 0.485 -21.964 12.688 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.919 -23.525 13.511 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.384 -24.293 13.160 1.00 0.00 H new ATOM 239 N ASN A 17 -0.613 -24.061 15.846 1.00 0.00 N ATOM 240 CA ASN A 17 -0.219 -23.915 17.247 1.00 0.00 C ATOM 241 C ASN A 17 -0.816 -22.644 17.845 1.00 0.00 C ATOM 242 O ASN A 17 -0.176 -21.965 18.648 1.00 0.00 O ATOM 243 CB ASN A 17 1.307 -23.868 17.359 1.00 0.00 C ATOM 244 CG ASN A 17 1.898 -25.228 17.000 1.00 0.00 C ATOM 245 OD1 ASN A 17 1.204 -26.244 17.057 1.00 0.00 O ATOM 246 ND2 ASN A 17 3.146 -25.309 16.632 1.00 0.00 N ATOM 0 H ASN A 17 -1.073 -24.944 15.626 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.597 -24.774 17.801 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.705 -23.102 16.694 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.597 -23.592 18.373 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.549 -26.215 16.391 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.720 -24.467 16.585 1.00 0.00 H new ATOM 253 N LEU A 18 -2.049 -22.326 17.450 1.00 0.00 N ATOM 254 CA LEU A 18 -2.731 -21.133 17.960 1.00 0.00 C ATOM 255 C LEU A 18 -3.790 -21.524 18.987 1.00 0.00 C ATOM 256 O LEU A 18 -4.445 -22.559 18.853 1.00 0.00 O ATOM 257 CB LEU A 18 -3.394 -20.370 16.800 1.00 0.00 C ATOM 258 CG LEU A 18 -4.534 -21.228 16.175 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.901 -20.750 16.701 1.00 0.00 C ATOM 260 CD2 LEU A 18 -4.511 -21.091 14.646 1.00 0.00 C ATOM 0 H LEU A 18 -2.594 -22.873 16.783 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.993 -20.490 18.440 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.797 -19.424 17.161 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.650 -20.131 16.040 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.380 -22.271 16.453 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.693 -21.355 16.259 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.929 -20.852 17.786 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.050 -19.705 16.431 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.311 -21.693 14.215 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.656 -20.046 14.372 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.550 -21.436 14.264 1.00 0.00 H new ATOM 272 N ASN A 19 -3.961 -20.691 20.009 1.00 0.00 N ATOM 273 CA ASN A 19 -4.952 -20.958 21.050 1.00 0.00 C ATOM 274 C ASN A 19 -6.342 -20.525 20.592 1.00 0.00 C ATOM 275 O ASN A 19 -6.496 -19.486 19.949 1.00 0.00 O ATOM 276 CB ASN A 19 -4.578 -20.210 22.331 1.00 0.00 C ATOM 277 CG ASN A 19 -5.485 -20.652 23.476 1.00 0.00 C ATOM 278 OD1 ASN A 19 -6.396 -21.455 23.272 1.00 0.00 O ATOM 279 ND2 ASN A 19 -5.288 -20.173 24.674 1.00 0.00 N ATOM 0 H ASN A 19 -3.430 -19.830 20.140 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.965 -22.030 21.246 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.536 -20.405 22.585 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -4.672 -19.135 22.175 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.890 -20.464 25.445 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.532 -19.508 24.839 1.00 0.00 H new ATOM 286 N ARG A 20 -7.350 -21.327 20.924 1.00 0.00 N ATOM 287 CA ARG A 20 -8.724 -21.014 20.542 1.00 0.00 C ATOM 288 C ARG A 20 -9.161 -19.684 21.148 1.00 0.00 C ATOM 289 O ARG A 20 -10.141 -19.083 20.708 1.00 0.00 O ATOM 290 CB ARG A 20 -9.665 -22.126 21.017 1.00 0.00 C ATOM 291 CG ARG A 20 -9.699 -22.153 22.550 1.00 0.00 C ATOM 292 CD ARG A 20 -10.470 -23.388 23.024 1.00 0.00 C ATOM 293 NE ARG A 20 -9.625 -24.585 22.916 1.00 0.00 N ATOM 294 CZ ARG A 20 -9.772 -25.467 21.914 1.00 0.00 C ATOM 295 NH1 ARG A 20 -10.684 -25.272 20.997 1.00 0.00 N ATOM 296 NH2 ARG A 20 -9.006 -26.521 21.851 1.00 0.00 N ATOM 0 H ARG A 20 -7.243 -22.193 21.453 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.769 -20.937 19.456 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.668 -21.960 20.624 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -9.328 -23.089 20.634 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.684 -22.171 22.946 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.173 -21.248 22.929 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.790 -23.252 24.057 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.372 -23.515 22.425 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.907 -24.751 23.621 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -11.285 -24.449 21.042 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.794 -25.943 20.237 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -8.293 -26.677 22.564 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -9.120 -27.189 21.089 1.00 0.00 H new ATOM 310 N GLU A 21 -8.430 -19.233 22.161 1.00 0.00 N ATOM 311 CA GLU A 21 -8.753 -17.975 22.825 1.00 0.00 C ATOM 312 C GLU A 21 -8.505 -16.798 21.891 1.00 0.00 C ATOM 313 O GLU A 21 -8.954 -15.681 22.151 1.00 0.00 O ATOM 314 CB GLU A 21 -7.903 -17.816 24.087 1.00 0.00 C ATOM 315 CG GLU A 21 -8.292 -18.890 25.104 1.00 0.00 C ATOM 316 CD GLU A 21 -7.466 -18.728 26.376 1.00 0.00 C ATOM 317 OE1 GLU A 21 -6.550 -17.924 26.364 1.00 0.00 O ATOM 318 OE2 GLU A 21 -7.764 -19.411 27.342 1.00 0.00 O ATOM 0 H GLU A 21 -7.615 -19.716 22.539 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.808 -17.991 23.098 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.845 -17.902 23.839 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.051 -16.825 24.515 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.354 -18.813 25.338 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.130 -19.881 24.679 1.00 0.00 H new ATOM 325 N LEU A 22 -7.785 -17.051 20.803 1.00 0.00 N ATOM 326 CA LEU A 22 -7.478 -15.998 19.840 1.00 0.00 C ATOM 327 C LEU A 22 -8.589 -15.888 18.799 1.00 0.00 C ATOM 328 O LEU A 22 -9.037 -16.893 18.245 1.00 0.00 O ATOM 329 CB LEU A 22 -6.149 -16.303 19.141 1.00 0.00 C ATOM 330 CG LEU A 22 -5.055 -16.532 20.194 1.00 0.00 C ATOM 331 CD1 LEU A 22 -3.734 -16.858 19.493 1.00 0.00 C ATOM 332 CD2 LEU A 22 -4.882 -15.266 21.051 1.00 0.00 C ATOM 0 H LEU A 22 -7.406 -17.968 20.567 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.399 -15.051 20.374 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -6.252 -17.186 18.511 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.872 -15.476 18.488 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.343 -17.364 20.837 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.957 -17.021 20.239 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.854 -17.759 18.892 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.449 -16.027 18.848 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.105 -15.435 21.796 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.597 -14.430 20.412 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.822 -15.035 21.553 1.00 0.00 H new ATOM 344 N THR A 23 -9.033 -14.661 18.535 1.00 0.00 N ATOM 345 CA THR A 23 -10.096 -14.423 17.553 1.00 0.00 C ATOM 346 C THR A 23 -9.515 -13.811 16.281 1.00 0.00 C ATOM 347 O THR A 23 -8.300 -13.659 16.150 1.00 0.00 O ATOM 348 CB THR A 23 -11.167 -13.487 18.149 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.559 -12.610 19.087 1.00 0.00 O ATOM 350 CG2 THR A 23 -12.253 -14.312 18.850 1.00 0.00 C ATOM 0 H THR A 23 -8.677 -13.817 18.984 1.00 0.00 H new ATOM 0 HA THR A 23 -10.560 -15.377 17.302 1.00 0.00 H new ATOM 0 HB THR A 23 -11.622 -12.907 17.346 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.238 -12.014 19.465 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.005 -13.643 19.268 1.00 0.00 H new ATOM 0 HG22 THR A 23 -12.723 -14.982 18.130 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.804 -14.899 19.651 1.00 0.00 H new ATOM 358 N GLU A 24 -10.397 -13.462 15.350 1.00 0.00 N ATOM 359 CA GLU A 24 -9.963 -12.872 14.093 1.00 0.00 C ATOM 360 C GLU A 24 -9.268 -11.540 14.345 1.00 0.00 C ATOM 361 O GLU A 24 -8.259 -11.229 13.714 1.00 0.00 O ATOM 362 CB GLU A 24 -11.172 -12.657 13.172 1.00 0.00 C ATOM 363 CG GLU A 24 -11.748 -14.020 12.747 1.00 0.00 C ATOM 364 CD GLU A 24 -12.631 -14.587 13.859 1.00 0.00 C ATOM 365 OE1 GLU A 24 -12.896 -13.863 14.806 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.031 -15.734 13.749 1.00 0.00 O ATOM 0 H GLU A 24 -11.406 -13.577 15.442 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.259 -13.552 13.613 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.935 -12.073 13.687 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.874 -12.087 12.292 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.329 -13.908 11.832 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -10.937 -14.714 12.527 1.00 0.00 H new ATOM 373 N GLY A 25 -9.816 -10.759 15.271 1.00 0.00 N ATOM 374 CA GLY A 25 -9.238 -9.464 15.600 1.00 0.00 C ATOM 375 C GLY A 25 -7.839 -9.625 16.183 1.00 0.00 C ATOM 376 O GLY A 25 -6.926 -8.873 15.844 1.00 0.00 O ATOM 0 H GLY A 25 -10.653 -10.999 15.802 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.194 -8.843 14.705 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -9.877 -8.947 16.316 1.00 0.00 H new ATOM 380 N ASP A 26 -7.680 -10.611 17.062 1.00 0.00 N ATOM 381 CA ASP A 26 -6.386 -10.859 17.688 1.00 0.00 C ATOM 382 C ASP A 26 -5.341 -11.219 16.639 1.00 0.00 C ATOM 383 O ASP A 26 -4.218 -10.719 16.675 1.00 0.00 O ATOM 384 CB ASP A 26 -6.506 -12.003 18.697 1.00 0.00 C ATOM 385 CG ASP A 26 -7.295 -11.543 19.918 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.465 -10.344 20.071 1.00 0.00 O ATOM 387 OD2 ASP A 26 -7.720 -12.394 20.681 1.00 0.00 O ATOM 0 H ASP A 26 -8.423 -11.245 17.354 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.073 -9.949 18.200 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.002 -12.856 18.234 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.514 -12.337 19.000 1.00 0.00 H new ATOM 392 N ILE A 27 -5.720 -12.085 15.703 1.00 0.00 N ATOM 393 CA ILE A 27 -4.806 -12.498 14.645 1.00 0.00 C ATOM 394 C ILE A 27 -4.427 -11.311 13.770 1.00 0.00 C ATOM 395 O ILE A 27 -3.260 -11.125 13.430 1.00 0.00 O ATOM 396 CB ILE A 27 -5.452 -13.590 13.785 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.573 -14.879 14.600 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.591 -13.850 12.542 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.471 -15.871 13.857 1.00 0.00 C ATOM 0 H ILE A 27 -6.646 -12.511 15.656 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.902 -12.894 15.108 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.444 -13.261 13.474 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.587 -15.314 14.760 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.989 -14.662 15.584 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.055 -14.627 11.934 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.509 -12.933 11.958 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.597 -14.175 12.849 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.557 -16.789 14.438 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.460 -15.434 13.720 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.036 -16.097 12.883 1.00 0.00 H new ATOM 411 N LEU A 28 -5.425 -10.510 13.409 1.00 0.00 N ATOM 412 CA LEU A 28 -5.180 -9.352 12.563 1.00 0.00 C ATOM 413 C LEU A 28 -4.170 -8.416 13.214 1.00 0.00 C ATOM 414 O LEU A 28 -3.221 -7.981 12.570 1.00 0.00 O ATOM 415 CB LEU A 28 -6.499 -8.596 12.332 1.00 0.00 C ATOM 416 CG LEU A 28 -7.375 -9.367 11.315 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.840 -8.959 11.481 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.925 -9.032 9.881 1.00 0.00 C ATOM 0 H LEU A 28 -6.398 -10.640 13.686 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.777 -9.696 11.610 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.034 -8.484 13.275 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.293 -7.592 11.961 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.267 -10.436 11.495 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.453 -9.504 10.763 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.171 -9.194 12.493 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.942 -7.888 11.305 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.544 -9.577 9.169 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.029 -7.961 9.708 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.882 -9.321 9.750 1.00 0.00 H new ATOM 430 N THR A 29 -4.372 -8.124 14.493 1.00 0.00 N ATOM 431 CA THR A 29 -3.467 -7.238 15.218 1.00 0.00 C ATOM 432 C THR A 29 -2.054 -7.806 15.258 1.00 0.00 C ATOM 433 O THR A 29 -1.075 -7.084 15.071 1.00 0.00 O ATOM 434 CB THR A 29 -3.969 -7.030 16.647 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.207 -6.332 16.616 1.00 0.00 O ATOM 436 CG2 THR A 29 -2.937 -6.221 17.445 1.00 0.00 C ATOM 0 H THR A 29 -5.149 -8.484 15.047 1.00 0.00 H new ATOM 0 HA THR A 29 -3.443 -6.283 14.693 1.00 0.00 H new ATOM 0 HB THR A 29 -4.112 -7.998 17.126 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.932 -6.960 16.414 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.298 -6.074 18.463 1.00 0.00 H new ATOM 0 HG22 THR A 29 -1.991 -6.762 17.470 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.788 -5.251 16.970 1.00 0.00 H new ATOM 444 N VAL A 30 -1.953 -9.102 15.509 1.00 0.00 N ATOM 445 CA VAL A 30 -0.652 -9.747 15.585 1.00 0.00 C ATOM 446 C VAL A 30 0.111 -9.600 14.268 1.00 0.00 C ATOM 447 O VAL A 30 1.285 -9.237 14.261 1.00 0.00 O ATOM 448 CB VAL A 30 -0.836 -11.238 15.911 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.506 -11.967 15.767 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.348 -11.389 17.350 1.00 0.00 C ATOM 0 H VAL A 30 -2.748 -9.723 15.662 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.073 -9.264 16.372 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.559 -11.672 15.220 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.373 -13.024 15.999 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.869 -11.863 14.744 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.231 -11.533 16.455 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.478 -12.446 17.581 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.626 -10.953 18.041 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.304 -10.875 17.452 1.00 0.00 H new ATOM 460 N PHE A 31 -0.561 -9.887 13.160 1.00 0.00 N ATOM 461 CA PHE A 31 0.061 -9.792 11.836 1.00 0.00 C ATOM 462 C PHE A 31 -0.060 -8.377 11.257 1.00 0.00 C ATOM 463 O PHE A 31 0.599 -8.036 10.276 1.00 0.00 O ATOM 464 CB PHE A 31 -0.597 -10.799 10.884 1.00 0.00 C ATOM 465 CG PHE A 31 -0.134 -12.200 11.221 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.631 -12.850 12.358 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.794 -12.847 10.396 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.199 -14.143 12.671 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.226 -14.141 10.709 1.00 0.00 C ATOM 470 CZ PHE A 31 0.729 -14.789 11.845 1.00 0.00 C ATOM 0 H PHE A 31 -1.536 -10.187 13.147 1.00 0.00 H new ATOM 0 HA PHE A 31 1.121 -10.021 11.944 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.682 -10.735 10.965 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.340 -10.559 9.852 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.348 -12.352 12.994 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.176 -12.348 9.518 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.581 -14.643 13.549 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.943 -14.639 10.074 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.061 -15.788 12.085 1.00 0.00 H new ATOM 480 N SER A 32 -0.918 -7.560 11.861 1.00 0.00 N ATOM 481 CA SER A 32 -1.141 -6.197 11.368 1.00 0.00 C ATOM 482 C SER A 32 0.170 -5.470 11.051 1.00 0.00 C ATOM 483 O SER A 32 0.399 -5.044 9.913 1.00 0.00 O ATOM 484 CB SER A 32 -1.908 -5.385 12.410 1.00 0.00 C ATOM 485 OG SER A 32 -1.913 -4.013 12.037 1.00 0.00 O ATOM 0 H SER A 32 -1.467 -7.810 12.684 1.00 0.00 H new ATOM 0 HA SER A 32 -1.716 -6.284 10.446 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.931 -5.754 12.492 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.446 -5.504 13.390 1.00 0.00 H new ATOM 0 HG SER A 32 -2.817 -3.752 11.763 1.00 0.00 H new ATOM 491 N GLU A 33 1.031 -5.346 12.055 1.00 0.00 N ATOM 492 CA GLU A 33 2.314 -4.666 11.877 1.00 0.00 C ATOM 493 C GLU A 33 3.220 -5.443 10.933 1.00 0.00 C ATOM 494 O GLU A 33 4.251 -4.939 10.489 1.00 0.00 O ATOM 495 CB GLU A 33 3.005 -4.498 13.232 1.00 0.00 C ATOM 496 CG GLU A 33 3.331 -5.874 13.812 1.00 0.00 C ATOM 497 CD GLU A 33 3.823 -5.732 15.248 1.00 0.00 C ATOM 498 OE1 GLU A 33 4.291 -4.659 15.591 1.00 0.00 O ATOM 499 OE2 GLU A 33 3.721 -6.698 15.986 1.00 0.00 O ATOM 0 H GLU A 33 0.868 -5.704 12.996 1.00 0.00 H new ATOM 0 HA GLU A 33 2.122 -3.686 11.439 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.918 -3.915 13.117 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.359 -3.947 13.916 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.445 -6.509 13.784 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.093 -6.362 13.205 1.00 0.00 H new ATOM 506 N TYR A 34 2.834 -6.678 10.635 1.00 0.00 N ATOM 507 CA TYR A 34 3.617 -7.541 9.752 1.00 0.00 C ATOM 508 C TYR A 34 2.868 -7.818 8.456 1.00 0.00 C ATOM 509 O TYR A 34 2.992 -8.902 7.886 1.00 0.00 O ATOM 510 CB TYR A 34 3.957 -8.855 10.460 1.00 0.00 C ATOM 511 CG TYR A 34 4.725 -8.563 11.730 1.00 0.00 C ATOM 512 CD1 TYR A 34 5.969 -7.921 11.667 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.189 -8.925 12.970 1.00 0.00 C ATOM 514 CE1 TYR A 34 6.675 -7.649 12.843 1.00 0.00 C ATOM 515 CE2 TYR A 34 4.895 -8.651 14.146 1.00 0.00 C ATOM 516 CZ TYR A 34 6.139 -8.012 14.083 1.00 0.00 C ATOM 517 OH TYR A 34 6.836 -7.742 15.243 1.00 0.00 O ATOM 0 H TYR A 34 1.981 -7.108 10.992 1.00 0.00 H new ATOM 0 HA TYR A 34 4.544 -7.023 9.505 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.043 -9.401 10.693 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.550 -9.491 9.803 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.382 -7.636 10.711 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.229 -9.417 13.020 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.636 -7.158 12.794 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.480 -8.932 15.103 1.00 0.00 H new ATOM 0 HH TYR A 34 6.208 -7.661 15.991 1.00 0.00 H new ATOM 527 N GLY A 35 2.080 -6.837 7.993 1.00 0.00 N ATOM 528 CA GLY A 35 1.312 -7.030 6.765 1.00 0.00 C ATOM 529 C GLY A 35 -0.146 -7.360 7.059 1.00 0.00 C ATOM 530 O GLY A 35 -0.575 -8.498 6.883 1.00 0.00 O ATOM 0 H GLY A 35 1.962 -5.927 8.439 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.365 -6.127 6.157 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.757 -7.835 6.180 1.00 0.00 H new ATOM 534 N VAL A 36 -0.899 -6.359 7.522 1.00 0.00 N ATOM 535 CA VAL A 36 -2.299 -6.576 7.879 1.00 0.00 C ATOM 536 C VAL A 36 -3.066 -7.210 6.700 1.00 0.00 C ATOM 537 O VAL A 36 -3.302 -6.574 5.674 1.00 0.00 O ATOM 538 CB VAL A 36 -2.956 -5.224 8.237 1.00 0.00 C ATOM 539 CG1 VAL A 36 -3.044 -4.325 6.987 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.367 -5.477 8.788 1.00 0.00 C ATOM 0 H VAL A 36 -0.567 -5.404 7.656 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.339 -7.250 8.734 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.349 -4.721 8.990 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.509 -3.376 7.253 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.042 -4.142 6.599 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.644 -4.821 6.224 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.834 -4.526 9.042 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.967 -5.986 8.033 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -4.303 -6.099 9.681 1.00 0.00 H new ATOM 550 N PRO A 37 -3.457 -8.470 6.845 1.00 0.00 N ATOM 551 CA PRO A 37 -4.210 -9.220 5.791 1.00 0.00 C ATOM 552 C PRO A 37 -5.501 -8.519 5.401 1.00 0.00 C ATOM 553 O PRO A 37 -6.102 -7.810 6.208 1.00 0.00 O ATOM 554 CB PRO A 37 -4.516 -10.574 6.446 1.00 0.00 C ATOM 555 CG PRO A 37 -3.508 -10.719 7.535 1.00 0.00 C ATOM 556 CD PRO A 37 -3.211 -9.319 8.031 1.00 0.00 C ATOM 0 HA PRO A 37 -3.635 -9.305 4.869 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.531 -10.599 6.843 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.436 -11.387 5.725 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.894 -11.343 8.341 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -2.603 -11.200 7.165 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.859 -9.043 8.863 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.183 -9.228 8.383 1.00 0.00 H new ATOM 564 N VAL A 38 -5.921 -8.723 4.158 1.00 0.00 N ATOM 565 CA VAL A 38 -7.149 -8.106 3.674 1.00 0.00 C ATOM 566 C VAL A 38 -8.327 -9.048 3.891 1.00 0.00 C ATOM 567 O VAL A 38 -9.478 -8.617 3.925 1.00 0.00 O ATOM 568 CB VAL A 38 -7.019 -7.775 2.187 1.00 0.00 C ATOM 569 CG1 VAL A 38 -6.024 -6.627 2.004 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.513 -9.008 1.431 1.00 0.00 C ATOM 0 H VAL A 38 -5.436 -9.304 3.474 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.322 -7.185 4.230 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.993 -7.480 1.796 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.931 -6.391 0.944 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.380 -5.748 2.542 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.051 -6.923 2.396 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.420 -8.772 0.371 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.540 -9.302 1.824 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.219 -9.829 1.560 1.00 0.00 H new ATOM 580 N ASP A 39 -8.031 -10.340 4.041 1.00 0.00 N ATOM 581 CA ASP A 39 -9.074 -11.335 4.262 1.00 0.00 C ATOM 582 C ASP A 39 -8.491 -12.585 4.921 1.00 0.00 C ATOM 583 O ASP A 39 -7.517 -13.156 4.429 1.00 0.00 O ATOM 584 CB ASP A 39 -9.730 -11.709 2.929 1.00 0.00 C ATOM 585 CG ASP A 39 -10.267 -10.459 2.243 1.00 0.00 C ATOM 586 OD1 ASP A 39 -11.153 -9.833 2.802 1.00 0.00 O ATOM 587 OD2 ASP A 39 -9.786 -10.145 1.166 1.00 0.00 O ATOM 0 H ASP A 39 -7.084 -10.717 4.013 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.826 -10.908 4.926 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.005 -12.205 2.284 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -10.541 -12.417 3.099 1.00 0.00 H new ATOM 592 N VAL A 40 -9.093 -13.012 6.033 1.00 0.00 N ATOM 593 CA VAL A 40 -8.618 -14.202 6.753 1.00 0.00 C ATOM 594 C VAL A 40 -9.651 -15.320 6.651 1.00 0.00 C ATOM 595 O VAL A 40 -10.826 -15.123 6.962 1.00 0.00 O ATOM 596 CB VAL A 40 -8.362 -13.861 8.224 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.761 -15.073 8.938 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.391 -12.681 8.311 1.00 0.00 C ATOM 0 H VAL A 40 -9.904 -12.558 6.454 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.685 -14.537 6.301 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.304 -13.594 8.703 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.580 -14.826 9.984 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.454 -15.912 8.877 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.819 -15.346 8.462 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.208 -12.437 9.357 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.450 -12.948 7.830 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.823 -11.816 7.807 1.00 0.00 H new ATOM 608 N ILE A 41 -9.208 -16.499 6.216 1.00 0.00 N ATOM 609 CA ILE A 41 -10.113 -17.643 6.068 1.00 0.00 C ATOM 610 C ILE A 41 -9.963 -18.614 7.235 1.00 0.00 C ATOM 611 O ILE A 41 -8.886 -19.170 7.457 1.00 0.00 O ATOM 612 CB ILE A 41 -9.809 -18.374 4.759 1.00 0.00 C ATOM 613 CG1 ILE A 41 -9.982 -17.408 3.583 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.774 -19.551 4.594 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.434 -18.051 2.305 1.00 0.00 C ATOM 0 H ILE A 41 -8.239 -16.688 5.962 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.137 -17.269 6.057 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.784 -18.744 4.781 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.036 -17.160 3.455 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.458 -16.474 3.786 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.557 -20.071 3.661 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.654 -20.240 5.430 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.799 -19.181 4.573 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.558 -17.362 1.469 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.376 -18.276 2.436 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.978 -18.973 2.099 1.00 0.00 H new ATOM 627 N LEU A 42 -11.052 -18.818 7.981 1.00 0.00 N ATOM 628 CA LEU A 42 -11.037 -19.736 9.125 1.00 0.00 C ATOM 629 C LEU A 42 -11.952 -20.926 8.858 1.00 0.00 C ATOM 630 O LEU A 42 -13.108 -20.759 8.467 1.00 0.00 O ATOM 631 CB LEU A 42 -11.487 -19.005 10.399 1.00 0.00 C ATOM 632 CG LEU A 42 -10.527 -17.825 10.705 1.00 0.00 C ATOM 633 CD1 LEU A 42 -11.066 -16.533 10.076 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.405 -17.634 12.223 1.00 0.00 C ATOM 0 H LEU A 42 -11.950 -18.364 7.816 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.019 -20.098 9.267 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.504 -18.633 10.274 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.502 -19.699 11.239 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.547 -18.051 10.285 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.386 -15.710 10.296 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.145 -16.660 8.996 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.050 -16.310 10.489 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.730 -16.804 12.432 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.387 -17.417 12.643 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.011 -18.545 12.674 1.00 0.00 H new ATOM 646 N SER A 43 -11.427 -22.126 9.069 1.00 0.00 N ATOM 647 CA SER A 43 -12.206 -23.340 8.842 1.00 0.00 C ATOM 648 C SER A 43 -13.119 -23.629 10.030 1.00 0.00 C ATOM 649 O SER A 43 -12.703 -23.524 11.184 1.00 0.00 O ATOM 650 CB SER A 43 -11.267 -24.523 8.624 1.00 0.00 C ATOM 651 OG SER A 43 -10.538 -24.327 7.419 1.00 0.00 O ATOM 0 H SER A 43 -10.474 -22.286 9.394 1.00 0.00 H new ATOM 0 HA SER A 43 -12.823 -23.191 7.956 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.582 -24.618 9.466 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.838 -25.450 8.571 1.00 0.00 H new ATOM 0 HG SER A 43 -9.654 -24.742 7.500 1.00 0.00 H new ATOM 657 N ARG A 44 -14.366 -24.000 9.742 1.00 0.00 N ATOM 658 CA ARG A 44 -15.328 -24.313 10.797 1.00 0.00 C ATOM 659 C ARG A 44 -16.240 -25.458 10.364 1.00 0.00 C ATOM 660 O ARG A 44 -16.829 -25.421 9.284 1.00 0.00 O ATOM 661 CB ARG A 44 -16.178 -23.079 11.127 1.00 0.00 C ATOM 662 CG ARG A 44 -17.002 -23.336 12.416 1.00 0.00 C ATOM 663 CD ARG A 44 -16.390 -22.560 13.591 1.00 0.00 C ATOM 664 NE ARG A 44 -14.950 -22.783 13.643 1.00 0.00 N ATOM 665 CZ ARG A 44 -14.192 -22.175 14.548 1.00 0.00 C ATOM 666 NH1 ARG A 44 -14.735 -21.361 15.412 1.00 0.00 N ATOM 667 NH2 ARG A 44 -12.906 -22.390 14.575 1.00 0.00 N ATOM 0 H ARG A 44 -14.732 -24.091 8.794 1.00 0.00 H new ATOM 0 HA ARG A 44 -14.773 -24.615 11.686 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.535 -22.209 11.263 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -16.847 -22.854 10.296 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -18.036 -23.027 12.264 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -17.017 -24.402 12.642 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -16.597 -21.496 13.481 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -16.849 -22.879 14.526 1.00 0.00 H new ATOM 0 HE ARG A 44 -14.517 -23.418 12.972 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -15.741 -21.192 15.392 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -14.154 -20.894 16.108 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -12.481 -23.026 13.900 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -12.325 -21.922 15.271 1.00 0.00 H new ATOM 786 N GLY A 53 -8.337 -26.024 14.598 1.00 0.00 N ATOM 787 CA GLY A 53 -7.579 -24.887 15.138 1.00 0.00 C ATOM 788 C GLY A 53 -6.544 -24.374 14.136 1.00 0.00 C ATOM 789 O GLY A 53 -5.406 -24.079 14.502 1.00 0.00 O ATOM 0 HA2 GLY A 53 -8.266 -24.081 15.397 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -7.078 -25.187 16.058 1.00 0.00 H new ATOM 793 N PHE A 54 -6.943 -24.273 12.866 1.00 0.00 N ATOM 794 CA PHE A 54 -6.039 -23.792 11.814 1.00 0.00 C ATOM 795 C PHE A 54 -6.747 -22.765 10.927 1.00 0.00 C ATOM 796 O PHE A 54 -7.971 -22.781 10.796 1.00 0.00 O ATOM 797 CB PHE A 54 -5.563 -24.973 10.959 1.00 0.00 C ATOM 798 CG PHE A 54 -6.703 -25.467 10.091 1.00 0.00 C ATOM 799 CD1 PHE A 54 -7.833 -26.037 10.683 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.625 -25.355 8.697 1.00 0.00 C ATOM 801 CE1 PHE A 54 -8.887 -26.496 9.886 1.00 0.00 C ATOM 802 CE2 PHE A 54 -7.679 -25.814 7.898 1.00 0.00 C ATOM 803 CZ PHE A 54 -8.811 -26.383 8.494 1.00 0.00 C ATOM 0 H PHE A 54 -7.879 -24.515 12.541 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.180 -23.314 12.284 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.724 -24.667 10.334 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.206 -25.779 11.601 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.893 -26.123 11.758 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -5.752 -24.915 8.239 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.759 -26.937 10.345 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -7.619 -25.729 6.823 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.626 -26.735 7.879 1.00 0.00 H new ATOM 813 N ALA A 55 -5.967 -21.873 10.319 1.00 0.00 N ATOM 814 CA ALA A 55 -6.529 -20.842 9.447 1.00 0.00 C ATOM 815 C ALA A 55 -5.502 -20.399 8.408 1.00 0.00 C ATOM 816 O ALA A 55 -4.298 -20.607 8.584 1.00 0.00 O ATOM 817 CB ALA A 55 -6.967 -19.638 10.283 1.00 0.00 C ATOM 0 H ALA A 55 -4.952 -21.842 10.413 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.393 -21.259 8.929 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.385 -18.873 9.628 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.722 -19.951 11.004 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.106 -19.231 10.813 1.00 0.00 H new ATOM 823 N TYR A 56 -5.986 -19.787 7.318 1.00 0.00 N ATOM 824 CA TYR A 56 -5.101 -19.320 6.247 1.00 0.00 C ATOM 825 C TYR A 56 -5.051 -17.793 6.222 1.00 0.00 C ATOM 826 O TYR A 56 -6.069 -17.121 6.411 1.00 0.00 O ATOM 827 CB TYR A 56 -5.598 -19.832 4.898 1.00 0.00 C ATOM 828 CG TYR A 56 -5.584 -21.342 4.893 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.381 -22.032 4.708 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.777 -22.054 5.074 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.369 -23.432 4.705 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.765 -23.454 5.071 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.562 -24.143 4.886 1.00 0.00 C ATOM 834 OH TYR A 56 -5.550 -25.523 4.883 1.00 0.00 O ATOM 0 H TYR A 56 -6.977 -19.606 7.157 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.099 -19.706 6.436 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.607 -19.467 4.709 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -4.965 -19.450 4.097 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.461 -21.484 4.567 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.706 -21.523 5.216 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.440 -23.964 4.563 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.685 -24.002 5.212 1.00 0.00 H new ATOM 0 HH TYR A 56 -6.460 -25.858 5.022 1.00 0.00 H new ATOM 844 N LEU A 57 -3.858 -17.243 5.988 1.00 0.00 N ATOM 845 CA LEU A 57 -3.678 -15.786 5.948 1.00 0.00 C ATOM 846 C LEU A 57 -3.351 -15.311 4.527 1.00 0.00 C ATOM 847 O LEU A 57 -2.592 -15.963 3.812 1.00 0.00 O ATOM 848 CB LEU A 57 -2.544 -15.378 6.904 1.00 0.00 C ATOM 849 CG LEU A 57 -2.879 -14.028 7.561 1.00 0.00 C ATOM 850 CD1 LEU A 57 -3.837 -14.257 8.753 1.00 0.00 C ATOM 851 CD2 LEU A 57 -1.585 -13.361 8.050 1.00 0.00 C ATOM 0 H LEU A 57 -3.005 -17.778 5.824 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.610 -15.316 6.261 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.408 -16.142 7.670 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.604 -15.304 6.358 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.364 -13.378 6.833 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.074 -13.300 9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.755 -14.725 8.397 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.358 -14.908 9.485 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.822 -12.404 8.516 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.095 -14.007 8.778 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.918 -13.197 7.204 1.00 0.00 H new ATOM 863 N LYS A 58 -3.930 -14.172 4.126 1.00 0.00 N ATOM 864 CA LYS A 58 -3.686 -13.616 2.790 1.00 0.00 C ATOM 865 C LYS A 58 -3.330 -12.130 2.860 1.00 0.00 C ATOM 866 O LYS A 58 -4.163 -11.302 3.246 1.00 0.00 O ATOM 867 CB LYS A 58 -4.930 -13.797 1.921 1.00 0.00 C ATOM 868 CG LYS A 58 -4.658 -13.266 0.510 1.00 0.00 C ATOM 869 CD LYS A 58 -5.869 -13.538 -0.383 1.00 0.00 C ATOM 870 CE LYS A 58 -5.614 -12.965 -1.779 1.00 0.00 C ATOM 871 NZ LYS A 58 -5.514 -11.480 -1.693 1.00 0.00 N ATOM 0 H LYS A 58 -4.566 -13.621 4.703 1.00 0.00 H new ATOM 0 HA LYS A 58 -2.843 -14.151 2.353 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.204 -14.851 1.876 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.774 -13.267 2.363 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.453 -12.196 0.546 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.772 -13.746 0.094 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.053 -14.610 -0.447 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.762 -13.086 0.049 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.694 -13.379 -2.192 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.422 -13.248 -2.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.664 -11.067 -2.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.238 -11.121 -1.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.570 -11.215 -1.345 1.00 0.00 H new ATOM 885 N TYR A 59 -2.093 -11.793 2.480 1.00 0.00 N ATOM 886 CA TYR A 59 -1.638 -10.396 2.484 1.00 0.00 C ATOM 887 C TYR A 59 -1.405 -9.914 1.050 1.00 0.00 C ATOM 888 O TYR A 59 -1.353 -10.712 0.114 1.00 0.00 O ATOM 889 CB TYR A 59 -0.350 -10.251 3.292 1.00 0.00 C ATOM 890 CG TYR A 59 0.019 -8.785 3.399 1.00 0.00 C ATOM 891 CD1 TYR A 59 -0.742 -7.932 4.205 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.116 -8.284 2.695 1.00 0.00 C ATOM 893 CE1 TYR A 59 -0.401 -6.578 4.302 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.458 -6.931 2.795 1.00 0.00 C ATOM 895 CZ TYR A 59 0.700 -6.078 3.599 1.00 0.00 C ATOM 896 OH TYR A 59 1.037 -4.743 3.698 1.00 0.00 O ATOM 0 H TYR A 59 -1.391 -12.464 2.167 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.413 -9.785 2.948 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.483 -10.677 4.287 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.457 -10.806 2.813 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -1.590 -8.317 4.751 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.702 -8.943 2.072 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -0.990 -5.917 4.921 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.308 -6.547 2.251 1.00 0.00 H new ATOM 0 HH TYR A 59 1.827 -4.563 3.147 1.00 0.00 H new ATOM 906 N GLU A 60 -1.272 -8.604 0.882 1.00 0.00 N ATOM 907 CA GLU A 60 -1.054 -8.032 -0.448 1.00 0.00 C ATOM 908 C GLU A 60 0.264 -8.513 -1.070 1.00 0.00 C ATOM 909 O GLU A 60 0.298 -8.943 -2.224 1.00 0.00 O ATOM 910 CB GLU A 60 -1.030 -6.506 -0.348 1.00 0.00 C ATOM 911 CG GLU A 60 -2.441 -5.988 -0.062 1.00 0.00 C ATOM 912 CD GLU A 60 -3.311 -6.136 -1.305 1.00 0.00 C ATOM 913 OE1 GLU A 60 -2.775 -6.502 -2.339 1.00 0.00 O ATOM 914 OE2 GLU A 60 -4.500 -5.883 -1.206 1.00 0.00 O ATOM 0 H GLU A 60 -1.310 -7.921 1.639 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.872 -8.363 -1.089 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.350 -6.194 0.444 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.655 -6.076 -1.277 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.880 -6.542 0.768 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.399 -4.942 0.241 1.00 0.00 H new ATOM 921 N ASP A 61 1.351 -8.447 -0.299 1.00 0.00 N ATOM 922 CA ASP A 61 2.678 -8.869 -0.788 1.00 0.00 C ATOM 923 C ASP A 61 3.178 -10.110 -0.048 1.00 0.00 C ATOM 924 O ASP A 61 3.401 -10.078 1.160 1.00 0.00 O ATOM 925 CB ASP A 61 3.677 -7.725 -0.600 1.00 0.00 C ATOM 926 CG ASP A 61 4.996 -8.072 -1.278 1.00 0.00 C ATOM 927 OD1 ASP A 61 5.176 -9.227 -1.627 1.00 0.00 O ATOM 928 OD2 ASP A 61 5.809 -7.176 -1.438 1.00 0.00 O ATOM 0 H ASP A 61 1.346 -8.108 0.663 1.00 0.00 H new ATOM 0 HA ASP A 61 2.587 -9.119 -1.845 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.273 -6.805 -1.021 1.00 0.00 H new ATOM 0 HB3 ASP A 61 3.841 -7.544 0.462 1.00 0.00 H new ATOM 933 N GLN A 62 3.357 -11.207 -0.781 1.00 0.00 N ATOM 934 CA GLN A 62 3.826 -12.452 -0.178 1.00 0.00 C ATOM 935 C GLN A 62 5.156 -12.235 0.543 1.00 0.00 C ATOM 936 O GLN A 62 5.549 -13.026 1.398 1.00 0.00 O ATOM 937 CB GLN A 62 3.995 -13.522 -1.257 1.00 0.00 C ATOM 938 CG GLN A 62 5.139 -13.127 -2.193 1.00 0.00 C ATOM 939 CD GLN A 62 5.112 -13.997 -3.445 1.00 0.00 C ATOM 940 OE1 GLN A 62 4.952 -15.214 -3.354 1.00 0.00 O ATOM 941 NE2 GLN A 62 5.260 -13.441 -4.616 1.00 0.00 N ATOM 0 H GLN A 62 3.186 -11.259 -1.785 1.00 0.00 H new ATOM 0 HA GLN A 62 3.084 -12.783 0.549 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.204 -14.488 -0.797 1.00 0.00 H new ATOM 0 HB3 GLN A 62 3.070 -13.632 -1.823 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.048 -12.076 -2.468 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.095 -13.241 -1.681 1.00 0.00 H new ATOM 0 HE21 GLN A 62 5.392 -12.432 -4.689 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.243 -14.015 -5.459 1.00 0.00 H new ATOM 950 N ARG A 63 5.845 -11.159 0.191 1.00 0.00 N ATOM 951 CA ARG A 63 7.126 -10.844 0.814 1.00 0.00 C ATOM 952 C ARG A 63 6.944 -10.562 2.304 1.00 0.00 C ATOM 953 O ARG A 63 7.799 -10.906 3.121 1.00 0.00 O ATOM 954 CB ARG A 63 7.754 -9.629 0.128 1.00 0.00 C ATOM 955 CG ARG A 63 8.134 -9.992 -1.319 1.00 0.00 C ATOM 956 CD ARG A 63 9.329 -10.972 -1.328 1.00 0.00 C ATOM 957 NE ARG A 63 8.853 -12.351 -1.333 1.00 0.00 N ATOM 958 CZ ARG A 63 9.658 -13.357 -1.009 1.00 0.00 C ATOM 959 NH1 ARG A 63 10.899 -13.120 -0.680 1.00 0.00 N ATOM 960 NH2 ARG A 63 9.208 -14.582 -1.019 1.00 0.00 N ATOM 0 H ARG A 63 5.542 -10.492 -0.518 1.00 0.00 H new ATOM 0 HA ARG A 63 7.787 -11.703 0.701 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.053 -8.794 0.132 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.639 -9.306 0.677 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.280 -10.444 -1.824 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.391 -9.089 -1.873 1.00 0.00 H new ATOM 0 HD2 ARG A 63 9.950 -10.791 -2.206 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.956 -10.800 -0.453 1.00 0.00 H new ATOM 0 HE ARG A 63 7.885 -12.546 -1.590 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.250 -12.163 -0.672 1.00 0.00 H new ATOM 0 HH12 ARG A 63 11.517 -13.892 -0.431 1.00 0.00 H new ATOM 0 HH21 ARG A 63 8.238 -14.767 -1.276 1.00 0.00 H new ATOM 0 HH22 ARG A 63 9.826 -15.354 -0.770 1.00 0.00 H new ATOM 974 N SER A 64 5.827 -9.929 2.653 1.00 0.00 N ATOM 975 CA SER A 64 5.543 -9.596 4.048 1.00 0.00 C ATOM 976 C SER A 64 5.464 -10.861 4.902 1.00 0.00 C ATOM 977 O SER A 64 5.630 -10.811 6.121 1.00 0.00 O ATOM 978 CB SER A 64 4.223 -8.832 4.147 1.00 0.00 C ATOM 979 OG SER A 64 4.354 -7.582 3.481 1.00 0.00 O ATOM 0 H SER A 64 5.106 -9.637 1.993 1.00 0.00 H new ATOM 0 HA SER A 64 6.355 -8.971 4.420 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.418 -9.414 3.698 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.958 -8.674 5.192 1.00 0.00 H new ATOM 0 HG SER A 64 3.485 -7.130 3.460 1.00 0.00 H new ATOM 985 N THR A 65 5.207 -11.992 4.253 1.00 0.00 N ATOM 986 CA THR A 65 5.100 -13.262 4.959 1.00 0.00 C ATOM 987 C THR A 65 6.399 -13.559 5.696 1.00 0.00 C ATOM 988 O THR A 65 6.390 -14.147 6.775 1.00 0.00 O ATOM 989 CB THR A 65 4.804 -14.392 3.964 1.00 0.00 C ATOM 990 OG1 THR A 65 5.937 -14.594 3.131 1.00 0.00 O ATOM 991 CG2 THR A 65 3.593 -14.017 3.099 1.00 0.00 C ATOM 0 H THR A 65 5.070 -12.054 3.244 1.00 0.00 H new ATOM 0 HA THR A 65 4.285 -13.196 5.680 1.00 0.00 H new ATOM 0 HB THR A 65 4.584 -15.308 4.512 1.00 0.00 H new ATOM 0 HG1 THR A 65 6.020 -13.845 2.504 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.386 -14.822 2.394 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.724 -13.862 3.738 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.808 -13.100 2.550 1.00 0.00 H new ATOM 999 N ILE A 66 7.514 -13.148 5.108 1.00 0.00 N ATOM 1000 CA ILE A 66 8.819 -13.372 5.721 1.00 0.00 C ATOM 1001 C ILE A 66 8.910 -12.645 7.060 1.00 0.00 C ATOM 1002 O ILE A 66 9.409 -13.196 8.042 1.00 0.00 O ATOM 1003 CB ILE A 66 9.929 -12.874 4.789 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.979 -13.757 3.536 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.278 -12.947 5.512 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.858 -13.091 2.476 1.00 0.00 C ATOM 0 H ILE A 66 7.543 -12.660 4.213 1.00 0.00 H new ATOM 0 HA ILE A 66 8.943 -14.442 5.890 1.00 0.00 H new ATOM 0 HB ILE A 66 9.724 -11.842 4.503 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.376 -14.741 3.787 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.973 -13.910 3.146 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.066 -12.593 4.848 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.247 -12.322 6.404 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.482 -13.979 5.799 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.893 -13.719 1.586 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.442 -12.118 2.217 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.867 -12.961 2.869 1.00 0.00 H new ATOM 1018 N LEU A 67 8.428 -11.404 7.091 1.00 0.00 N ATOM 1019 CA LEU A 67 8.470 -10.611 8.316 1.00 0.00 C ATOM 1020 C LEU A 67 7.686 -11.296 9.435 1.00 0.00 C ATOM 1021 O LEU A 67 8.176 -11.425 10.557 1.00 0.00 O ATOM 1022 CB LEU A 67 7.874 -9.221 8.058 1.00 0.00 C ATOM 1023 CG LEU A 67 8.866 -8.375 7.237 1.00 0.00 C ATOM 1024 CD1 LEU A 67 8.141 -7.129 6.692 1.00 0.00 C ATOM 1025 CD2 LEU A 67 10.064 -7.936 8.135 1.00 0.00 C ATOM 0 H LEU A 67 8.008 -10.931 6.291 1.00 0.00 H new ATOM 0 HA LEU A 67 9.511 -10.515 8.624 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.929 -9.313 7.522 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.656 -8.727 9.005 1.00 0.00 H new ATOM 0 HG LEU A 67 9.247 -8.970 6.407 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.839 -6.527 6.110 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.312 -7.439 6.056 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.758 -6.538 7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.760 -7.338 7.546 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.694 -7.343 8.971 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.576 -8.820 8.516 1.00 0.00 H new ATOM 1037 N ALA A 68 6.474 -11.737 9.119 1.00 0.00 N ATOM 1038 CA ALA A 68 5.634 -12.412 10.106 1.00 0.00 C ATOM 1039 C ALA A 68 6.243 -13.746 10.519 1.00 0.00 C ATOM 1040 O ALA A 68 6.209 -14.122 11.691 1.00 0.00 O ATOM 1041 CB ALA A 68 4.235 -12.640 9.529 1.00 0.00 C ATOM 0 H ALA A 68 6.052 -11.641 8.195 1.00 0.00 H new ATOM 0 HA ALA A 68 5.566 -11.776 10.989 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.614 -13.144 10.270 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.787 -11.680 9.271 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.307 -13.259 8.634 1.00 0.00 H new ATOM 1047 N VAL A 69 6.798 -14.458 9.549 1.00 0.00 N ATOM 1048 CA VAL A 69 7.397 -15.756 9.825 1.00 0.00 C ATOM 1049 C VAL A 69 8.485 -15.653 10.895 1.00 0.00 C ATOM 1050 O VAL A 69 8.327 -16.160 11.996 1.00 0.00 O ATOM 1051 CB VAL A 69 8.008 -16.331 8.531 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.908 -17.534 8.869 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.878 -16.789 7.581 1.00 0.00 C ATOM 0 H VAL A 69 6.846 -14.163 8.574 1.00 0.00 H new ATOM 0 HA VAL A 69 6.613 -16.416 10.196 1.00 0.00 H new ATOM 0 HB VAL A 69 8.603 -15.558 8.044 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.337 -17.937 7.951 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.710 -17.213 9.534 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.315 -18.305 9.361 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.313 -17.195 6.668 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.280 -17.557 8.071 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.243 -15.938 7.334 1.00 0.00 H new ATOM 1063 N ASP A 70 9.577 -14.986 10.566 1.00 0.00 N ATOM 1064 CA ASP A 70 10.692 -14.857 11.504 1.00 0.00 C ATOM 1065 C ASP A 70 10.256 -14.229 12.829 1.00 0.00 C ATOM 1066 O ASP A 70 10.661 -14.673 13.904 1.00 0.00 O ATOM 1067 CB ASP A 70 11.790 -13.995 10.879 1.00 0.00 C ATOM 1068 CG ASP A 70 12.994 -13.926 11.812 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.923 -14.502 12.884 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.972 -13.298 11.438 1.00 0.00 O ATOM 0 H ASP A 70 9.721 -14.527 9.667 1.00 0.00 H new ATOM 0 HA ASP A 70 11.065 -15.860 11.712 1.00 0.00 H new ATOM 0 HB2 ASP A 70 12.088 -14.413 9.917 1.00 0.00 H new ATOM 0 HB3 ASP A 70 11.411 -12.991 10.687 1.00 0.00 H new ATOM 1075 N ASN A 71 9.435 -13.195 12.748 1.00 0.00 N ATOM 1076 CA ASN A 71 8.970 -12.504 13.950 1.00 0.00 C ATOM 1077 C ASN A 71 8.129 -13.413 14.861 1.00 0.00 C ATOM 1078 O ASN A 71 8.319 -13.439 16.076 1.00 0.00 O ATOM 1079 CB ASN A 71 8.126 -11.297 13.547 1.00 0.00 C ATOM 1080 CG ASN A 71 7.785 -10.468 14.779 1.00 0.00 C ATOM 1081 OD1 ASN A 71 8.661 -9.823 15.355 1.00 0.00 O ATOM 1082 ND2 ASN A 71 6.558 -10.446 15.221 1.00 0.00 N ATOM 0 H ASN A 71 9.076 -12.814 11.872 1.00 0.00 H new ATOM 0 HA ASN A 71 9.854 -12.195 14.508 1.00 0.00 H new ATOM 0 HB2 ASN A 71 8.670 -10.686 12.826 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.211 -11.629 13.057 1.00 0.00 H new ATOM 0 HD21 ASN A 71 6.323 -9.894 16.046 1.00 0.00 H new ATOM 0 HD22 ASN A 71 5.834 -10.981 14.742 1.00 0.00 H new ATOM 1089 N LEU A 72 7.196 -14.154 14.266 1.00 0.00 N ATOM 1090 CA LEU A 72 6.311 -15.038 15.040 1.00 0.00 C ATOM 1091 C LEU A 72 6.884 -16.452 15.182 1.00 0.00 C ATOM 1092 O LEU A 72 6.452 -17.229 16.035 1.00 0.00 O ATOM 1093 CB LEU A 72 4.952 -15.101 14.350 1.00 0.00 C ATOM 1094 CG LEU A 72 4.359 -13.683 14.239 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.044 -13.748 13.462 1.00 0.00 C ATOM 1096 CD2 LEU A 72 4.095 -13.105 15.647 1.00 0.00 C ATOM 0 H LEU A 72 7.030 -14.164 13.260 1.00 0.00 H new ATOM 0 HA LEU A 72 6.215 -14.626 16.045 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.057 -15.540 13.358 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.277 -15.745 14.914 1.00 0.00 H new ATOM 0 HG LEU A 72 5.067 -13.038 13.718 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.620 -12.747 13.380 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.230 -14.146 12.464 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.343 -14.397 13.987 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.676 -12.103 15.556 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.391 -13.746 16.177 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.032 -13.058 16.202 1.00 0.00 H new ATOM 1108 N ASN A 73 7.857 -16.779 14.345 1.00 0.00 N ATOM 1109 CA ASN A 73 8.482 -18.101 14.384 1.00 0.00 C ATOM 1110 C ASN A 73 9.407 -18.219 15.583 1.00 0.00 C ATOM 1111 O ASN A 73 10.398 -17.495 15.686 1.00 0.00 O ATOM 1112 CB ASN A 73 9.280 -18.349 13.101 1.00 0.00 C ATOM 1113 CG ASN A 73 10.016 -19.682 13.183 1.00 0.00 C ATOM 1114 OD1 ASN A 73 9.394 -20.733 13.328 1.00 0.00 O ATOM 1115 ND2 ASN A 73 11.318 -19.698 13.099 1.00 0.00 N ATOM 0 H ASN A 73 8.233 -16.153 13.632 1.00 0.00 H new ATOM 0 HA ASN A 73 7.692 -18.847 14.469 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.609 -18.349 12.242 1.00 0.00 H new ATOM 0 HB3 ASN A 73 9.995 -17.540 12.947 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.822 -20.583 13.154 1.00 0.00 H new ATOM 0 HD22 ASN A 73 11.832 -18.825 12.979 1.00 0.00 H new ATOM 1122 N GLY A 74 9.078 -19.136 16.484 1.00 0.00 N ATOM 1123 CA GLY A 74 9.890 -19.343 17.675 1.00 0.00 C ATOM 1124 C GLY A 74 9.409 -18.463 18.822 1.00 0.00 C ATOM 1125 O GLY A 74 10.045 -18.404 19.874 1.00 0.00 O ATOM 0 H GLY A 74 8.262 -19.743 16.414 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.846 -20.391 17.972 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.933 -19.119 17.452 1.00 0.00 H new ATOM 1129 N PHE A 75 8.279 -17.774 18.614 1.00 0.00 N ATOM 1130 CA PHE A 75 7.725 -16.895 19.645 1.00 0.00 C ATOM 1131 C PHE A 75 6.593 -17.596 20.385 1.00 0.00 C ATOM 1132 O PHE A 75 5.639 -18.083 19.771 1.00 0.00 O ATOM 1133 CB PHE A 75 7.207 -15.590 19.018 1.00 0.00 C ATOM 1134 CG PHE A 75 6.743 -14.633 20.112 1.00 0.00 C ATOM 1135 CD1 PHE A 75 7.588 -14.321 21.190 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.462 -14.068 20.043 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.157 -13.449 22.193 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.035 -13.188 21.048 1.00 0.00 C ATOM 1139 CZ PHE A 75 5.882 -12.882 22.123 1.00 0.00 C ATOM 0 H PHE A 75 7.738 -17.809 17.750 1.00 0.00 H new ATOM 0 HA PHE A 75 8.518 -16.655 20.353 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.995 -15.124 18.426 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.382 -15.806 18.338 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.575 -14.757 21.244 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.807 -14.309 19.219 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.809 -13.214 23.021 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.052 -12.745 20.994 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.548 -12.207 22.898 1.00 0.00 H new ATOM 1149 N LYS A 76 6.704 -17.647 21.710 1.00 0.00 N ATOM 1150 CA LYS A 76 5.690 -18.298 22.524 1.00 0.00 C ATOM 1151 C LYS A 76 4.542 -17.342 22.832 1.00 0.00 C ATOM 1152 O LYS A 76 4.753 -16.253 23.365 1.00 0.00 O ATOM 1153 CB LYS A 76 6.312 -18.782 23.830 1.00 0.00 C ATOM 1154 CG LYS A 76 5.353 -19.752 24.528 1.00 0.00 C ATOM 1155 CD LYS A 76 6.006 -20.298 25.810 1.00 0.00 C ATOM 1156 CE LYS A 76 6.986 -21.429 25.456 1.00 0.00 C ATOM 1157 NZ LYS A 76 7.527 -22.034 26.707 1.00 0.00 N ATOM 0 H LYS A 76 7.481 -17.248 22.237 1.00 0.00 H new ATOM 0 HA LYS A 76 5.295 -19.147 21.965 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.263 -19.276 23.630 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.524 -17.933 24.480 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.420 -19.243 24.772 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.102 -20.574 23.858 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.533 -19.498 26.330 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.239 -20.669 26.490 1.00 0.00 H new ATOM 0 HE2 LYS A 76 6.479 -22.190 24.862 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.801 -21.039 24.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.189 -22.798 26.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 8.025 -21.306 27.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.744 -22.420 27.272 1.00 0.00 H new ATOM 1171 N ILE A 77 3.321 -17.756 22.493 1.00 0.00 N ATOM 1172 CA ILE A 77 2.134 -16.937 22.749 1.00 0.00 C ATOM 1173 C ILE A 77 1.034 -17.786 23.378 1.00 0.00 C ATOM 1174 O ILE A 77 0.672 -18.840 22.853 1.00 0.00 O ATOM 1175 CB ILE A 77 1.624 -16.302 21.445 1.00 0.00 C ATOM 1176 CG1 ILE A 77 2.590 -15.192 20.996 1.00 0.00 C ATOM 1177 CG2 ILE A 77 0.230 -15.706 21.662 1.00 0.00 C ATOM 1178 CD1 ILE A 77 2.233 -14.724 19.571 1.00 0.00 C ATOM 0 H ILE A 77 3.127 -18.650 22.042 1.00 0.00 H new ATOM 0 HA ILE A 77 2.409 -16.141 23.441 1.00 0.00 H new ATOM 0 HB ILE A 77 1.569 -17.072 20.675 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.537 -14.351 21.687 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.616 -15.560 21.020 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.123 -15.258 20.733 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.458 -16.493 21.970 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.278 -14.942 22.438 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.923 -13.938 19.263 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.310 -15.565 18.882 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.214 -14.337 19.560 1.00 0.00 H new ATOM 1190 N GLY A 78 0.503 -17.317 24.501 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.557 -18.037 25.186 1.00 0.00 C ATOM 1192 C GLY A 78 0.004 -19.236 25.940 1.00 0.00 C ATOM 1193 O GLY A 78 -0.428 -19.538 27.052 1.00 0.00 O ATOM 0 H GLY A 78 0.788 -16.448 24.952 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.066 -17.370 25.882 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.301 -18.372 24.464 1.00 0.00 H new ATOM 1197 N GLY A 79 0.971 -19.914 25.326 1.00 0.00 N ATOM 1198 CA GLY A 79 1.586 -21.083 25.947 1.00 0.00 C ATOM 1199 C GLY A 79 2.198 -22.003 24.895 1.00 0.00 C ATOM 1200 O GLY A 79 2.902 -22.957 25.228 1.00 0.00 O ATOM 0 H GLY A 79 1.343 -19.676 24.406 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.357 -20.763 26.648 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.838 -21.629 26.522 1.00 0.00 H new ATOM 1204 N ARG A 80 1.929 -21.712 23.618 1.00 0.00 N ATOM 1205 CA ARG A 80 2.461 -22.520 22.517 1.00 0.00 C ATOM 1206 C ARG A 80 3.184 -21.639 21.501 1.00 0.00 C ATOM 1207 O ARG A 80 2.875 -20.456 21.360 1.00 0.00 O ATOM 1208 CB ARG A 80 1.328 -23.273 21.827 1.00 0.00 C ATOM 1209 CG ARG A 80 0.716 -24.274 22.805 1.00 0.00 C ATOM 1210 CD ARG A 80 -0.350 -25.094 22.087 1.00 0.00 C ATOM 1211 NE ARG A 80 -1.006 -26.000 23.024 1.00 0.00 N ATOM 1212 CZ ARG A 80 -0.461 -27.169 23.347 1.00 0.00 C ATOM 1213 NH1 ARG A 80 0.681 -27.523 22.822 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -1.066 -27.961 24.188 1.00 0.00 N ATOM 0 H ARG A 80 1.349 -20.927 23.323 1.00 0.00 H new ATOM 0 HA ARG A 80 3.173 -23.235 22.930 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.567 -22.572 21.483 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.705 -23.792 20.946 1.00 0.00 H new ATOM 0 HG2 ARG A 80 1.490 -24.931 23.202 1.00 0.00 H new ATOM 0 HG3 ARG A 80 0.277 -23.749 23.653 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.087 -24.430 21.636 1.00 0.00 H new ATOM 0 HD3 ARG A 80 0.104 -25.664 21.276 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.899 -25.732 23.439 1.00 0.00 H new ATOM 0 HH11 ARG A 80 1.154 -26.903 22.165 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.100 -28.420 23.069 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -1.958 -27.684 24.598 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.647 -28.858 24.435 1.00 0.00 H new ATOM 1228 N ALA A 81 4.151 -22.223 20.797 1.00 0.00 N ATOM 1229 CA ALA A 81 4.917 -21.479 19.797 1.00 0.00 C ATOM 1230 C ALA A 81 4.174 -21.433 18.466 1.00 0.00 C ATOM 1231 O ALA A 81 3.710 -22.459 17.970 1.00 0.00 O ATOM 1232 CB ALA A 81 6.286 -22.134 19.597 1.00 0.00 C ATOM 0 H ALA A 81 4.422 -23.201 20.898 1.00 0.00 H new ATOM 0 HA ALA A 81 5.048 -20.459 20.157 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.851 -21.575 18.851 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.831 -22.133 20.541 1.00 0.00 H new ATOM 0 HB3 ALA A 81 6.152 -23.161 19.256 1.00 0.00 H new ATOM 1238 N LEU A 82 4.067 -20.236 17.892 1.00 0.00 N ATOM 1239 CA LEU A 82 3.377 -20.072 16.614 1.00 0.00 C ATOM 1240 C LEU A 82 4.103 -20.832 15.507 1.00 0.00 C ATOM 1241 O LEU A 82 5.329 -20.776 15.408 1.00 0.00 O ATOM 1242 CB LEU A 82 3.299 -18.575 16.242 1.00 0.00 C ATOM 1243 CG LEU A 82 1.962 -17.994 16.705 1.00 0.00 C ATOM 1244 CD1 LEU A 82 1.891 -18.048 18.224 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.841 -16.545 16.237 1.00 0.00 C ATOM 0 H LEU A 82 4.445 -19.374 18.286 1.00 0.00 H new ATOM 0 HA LEU A 82 2.370 -20.475 16.717 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.122 -18.032 16.707 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.405 -18.453 15.164 1.00 0.00 H new ATOM 0 HG LEU A 82 1.145 -18.577 16.280 1.00 0.00 H new ATOM 0 HD11 LEU A 82 0.940 -17.635 18.559 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.974 -19.083 18.556 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.709 -17.465 18.647 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.887 -16.134 16.568 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.656 -15.957 16.659 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.893 -16.509 15.149 1.00 0.00 H new ATOM 1257 N LYS A 83 3.338 -21.539 14.673 1.00 0.00 N ATOM 1258 CA LYS A 83 3.927 -22.299 13.568 1.00 0.00 C ATOM 1259 C LYS A 83 3.563 -21.660 12.231 1.00 0.00 C ATOM 1260 O LYS A 83 2.461 -21.852 11.719 1.00 0.00 O ATOM 1261 CB LYS A 83 3.418 -23.739 13.602 1.00 0.00 C ATOM 1262 CG LYS A 83 4.189 -24.578 12.579 1.00 0.00 C ATOM 1263 CD LYS A 83 3.723 -26.033 12.659 1.00 0.00 C ATOM 1264 CE LYS A 83 4.527 -26.880 11.669 1.00 0.00 C ATOM 1265 NZ LYS A 83 4.104 -28.305 11.778 1.00 0.00 N ATOM 0 H LYS A 83 2.322 -21.602 14.739 1.00 0.00 H new ATOM 0 HA LYS A 83 5.011 -22.293 13.679 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.545 -24.157 14.601 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.351 -23.764 13.379 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.026 -24.187 11.575 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.260 -24.516 12.775 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.856 -26.414 13.672 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.659 -26.099 12.431 1.00 0.00 H new ATOM 0 HE2 LYS A 83 4.369 -26.519 10.653 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.593 -26.789 11.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 4.650 -28.881 11.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.276 -28.645 12.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 3.090 -28.384 11.559 1.00 0.00 H new ATOM 1279 N ILE A 84 4.502 -20.903 11.662 1.00 0.00 N ATOM 1280 CA ILE A 84 4.274 -20.234 10.377 1.00 0.00 C ATOM 1281 C ILE A 84 4.903 -21.049 9.249 1.00 0.00 C ATOM 1282 O ILE A 84 6.083 -21.392 9.304 1.00 0.00 O ATOM 1283 CB ILE A 84 4.879 -18.803 10.397 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.688 -18.159 11.799 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.175 -17.932 9.333 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.225 -17.740 11.999 1.00 0.00 C ATOM 0 H ILE A 84 5.423 -20.737 12.067 1.00 0.00 H new ATOM 0 HA ILE A 84 3.200 -20.157 10.208 1.00 0.00 H new ATOM 0 HB ILE A 84 5.945 -18.866 10.177 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.980 -18.867 12.575 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.339 -17.290 11.899 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.599 -16.928 9.346 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.320 -18.374 8.347 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.109 -17.879 9.554 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.107 -17.291 12.985 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.946 -17.015 11.234 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.582 -18.616 11.920 1.00 0.00 H new ATOM 1298 N ASP A 85 4.108 -21.354 8.225 1.00 0.00 N ATOM 1299 CA ASP A 85 4.601 -22.133 7.086 1.00 0.00 C ATOM 1300 C ASP A 85 3.941 -21.667 5.791 1.00 0.00 C ATOM 1301 O ASP A 85 2.821 -21.156 5.802 1.00 0.00 O ATOM 1302 CB ASP A 85 4.310 -23.624 7.305 1.00 0.00 C ATOM 1303 CG ASP A 85 5.178 -24.475 6.378 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.145 -23.950 5.853 1.00 0.00 O ATOM 1305 OD2 ASP A 85 4.858 -25.641 6.202 1.00 0.00 O ATOM 0 H ASP A 85 3.128 -21.078 8.158 1.00 0.00 H new ATOM 0 HA ASP A 85 5.677 -21.982 7.006 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.505 -23.891 8.344 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.256 -23.828 7.116 1.00 0.00 H new ATOM 1310 N HIS A 86 4.645 -21.842 4.673 1.00 0.00 N ATOM 1311 CA HIS A 86 4.120 -21.427 3.375 1.00 0.00 C ATOM 1312 C HIS A 86 3.192 -22.494 2.803 1.00 0.00 C ATOM 1313 O HIS A 86 3.492 -23.686 2.855 1.00 0.00 O ATOM 1314 CB HIS A 86 5.273 -21.181 2.402 1.00 0.00 C ATOM 1315 CG HIS A 86 6.140 -20.067 2.923 1.00 0.00 C ATOM 1316 ND1 HIS A 86 5.826 -18.731 2.730 1.00 0.00 N ATOM 1317 CD2 HIS A 86 7.315 -20.077 3.634 1.00 0.00 C ATOM 1318 CE1 HIS A 86 6.792 -17.998 3.312 1.00 0.00 C ATOM 1319 NE2 HIS A 86 7.725 -18.770 3.879 1.00 0.00 N ATOM 0 H HIS A 86 5.573 -22.265 4.641 1.00 0.00 H new ATOM 0 HA HIS A 86 3.554 -20.506 3.512 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.863 -22.090 2.283 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.883 -20.923 1.417 1.00 0.00 H new ATOM 0 HD2 HIS A 86 7.841 -20.964 3.954 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.812 -16.918 3.320 1.00 0.00 H new ATOM 0 HE2 HIS A 86 8.558 -18.466 4.383 1.00 0.00 H new ATOM 1328 N THR A 87 2.061 -22.057 2.254 1.00 0.00 N ATOM 1329 CA THR A 87 1.091 -22.982 1.670 1.00 0.00 C ATOM 1330 C THR A 87 0.343 -22.320 0.512 1.00 0.00 C ATOM 1331 O THR A 87 0.291 -21.094 0.415 1.00 0.00 O ATOM 1332 CB THR A 87 0.094 -23.435 2.742 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.918 -24.226 2.138 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.535 -22.212 3.413 1.00 0.00 C ATOM 0 H THR A 87 1.794 -21.074 2.201 1.00 0.00 H new ATOM 0 HA THR A 87 1.627 -23.849 1.285 1.00 0.00 H new ATOM 0 HB THR A 87 0.614 -24.026 3.496 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.556 -24.519 2.822 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.243 -22.539 4.174 1.00 0.00 H new ATOM 0 HG22 THR A 87 0.246 -21.610 3.878 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.056 -21.615 2.665 1.00 0.00 H new ATOM 1342 N PHE A 88 -0.237 -23.138 -0.365 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.981 -22.621 -1.516 1.00 0.00 C ATOM 1344 C PHE A 88 -2.245 -23.444 -1.757 1.00 0.00 C ATOM 1345 O PHE A 88 -2.636 -23.675 -2.900 1.00 0.00 O ATOM 1346 CB PHE A 88 -0.095 -22.655 -2.765 1.00 0.00 C ATOM 1347 CG PHE A 88 0.629 -23.978 -2.833 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.857 -24.136 -2.180 1.00 0.00 C ATOM 1349 CD2 PHE A 88 0.073 -25.048 -3.547 1.00 0.00 C ATOM 1350 CE1 PHE A 88 2.529 -25.363 -2.240 1.00 0.00 C ATOM 1351 CE2 PHE A 88 0.746 -26.274 -3.608 1.00 0.00 C ATOM 1352 CZ PHE A 88 1.974 -26.431 -2.954 1.00 0.00 C ATOM 0 H PHE A 88 -0.208 -24.156 -0.303 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.272 -21.592 -1.305 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.703 -22.515 -3.659 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.624 -21.836 -2.736 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.286 -23.312 -1.630 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -0.875 -24.927 -4.050 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.476 -25.485 -1.735 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.318 -27.098 -4.159 1.00 0.00 H new ATOM 0 HZ PHE A 88 2.493 -27.377 -3.001 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.878 -23.879 -0.674 1.00 0.00 N ATOM 1363 CA TYR A 89 -4.095 -24.675 -0.781 1.00 0.00 C ATOM 1364 C TYR A 89 -5.108 -23.980 -1.693 1.00 0.00 C ATOM 1365 O TYR A 89 -5.107 -22.755 -1.817 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.702 -24.885 0.618 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.524 -23.672 1.011 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -4.884 -22.474 1.349 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.921 -23.749 1.028 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -5.643 -21.353 1.704 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.679 -22.629 1.384 1.00 0.00 C ATOM 1372 CZ TYR A 89 -7.040 -21.430 1.721 1.00 0.00 C ATOM 1373 OH TYR A 89 -7.787 -20.324 2.072 1.00 0.00 O ATOM 0 H TYR A 89 -2.572 -23.696 0.282 1.00 0.00 H new ATOM 0 HA TYR A 89 -3.846 -25.644 -1.214 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -5.329 -25.777 0.622 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.909 -25.050 1.347 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -3.806 -22.415 1.336 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.414 -24.674 0.766 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -5.150 -20.428 1.965 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.757 -22.689 1.399 1.00 0.00 H new ATOM 0 HH TYR A 89 -7.863 -20.277 3.048 1.00 0.00 H new ATOM 2031 N PHE B 311 12.486 -5.177 4.451 1.00 0.00 N ATOM 2032 CA PHE B 311 11.267 -4.410 4.217 1.00 0.00 C ATOM 2033 C PHE B 311 10.796 -3.757 5.514 1.00 0.00 C ATOM 2034 O PHE B 311 10.386 -4.443 6.450 1.00 0.00 O ATOM 2035 CB PHE B 311 10.144 -5.331 3.651 1.00 0.00 C ATOM 2036 CG PHE B 311 10.613 -6.777 3.636 1.00 0.00 C ATOM 2037 CD1 PHE B 311 10.979 -7.407 4.834 1.00 0.00 C ATOM 2038 CD2 PHE B 311 10.689 -7.474 2.427 1.00 0.00 C ATOM 2039 CE1 PHE B 311 11.417 -8.734 4.823 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.127 -8.805 2.418 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.492 -9.433 3.617 1.00 0.00 C ATOM 0 HA PHE B 311 11.486 -3.632 3.486 1.00 0.00 H new ATOM 0 HB2 PHE B 311 9.245 -5.238 4.261 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.879 -5.016 2.642 1.00 0.00 H new ATOM 0 HD1 PHE B 311 10.922 -6.866 5.767 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.411 -6.989 1.503 1.00 0.00 H new ATOM 0 HE1 PHE B 311 11.697 -9.218 5.747 1.00 0.00 H new ATOM 0 HE2 PHE B 311 11.183 -9.348 1.486 1.00 0.00 H new ATOM 0 HZ PHE B 311 11.831 -10.458 3.608 1.00 0.00 H new ATOM 2051 N ALA B 312 10.852 -2.430 5.559 1.00 0.00 N ATOM 2052 CA ALA B 312 10.418 -1.696 6.745 1.00 0.00 C ATOM 2053 C ALA B 312 8.952 -1.290 6.614 1.00 0.00 C ATOM 2054 O ALA B 312 8.636 -0.115 6.432 1.00 0.00 O ATOM 2055 CB ALA B 312 11.281 -0.446 6.929 1.00 0.00 C ATOM 0 H ALA B 312 11.190 -1.844 4.796 1.00 0.00 H new ATOM 0 HA ALA B 312 10.529 -2.345 7.614 1.00 0.00 H new ATOM 0 HB1 ALA B 312 10.952 0.096 7.815 1.00 0.00 H new ATOM 0 HB2 ALA B 312 12.324 -0.739 7.049 1.00 0.00 H new ATOM 0 HB3 ALA B 312 11.183 0.196 6.054 1.00 0.00 H new ATOM 2061 N ILE B 313 8.060 -2.271 6.710 1.00 0.00 N ATOM 2062 CA ILE B 313 6.628 -2.004 6.598 1.00 0.00 C ATOM 2063 C ILE B 313 6.124 -1.276 7.841 1.00 0.00 C ATOM 2064 O ILE B 313 6.319 -1.739 8.965 1.00 0.00 O ATOM 2065 CB ILE B 313 5.861 -3.316 6.426 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.340 -4.023 5.151 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.362 -3.024 6.317 1.00 0.00 C ATOM 2068 CD1 ILE B 313 5.710 -5.418 5.065 1.00 0.00 C ATOM 0 H ILE B 313 8.299 -3.251 6.864 1.00 0.00 H new ATOM 0 HA ILE B 313 6.462 -1.372 5.725 1.00 0.00 H new ATOM 0 HB ILE B 313 6.042 -3.958 7.288 1.00 0.00 H new ATOM 0 HG12 ILE B 313 6.068 -3.436 4.274 1.00 0.00 H new ATOM 0 HG13 ILE B 313 7.427 -4.104 5.155 1.00 0.00 H new ATOM 0 HG21 ILE B 313 3.817 -3.960 6.194 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.022 -2.522 7.223 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.178 -2.382 5.456 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.053 -5.917 4.158 1.00 0.00 H new ATOM 0 HD12 ILE B 313 6.005 -6.005 5.935 1.00 0.00 H new ATOM 0 HD13 ILE B 313 4.624 -5.326 5.040 1.00 0.00 H new ATOM 2080 N MET B 314 5.477 -0.133 7.628 1.00 0.00 N ATOM 2081 CA MET B 314 4.956 0.660 8.736 1.00 0.00 C ATOM 2082 C MET B 314 3.729 -0.019 9.381 1.00 0.00 C ATOM 2083 O MET B 314 3.055 -0.822 8.733 1.00 0.00 O ATOM 2084 CB MET B 314 4.571 2.071 8.237 1.00 0.00 C ATOM 2085 CG MET B 314 3.258 2.016 7.427 1.00 0.00 C ATOM 2086 SD MET B 314 3.426 0.813 6.081 1.00 0.00 S ATOM 2087 CE MET B 314 4.649 1.726 5.101 1.00 0.00 C ATOM 0 H MET B 314 5.302 0.262 6.704 1.00 0.00 H new ATOM 0 HA MET B 314 5.737 0.740 9.492 1.00 0.00 H new ATOM 0 HB2 MET B 314 4.454 2.744 9.086 1.00 0.00 H new ATOM 0 HB3 MET B 314 5.371 2.475 7.617 1.00 0.00 H new ATOM 0 HG2 MET B 314 2.429 1.737 8.077 1.00 0.00 H new ATOM 0 HG3 MET B 314 3.027 3.001 7.022 1.00 0.00 H new ATOM 0 HE1 MET B 314 4.343 1.736 4.055 1.00 0.00 H new ATOM 0 HE2 MET B 314 4.718 2.750 5.468 1.00 0.00 H new ATOM 0 HE3 MET B 314 5.621 1.242 5.190 1.00 0.00 H new ATOM 2097 N PRO B 315 3.421 0.300 10.632 1.00 0.00 N ATOM 2098 CA PRO B 315 2.240 -0.277 11.355 1.00 0.00 C ATOM 2099 C PRO B 315 0.913 0.100 10.692 1.00 0.00 C ATOM 2100 O PRO B 315 0.807 1.146 10.051 1.00 0.00 O ATOM 2101 CB PRO B 315 2.338 0.334 12.768 1.00 0.00 C ATOM 2102 CG PRO B 315 3.741 0.837 12.889 1.00 0.00 C ATOM 2103 CD PRO B 315 4.168 1.238 11.487 1.00 0.00 C ATOM 0 HA PRO B 315 2.257 -1.367 11.354 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.619 1.143 12.897 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.121 -0.411 13.534 1.00 0.00 H new ATOM 0 HG2 PRO B 315 3.793 1.686 13.570 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.398 0.066 13.291 1.00 0.00 H new ATOM 0 HD2 PRO B 315 3.912 2.275 11.268 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.245 1.140 11.349 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.100 -0.756 10.851 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.422 -0.493 10.271 1.00 0.00 C ATOM 2113 C GLY B 316 -2.402 -0.041 11.349 1.00 0.00 C ATOM 2114 O GLY B 316 -2.148 -0.205 12.538 1.00 0.00 O ATOM 0 H GLY B 316 -0.033 -1.630 11.372 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.341 0.274 9.501 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.798 -1.394 9.785 1.00 0.00 H new ATOM 2118 N SER B 317 -3.523 0.529 10.926 1.00 0.00 N ATOM 2119 CA SER B 317 -4.531 1.001 11.867 1.00 0.00 C ATOM 2120 C SER B 317 -5.094 -0.161 12.688 1.00 0.00 C ATOM 2121 O SER B 317 -5.274 -0.050 13.903 1.00 0.00 O ATOM 2122 CB SER B 317 -5.668 1.690 11.111 1.00 0.00 C ATOM 2123 OG SER B 317 -6.630 2.167 12.042 1.00 0.00 O ATOM 0 H SER B 317 -3.757 0.675 9.944 1.00 0.00 H new ATOM 0 HA SER B 317 -4.059 1.712 12.545 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.277 2.517 10.518 1.00 0.00 H new ATOM 0 HB3 SER B 317 -6.133 0.992 10.415 1.00 0.00 H new ATOM 0 HG SER B 317 -7.359 2.611 11.561 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.370 -1.275 12.014 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.916 -2.448 12.687 1.00 0.00 C ATOM 2131 C ARG B 318 -4.898 -3.029 13.668 1.00 0.00 C ATOM 2132 O ARG B 318 -5.120 -4.090 14.252 1.00 0.00 O ATOM 2133 CB ARG B 318 -6.318 -3.520 11.648 1.00 0.00 C ATOM 2134 CG ARG B 318 -7.451 -4.410 12.210 1.00 0.00 C ATOM 2135 CD ARG B 318 -8.276 -4.980 11.061 1.00 0.00 C ATOM 2136 NE ARG B 318 -8.868 -3.901 10.280 1.00 0.00 N ATOM 2137 CZ ARG B 318 -9.514 -4.145 9.145 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -9.628 -5.372 8.711 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -10.032 -3.161 8.463 1.00 0.00 N ATOM 0 H ARG B 318 -5.226 -1.389 11.011 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.801 -2.143 13.245 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -6.647 -3.039 10.727 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -5.454 -4.135 11.396 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -7.029 -5.220 12.804 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -8.089 -3.827 12.874 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -7.644 -5.597 10.422 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -9.061 -5.627 11.453 1.00 0.00 H new ATOM 0 HE ARG B 318 -8.785 -2.940 10.611 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -9.221 -6.141 9.243 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -10.124 -5.561 7.840 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -9.941 -2.203 8.801 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -10.528 -3.350 7.592 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.782 -2.331 13.838 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.737 -2.781 14.746 1.00 0.00 C ATOM 2155 C TRP B 319 -3.197 -2.700 16.199 1.00 0.00 C ATOM 2156 O TRP B 319 -2.648 -3.359 17.079 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.478 -1.933 14.562 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.445 -2.349 15.557 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.217 -3.621 15.957 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.495 -1.519 16.292 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.805 -3.622 16.884 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.276 -2.350 17.125 1.00 0.00 C ATOM 2163 CE3 TRP B 319 0.745 -0.136 16.314 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.271 -1.837 17.951 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 1.748 0.389 17.144 1.00 0.00 C ATOM 2166 CH2 TRP B 319 2.508 -0.458 17.961 1.00 0.00 C ATOM 0 H TRP B 319 -3.578 -1.453 13.360 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.515 -3.822 14.510 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -1.092 -2.052 13.550 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.716 -0.877 14.690 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.748 -4.494 15.608 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.167 -4.462 17.336 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.163 0.526 15.690 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 2.854 -2.496 18.578 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 1.935 1.453 17.153 1.00 0.00 H new ATOM 0 HH2 TRP B 319 3.277 -0.047 18.598 1.00 0.00 H new ATOM 2177 N ASP B 320 -4.195 -1.875 16.447 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.724 -1.701 17.802 1.00 0.00 C ATOM 2179 C ASP B 320 -3.688 -1.024 18.705 1.00 0.00 C ATOM 2180 O ASP B 320 -4.040 -0.257 19.601 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.109 -3.062 18.395 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.088 -2.876 19.551 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -6.170 -1.770 20.058 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.741 -3.842 19.911 1.00 0.00 O ATOM 0 H ASP B 320 -4.661 -1.312 15.735 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.608 -1.066 17.744 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.559 -3.688 17.625 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -4.216 -3.580 18.745 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.407 -1.312 18.462 1.00 0.00 N ATOM 2190 CA GLY B 321 -1.327 -0.729 19.260 1.00 0.00 C ATOM 2191 C GLY B 321 -0.672 -1.784 20.149 1.00 0.00 C ATOM 2192 O GLY B 321 0.092 -1.456 21.056 1.00 0.00 O ATOM 0 H GLY B 321 -2.094 -1.942 17.723 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.579 -0.289 18.600 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.721 0.078 19.878 1.00 0.00 H new ATOM 2196 N VAL B 322 -0.976 -3.054 19.881 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.405 -4.151 20.666 1.00 0.00 C ATOM 2198 C VAL B 322 0.948 -4.563 20.089 1.00 0.00 C ATOM 2199 O VAL B 322 1.056 -4.909 18.915 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.353 -5.349 20.659 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -0.721 -6.511 21.429 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -2.674 -4.957 21.326 1.00 0.00 C ATOM 0 H VAL B 322 -1.607 -3.348 19.135 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.266 -3.810 21.692 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.539 -5.656 19.630 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.400 -7.364 21.422 1.00 0.00 H new ATOM 0 HG12 VAL B 322 0.220 -6.792 20.956 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -0.532 -6.206 22.458 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.351 -5.811 21.322 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -2.485 -4.649 22.354 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.128 -4.131 20.778 1.00 0.00 H new ATOM 2212 N HIS B 323 1.978 -4.525 20.926 1.00 0.00 N ATOM 2213 CA HIS B 323 3.326 -4.890 20.489 1.00 0.00 C ATOM 2214 C HIS B 323 3.528 -6.409 20.513 1.00 0.00 C ATOM 2215 O HIS B 323 3.334 -7.054 21.540 1.00 0.00 O ATOM 2216 CB HIS B 323 4.363 -4.216 21.407 1.00 0.00 C ATOM 2217 CG HIS B 323 3.866 -4.222 22.835 1.00 0.00 C ATOM 2218 ND1 HIS B 323 4.419 -3.412 23.815 1.00 0.00 N ATOM 2219 CD2 HIS B 323 2.867 -4.933 23.458 1.00 0.00 C ATOM 2220 CE1 HIS B 323 3.758 -3.654 24.963 1.00 0.00 C ATOM 2221 NE2 HIS B 323 2.804 -4.573 24.799 1.00 0.00 N ATOM 0 H HIS B 323 1.910 -4.248 21.905 1.00 0.00 H new ATOM 0 HA HIS B 323 3.457 -4.547 19.463 1.00 0.00 H new ATOM 0 HB2 HIS B 323 5.316 -4.742 21.342 1.00 0.00 H new ATOM 0 HB3 HIS B 323 4.541 -3.192 21.079 1.00 0.00 H new ATOM 0 HD2 HIS B 323 2.229 -5.660 22.978 1.00 0.00 H new ATOM 0 HE1 HIS B 323 3.973 -3.165 25.901 1.00 0.00 H new ATOM 0 HE2 HIS B 323 2.165 -4.934 25.507 1.00 0.00 H new ATOM 2230 N ARG B 324 3.923 -6.977 19.369 1.00 0.00 N ATOM 2231 CA ARG B 324 4.164 -8.421 19.281 1.00 0.00 C ATOM 2232 C ARG B 324 5.410 -8.698 18.444 1.00 0.00 C ATOM 2233 O ARG B 324 5.392 -8.554 17.223 1.00 0.00 O ATOM 2234 CB ARG B 324 2.946 -9.126 18.653 1.00 0.00 C ATOM 2235 CG ARG B 324 2.916 -10.616 19.088 1.00 0.00 C ATOM 2236 CD ARG B 324 2.160 -10.767 20.424 1.00 0.00 C ATOM 2237 NE ARG B 324 3.029 -10.407 21.539 1.00 0.00 N ATOM 2238 CZ ARG B 324 2.552 -10.295 22.775 1.00 0.00 C ATOM 2239 NH1 ARG B 324 1.286 -10.509 23.008 1.00 0.00 N ATOM 2240 NH2 ARG B 324 3.350 -9.969 23.755 1.00 0.00 N ATOM 0 H ARG B 324 4.081 -6.466 18.500 1.00 0.00 H new ATOM 0 HA ARG B 324 4.319 -8.809 20.288 1.00 0.00 H new ATOM 0 HB2 ARG B 324 2.027 -8.629 18.963 1.00 0.00 H new ATOM 0 HB3 ARG B 324 2.995 -9.056 17.566 1.00 0.00 H new ATOM 0 HG2 ARG B 324 2.432 -11.217 18.318 1.00 0.00 H new ATOM 0 HG3 ARG B 324 3.934 -10.992 19.193 1.00 0.00 H new ATOM 0 HD2 ARG B 324 1.275 -10.131 20.423 1.00 0.00 H new ATOM 0 HD3 ARG B 324 1.814 -11.794 20.540 1.00 0.00 H new ATOM 0 HE ARG B 324 4.020 -10.238 21.367 1.00 0.00 H new ATOM 0 HH11 ARG B 324 0.662 -10.762 22.242 1.00 0.00 H new ATOM 0 HH12 ARG B 324 0.920 -10.423 23.956 1.00 0.00 H new ATOM 0 HH21 ARG B 324 4.339 -9.800 23.573 1.00 0.00 H new ATOM 0 HH22 ARG B 324 2.984 -9.883 24.703 1.00 0.00 H new ATOM 2254 N SER B 325 6.487 -9.103 19.106 1.00 0.00 N ATOM 2255 CA SER B 325 7.737 -9.396 18.410 1.00 0.00 C ATOM 2256 C SER B 325 8.614 -10.314 19.249 1.00 0.00 C ATOM 2257 O SER B 325 8.365 -10.505 20.439 1.00 0.00 O ATOM 2258 CB SER B 325 8.488 -8.097 18.112 1.00 0.00 C ATOM 2259 OG SER B 325 8.931 -7.521 19.334 1.00 0.00 O ATOM 0 H SER B 325 6.522 -9.236 20.117 1.00 0.00 H new ATOM 0 HA SER B 325 7.499 -9.899 17.472 1.00 0.00 H new ATOM 0 HB2 SER B 325 9.339 -8.296 17.461 1.00 0.00 H new ATOM 0 HB3 SER B 325 7.838 -7.400 17.583 1.00 0.00 H new ATOM 0 HG SER B 325 9.414 -6.689 19.147 1.00 0.00 H new ATOM 2286 N PHE B 328 15.358 -10.038 18.991 1.00 0.00 N ATOM 2287 CA PHE B 328 16.227 -9.304 19.900 1.00 0.00 C ATOM 2288 C PHE B 328 16.973 -8.204 19.155 1.00 0.00 C ATOM 2289 O PHE B 328 17.034 -7.065 19.605 1.00 0.00 O ATOM 2290 CB PHE B 328 17.229 -10.260 20.551 1.00 0.00 C ATOM 2291 CG PHE B 328 18.111 -9.493 21.507 1.00 0.00 C ATOM 2292 CD1 PHE B 328 17.656 -9.204 22.800 1.00 0.00 C ATOM 2293 CD2 PHE B 328 19.383 -9.071 21.102 1.00 0.00 C ATOM 2294 CE1 PHE B 328 18.472 -8.493 23.686 1.00 0.00 C ATOM 2295 CE2 PHE B 328 20.199 -8.358 21.988 1.00 0.00 C ATOM 2296 CZ PHE B 328 19.745 -8.071 23.281 1.00 0.00 C ATOM 0 HA PHE B 328 15.611 -8.846 20.674 1.00 0.00 H new ATOM 0 HB2 PHE B 328 16.700 -11.051 21.083 1.00 0.00 H new ATOM 0 HB3 PHE B 328 17.837 -10.742 19.786 1.00 0.00 H new ATOM 0 HD1 PHE B 328 16.675 -9.530 23.113 1.00 0.00 H new ATOM 0 HD2 PHE B 328 19.735 -9.296 20.106 1.00 0.00 H new ATOM 0 HE1 PHE B 328 18.121 -8.269 24.682 1.00 0.00 H new ATOM 0 HE2 PHE B 328 21.179 -8.029 21.674 1.00 0.00 H new ATOM 0 HZ PHE B 328 20.376 -7.524 23.966 1.00 0.00 H new ATOM 2306 N GLU B 329 17.537 -8.553 18.005 1.00 0.00 N ATOM 2307 CA GLU B 329 18.287 -7.591 17.201 1.00 0.00 C ATOM 2308 C GLU B 329 17.415 -6.394 16.822 1.00 0.00 C ATOM 2309 O GLU B 329 17.913 -5.321 16.475 1.00 0.00 O ATOM 2310 CB GLU B 329 18.811 -8.266 15.931 1.00 0.00 C ATOM 2311 CG GLU B 329 19.952 -9.217 16.292 1.00 0.00 C ATOM 2312 CD GLU B 329 20.564 -9.800 15.024 1.00 0.00 C ATOM 2313 OE1 GLU B 329 19.897 -10.588 14.375 1.00 0.00 O ATOM 2314 OE2 GLU B 329 21.691 -9.447 14.721 1.00 0.00 O ATOM 0 H GLU B 329 17.491 -9.491 17.608 1.00 0.00 H new ATOM 0 HA GLU B 329 19.126 -7.233 17.798 1.00 0.00 H new ATOM 0 HB2 GLU B 329 18.007 -8.815 15.440 1.00 0.00 H new ATOM 0 HB3 GLU B 329 19.161 -7.513 15.224 1.00 0.00 H new ATOM 0 HG2 GLU B 329 20.714 -8.685 16.862 1.00 0.00 H new ATOM 0 HG3 GLU B 329 19.580 -10.020 16.929 1.00 0.00 H new ATOM 2321 N GLU B 330 16.110 -6.587 16.884 1.00 0.00 N ATOM 2322 CA GLU B 330 15.177 -5.522 16.545 1.00 0.00 C ATOM 2323 C GLU B 330 15.468 -4.264 17.370 1.00 0.00 C ATOM 2324 O GLU B 330 15.058 -3.166 17.001 1.00 0.00 O ATOM 2325 CB GLU B 330 13.741 -5.985 16.804 1.00 0.00 C ATOM 2326 CG GLU B 330 12.762 -4.946 16.257 1.00 0.00 C ATOM 2327 CD GLU B 330 11.328 -5.435 16.438 1.00 0.00 C ATOM 2328 OE1 GLU B 330 11.154 -6.504 17.000 1.00 0.00 O ATOM 2329 OE2 GLU B 330 10.426 -4.734 16.011 1.00 0.00 O ATOM 0 H GLU B 330 15.672 -7.465 17.164 1.00 0.00 H new ATOM 0 HA GLU B 330 15.298 -5.283 15.488 1.00 0.00 H new ATOM 0 HB2 GLU B 330 13.567 -6.950 16.327 1.00 0.00 H new ATOM 0 HB3 GLU B 330 13.580 -6.124 17.873 1.00 0.00 H new ATOM 0 HG2 GLU B 330 12.899 -3.997 16.775 1.00 0.00 H new ATOM 0 HG3 GLU B 330 12.963 -4.765 15.201 1.00 0.00 H new ATOM 2336 N LYS B 331 16.169 -4.434 18.492 1.00 0.00 N ATOM 2337 CA LYS B 331 16.496 -3.305 19.367 1.00 0.00 C ATOM 2338 C LYS B 331 17.254 -2.202 18.603 1.00 0.00 C ATOM 2339 O LYS B 331 16.765 -1.078 18.474 1.00 0.00 O ATOM 2340 CB LYS B 331 17.365 -3.789 20.556 1.00 0.00 C ATOM 2341 CG LYS B 331 18.536 -4.689 20.046 1.00 0.00 C ATOM 2342 CD LYS B 331 19.892 -4.002 20.315 1.00 0.00 C ATOM 2343 CE LYS B 331 20.252 -4.130 21.802 1.00 0.00 C ATOM 2344 NZ LYS B 331 20.922 -5.441 22.041 1.00 0.00 N ATOM 0 H LYS B 331 16.520 -5.336 18.816 1.00 0.00 H new ATOM 0 HA LYS B 331 15.558 -2.890 19.736 1.00 0.00 H new ATOM 0 HB2 LYS B 331 17.766 -2.930 21.094 1.00 0.00 H new ATOM 0 HB3 LYS B 331 16.749 -4.348 21.261 1.00 0.00 H new ATOM 0 HG2 LYS B 331 18.505 -5.657 20.546 1.00 0.00 H new ATOM 0 HG3 LYS B 331 18.421 -4.878 18.979 1.00 0.00 H new ATOM 0 HD2 LYS B 331 20.669 -4.458 19.702 1.00 0.00 H new ATOM 0 HD3 LYS B 331 19.840 -2.950 20.033 1.00 0.00 H new ATOM 0 HE2 LYS B 331 20.910 -3.314 22.099 1.00 0.00 H new ATOM 0 HE3 LYS B 331 19.353 -4.053 22.413 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 21.472 -5.394 22.922 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 20.203 -6.189 22.121 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 21.558 -5.656 21.247 1.00 0.00 H new ATOM 2358 N TRP B 332 18.450 -2.533 18.098 1.00 0.00 N ATOM 2359 CA TRP B 332 19.267 -1.569 17.359 1.00 0.00 C ATOM 2360 C TRP B 332 18.637 -1.257 16.009 1.00 0.00 C ATOM 2361 O TRP B 332 18.856 -0.186 15.444 1.00 0.00 O ATOM 2362 CB TRP B 332 20.693 -2.122 17.158 1.00 0.00 C ATOM 2363 CG TRP B 332 20.674 -3.260 16.174 1.00 0.00 C ATOM 2364 CD1 TRP B 332 20.427 -4.550 16.486 1.00 0.00 C ATOM 2365 CD2 TRP B 332 20.918 -3.232 14.731 1.00 0.00 C ATOM 2366 NE1 TRP B 332 20.489 -5.311 15.332 1.00 0.00 N ATOM 2367 CE2 TRP B 332 20.790 -4.546 14.225 1.00 0.00 C ATOM 2368 CE3 TRP B 332 21.231 -2.205 13.822 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 20.959 -4.831 12.871 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 21.408 -2.486 12.460 1.00 0.00 C ATOM 2371 CH2 TRP B 332 21.273 -3.797 11.984 1.00 0.00 C ATOM 0 H TRP B 332 18.870 -3.458 18.189 1.00 0.00 H new ATOM 0 HA TRP B 332 19.321 -0.648 17.940 1.00 0.00 H new ATOM 0 HB2 TRP B 332 21.350 -1.331 16.798 1.00 0.00 H new ATOM 0 HB3 TRP B 332 21.097 -2.463 18.111 1.00 0.00 H new ATOM 0 HD1 TRP B 332 20.215 -4.927 17.476 1.00 0.00 H new ATOM 0 HE1 TRP B 332 20.331 -6.318 15.304 1.00 0.00 H new ATOM 0 HE3 TRP B 332 21.336 -1.190 14.177 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 20.848 -5.843 12.510 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 21.650 -1.688 11.774 1.00 0.00 H new ATOM 0 HH2 TRP B 332 21.411 -4.008 10.934 1.00 0.00 H new ATOM 2382 N PHE B 333 17.863 -2.203 15.497 1.00 0.00 N ATOM 2383 CA PHE B 333 17.210 -2.016 14.209 1.00 0.00 C ATOM 2384 C PHE B 333 16.036 -1.051 14.349 1.00 0.00 C ATOM 2385 O PHE B 333 15.807 -0.209 13.481 1.00 0.00 O ATOM 2386 CB PHE B 333 16.713 -3.375 13.670 1.00 0.00 C ATOM 2387 CG PHE B 333 16.723 -3.365 12.154 1.00 0.00 C ATOM 2388 CD1 PHE B 333 17.937 -3.183 11.478 1.00 0.00 C ATOM 2389 CD2 PHE B 333 15.534 -3.530 11.436 1.00 0.00 C ATOM 2390 CE1 PHE B 333 17.959 -3.166 10.082 1.00 0.00 C ATOM 2391 CE2 PHE B 333 15.557 -3.516 10.037 1.00 0.00 C ATOM 2392 CZ PHE B 333 16.769 -3.334 9.359 1.00 0.00 C ATOM 0 H PHE B 333 17.673 -3.098 15.947 1.00 0.00 H new ATOM 0 HA PHE B 333 17.929 -1.595 13.507 1.00 0.00 H new ATOM 0 HB2 PHE B 333 17.350 -4.178 14.041 1.00 0.00 H new ATOM 0 HB3 PHE B 333 15.705 -3.574 14.034 1.00 0.00 H new ATOM 0 HD1 PHE B 333 18.853 -3.056 12.035 1.00 0.00 H new ATOM 0 HD2 PHE B 333 14.600 -3.668 11.960 1.00 0.00 H new ATOM 0 HE1 PHE B 333 18.893 -3.023 9.559 1.00 0.00 H new ATOM 0 HE2 PHE B 333 14.641 -3.645 9.480 1.00 0.00 H new ATOM 0 HZ PHE B 333 16.787 -3.323 8.279 1.00 0.00 H new ATOM 2402 N ALA B 334 15.292 -1.188 15.446 1.00 0.00 N ATOM 2403 CA ALA B 334 14.145 -0.326 15.690 1.00 0.00 C ATOM 2404 C ALA B 334 14.600 1.118 15.835 1.00 0.00 C ATOM 2405 O ALA B 334 13.988 2.029 15.278 1.00 0.00 O ATOM 2406 CB ALA B 334 13.414 -0.767 16.961 1.00 0.00 C ATOM 0 H ALA B 334 15.464 -1.883 16.172 1.00 0.00 H new ATOM 0 HA ALA B 334 13.463 -0.403 14.843 1.00 0.00 H new ATOM 0 HB1 ALA B 334 12.558 -0.115 17.133 1.00 0.00 H new ATOM 0 HB2 ALA B 334 13.070 -1.795 16.845 1.00 0.00 H new ATOM 0 HB3 ALA B 334 14.093 -0.706 17.811 1.00 0.00 H new ATOM 2412 N LYS B 335 15.679 1.318 16.585 1.00 0.00 N ATOM 2413 CA LYS B 335 16.206 2.655 16.795 1.00 0.00 C ATOM 2414 C LYS B 335 16.721 3.214 15.478 1.00 0.00 C ATOM 2415 O LYS B 335 16.546 4.395 15.186 1.00 0.00 O ATOM 2416 CB LYS B 335 17.344 2.610 17.823 1.00 0.00 C ATOM 2417 CG LYS B 335 16.814 2.086 19.171 1.00 0.00 C ATOM 2418 CD LYS B 335 15.967 3.165 19.866 1.00 0.00 C ATOM 2419 CE LYS B 335 15.673 2.743 21.306 1.00 0.00 C ATOM 2420 NZ LYS B 335 14.820 3.777 21.961 1.00 0.00 N ATOM 0 H LYS B 335 16.200 0.576 17.053 1.00 0.00 H new ATOM 0 HA LYS B 335 15.412 3.299 17.172 1.00 0.00 H new ATOM 0 HB2 LYS B 335 18.146 1.966 17.463 1.00 0.00 H new ATOM 0 HB3 LYS B 335 17.769 3.606 17.952 1.00 0.00 H new ATOM 0 HG2 LYS B 335 16.214 1.190 19.010 1.00 0.00 H new ATOM 0 HG3 LYS B 335 17.648 1.800 19.811 1.00 0.00 H new ATOM 0 HD2 LYS B 335 16.496 4.118 19.857 1.00 0.00 H new ATOM 0 HD3 LYS B 335 15.034 3.314 19.323 1.00 0.00 H new ATOM 0 HE2 LYS B 335 15.167 1.778 21.318 1.00 0.00 H new ATOM 0 HE3 LYS B 335 16.605 2.621 21.858 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 14.619 3.492 22.941 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 15.319 4.689 21.962 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 13.926 3.872 21.438 1.00 0.00 H new ATOM 2434 N GLN B 336 17.352 2.353 14.684 1.00 0.00 N ATOM 2435 CA GLN B 336 17.884 2.773 13.398 1.00 0.00 C ATOM 2436 C GLN B 336 16.759 3.276 12.497 1.00 0.00 C ATOM 2437 O GLN B 336 16.904 4.291 11.817 1.00 0.00 O ATOM 2438 CB GLN B 336 18.605 1.596 12.719 1.00 0.00 C ATOM 2439 CG GLN B 336 19.218 2.058 11.394 1.00 0.00 C ATOM 2440 CD GLN B 336 20.283 3.117 11.653 1.00 0.00 C ATOM 2441 OE1 GLN B 336 21.235 2.875 12.395 1.00 0.00 O ATOM 2442 NE2 GLN B 336 20.179 4.288 11.083 1.00 0.00 N ATOM 0 H GLN B 336 17.505 1.370 14.909 1.00 0.00 H new ATOM 0 HA GLN B 336 18.594 3.584 13.562 1.00 0.00 H new ATOM 0 HB2 GLN B 336 19.384 1.208 13.375 1.00 0.00 H new ATOM 0 HB3 GLN B 336 17.903 0.781 12.541 1.00 0.00 H new ATOM 0 HG2 GLN B 336 19.658 1.208 10.872 1.00 0.00 H new ATOM 0 HG3 GLN B 336 18.441 2.463 10.746 1.00 0.00 H new ATOM 0 HE21 GLN B 336 19.390 4.488 10.468 1.00 0.00 H new ATOM 0 HE22 GLN B 336 20.887 5.002 11.253 1.00 0.00 H new ATOM 2451 N ASN B 337 15.644 2.556 12.492 1.00 0.00 N ATOM 2452 CA ASN B 337 14.504 2.939 11.669 1.00 0.00 C ATOM 2453 C ASN B 337 13.757 4.117 12.290 1.00 0.00 C ATOM 2454 O ASN B 337 13.104 4.889 11.599 1.00 0.00 O ATOM 2455 CB ASN B 337 13.550 1.752 11.514 1.00 0.00 C ATOM 2456 CG ASN B 337 14.194 0.678 10.642 1.00 0.00 C ATOM 2457 OD1 ASN B 337 14.296 0.843 9.426 1.00 0.00 O ATOM 2458 ND2 ASN B 337 14.634 -0.419 11.193 1.00 0.00 N ATOM 0 H ASN B 337 15.505 1.710 13.044 1.00 0.00 H new ATOM 0 HA ASN B 337 14.876 3.239 10.689 1.00 0.00 H new ATOM 0 HB2 ASN B 337 13.306 1.340 12.493 1.00 0.00 H new ATOM 0 HB3 ASN B 337 12.613 2.083 11.066 1.00 0.00 H new ATOM 0 HD21 ASN B 337 15.064 -1.142 10.617 1.00 0.00 H new ATOM 0 HD22 ASN B 337 14.548 -0.554 12.200 1.00 0.00 H new ATOM 2465 N GLU B 338 13.854 4.246 13.602 1.00 0.00 N ATOM 2466 CA GLU B 338 13.177 5.329 14.303 1.00 0.00 C ATOM 2467 C GLU B 338 13.771 6.685 13.922 1.00 0.00 C ATOM 2468 O GLU B 338 13.051 7.677 13.781 1.00 0.00 O ATOM 2469 CB GLU B 338 13.299 5.125 15.819 1.00 0.00 C ATOM 2470 CG GLU B 338 12.440 6.163 16.553 1.00 0.00 C ATOM 2471 CD GLU B 338 10.962 5.907 16.275 1.00 0.00 C ATOM 2472 OE1 GLU B 338 10.637 4.792 15.899 1.00 0.00 O ATOM 2473 OE2 GLU B 338 10.180 6.827 16.440 1.00 0.00 O ATOM 0 H GLU B 338 14.391 3.620 14.202 1.00 0.00 H new ATOM 0 HA GLU B 338 12.126 5.317 14.013 1.00 0.00 H new ATOM 0 HB2 GLU B 338 12.978 4.118 16.087 1.00 0.00 H new ATOM 0 HB3 GLU B 338 14.341 5.219 16.125 1.00 0.00 H new ATOM 0 HG2 GLU B 338 12.631 6.113 17.625 1.00 0.00 H new ATOM 0 HG3 GLU B 338 12.711 7.167 16.228 1.00 0.00 H new