USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 943 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 61 TYR OH : rot -26:sc= -0.816 USER MOD Set 1.2: C 230 ASN : amide:sc= 1.43 K(o=0.61,f=-1.9) USER MOD Set 2.1: A 30 ASN :FLIP amide:sc= 0.733 F(o=-0.57,f=0.39) USER MOD Set 2.2: C 261 TYR OH : rot 16:sc= -0.345 USER MOD Single : A 16 SER OG : rot -43:sc= 1.07 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -2.89! X(o=-2.9!,f=-2.6) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.0348 X(o=-0.035,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot -120:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.199 K(o=-0.2,f=-1.2) USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -1.29 K(o=-1.3,f=-4.4!) USER MOD Single : A 43 LYS NZ :NH3+ 166:sc= -0.0198 (180deg=-0.23) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 54 LYS NZ :NH3+ 150:sc= -0.185 (180deg=-1.79!) USER MOD Single : A 56 LYS NZ :NH3+ 175:sc= 1.19 (180deg=1.11) USER MOD Single : A 59 GLN : amide:sc= -0.198 X(o=-0.2,f=-0.16) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.463 X(o=-0.46,f=-0.003) USER MOD Single : C 216 SER OG : rot -49:sc= 0.409 USER MOD Single : C 217 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : C 222 ASN : amide:sc= -4.1! C(o=-4.1!,f=-4!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HE2:sc= -1.9 X(o=-1.9,f=-2.2!) USER MOD Single : C 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 231 THR OG1 : rot 68:sc= -0.513 USER MOD Single : C 233 ASN : amide:sc= -0.0308 X(o=-0.031,f=-0.25) USER MOD Single : C 234 CYS SG : rot 180:sc= 0 USER MOD Single : C 237 GLN : amide:sc= -0.367 K(o=-0.37,f=-1.1) USER MOD Single : C 243 LYS NZ :NH3+ 168:sc= -0.0183 (180deg=-0.194) USER MOD Single : C 248 GLN : amide:sc= 0.991 K(o=0.99,f=-5.3!) USER MOD Single : C 254 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 1.32 (180deg=1.32) USER MOD Single : C 259 GLN :FLIP amide:sc= -0.367 F(o=-1.9,f=-0.37) USER MOD Single : C 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 267 ASN :FLIP amide:sc= -0.0126 F(o=-0.69,f=-0.013) USER MOD Single : C 268 LYS NZ :NH3+ -164:sc= -0.048 (180deg=-0.326) USER MOD ----------------------------------------------------------------- ATOM 163 N CYS A 11 0.638 1.520 -14.226 1.00 25.24 N ATOM 164 CA CYS A 11 -0.649 2.035 -14.597 1.00 24.15 C ATOM 165 C CYS A 11 -0.516 3.290 -15.414 1.00 14.43 C ATOM 166 O CYS A 11 0.036 4.280 -14.951 1.00 32.21 O ATOM 167 CB CYS A 11 -1.458 2.311 -13.343 1.00 13.34 C ATOM 168 SG CYS A 11 -1.573 0.879 -12.236 1.00 72.35 S ATOM 0 HA CYS A 11 -1.160 1.292 -15.209 1.00 24.15 H new ATOM 0 HB2 CYS A 11 -1.007 3.144 -12.803 1.00 13.34 H new ATOM 0 HB3 CYS A 11 -2.463 2.623 -13.628 1.00 13.34 H new ATOM 173 N ARG A 12 -0.993 3.238 -16.644 1.00 40.31 N ATOM 174 CA ARG A 12 -1.010 4.418 -17.504 1.00 70.33 C ATOM 175 C ARG A 12 -2.338 5.141 -17.315 1.00 60.14 C ATOM 176 O ARG A 12 -2.519 6.278 -17.744 1.00 12.45 O ATOM 177 CB ARG A 12 -0.857 4.025 -18.973 1.00 11.10 C ATOM 178 CG ARG A 12 0.415 3.271 -19.312 1.00 1.24 C ATOM 179 CD ARG A 12 0.476 2.986 -20.801 1.00 40.50 C ATOM 180 NE ARG A 12 1.660 2.217 -21.187 1.00 63.54 N ATOM 181 CZ ARG A 12 2.132 2.125 -22.440 1.00 54.52 C ATOM 182 NH1 ARG A 12 1.582 2.843 -23.420 1.00 64.31 N ATOM 183 NH2 ARG A 12 3.164 1.335 -22.701 1.00 74.53 N ATOM 0 H ARG A 12 -1.374 2.395 -17.074 1.00 40.31 H new ATOM 0 HA ARG A 12 -0.177 5.066 -17.232 1.00 70.33 H new ATOM 0 HB2 ARG A 12 -1.711 3.411 -19.259 1.00 11.10 H new ATOM 0 HB3 ARG A 12 -0.897 4.929 -19.580 1.00 11.10 H new ATOM 0 HG2 ARG A 12 1.284 3.856 -19.011 1.00 1.24 H new ATOM 0 HG3 ARG A 12 0.451 2.335 -18.754 1.00 1.24 H new ATOM 0 HD2 ARG A 12 -0.419 2.439 -21.098 1.00 40.50 H new ATOM 0 HD3 ARG A 12 0.468 3.930 -21.347 1.00 40.50 H new ATOM 0 HE ARG A 12 2.161 1.716 -20.453 1.00 63.54 H new ATOM 0 HH11 ARG A 12 0.799 3.465 -23.219 1.00 64.31 H new ATOM 0 HH12 ARG A 12 1.944 2.770 -24.371 1.00 64.31 H new ATOM 0 HH21 ARG A 12 3.598 0.798 -21.950 1.00 74.53 H new ATOM 0 HH22 ARG A 12 3.524 1.264 -23.653 1.00 74.53 H new ATOM 197 N PHE A 13 -3.248 4.455 -16.664 1.00 75.35 N ATOM 198 CA PHE A 13 -4.572 4.938 -16.388 1.00 4.41 C ATOM 199 C PHE A 13 -4.889 4.594 -14.955 1.00 53.45 C ATOM 200 O PHE A 13 -4.291 3.661 -14.401 1.00 33.23 O ATOM 201 CB PHE A 13 -5.596 4.257 -17.325 1.00 42.05 C ATOM 202 CG PHE A 13 -5.679 2.744 -17.176 1.00 15.15 C ATOM 203 CD1 PHE A 13 -4.815 1.910 -17.868 1.00 14.14 C ATOM 204 CD2 PHE A 13 -6.622 2.167 -16.333 1.00 72.34 C ATOM 205 CE1 PHE A 13 -4.889 0.537 -17.724 1.00 32.13 C ATOM 206 CE2 PHE A 13 -6.698 0.799 -16.186 1.00 14.25 C ATOM 207 CZ PHE A 13 -5.830 -0.017 -16.881 1.00 42.12 C ATOM 0 H PHE A 13 -3.077 3.517 -16.302 1.00 75.35 H new ATOM 0 HA PHE A 13 -4.625 6.014 -16.551 1.00 4.41 H new ATOM 0 HB2 PHE A 13 -6.582 4.683 -17.136 1.00 42.05 H new ATOM 0 HB3 PHE A 13 -5.339 4.494 -18.357 1.00 42.05 H new ATOM 0 HD1 PHE A 13 -4.075 2.338 -18.528 1.00 14.14 H new ATOM 0 HD2 PHE A 13 -7.305 2.800 -15.786 1.00 72.34 H new ATOM 0 HE1 PHE A 13 -4.211 -0.101 -18.271 1.00 32.13 H new ATOM 0 HE2 PHE A 13 -7.436 0.366 -15.527 1.00 14.25 H new ATOM 0 HZ PHE A 13 -5.887 -1.089 -16.765 1.00 42.12 H new ATOM 217 N PHE A 14 -5.792 5.316 -14.354 1.00 23.02 N ATOM 218 CA PHE A 14 -6.165 5.038 -12.994 1.00 23.34 C ATOM 219 C PHE A 14 -7.679 5.106 -12.866 1.00 31.31 C ATOM 220 O PHE A 14 -8.337 5.808 -13.641 1.00 60.24 O ATOM 221 CB PHE A 14 -5.500 6.013 -12.010 1.00 25.35 C ATOM 222 CG PHE A 14 -6.124 7.376 -11.949 1.00 52.33 C ATOM 223 CD1 PHE A 14 -5.782 8.372 -12.845 1.00 31.51 C ATOM 224 CD2 PHE A 14 -7.065 7.651 -10.968 1.00 24.44 C ATOM 225 CE1 PHE A 14 -6.376 9.617 -12.759 1.00 44.14 C ATOM 226 CE2 PHE A 14 -7.654 8.875 -10.874 1.00 43.15 C ATOM 227 CZ PHE A 14 -7.314 9.866 -11.768 1.00 14.20 C ATOM 0 H PHE A 14 -6.283 6.100 -14.782 1.00 23.02 H new ATOM 0 HA PHE A 14 -5.817 4.037 -12.740 1.00 23.34 H new ATOM 0 HB2 PHE A 14 -5.526 5.573 -11.013 1.00 25.35 H new ATOM 0 HB3 PHE A 14 -4.451 6.122 -12.283 1.00 25.35 H new ATOM 0 HD1 PHE A 14 -5.049 8.177 -13.614 1.00 31.51 H new ATOM 0 HD2 PHE A 14 -7.336 6.878 -10.264 1.00 24.44 H new ATOM 0 HE1 PHE A 14 -6.111 10.393 -13.461 1.00 44.14 H new ATOM 0 HE2 PHE A 14 -8.384 9.068 -10.102 1.00 43.15 H new ATOM 0 HZ PHE A 14 -7.778 10.838 -11.697 1.00 14.20 H new ATOM 237 N GLU A 15 -8.221 4.379 -11.939 1.00 24.44 N ATOM 238 CA GLU A 15 -9.624 4.402 -11.681 1.00 3.11 C ATOM 239 C GLU A 15 -9.917 5.531 -10.701 1.00 21.41 C ATOM 240 O GLU A 15 -9.249 5.664 -9.682 1.00 71.34 O ATOM 241 CB GLU A 15 -10.067 3.043 -11.121 1.00 51.21 C ATOM 242 CG GLU A 15 -11.529 2.962 -10.712 1.00 61.43 C ATOM 243 CD GLU A 15 -12.472 3.319 -11.829 1.00 41.05 C ATOM 244 OE1 GLU A 15 -12.827 2.446 -12.633 1.00 54.04 O ATOM 245 OE2 GLU A 15 -12.871 4.485 -11.917 1.00 72.45 O ATOM 0 H GLU A 15 -7.695 3.747 -11.335 1.00 24.44 H new ATOM 0 HA GLU A 15 -10.182 4.580 -12.600 1.00 3.11 H new ATOM 0 HB2 GLU A 15 -9.872 2.277 -11.872 1.00 51.21 H new ATOM 0 HB3 GLU A 15 -9.449 2.805 -10.255 1.00 51.21 H new ATOM 0 HG2 GLU A 15 -11.749 1.952 -10.367 1.00 61.43 H new ATOM 0 HG3 GLU A 15 -11.703 3.631 -9.869 1.00 61.43 H new ATOM 252 N SER A 16 -10.891 6.340 -11.018 1.00 22.32 N ATOM 253 CA SER A 16 -11.245 7.455 -10.178 1.00 3.15 C ATOM 254 C SER A 16 -12.374 7.060 -9.238 1.00 41.32 C ATOM 255 O SER A 16 -12.614 7.718 -8.206 1.00 52.45 O ATOM 256 CB SER A 16 -11.661 8.632 -11.048 1.00 55.04 C ATOM 257 OG SER A 16 -10.638 8.928 -11.984 1.00 25.20 O ATOM 0 H SER A 16 -11.459 6.247 -11.860 1.00 22.32 H new ATOM 0 HA SER A 16 -10.384 7.746 -9.577 1.00 3.15 H new ATOM 0 HB2 SER A 16 -12.588 8.398 -11.572 1.00 55.04 H new ATOM 0 HB3 SER A 16 -11.858 9.504 -10.424 1.00 55.04 H new ATOM 0 HG SER A 16 -9.766 8.885 -11.540 1.00 25.20 H new ATOM 263 N HIS A 17 -13.060 5.984 -9.583 1.00 72.10 N ATOM 264 CA HIS A 17 -14.156 5.498 -8.795 1.00 15.14 C ATOM 265 C HIS A 17 -13.652 4.587 -7.683 1.00 23.44 C ATOM 266 O HIS A 17 -13.677 3.363 -7.797 1.00 72.50 O ATOM 267 CB HIS A 17 -15.213 4.802 -9.686 1.00 73.23 C ATOM 268 CG HIS A 17 -16.425 4.287 -8.962 1.00 54.10 C ATOM 269 ND1 HIS A 17 -17.420 5.101 -8.492 1.00 62.25 N ATOM 270 CD2 HIS A 17 -16.791 3.030 -8.635 1.00 2.51 C ATOM 271 CE1 HIS A 17 -18.342 4.375 -7.907 1.00 25.42 C ATOM 272 NE2 HIS A 17 -17.987 3.118 -7.980 1.00 62.22 N ATOM 0 H HIS A 17 -12.866 5.431 -10.417 1.00 72.10 H new ATOM 0 HA HIS A 17 -14.649 6.347 -8.322 1.00 15.14 H new ATOM 0 HB2 HIS A 17 -15.539 5.506 -10.451 1.00 73.23 H new ATOM 0 HB3 HIS A 17 -14.737 3.968 -10.202 1.00 73.23 H new ATOM 0 HD2 HIS A 17 -16.242 2.125 -8.850 1.00 2.51 H new ATOM 0 HE1 HIS A 17 -19.242 4.751 -7.443 1.00 25.42 H new ATOM 0 HE2 HIS A 17 -18.518 2.330 -7.608 1.00 62.22 H new ATOM 281 N VAL A 18 -13.137 5.197 -6.649 1.00 0.04 N ATOM 282 CA VAL A 18 -12.648 4.480 -5.511 1.00 3.10 C ATOM 283 C VAL A 18 -13.076 5.181 -4.230 1.00 2.34 C ATOM 284 O VAL A 18 -12.885 6.398 -4.072 1.00 32.30 O ATOM 285 CB VAL A 18 -11.095 4.279 -5.537 1.00 15.23 C ATOM 286 CG1 VAL A 18 -10.354 5.611 -5.604 1.00 63.15 C ATOM 287 CG2 VAL A 18 -10.656 3.474 -4.319 1.00 24.43 C ATOM 0 H VAL A 18 -13.046 6.210 -6.576 1.00 0.04 H new ATOM 0 HA VAL A 18 -13.089 3.484 -5.547 1.00 3.10 H new ATOM 0 HB VAL A 18 -10.840 3.725 -6.440 1.00 15.23 H new ATOM 0 HG11 VAL A 18 -9.279 5.429 -5.620 1.00 63.15 H new ATOM 0 HG12 VAL A 18 -10.646 6.144 -6.509 1.00 63.15 H new ATOM 0 HG13 VAL A 18 -10.607 6.212 -4.731 1.00 63.15 H new ATOM 0 HG21 VAL A 18 -9.575 3.338 -4.343 1.00 24.43 H new ATOM 0 HG22 VAL A 18 -10.934 4.008 -3.410 1.00 24.43 H new ATOM 0 HG23 VAL A 18 -11.145 2.500 -4.331 1.00 24.43 H new ATOM 297 N ALA A 19 -13.687 4.445 -3.355 1.00 35.25 N ATOM 298 CA ALA A 19 -14.107 4.980 -2.095 1.00 51.24 C ATOM 299 C ALA A 19 -13.330 4.324 -0.972 1.00 12.21 C ATOM 300 O ALA A 19 -13.097 3.115 -0.987 1.00 24.32 O ATOM 301 CB ALA A 19 -15.603 4.783 -1.904 1.00 61.44 C ATOM 0 H ALA A 19 -13.909 3.459 -3.492 1.00 35.25 H new ATOM 0 HA ALA A 19 -13.904 6.051 -2.080 1.00 51.24 H new ATOM 0 HB1 ALA A 19 -15.904 5.196 -0.941 1.00 61.44 H new ATOM 0 HB2 ALA A 19 -16.142 5.293 -2.702 1.00 61.44 H new ATOM 0 HB3 ALA A 19 -15.836 3.719 -1.932 1.00 61.44 H new ATOM 307 N ARG A 20 -12.942 5.121 -0.001 1.00 24.53 N ATOM 308 CA ARG A 20 -12.174 4.663 1.172 1.00 73.43 C ATOM 309 C ARG A 20 -13.003 3.679 2.024 1.00 14.53 C ATOM 310 O ARG A 20 -12.465 2.882 2.781 1.00 24.43 O ATOM 311 CB ARG A 20 -11.752 5.892 1.989 1.00 35.13 C ATOM 312 CG ARG A 20 -10.976 5.609 3.262 1.00 43.00 C ATOM 313 CD ARG A 20 -10.590 6.910 3.948 1.00 13.33 C ATOM 314 NE ARG A 20 -10.001 6.693 5.274 1.00 75.24 N ATOM 315 CZ ARG A 20 -9.532 7.662 6.084 1.00 21.04 C ATOM 316 NH1 ARG A 20 -9.525 8.936 5.681 1.00 12.12 N ATOM 317 NH2 ARG A 20 -9.087 7.355 7.299 1.00 4.04 N ATOM 0 H ARG A 20 -13.146 6.120 0.011 1.00 24.53 H new ATOM 0 HA ARG A 20 -11.285 4.125 0.844 1.00 73.43 H new ATOM 0 HB2 ARG A 20 -11.145 6.536 1.353 1.00 35.13 H new ATOM 0 HB3 ARG A 20 -12.648 6.455 2.251 1.00 35.13 H new ATOM 0 HG2 ARG A 20 -11.579 5.000 3.936 1.00 43.00 H new ATOM 0 HG3 ARG A 20 -10.080 5.034 3.029 1.00 43.00 H new ATOM 0 HD2 ARG A 20 -9.879 7.450 3.322 1.00 13.33 H new ATOM 0 HD3 ARG A 20 -11.473 7.542 4.045 1.00 13.33 H new ATOM 0 HE ARG A 20 -9.942 5.732 5.610 1.00 75.24 H new ATOM 0 HH11 ARG A 20 -9.876 9.180 4.755 1.00 12.12 H new ATOM 0 HH12 ARG A 20 -9.168 9.665 6.299 1.00 12.12 H new ATOM 0 HH21 ARG A 20 -9.101 6.386 7.617 1.00 4.04 H new ATOM 0 HH22 ARG A 20 -8.732 8.088 7.912 1.00 4.04 H new ATOM 331 N ALA A 21 -14.295 3.743 1.887 1.00 40.42 N ATOM 332 CA ALA A 21 -15.165 2.820 2.576 1.00 55.43 C ATOM 333 C ALA A 21 -15.254 1.482 1.826 1.00 41.34 C ATOM 334 O ALA A 21 -15.661 0.461 2.396 1.00 32.12 O ATOM 335 CB ALA A 21 -16.546 3.428 2.755 1.00 61.11 C ATOM 0 H ALA A 21 -14.777 4.426 1.303 1.00 40.42 H new ATOM 0 HA ALA A 21 -14.742 2.624 3.561 1.00 55.43 H new ATOM 0 HB1 ALA A 21 -17.190 2.720 3.276 1.00 61.11 H new ATOM 0 HB2 ALA A 21 -16.467 4.345 3.339 1.00 61.11 H new ATOM 0 HB3 ALA A 21 -16.973 3.656 1.778 1.00 61.11 H new ATOM 341 N ASN A 22 -14.853 1.473 0.559 1.00 55.23 N ATOM 342 CA ASN A 22 -14.961 0.295 -0.254 1.00 60.53 C ATOM 343 C ASN A 22 -13.624 -0.426 -0.322 1.00 63.14 C ATOM 344 O ASN A 22 -13.576 -1.614 -0.528 1.00 42.23 O ATOM 345 CB ASN A 22 -15.448 0.685 -1.652 1.00 11.22 C ATOM 346 CG ASN A 22 -15.701 -0.503 -2.564 1.00 75.12 C ATOM 347 OD1 ASN A 22 -16.028 -1.608 -2.119 1.00 70.00 O ATOM 348 ND2 ASN A 22 -15.577 -0.281 -3.829 1.00 63.43 N ATOM 0 H ASN A 22 -14.450 2.280 0.082 1.00 55.23 H new ATOM 0 HA ASN A 22 -15.684 -0.388 0.191 1.00 60.53 H new ATOM 0 HB2 ASN A 22 -16.368 1.262 -1.559 1.00 11.22 H new ATOM 0 HB3 ASN A 22 -14.708 1.337 -2.116 1.00 11.22 H new ATOM 0 HD21 ASN A 22 -15.751 -1.031 -4.498 1.00 63.43 H new ATOM 0 HD22 ASN A 22 -15.305 0.645 -4.160 1.00 63.43 H new ATOM 355 N VAL A 23 -12.542 0.304 -0.139 1.00 13.44 N ATOM 356 CA VAL A 23 -11.228 -0.277 -0.154 1.00 23.32 C ATOM 357 C VAL A 23 -11.033 -1.332 0.953 1.00 35.24 C ATOM 358 O VAL A 23 -11.522 -1.190 2.076 1.00 35.35 O ATOM 359 CB VAL A 23 -10.132 0.814 -0.083 1.00 40.52 C ATOM 360 CG1 VAL A 23 -10.198 1.701 -1.282 1.00 44.03 C ATOM 361 CG2 VAL A 23 -10.218 1.616 1.193 1.00 51.31 C ATOM 0 H VAL A 23 -12.555 1.311 0.023 1.00 13.44 H new ATOM 0 HA VAL A 23 -11.130 -0.799 -1.106 1.00 23.32 H new ATOM 0 HB VAL A 23 -9.165 0.311 -0.079 1.00 40.52 H new ATOM 0 HG11 VAL A 23 -9.420 2.462 -1.215 1.00 44.03 H new ATOM 0 HG12 VAL A 23 -10.047 1.107 -2.183 1.00 44.03 H new ATOM 0 HG13 VAL A 23 -11.175 2.183 -1.325 1.00 44.03 H new ATOM 0 HG21 VAL A 23 -9.431 2.370 1.202 1.00 51.31 H new ATOM 0 HG22 VAL A 23 -11.190 2.105 1.250 1.00 51.31 H new ATOM 0 HG23 VAL A 23 -10.095 0.952 2.049 1.00 51.31 H new ATOM 371 N LYS A 24 -10.383 -2.403 0.587 1.00 41.22 N ATOM 372 CA LYS A 24 -10.013 -3.471 1.507 1.00 32.24 C ATOM 373 C LYS A 24 -8.624 -3.180 1.982 1.00 74.20 C ATOM 374 O LYS A 24 -8.270 -3.385 3.147 1.00 25.21 O ATOM 375 CB LYS A 24 -9.959 -4.788 0.752 1.00 61.53 C ATOM 376 CG LYS A 24 -11.226 -5.147 0.050 1.00 3.01 C ATOM 377 CD LYS A 24 -11.032 -6.329 -0.879 1.00 22.10 C ATOM 378 CE LYS A 24 -10.663 -7.607 -0.140 1.00 63.24 C ATOM 379 NZ LYS A 24 -10.639 -8.786 -1.039 1.00 2.43 N ATOM 0 H LYS A 24 -10.085 -2.571 -0.374 1.00 41.22 H new ATOM 0 HA LYS A 24 -10.730 -3.532 2.326 1.00 32.24 H new ATOM 0 HB2 LYS A 24 -9.153 -4.741 0.020 1.00 61.53 H new ATOM 0 HB3 LYS A 24 -9.707 -5.585 1.452 1.00 61.53 H new ATOM 0 HG2 LYS A 24 -11.996 -5.383 0.785 1.00 3.01 H new ATOM 0 HG3 LYS A 24 -11.582 -4.289 -0.521 1.00 3.01 H new ATOM 0 HD2 LYS A 24 -11.949 -6.494 -1.445 1.00 22.10 H new ATOM 0 HD3 LYS A 24 -10.250 -6.093 -1.600 1.00 22.10 H new ATOM 0 HE2 LYS A 24 -9.684 -7.486 0.325 1.00 63.24 H new ATOM 0 HE3 LYS A 24 -11.379 -7.780 0.664 1.00 63.24 H new ATOM 0 HZ1 LYS A 24 -10.383 -9.634 -0.493 1.00 2.43 H new ATOM 0 HZ2 LYS A 24 -11.579 -8.918 -1.463 1.00 2.43 H new ATOM 0 HZ3 LYS A 24 -9.938 -8.634 -1.792 1.00 2.43 H new ATOM 393 N HIS A 25 -7.831 -2.722 1.041 1.00 54.24 N ATOM 394 CA HIS A 25 -6.454 -2.373 1.271 1.00 74.20 C ATOM 395 C HIS A 25 -5.910 -1.628 0.070 1.00 22.22 C ATOM 396 O HIS A 25 -6.514 -1.668 -1.013 1.00 34.22 O ATOM 397 CB HIS A 25 -5.573 -3.633 1.594 1.00 53.30 C ATOM 398 CG HIS A 25 -5.503 -4.682 0.519 1.00 62.32 C ATOM 399 ND1 HIS A 25 -6.358 -5.753 0.466 1.00 15.54 N ATOM 400 CD2 HIS A 25 -4.665 -4.827 -0.541 1.00 62.52 C ATOM 401 CE1 HIS A 25 -6.067 -6.499 -0.569 1.00 61.24 C ATOM 402 NE2 HIS A 25 -5.046 -5.964 -1.198 1.00 15.41 N ATOM 0 H HIS A 25 -8.134 -2.580 0.077 1.00 54.24 H new ATOM 0 HA HIS A 25 -6.411 -1.725 2.147 1.00 74.20 H new ATOM 0 HB2 HIS A 25 -4.559 -3.297 1.812 1.00 53.30 H new ATOM 0 HB3 HIS A 25 -5.957 -4.097 2.502 1.00 53.30 H new ATOM 0 HD2 HIS A 25 -3.853 -4.169 -0.813 1.00 62.52 H new ATOM 0 HE1 HIS A 25 -6.581 -7.404 -0.858 1.00 61.24 H new ATOM 0 HE2 HIS A 25 -4.608 -6.336 -2.041 1.00 15.41 H new ATOM 411 N LEU A 26 -4.783 -0.998 0.254 1.00 32.31 N ATOM 412 CA LEU A 26 -4.100 -0.278 -0.803 1.00 62.45 C ATOM 413 C LEU A 26 -2.823 -1.001 -1.100 1.00 71.31 C ATOM 414 O LEU A 26 -2.294 -1.695 -0.241 1.00 33.34 O ATOM 415 CB LEU A 26 -3.739 1.165 -0.386 1.00 70.43 C ATOM 416 CG LEU A 26 -4.863 2.137 -0.093 1.00 3.30 C ATOM 417 CD1 LEU A 26 -4.273 3.479 0.244 1.00 34.45 C ATOM 418 CD2 LEU A 26 -5.772 2.287 -1.282 1.00 75.35 C ATOM 0 H LEU A 26 -4.300 -0.965 1.152 1.00 32.31 H new ATOM 0 HA LEU A 26 -4.764 -0.229 -1.666 1.00 62.45 H new ATOM 0 HB2 LEU A 26 -3.112 1.106 0.504 1.00 70.43 H new ATOM 0 HB3 LEU A 26 -3.127 1.596 -1.179 1.00 70.43 H new ATOM 0 HG LEU A 26 -5.446 1.752 0.743 1.00 3.30 H new ATOM 0 HD11 LEU A 26 -5.075 4.186 0.457 1.00 34.45 H new ATOM 0 HD12 LEU A 26 -3.631 3.385 1.120 1.00 34.45 H new ATOM 0 HD13 LEU A 26 -3.685 3.840 -0.600 1.00 34.45 H new ATOM 0 HD21 LEU A 26 -6.570 2.990 -1.044 1.00 75.35 H new ATOM 0 HD22 LEU A 26 -5.201 2.661 -2.132 1.00 75.35 H new ATOM 0 HD23 LEU A 26 -6.205 1.319 -1.533 1.00 75.35 H new ATOM 430 N LYS A 27 -2.366 -0.888 -2.297 1.00 41.33 N ATOM 431 CA LYS A 27 -1.143 -1.492 -2.704 1.00 1.14 C ATOM 432 C LYS A 27 -0.286 -0.453 -3.411 1.00 4.12 C ATOM 433 O LYS A 27 -0.693 0.090 -4.417 1.00 13.03 O ATOM 434 CB LYS A 27 -1.437 -2.673 -3.630 1.00 74.43 C ATOM 435 CG LYS A 27 -0.208 -3.482 -3.971 1.00 44.11 C ATOM 436 CD LYS A 27 -0.532 -4.703 -4.814 1.00 2.00 C ATOM 437 CE LYS A 27 -1.013 -4.333 -6.214 1.00 45.02 C ATOM 438 NZ LYS A 27 -1.332 -5.524 -7.037 1.00 23.35 N ATOM 0 H LYS A 27 -2.838 -0.365 -3.035 1.00 41.33 H new ATOM 0 HA LYS A 27 -0.602 -1.864 -1.834 1.00 1.14 H new ATOM 0 HB2 LYS A 27 -2.172 -3.323 -3.156 1.00 74.43 H new ATOM 0 HB3 LYS A 27 -1.886 -2.301 -4.551 1.00 74.43 H new ATOM 0 HG2 LYS A 27 0.501 -2.851 -4.508 1.00 44.11 H new ATOM 0 HG3 LYS A 27 0.281 -3.799 -3.050 1.00 44.11 H new ATOM 0 HD2 LYS A 27 0.354 -5.333 -4.892 1.00 2.00 H new ATOM 0 HD3 LYS A 27 -1.299 -5.293 -4.313 1.00 2.00 H new ATOM 0 HE2 LYS A 27 -1.898 -3.702 -6.136 1.00 45.02 H new ATOM 0 HE3 LYS A 27 -0.245 -3.744 -6.715 1.00 45.02 H new ATOM 0 HZ1 LYS A 27 -1.654 -5.220 -7.978 1.00 23.35 H new ATOM 0 HZ2 LYS A 27 -0.482 -6.115 -7.136 1.00 23.35 H new ATOM 0 HZ3 LYS A 27 -2.084 -6.074 -6.575 1.00 23.35 H new ATOM 452 N ILE A 28 0.880 -0.173 -2.875 1.00 51.11 N ATOM 453 CA ILE A 28 1.785 0.796 -3.459 1.00 22.04 C ATOM 454 C ILE A 28 2.869 0.011 -4.171 1.00 74.14 C ATOM 455 O ILE A 28 3.620 -0.698 -3.526 1.00 4.41 O ATOM 456 CB ILE A 28 2.474 1.637 -2.359 1.00 31.53 C ATOM 457 CG1 ILE A 28 1.456 2.358 -1.468 1.00 0.13 C ATOM 458 CG2 ILE A 28 3.385 2.667 -3.009 1.00 25.11 C ATOM 459 CD1 ILE A 28 0.805 3.542 -2.117 1.00 43.31 C ATOM 0 H ILE A 28 1.230 -0.609 -2.022 1.00 51.11 H new ATOM 0 HA ILE A 28 1.232 1.459 -4.124 1.00 22.04 H new ATOM 0 HB ILE A 28 3.049 0.957 -1.731 1.00 31.53 H new ATOM 0 HG12 ILE A 28 0.683 1.649 -1.171 1.00 0.13 H new ATOM 0 HG13 ILE A 28 1.955 2.686 -0.556 1.00 0.13 H new ATOM 0 HG21 ILE A 28 3.872 3.261 -2.236 1.00 25.11 H new ATOM 0 HG22 ILE A 28 4.142 2.158 -3.606 1.00 25.11 H new ATOM 0 HG23 ILE A 28 2.795 3.321 -3.651 1.00 25.11 H new ATOM 0 HD11 ILE A 28 0.099 3.996 -1.421 1.00 43.31 H new ATOM 0 HD12 ILE A 28 1.567 4.272 -2.389 1.00 43.31 H new ATOM 0 HD13 ILE A 28 0.275 3.220 -3.013 1.00 43.31 H new ATOM 471 N LEU A 29 2.941 0.125 -5.466 1.00 42.13 N ATOM 472 CA LEU A 29 3.870 -0.663 -6.259 1.00 42.14 C ATOM 473 C LEU A 29 5.261 -0.056 -6.310 1.00 15.21 C ATOM 474 O LEU A 29 5.421 1.159 -6.490 1.00 51.32 O ATOM 475 CB LEU A 29 3.337 -0.950 -7.688 1.00 45.11 C ATOM 476 CG LEU A 29 2.089 -1.868 -7.822 1.00 23.42 C ATOM 477 CD1 LEU A 29 0.849 -1.260 -7.184 1.00 61.35 C ATOM 478 CD2 LEU A 29 1.829 -2.208 -9.279 1.00 71.11 C ATOM 0 H LEU A 29 2.362 0.764 -6.012 1.00 42.13 H new ATOM 0 HA LEU A 29 3.954 -1.619 -5.743 1.00 42.14 H new ATOM 0 HB2 LEU A 29 3.103 0.006 -8.157 1.00 45.11 H new ATOM 0 HB3 LEU A 29 4.146 -1.398 -8.264 1.00 45.11 H new ATOM 0 HG LEU A 29 2.309 -2.786 -7.278 1.00 23.42 H new ATOM 0 HD11 LEU A 29 0.006 -1.941 -7.305 1.00 61.35 H new ATOM 0 HD12 LEU A 29 1.031 -1.093 -6.122 1.00 61.35 H new ATOM 0 HD13 LEU A 29 0.620 -0.310 -7.667 1.00 61.35 H new ATOM 0 HD21 LEU A 29 0.952 -2.851 -9.352 1.00 71.11 H new ATOM 0 HD22 LEU A 29 1.654 -1.291 -9.841 1.00 71.11 H new ATOM 0 HD23 LEU A 29 2.694 -2.727 -9.692 1.00 71.11 H new ATOM 490 N ASN A 30 6.272 -0.901 -6.157 1.00 50.40 N ATOM 491 CA ASN A 30 7.650 -0.455 -6.211 1.00 72.12 C ATOM 492 C ASN A 30 8.029 -0.392 -7.639 1.00 54.42 C ATOM 493 O ASN A 30 8.164 -1.423 -8.317 1.00 15.41 O ATOM 494 CB ASN A 30 8.569 -1.424 -5.475 1.00 64.45 C ATOM 495 CG ASN A 30 9.978 -0.904 -5.285 1.00 30.34 C ATOM 496 OD1 ASN A 30 10.194 -0.243 -4.184 1.00 73.12 O flip ATOM 497 ND2 ASN A 30 10.865 -1.102 -6.128 1.00 24.43 N flip ATOM 0 H ASN A 30 6.159 -1.902 -5.994 1.00 50.40 H new ATOM 0 HA ASN A 30 7.749 0.518 -5.729 1.00 72.12 H new ATOM 0 HB2 ASN A 30 8.139 -1.647 -4.498 1.00 64.45 H new ATOM 0 HB3 ASN A 30 8.609 -2.363 -6.028 1.00 64.45 H new ATOM 0 HD21 ASN A 30 10.653 -1.625 -6.978 1.00 24.43 H new ATOM 0 HD22 ASN A 30 11.806 -0.742 -5.972 1.00 24.43 H new ATOM 504 N THR A 31 8.189 0.786 -8.101 1.00 0.43 N ATOM 505 CA THR A 31 8.382 1.026 -9.475 1.00 4.45 C ATOM 506 C THR A 31 9.767 1.675 -9.654 1.00 52.52 C ATOM 507 O THR A 31 10.231 2.375 -8.759 1.00 15.51 O ATOM 508 CB THR A 31 7.245 1.963 -9.925 1.00 14.04 C ATOM 509 OG1 THR A 31 6.003 1.467 -9.395 1.00 52.44 O ATOM 510 CG2 THR A 31 7.108 2.002 -11.416 1.00 52.14 C ATOM 0 H THR A 31 8.190 1.627 -7.524 1.00 0.43 H new ATOM 0 HA THR A 31 8.356 0.117 -10.076 1.00 4.45 H new ATOM 0 HB THR A 31 7.479 2.964 -9.563 1.00 14.04 H new ATOM 0 HG1 THR A 31 5.391 1.264 -10.133 1.00 52.44 H new ATOM 0 HG21 THR A 31 6.295 2.675 -11.689 1.00 52.14 H new ATOM 0 HG22 THR A 31 8.038 2.359 -11.858 1.00 52.14 H new ATOM 0 HG23 THR A 31 6.891 1.001 -11.788 1.00 52.14 H new ATOM 518 N PRO A 32 10.473 1.391 -10.755 1.00 24.22 N ATOM 519 CA PRO A 32 11.800 1.958 -11.015 1.00 23.25 C ATOM 520 C PRO A 32 11.834 3.497 -11.081 1.00 33.13 C ATOM 521 O PRO A 32 12.348 4.149 -10.164 1.00 11.43 O ATOM 522 CB PRO A 32 12.198 1.342 -12.358 1.00 53.22 C ATOM 523 CG PRO A 32 11.396 0.103 -12.431 1.00 44.53 C ATOM 524 CD PRO A 32 10.083 0.448 -11.809 1.00 73.10 C ATOM 0 HA PRO A 32 12.484 1.728 -10.198 1.00 23.25 H new ATOM 0 HB2 PRO A 32 11.974 2.013 -13.187 1.00 53.22 H new ATOM 0 HB3 PRO A 32 13.266 1.130 -12.399 1.00 53.22 H new ATOM 0 HG2 PRO A 32 11.269 -0.223 -13.463 1.00 44.53 H new ATOM 0 HG3 PRO A 32 11.883 -0.713 -11.896 1.00 44.53 H new ATOM 0 HD2 PRO A 32 9.400 0.901 -12.527 1.00 73.10 H new ATOM 0 HD3 PRO A 32 9.582 -0.431 -11.403 1.00 73.10 H new ATOM 532 N ASN A 33 11.253 4.086 -12.130 1.00 23.12 N ATOM 533 CA ASN A 33 11.351 5.546 -12.300 1.00 73.22 C ATOM 534 C ASN A 33 10.092 6.262 -11.777 1.00 73.31 C ATOM 535 O ASN A 33 9.923 7.470 -11.917 1.00 10.43 O ATOM 536 CB ASN A 33 11.638 5.919 -13.764 1.00 11.11 C ATOM 537 CG ASN A 33 12.063 7.376 -13.912 1.00 71.00 C ATOM 538 OD1 ASN A 33 12.686 7.952 -13.011 1.00 0.01 O ATOM 539 ND2 ASN A 33 11.740 7.980 -15.021 1.00 24.33 N ATOM 0 H ASN A 33 10.726 3.598 -12.854 1.00 23.12 H new ATOM 0 HA ASN A 33 12.194 5.889 -11.700 1.00 73.22 H new ATOM 0 HB2 ASN A 33 12.423 5.271 -14.156 1.00 11.11 H new ATOM 0 HB3 ASN A 33 10.747 5.739 -14.365 1.00 11.11 H new ATOM 0 HD21 ASN A 33 12.001 8.955 -15.165 1.00 24.33 H new ATOM 0 HD22 ASN A 33 11.226 7.477 -15.745 1.00 24.33 H new ATOM 546 N CYS A 34 9.236 5.517 -11.162 1.00 45.30 N ATOM 547 CA CYS A 34 8.057 6.065 -10.528 1.00 71.54 C ATOM 548 C CYS A 34 8.103 5.641 -9.090 1.00 40.43 C ATOM 549 O CYS A 34 8.421 4.498 -8.797 1.00 63.10 O ATOM 550 CB CYS A 34 6.770 5.575 -11.206 1.00 54.12 C ATOM 551 SG CYS A 34 6.569 6.101 -12.950 1.00 4.33 S ATOM 0 H CYS A 34 9.324 4.504 -11.078 1.00 45.30 H new ATOM 0 HA CYS A 34 8.049 7.151 -10.615 1.00 71.54 H new ATOM 0 HB2 CYS A 34 6.747 4.486 -11.165 1.00 54.12 H new ATOM 0 HB3 CYS A 34 5.915 5.934 -10.633 1.00 54.12 H new ATOM 0 HG CYS A 34 5.452 5.630 -13.419 1.00 4.33 H new ATOM 556 N ALA A 35 7.838 6.537 -8.198 1.00 71.25 N ATOM 557 CA ALA A 35 7.998 6.229 -6.805 1.00 73.24 C ATOM 558 C ALA A 35 6.702 5.814 -6.129 1.00 3.44 C ATOM 559 O ALA A 35 6.726 5.129 -5.111 1.00 21.30 O ATOM 560 CB ALA A 35 8.646 7.391 -6.092 1.00 74.33 C ATOM 0 H ALA A 35 7.512 7.482 -8.400 1.00 71.25 H new ATOM 0 HA ALA A 35 8.652 5.360 -6.740 1.00 73.24 H new ATOM 0 HB1 ALA A 35 8.764 7.150 -5.036 1.00 74.33 H new ATOM 0 HB2 ALA A 35 9.624 7.587 -6.531 1.00 74.33 H new ATOM 0 HB3 ALA A 35 8.018 8.276 -6.194 1.00 74.33 H new ATOM 566 N CYS A 36 5.582 6.203 -6.686 1.00 41.55 N ATOM 567 CA CYS A 36 4.322 5.872 -6.073 1.00 11.54 C ATOM 568 C CYS A 36 3.247 5.492 -7.094 1.00 43.44 C ATOM 569 O CYS A 36 2.694 6.349 -7.794 1.00 41.54 O ATOM 570 CB CYS A 36 3.839 7.012 -5.160 1.00 3.53 C ATOM 571 SG CYS A 36 2.236 6.693 -4.353 1.00 53.44 S ATOM 0 H CYS A 36 5.517 6.741 -7.550 1.00 41.55 H new ATOM 0 HA CYS A 36 4.495 4.987 -5.461 1.00 11.54 H new ATOM 0 HB2 CYS A 36 4.591 7.191 -4.391 1.00 3.53 H new ATOM 0 HB3 CYS A 36 3.761 7.926 -5.749 1.00 3.53 H new ATOM 576 N GLN A 37 3.008 4.198 -7.213 1.00 11.30 N ATOM 577 CA GLN A 37 1.921 3.658 -8.009 1.00 64.13 C ATOM 578 C GLN A 37 0.953 2.974 -7.054 1.00 23.02 C ATOM 579 O GLN A 37 1.347 2.071 -6.342 1.00 21.41 O ATOM 580 CB GLN A 37 2.446 2.658 -9.064 1.00 24.30 C ATOM 581 CG GLN A 37 3.412 3.261 -10.068 1.00 74.13 C ATOM 582 CD GLN A 37 2.866 4.481 -10.796 1.00 13.43 C ATOM 583 OE1 GLN A 37 3.623 5.355 -11.184 1.00 72.44 O ATOM 584 NE2 GLN A 37 1.569 4.561 -10.982 1.00 30.33 N ATOM 0 H GLN A 37 3.572 3.483 -6.753 1.00 11.30 H new ATOM 0 HA GLN A 37 1.421 4.459 -8.554 1.00 64.13 H new ATOM 0 HB2 GLN A 37 2.941 1.833 -8.551 1.00 24.30 H new ATOM 0 HB3 GLN A 37 1.597 2.236 -9.602 1.00 24.30 H new ATOM 0 HG2 GLN A 37 4.330 3.540 -9.551 1.00 74.13 H new ATOM 0 HG3 GLN A 37 3.678 2.501 -10.803 1.00 74.13 H new ATOM 0 HE21 GLN A 37 0.959 3.815 -10.647 1.00 30.33 H new ATOM 0 HE22 GLN A 37 1.171 5.369 -11.461 1.00 30.33 H new ATOM 593 N ILE A 38 -0.291 3.402 -7.021 1.00 34.23 N ATOM 594 CA ILE A 38 -1.219 2.901 -6.019 1.00 15.52 C ATOM 595 C ILE A 38 -2.356 2.081 -6.627 1.00 62.24 C ATOM 596 O ILE A 38 -2.913 2.427 -7.652 1.00 75.33 O ATOM 597 CB ILE A 38 -1.827 4.074 -5.220 1.00 1.21 C ATOM 598 CG1 ILE A 38 -0.719 5.030 -4.806 1.00 75.13 C ATOM 599 CG2 ILE A 38 -2.594 3.569 -3.987 1.00 65.42 C ATOM 600 CD1 ILE A 38 -1.154 6.109 -3.879 1.00 64.34 C ATOM 0 H ILE A 38 -0.684 4.087 -7.666 1.00 34.23 H new ATOM 0 HA ILE A 38 -0.643 2.248 -5.364 1.00 15.52 H new ATOM 0 HB ILE A 38 -2.539 4.599 -5.856 1.00 1.21 H new ATOM 0 HG12 ILE A 38 0.079 4.459 -4.331 1.00 75.13 H new ATOM 0 HG13 ILE A 38 -0.295 5.485 -5.701 1.00 75.13 H new ATOM 0 HG21 ILE A 38 -3.011 4.418 -3.445 1.00 65.42 H new ATOM 0 HG22 ILE A 38 -3.402 2.910 -4.306 1.00 65.42 H new ATOM 0 HG23 ILE A 38 -1.914 3.020 -3.335 1.00 65.42 H new ATOM 0 HD11 ILE A 38 -0.303 6.744 -3.635 1.00 64.34 H new ATOM 0 HD12 ILE A 38 -1.929 6.708 -4.357 1.00 64.34 H new ATOM 0 HD13 ILE A 38 -1.550 5.666 -2.965 1.00 64.34 H new ATOM 612 N VAL A 39 -2.666 1.004 -5.982 1.00 3.05 N ATOM 613 CA VAL A 39 -3.765 0.141 -6.324 1.00 2.34 C ATOM 614 C VAL A 39 -4.720 0.011 -5.151 1.00 63.14 C ATOM 615 O VAL A 39 -4.294 -0.102 -4.009 1.00 23.24 O ATOM 616 CB VAL A 39 -3.263 -1.266 -6.822 1.00 24.41 C ATOM 617 CG1 VAL A 39 -4.303 -2.350 -6.597 1.00 25.24 C ATOM 618 CG2 VAL A 39 -2.981 -1.200 -8.301 1.00 63.01 C ATOM 0 H VAL A 39 -2.143 0.682 -5.168 1.00 3.05 H new ATOM 0 HA VAL A 39 -4.307 0.594 -7.154 1.00 2.34 H new ATOM 0 HB VAL A 39 -2.366 -1.512 -6.254 1.00 24.41 H new ATOM 0 HG11 VAL A 39 -3.917 -3.305 -6.954 1.00 25.24 H new ATOM 0 HG12 VAL A 39 -4.527 -2.424 -5.533 1.00 25.24 H new ATOM 0 HG13 VAL A 39 -5.213 -2.100 -7.142 1.00 25.24 H new ATOM 0 HG21 VAL A 39 -2.633 -2.173 -8.649 1.00 63.01 H new ATOM 0 HG22 VAL A 39 -3.893 -0.929 -8.833 1.00 63.01 H new ATOM 0 HG23 VAL A 39 -2.213 -0.451 -8.492 1.00 63.01 H new ATOM 628 N ALA A 40 -5.991 0.057 -5.438 1.00 0.25 N ATOM 629 CA ALA A 40 -7.007 -0.119 -4.451 1.00 41.20 C ATOM 630 C ALA A 40 -7.721 -1.398 -4.730 1.00 63.23 C ATOM 631 O ALA A 40 -8.129 -1.650 -5.864 1.00 43.34 O ATOM 632 CB ALA A 40 -7.993 1.013 -4.498 1.00 55.31 C ATOM 0 H ALA A 40 -6.350 0.220 -6.379 1.00 0.25 H new ATOM 0 HA ALA A 40 -6.547 -0.140 -3.463 1.00 41.20 H new ATOM 0 HB1 ALA A 40 -8.759 0.860 -3.738 1.00 55.31 H new ATOM 0 HB2 ALA A 40 -7.476 1.954 -4.308 1.00 55.31 H new ATOM 0 HB3 ALA A 40 -8.460 1.048 -5.482 1.00 55.31 H new ATOM 638 N ARG A 41 -7.867 -2.220 -3.749 1.00 52.43 N ATOM 639 CA ARG A 41 -8.598 -3.414 -3.958 1.00 43.24 C ATOM 640 C ARG A 41 -9.891 -3.223 -3.226 1.00 21.01 C ATOM 641 O ARG A 41 -9.877 -2.885 -2.036 1.00 3.24 O ATOM 642 CB ARG A 41 -7.851 -4.620 -3.451 1.00 52.11 C ATOM 643 CG ARG A 41 -8.145 -5.854 -4.272 1.00 61.42 C ATOM 644 CD ARG A 41 -7.504 -7.052 -3.673 1.00 51.00 C ATOM 645 NE ARG A 41 -7.753 -8.280 -4.432 1.00 44.11 N ATOM 646 CZ ARG A 41 -6.792 -9.128 -4.843 1.00 51.14 C ATOM 647 NH1 ARG A 41 -5.515 -8.799 -4.714 1.00 72.43 N ATOM 648 NH2 ARG A 41 -7.115 -10.284 -5.406 1.00 20.34 N ATOM 0 H ARG A 41 -7.495 -2.088 -2.808 1.00 52.43 H new ATOM 0 HA ARG A 41 -8.761 -3.600 -5.020 1.00 43.24 H new ATOM 0 HB2 ARG A 41 -6.780 -4.418 -3.471 1.00 52.11 H new ATOM 0 HB3 ARG A 41 -8.122 -4.803 -2.411 1.00 52.11 H new ATOM 0 HG2 ARG A 41 -9.223 -6.006 -4.335 1.00 61.42 H new ATOM 0 HG3 ARG A 41 -7.783 -5.713 -5.290 1.00 61.42 H new ATOM 0 HD2 ARG A 41 -6.429 -6.886 -3.606 1.00 51.00 H new ATOM 0 HD3 ARG A 41 -7.871 -7.181 -2.655 1.00 51.00 H new ATOM 0 HE ARG A 41 -8.720 -8.508 -4.665 1.00 44.11 H new ATOM 0 HH11 ARG A 41 -5.259 -7.902 -4.303 1.00 72.43 H new ATOM 0 HH12 ARG A 41 -4.788 -9.443 -5.026 1.00 72.43 H new ATOM 0 HH21 ARG A 41 -8.096 -10.535 -5.530 1.00 20.34 H new ATOM 0 HH22 ARG A 41 -6.383 -10.923 -5.716 1.00 20.34 H new ATOM 662 N LEU A 42 -10.981 -3.418 -3.893 1.00 12.15 N ATOM 663 CA LEU A 42 -12.261 -3.020 -3.347 1.00 52.41 C ATOM 664 C LEU A 42 -13.041 -4.203 -2.818 1.00 55.31 C ATOM 665 O LEU A 42 -12.928 -5.329 -3.332 1.00 54.41 O ATOM 666 CB LEU A 42 -13.068 -2.262 -4.396 1.00 53.34 C ATOM 667 CG LEU A 42 -12.310 -1.143 -5.124 1.00 32.13 C ATOM 668 CD1 LEU A 42 -13.171 -0.517 -6.202 1.00 13.03 C ATOM 669 CD2 LEU A 42 -11.839 -0.086 -4.142 1.00 13.54 C ATOM 0 H LEU A 42 -11.023 -3.849 -4.817 1.00 12.15 H new ATOM 0 HA LEU A 42 -12.071 -2.358 -2.502 1.00 52.41 H new ATOM 0 HB2 LEU A 42 -13.430 -2.975 -5.137 1.00 53.34 H new ATOM 0 HB3 LEU A 42 -13.945 -1.830 -3.914 1.00 53.34 H new ATOM 0 HG LEU A 42 -11.435 -1.586 -5.601 1.00 32.13 H new ATOM 0 HD11 LEU A 42 -12.611 0.273 -6.702 1.00 13.03 H new ATOM 0 HD12 LEU A 42 -13.454 -1.278 -6.929 1.00 13.03 H new ATOM 0 HD13 LEU A 42 -14.069 -0.095 -5.751 1.00 13.03 H new ATOM 0 HD21 LEU A 42 -11.304 0.697 -4.679 1.00 13.54 H new ATOM 0 HD22 LEU A 42 -12.700 0.346 -3.632 1.00 13.54 H new ATOM 0 HD23 LEU A 42 -11.174 -0.542 -3.408 1.00 13.54 H new ATOM 681 N LYS A 43 -13.817 -3.934 -1.793 1.00 72.25 N ATOM 682 CA LYS A 43 -14.619 -4.904 -1.089 1.00 4.31 C ATOM 683 C LYS A 43 -15.659 -5.499 -2.019 1.00 20.35 C ATOM 684 O LYS A 43 -15.667 -6.710 -2.262 1.00 3.55 O ATOM 685 CB LYS A 43 -15.294 -4.210 0.094 1.00 4.53 C ATOM 686 CG LYS A 43 -16.083 -5.111 1.007 1.00 45.12 C ATOM 687 CD LYS A 43 -16.749 -4.297 2.097 1.00 25.33 C ATOM 688 CE LYS A 43 -17.479 -5.179 3.086 1.00 21.35 C ATOM 689 NZ LYS A 43 -16.554 -6.048 3.842 1.00 53.44 N ATOM 0 H LYS A 43 -13.909 -2.992 -1.412 1.00 72.25 H new ATOM 0 HA LYS A 43 -13.988 -5.716 -0.727 1.00 4.31 H new ATOM 0 HB2 LYS A 43 -14.528 -3.705 0.683 1.00 4.53 H new ATOM 0 HB3 LYS A 43 -15.960 -3.438 -0.291 1.00 4.53 H new ATOM 0 HG2 LYS A 43 -16.837 -5.651 0.434 1.00 45.12 H new ATOM 0 HG3 LYS A 43 -15.425 -5.858 1.451 1.00 45.12 H new ATOM 0 HD2 LYS A 43 -15.997 -3.707 2.621 1.00 25.33 H new ATOM 0 HD3 LYS A 43 -17.451 -3.594 1.649 1.00 25.33 H new ATOM 0 HE2 LYS A 43 -18.041 -4.556 3.782 1.00 21.35 H new ATOM 0 HE3 LYS A 43 -18.204 -5.796 2.555 1.00 21.35 H new ATOM 0 HZ1 LYS A 43 -17.051 -6.456 4.659 1.00 53.44 H new ATOM 0 HZ2 LYS A 43 -16.215 -6.814 3.225 1.00 53.44 H new ATOM 0 HZ3 LYS A 43 -15.744 -5.487 4.174 1.00 53.44 H new ATOM 745 N ARG A 47 -13.455 -5.429 -7.732 1.00 34.30 N ATOM 746 CA ARG A 47 -12.379 -6.284 -7.243 1.00 3.31 C ATOM 747 C ARG A 47 -11.087 -5.565 -6.970 1.00 1.10 C ATOM 748 O ARG A 47 -10.772 -5.280 -5.831 1.00 0.04 O ATOM 749 CB ARG A 47 -12.213 -7.539 -8.093 1.00 71.02 C ATOM 750 CG ARG A 47 -13.457 -8.411 -8.072 1.00 25.34 C ATOM 751 CD ARG A 47 -13.307 -9.657 -8.909 1.00 72.22 C ATOM 752 NE ARG A 47 -14.534 -10.452 -8.878 1.00 10.22 N ATOM 753 CZ ARG A 47 -14.675 -11.686 -9.359 1.00 4.10 C ATOM 754 NH1 ARG A 47 -13.651 -12.313 -9.924 1.00 11.32 N ATOM 755 NH2 ARG A 47 -15.854 -12.289 -9.267 1.00 15.10 N ATOM 0 HA ARG A 47 -12.699 -6.619 -6.256 1.00 3.31 H new ATOM 0 HB2 ARG A 47 -11.988 -7.253 -9.121 1.00 71.02 H new ATOM 0 HB3 ARG A 47 -11.362 -8.114 -7.728 1.00 71.02 H new ATOM 0 HG2 ARG A 47 -13.681 -8.694 -7.043 1.00 25.34 H new ATOM 0 HG3 ARG A 47 -14.307 -7.834 -8.436 1.00 25.34 H new ATOM 0 HD2 ARG A 47 -13.071 -9.384 -9.937 1.00 72.22 H new ATOM 0 HD3 ARG A 47 -12.473 -10.252 -8.538 1.00 72.22 H new ATOM 0 HE ARG A 47 -15.355 -10.023 -8.450 1.00 10.22 H new ATOM 0 HH11 ARG A 47 -12.745 -11.850 -9.993 1.00 11.32 H new ATOM 0 HH12 ARG A 47 -13.770 -13.258 -10.289 1.00 11.32 H new ATOM 0 HH21 ARG A 47 -16.641 -11.807 -8.831 1.00 15.10 H new ATOM 0 HH22 ARG A 47 -15.973 -13.234 -9.632 1.00 15.10 H new ATOM 769 N GLN A 48 -10.380 -5.260 -7.976 1.00 20.23 N ATOM 770 CA GLN A 48 -9.106 -4.583 -7.837 1.00 41.21 C ATOM 771 C GLN A 48 -8.947 -3.535 -8.935 1.00 60.51 C ATOM 772 O GLN A 48 -9.251 -3.800 -10.105 1.00 14.21 O ATOM 773 CB GLN A 48 -7.953 -5.589 -7.872 1.00 21.42 C ATOM 774 CG GLN A 48 -6.604 -4.966 -7.592 1.00 33.21 C ATOM 775 CD GLN A 48 -5.463 -5.954 -7.672 1.00 43.34 C ATOM 776 OE1 GLN A 48 -5.091 -6.571 -6.678 1.00 13.20 O ATOM 777 NE2 GLN A 48 -4.893 -6.109 -8.846 1.00 21.20 N ATOM 0 H GLN A 48 -10.646 -5.462 -8.940 1.00 20.23 H new ATOM 0 HA GLN A 48 -9.081 -4.079 -6.871 1.00 41.21 H new ATOM 0 HB2 GLN A 48 -8.142 -6.373 -7.139 1.00 21.42 H new ATOM 0 HB3 GLN A 48 -7.928 -6.068 -8.851 1.00 21.42 H new ATOM 0 HG2 GLN A 48 -6.429 -4.160 -8.304 1.00 33.21 H new ATOM 0 HG3 GLN A 48 -6.618 -4.517 -6.599 1.00 33.21 H new ATOM 0 HE21 GLN A 48 -5.229 -5.579 -9.650 1.00 21.20 H new ATOM 0 HE22 GLN A 48 -4.114 -6.759 -8.953 1.00 21.20 H new ATOM 786 N VAL A 49 -8.485 -2.348 -8.562 1.00 72.21 N ATOM 787 CA VAL A 49 -8.337 -1.240 -9.483 1.00 74.13 C ATOM 788 C VAL A 49 -7.046 -0.512 -9.184 1.00 21.41 C ATOM 789 O VAL A 49 -6.531 -0.594 -8.080 1.00 32.44 O ATOM 790 CB VAL A 49 -9.530 -0.219 -9.396 1.00 74.34 C ATOM 791 CG1 VAL A 49 -10.843 -0.871 -9.771 1.00 55.13 C ATOM 792 CG2 VAL A 49 -9.631 0.409 -8.007 1.00 62.34 C ATOM 0 H VAL A 49 -8.202 -2.131 -7.606 1.00 72.21 H new ATOM 0 HA VAL A 49 -8.329 -1.655 -10.491 1.00 74.13 H new ATOM 0 HB VAL A 49 -9.322 0.574 -10.114 1.00 74.34 H new ATOM 0 HG11 VAL A 49 -11.647 -0.138 -9.700 1.00 55.13 H new ATOM 0 HG12 VAL A 49 -10.784 -1.247 -10.792 1.00 55.13 H new ATOM 0 HG13 VAL A 49 -11.046 -1.698 -9.091 1.00 55.13 H new ATOM 0 HG21 VAL A 49 -10.466 1.109 -7.984 1.00 62.34 H new ATOM 0 HG22 VAL A 49 -9.792 -0.373 -7.265 1.00 62.34 H new ATOM 0 HG23 VAL A 49 -8.707 0.940 -7.780 1.00 62.34 H new ATOM 802 N CYS A 50 -6.528 0.182 -10.137 1.00 0.44 N ATOM 803 CA CYS A 50 -5.343 0.955 -9.903 1.00 14.44 C ATOM 804 C CYS A 50 -5.758 2.396 -9.805 1.00 22.02 C ATOM 805 O CYS A 50 -6.495 2.869 -10.644 1.00 40.11 O ATOM 806 CB CYS A 50 -4.322 0.739 -11.017 1.00 12.03 C ATOM 807 SG CYS A 50 -2.727 1.554 -10.733 1.00 60.20 S ATOM 0 H CYS A 50 -6.899 0.235 -11.085 1.00 0.44 H new ATOM 0 HA CYS A 50 -4.858 0.644 -8.978 1.00 14.44 H new ATOM 0 HB2 CYS A 50 -4.154 -0.331 -11.138 1.00 12.03 H new ATOM 0 HB3 CYS A 50 -4.742 1.104 -11.955 1.00 12.03 H new ATOM 812 N ILE A 51 -5.323 3.076 -8.781 1.00 15.33 N ATOM 813 CA ILE A 51 -5.743 4.430 -8.529 1.00 0.41 C ATOM 814 C ILE A 51 -4.575 5.413 -8.541 1.00 14.30 C ATOM 815 O ILE A 51 -3.431 5.041 -8.815 1.00 13.42 O ATOM 816 CB ILE A 51 -6.537 4.528 -7.220 1.00 51.10 C ATOM 817 CG1 ILE A 51 -5.758 3.924 -6.071 1.00 44.25 C ATOM 818 CG2 ILE A 51 -7.873 3.829 -7.382 1.00 34.13 C ATOM 819 CD1 ILE A 51 -6.451 4.059 -4.746 1.00 53.12 C ATOM 0 H ILE A 51 -4.665 2.707 -8.094 1.00 15.33 H new ATOM 0 HA ILE A 51 -6.402 4.714 -9.349 1.00 0.41 H new ATOM 0 HB ILE A 51 -6.709 5.580 -6.991 1.00 51.10 H new ATOM 0 HG12 ILE A 51 -5.583 2.868 -6.276 1.00 44.25 H new ATOM 0 HG13 ILE A 51 -4.781 4.403 -6.012 1.00 44.25 H new ATOM 0 HG21 ILE A 51 -8.436 3.900 -6.451 1.00 34.13 H new ATOM 0 HG22 ILE A 51 -8.437 4.304 -8.184 1.00 34.13 H new ATOM 0 HG23 ILE A 51 -7.707 2.780 -7.627 1.00 34.13 H new ATOM 0 HD11 ILE A 51 -5.838 3.605 -3.967 1.00 53.12 H new ATOM 0 HD12 ILE A 51 -6.602 5.115 -4.520 1.00 53.12 H new ATOM 0 HD13 ILE A 51 -7.417 3.555 -4.787 1.00 53.12 H new ATOM 831 N ASP A 52 -4.867 6.648 -8.251 1.00 53.24 N ATOM 832 CA ASP A 52 -3.888 7.723 -8.360 1.00 50.14 C ATOM 833 C ASP A 52 -3.547 8.340 -6.996 1.00 34.12 C ATOM 834 O ASP A 52 -4.426 8.630 -6.208 1.00 63.11 O ATOM 835 CB ASP A 52 -4.451 8.777 -9.300 1.00 63.32 C ATOM 836 CG ASP A 52 -3.581 9.973 -9.506 1.00 10.13 C ATOM 837 OD1 ASP A 52 -2.538 9.872 -10.178 1.00 1.54 O ATOM 838 OD2 ASP A 52 -3.948 11.042 -9.014 1.00 10.42 O ATOM 0 H ASP A 52 -5.787 6.952 -7.931 1.00 53.24 H new ATOM 0 HA ASP A 52 -2.956 7.316 -8.752 1.00 50.14 H new ATOM 0 HB2 ASP A 52 -4.640 8.314 -10.268 1.00 63.32 H new ATOM 0 HB3 ASP A 52 -5.414 9.110 -8.912 1.00 63.32 H new ATOM 843 N PRO A 53 -2.248 8.528 -6.705 1.00 10.13 N ATOM 844 CA PRO A 53 -1.778 9.129 -5.437 1.00 2.01 C ATOM 845 C PRO A 53 -2.257 10.552 -5.174 1.00 4.32 C ATOM 846 O PRO A 53 -2.152 11.033 -4.053 1.00 53.42 O ATOM 847 CB PRO A 53 -0.259 9.121 -5.541 1.00 40.12 C ATOM 848 CG PRO A 53 0.096 8.656 -6.910 1.00 5.14 C ATOM 849 CD PRO A 53 -1.134 8.106 -7.566 1.00 31.33 C ATOM 0 HA PRO A 53 -2.182 8.552 -4.605 1.00 2.01 H new ATOM 0 HB2 PRO A 53 0.143 10.118 -5.359 1.00 40.12 H new ATOM 0 HB3 PRO A 53 0.173 8.461 -4.788 1.00 40.12 H new ATOM 0 HG2 PRO A 53 0.500 9.481 -7.496 1.00 5.14 H new ATOM 0 HG3 PRO A 53 0.871 7.891 -6.860 1.00 5.14 H new ATOM 0 HD2 PRO A 53 -1.249 8.495 -8.578 1.00 31.33 H new ATOM 0 HD3 PRO A 53 -1.086 7.020 -7.645 1.00 31.33 H new ATOM 857 N LYS A 54 -2.763 11.223 -6.181 1.00 60.54 N ATOM 858 CA LYS A 54 -3.238 12.566 -6.006 1.00 2.22 C ATOM 859 C LYS A 54 -4.633 12.622 -5.416 1.00 2.33 C ATOM 860 O LYS A 54 -5.156 13.705 -5.139 1.00 33.31 O ATOM 861 CB LYS A 54 -3.193 13.287 -7.284 1.00 30.50 C ATOM 862 CG LYS A 54 -1.800 13.359 -7.822 1.00 21.23 C ATOM 863 CD LYS A 54 -1.724 14.261 -8.982 1.00 41.10 C ATOM 864 CE LYS A 54 -2.254 13.669 -10.302 1.00 73.04 C ATOM 865 NZ LYS A 54 -3.693 13.331 -10.295 1.00 24.20 N ATOM 0 H LYS A 54 -2.855 10.857 -7.129 1.00 60.54 H new ATOM 0 HA LYS A 54 -2.574 13.050 -5.290 1.00 2.22 H new ATOM 0 HB2 LYS A 54 -3.838 12.789 -8.007 1.00 30.50 H new ATOM 0 HB3 LYS A 54 -3.585 14.295 -7.149 1.00 30.50 H new ATOM 0 HG2 LYS A 54 -1.124 13.708 -7.042 1.00 21.23 H new ATOM 0 HG3 LYS A 54 -1.467 12.362 -8.111 1.00 21.23 H new ATOM 0 HD2 LYS A 54 -2.286 15.167 -8.756 1.00 41.10 H new ATOM 0 HD3 LYS A 54 -0.685 14.558 -9.125 1.00 41.10 H new ATOM 0 HE2 LYS A 54 -2.066 14.382 -11.105 1.00 73.04 H new ATOM 0 HE3 LYS A 54 -1.685 12.769 -10.535 1.00 73.04 H new ATOM 0 HZ1 LYS A 54 -4.078 13.433 -11.256 1.00 24.20 H new ATOM 0 HZ2 LYS A 54 -3.818 12.350 -9.974 1.00 24.20 H new ATOM 0 HZ3 LYS A 54 -4.197 13.972 -9.650 1.00 24.20 H new ATOM 879 N LEU A 55 -5.250 11.458 -5.238 1.00 43.42 N ATOM 880 CA LEU A 55 -6.542 11.372 -4.603 1.00 53.31 C ATOM 881 C LEU A 55 -6.400 11.844 -3.162 1.00 45.14 C ATOM 882 O LEU A 55 -5.547 11.344 -2.415 1.00 21.14 O ATOM 883 CB LEU A 55 -7.052 9.931 -4.647 1.00 54.45 C ATOM 884 CG LEU A 55 -7.255 9.331 -6.043 1.00 61.31 C ATOM 885 CD1 LEU A 55 -7.606 7.862 -5.946 1.00 61.10 C ATOM 886 CD2 LEU A 55 -8.332 10.079 -6.805 1.00 21.32 C ATOM 0 H LEU A 55 -4.865 10.560 -5.530 1.00 43.42 H new ATOM 0 HA LEU A 55 -7.262 12.001 -5.127 1.00 53.31 H new ATOM 0 HB2 LEU A 55 -6.349 9.301 -4.102 1.00 54.45 H new ATOM 0 HB3 LEU A 55 -8.001 9.886 -4.113 1.00 54.45 H new ATOM 0 HG LEU A 55 -6.317 9.431 -6.590 1.00 61.31 H new ATOM 0 HD11 LEU A 55 -7.746 7.455 -6.947 1.00 61.10 H new ATOM 0 HD12 LEU A 55 -6.798 7.327 -5.446 1.00 61.10 H new ATOM 0 HD13 LEU A 55 -8.527 7.745 -5.375 1.00 61.10 H new ATOM 0 HD21 LEU A 55 -8.456 9.633 -7.792 1.00 21.32 H new ATOM 0 HD22 LEU A 55 -9.273 10.018 -6.259 1.00 21.32 H new ATOM 0 HD23 LEU A 55 -8.042 11.124 -6.913 1.00 21.32 H new ATOM 898 N LYS A 56 -7.218 12.800 -2.784 1.00 25.13 N ATOM 899 CA LYS A 56 -7.123 13.433 -1.484 1.00 74.15 C ATOM 900 C LYS A 56 -7.245 12.440 -0.335 1.00 52.34 C ATOM 901 O LYS A 56 -6.471 12.527 0.631 1.00 1.55 O ATOM 902 CB LYS A 56 -8.119 14.625 -1.377 1.00 40.45 C ATOM 903 CG LYS A 56 -8.030 15.493 -0.091 1.00 55.12 C ATOM 904 CD LYS A 56 -8.690 14.883 1.143 1.00 21.52 C ATOM 905 CE LYS A 56 -10.189 14.709 0.958 1.00 2.34 C ATOM 906 NZ LYS A 56 -10.838 14.193 2.179 1.00 72.22 N ATOM 0 H LYS A 56 -7.970 13.163 -3.369 1.00 25.13 H new ATOM 0 HA LYS A 56 -6.119 13.846 -1.389 1.00 74.15 H new ATOM 0 HB2 LYS A 56 -7.966 15.275 -2.238 1.00 40.45 H new ATOM 0 HB3 LYS A 56 -9.132 14.230 -1.452 1.00 40.45 H new ATOM 0 HG2 LYS A 56 -6.979 15.680 0.132 1.00 55.12 H new ATOM 0 HG3 LYS A 56 -8.491 16.461 -0.291 1.00 55.12 H new ATOM 0 HD2 LYS A 56 -8.236 13.915 1.356 1.00 21.52 H new ATOM 0 HD3 LYS A 56 -8.503 15.520 2.007 1.00 21.52 H new ATOM 0 HE2 LYS A 56 -10.635 15.666 0.687 1.00 2.34 H new ATOM 0 HE3 LYS A 56 -10.376 14.024 0.131 1.00 2.34 H new ATOM 0 HZ1 LYS A 56 -11.868 14.168 2.041 1.00 72.22 H new ATOM 0 HZ2 LYS A 56 -10.492 13.232 2.376 1.00 72.22 H new ATOM 0 HZ3 LYS A 56 -10.611 14.814 2.982 1.00 72.22 H new ATOM 920 N TRP A 57 -8.170 11.471 -0.435 1.00 24.51 N ATOM 921 CA TRP A 57 -8.326 10.524 0.662 1.00 33.20 C ATOM 922 C TRP A 57 -7.101 9.600 0.750 1.00 62.34 C ATOM 923 O TRP A 57 -6.716 9.181 1.831 1.00 74.33 O ATOM 924 CB TRP A 57 -9.668 9.722 0.616 1.00 41.14 C ATOM 925 CG TRP A 57 -9.762 8.572 -0.359 1.00 53.10 C ATOM 926 CD1 TRP A 57 -10.392 8.545 -1.562 1.00 40.14 C ATOM 927 CD2 TRP A 57 -9.229 7.263 -0.158 1.00 62.51 C ATOM 928 NE1 TRP A 57 -10.272 7.295 -2.127 1.00 44.50 N ATOM 929 CE2 TRP A 57 -9.556 6.493 -1.275 1.00 14.14 C ATOM 930 CE3 TRP A 57 -8.498 6.676 0.873 1.00 21.34 C ATOM 931 CZ2 TRP A 57 -9.171 5.160 -1.383 1.00 13.32 C ATOM 932 CZ3 TRP A 57 -8.126 5.373 0.760 1.00 23.30 C ATOM 933 CH2 TRP A 57 -8.459 4.630 -0.348 1.00 33.23 C ATOM 0 H TRP A 57 -8.793 11.331 -1.231 1.00 24.51 H new ATOM 0 HA TRP A 57 -8.384 11.111 1.579 1.00 33.20 H new ATOM 0 HB2 TRP A 57 -9.861 9.332 1.615 1.00 41.14 H new ATOM 0 HB3 TRP A 57 -10.471 10.423 0.387 1.00 41.14 H new ATOM 0 HD1 TRP A 57 -10.910 9.380 -2.009 1.00 40.14 H new ATOM 0 HE1 TRP A 57 -10.653 7.012 -3.030 1.00 44.50 H new ATOM 0 HE3 TRP A 57 -8.231 7.248 1.749 1.00 21.34 H new ATOM 0 HZ2 TRP A 57 -9.426 4.570 -2.251 1.00 13.32 H new ATOM 0 HZ3 TRP A 57 -7.558 4.913 1.555 1.00 23.30 H new ATOM 0 HH2 TRP A 57 -8.148 3.597 -0.400 1.00 33.23 H new ATOM 944 N ILE A 58 -6.489 9.309 -0.405 1.00 64.11 N ATOM 945 CA ILE A 58 -5.256 8.512 -0.476 1.00 31.14 C ATOM 946 C ILE A 58 -4.170 9.155 0.336 1.00 14.44 C ATOM 947 O ILE A 58 -3.493 8.498 1.135 1.00 54.14 O ATOM 948 CB ILE A 58 -4.779 8.331 -1.951 1.00 23.41 C ATOM 949 CG1 ILE A 58 -5.534 7.204 -2.639 1.00 22.13 C ATOM 950 CG2 ILE A 58 -3.274 8.101 -2.046 1.00 23.14 C ATOM 951 CD1 ILE A 58 -5.144 5.844 -2.120 1.00 65.32 C ATOM 0 H ILE A 58 -6.833 9.618 -1.314 1.00 64.11 H new ATOM 0 HA ILE A 58 -5.476 7.526 -0.066 1.00 31.14 H new ATOM 0 HB ILE A 58 -5.001 9.264 -2.469 1.00 23.41 H new ATOM 0 HG12 ILE A 58 -6.605 7.350 -2.497 1.00 22.13 H new ATOM 0 HG13 ILE A 58 -5.346 7.247 -3.712 1.00 22.13 H new ATOM 0 HG21 ILE A 58 -2.990 7.981 -3.091 1.00 23.14 H new ATOM 0 HG22 ILE A 58 -2.748 8.957 -1.623 1.00 23.14 H new ATOM 0 HG23 ILE A 58 -3.008 7.201 -1.492 1.00 23.14 H new ATOM 0 HD11 ILE A 58 -5.713 5.077 -2.645 1.00 65.32 H new ATOM 0 HD12 ILE A 58 -4.079 5.683 -2.286 1.00 65.32 H new ATOM 0 HD13 ILE A 58 -5.358 5.787 -1.053 1.00 65.32 H new ATOM 963 N GLN A 59 -4.017 10.435 0.146 1.00 4.11 N ATOM 964 CA GLN A 59 -3.021 11.170 0.832 1.00 20.11 C ATOM 965 C GLN A 59 -3.288 11.197 2.330 1.00 33.14 C ATOM 966 O GLN A 59 -2.375 11.194 3.115 1.00 31.44 O ATOM 967 CB GLN A 59 -2.870 12.542 0.228 1.00 45.34 C ATOM 968 CG GLN A 59 -2.547 12.439 -1.244 1.00 1.24 C ATOM 969 CD GLN A 59 -2.101 13.703 -1.876 1.00 3.42 C ATOM 970 OE1 GLN A 59 -2.476 14.806 -1.470 1.00 45.34 O ATOM 971 NE2 GLN A 59 -1.302 13.547 -2.891 1.00 51.14 N ATOM 0 H GLN A 59 -4.587 10.989 -0.493 1.00 4.11 H new ATOM 0 HA GLN A 59 -2.062 10.666 0.710 1.00 20.11 H new ATOM 0 HB2 GLN A 59 -3.790 13.110 0.366 1.00 45.34 H new ATOM 0 HB3 GLN A 59 -2.079 13.087 0.743 1.00 45.34 H new ATOM 0 HG2 GLN A 59 -1.768 11.688 -1.378 1.00 1.24 H new ATOM 0 HG3 GLN A 59 -3.431 12.079 -1.770 1.00 1.24 H new ATOM 0 HE21 GLN A 59 -1.025 12.610 -3.183 1.00 51.14 H new ATOM 0 HE22 GLN A 59 -0.953 14.362 -3.395 1.00 51.14 H new ATOM 980 N GLU A 60 -4.553 11.163 2.716 1.00 2.10 N ATOM 981 CA GLU A 60 -4.913 11.109 4.140 1.00 34.11 C ATOM 982 C GLU A 60 -4.616 9.719 4.685 1.00 15.13 C ATOM 983 O GLU A 60 -4.261 9.565 5.847 1.00 63.11 O ATOM 984 CB GLU A 60 -6.402 11.344 4.348 1.00 53.00 C ATOM 985 CG GLU A 60 -7.000 12.614 3.790 1.00 21.20 C ATOM 986 CD GLU A 60 -8.485 12.664 4.090 1.00 10.33 C ATOM 987 OE1 GLU A 60 -8.869 12.999 5.233 1.00 52.31 O ATOM 988 OE2 GLU A 60 -9.295 12.328 3.199 1.00 34.51 O ATOM 0 H GLU A 60 -5.348 11.171 2.077 1.00 2.10 H new ATOM 0 HA GLU A 60 -4.336 11.882 4.648 1.00 34.11 H new ATOM 0 HB2 GLU A 60 -6.938 10.501 3.911 1.00 53.00 H new ATOM 0 HB3 GLU A 60 -6.597 11.325 5.420 1.00 53.00 H new ATOM 0 HG2 GLU A 60 -6.503 13.481 4.225 1.00 21.20 H new ATOM 0 HG3 GLU A 60 -6.836 12.660 2.713 1.00 21.20 H new ATOM 995 N TYR A 61 -4.769 8.716 3.833 1.00 34.55 N ATOM 996 CA TYR A 61 -4.611 7.324 4.228 1.00 41.04 C ATOM 997 C TYR A 61 -3.182 7.099 4.662 1.00 1.13 C ATOM 998 O TYR A 61 -2.918 6.479 5.681 1.00 5.31 O ATOM 999 CB TYR A 61 -4.945 6.408 3.053 1.00 13.34 C ATOM 1000 CG TYR A 61 -5.582 5.129 3.443 1.00 14.34 C ATOM 1001 CD1 TYR A 61 -6.907 5.082 3.861 1.00 72.54 C ATOM 1002 CD2 TYR A 61 -4.889 3.965 3.360 1.00 62.45 C ATOM 1003 CE1 TYR A 61 -7.486 3.895 4.178 1.00 50.40 C ATOM 1004 CE2 TYR A 61 -5.467 2.781 3.677 1.00 62.11 C ATOM 1005 CZ TYR A 61 -6.750 2.750 4.081 1.00 60.12 C ATOM 1006 OH TYR A 61 -7.303 1.579 4.389 1.00 21.11 O ATOM 0 H TYR A 61 -5.006 8.844 2.849 1.00 34.55 H new ATOM 0 HA TYR A 61 -5.288 7.097 5.052 1.00 41.04 H new ATOM 0 HB2 TYR A 61 -5.609 6.938 2.370 1.00 13.34 H new ATOM 0 HB3 TYR A 61 -4.029 6.192 2.503 1.00 13.34 H new ATOM 0 HD1 TYR A 61 -7.479 5.995 3.934 1.00 72.54 H new ATOM 0 HD2 TYR A 61 -3.859 3.983 3.036 1.00 62.45 H new ATOM 0 HE1 TYR A 61 -8.515 3.858 4.503 1.00 50.40 H new ATOM 0 HE2 TYR A 61 -4.899 1.865 3.606 1.00 62.11 H new ATOM 0 HH TYR A 61 -8.033 1.720 5.028 1.00 21.11 H new ATOM 1016 N LEU A 62 -2.274 7.638 3.889 1.00 40.23 N ATOM 1017 CA LEU A 62 -0.889 7.560 4.177 1.00 30.13 C ATOM 1018 C LEU A 62 -0.494 8.497 5.326 1.00 34.32 C ATOM 1019 O LEU A 62 0.461 8.234 6.056 1.00 71.11 O ATOM 1020 CB LEU A 62 -0.048 7.648 2.899 1.00 21.25 C ATOM 1021 CG LEU A 62 -0.288 8.819 1.967 1.00 72.21 C ATOM 1022 CD1 LEU A 62 0.408 10.036 2.457 1.00 72.05 C ATOM 1023 CD2 LEU A 62 0.099 8.493 0.528 1.00 34.10 C ATOM 0 H LEU A 62 -2.493 8.148 3.033 1.00 40.23 H new ATOM 0 HA LEU A 62 -0.655 6.571 4.571 1.00 30.13 H new ATOM 0 HB2 LEU A 62 1.002 7.664 3.191 1.00 21.25 H new ATOM 0 HB3 LEU A 62 -0.207 6.731 2.331 1.00 21.25 H new ATOM 0 HG LEU A 62 -1.359 9.022 1.965 1.00 72.21 H new ATOM 0 HD11 LEU A 62 0.221 10.863 1.772 1.00 72.05 H new ATOM 0 HD12 LEU A 62 0.035 10.294 3.448 1.00 72.05 H new ATOM 0 HD13 LEU A 62 1.480 9.845 2.511 1.00 72.05 H new ATOM 0 HD21 LEU A 62 -0.090 9.360 -0.105 1.00 34.10 H new ATOM 0 HD22 LEU A 62 1.157 8.236 0.485 1.00 34.10 H new ATOM 0 HD23 LEU A 62 -0.494 7.650 0.174 1.00 34.10 H new ATOM 1035 N GLU A 63 -1.248 9.593 5.485 1.00 5.01 N ATOM 1036 CA GLU A 63 -1.091 10.477 6.641 1.00 21.34 C ATOM 1037 C GLU A 63 -1.375 9.737 7.942 1.00 43.01 C ATOM 1038 O GLU A 63 -0.851 10.085 8.994 1.00 65.21 O ATOM 1039 CB GLU A 63 -1.945 11.731 6.534 1.00 33.03 C ATOM 1040 CG GLU A 63 -1.449 12.732 5.507 1.00 73.04 C ATOM 1041 CD GLU A 63 -0.143 13.406 5.883 1.00 74.21 C ATOM 1042 OE1 GLU A 63 0.048 13.752 7.080 1.00 34.33 O ATOM 1043 OE2 GLU A 63 0.678 13.678 4.988 1.00 60.14 O ATOM 0 H GLU A 63 -1.971 9.886 4.827 1.00 5.01 H new ATOM 0 HA GLU A 63 -0.050 10.800 6.648 1.00 21.34 H new ATOM 0 HB2 GLU A 63 -2.965 11.442 6.281 1.00 33.03 H new ATOM 0 HB3 GLU A 63 -1.983 12.216 7.509 1.00 33.03 H new ATOM 0 HG2 GLU A 63 -1.322 12.224 4.551 1.00 73.04 H new ATOM 0 HG3 GLU A 63 -2.212 13.497 5.362 1.00 73.04 H new ATOM 1050 N LYS A 64 -2.198 8.692 7.851 1.00 1.24 N ATOM 1051 CA LYS A 64 -2.523 7.859 9.003 1.00 61.33 C ATOM 1052 C LYS A 64 -1.307 7.016 9.386 1.00 73.12 C ATOM 1053 O LYS A 64 -1.213 6.522 10.497 1.00 63.13 O ATOM 1054 CB LYS A 64 -3.700 6.910 8.697 1.00 13.34 C ATOM 1055 CG LYS A 64 -4.962 7.578 8.154 1.00 70.14 C ATOM 1056 CD LYS A 64 -5.531 8.637 9.084 1.00 21.03 C ATOM 1057 CE LYS A 64 -5.953 8.066 10.425 1.00 1.51 C ATOM 1058 NZ LYS A 64 -6.581 9.095 11.276 1.00 22.12 N ATOM 0 H LYS A 64 -2.653 8.403 6.985 1.00 1.24 H new ATOM 0 HA LYS A 64 -2.807 8.520 9.822 1.00 61.33 H new ATOM 0 HB2 LYS A 64 -3.365 6.166 7.975 1.00 13.34 H new ATOM 0 HB3 LYS A 64 -3.958 6.374 9.610 1.00 13.34 H new ATOM 0 HG2 LYS A 64 -4.737 8.034 7.190 1.00 70.14 H new ATOM 0 HG3 LYS A 64 -5.720 6.815 7.976 1.00 70.14 H new ATOM 0 HD2 LYS A 64 -4.785 9.415 9.243 1.00 21.03 H new ATOM 0 HD3 LYS A 64 -6.390 9.111 8.608 1.00 21.03 H new ATOM 0 HE2 LYS A 64 -6.653 7.245 10.268 1.00 1.51 H new ATOM 0 HE3 LYS A 64 -5.084 7.651 10.935 1.00 1.51 H new ATOM 0 HZ1 LYS A 64 -6.858 8.672 12.185 1.00 22.12 H new ATOM 0 HZ2 LYS A 64 -5.904 9.866 11.445 1.00 22.12 H new ATOM 0 HZ3 LYS A 64 -7.424 9.473 10.799 1.00 22.12 H new ATOM 1072 N CYS A 65 -0.394 6.854 8.446 1.00 75.51 N ATOM 1073 CA CYS A 65 0.809 6.078 8.670 1.00 4.54 C ATOM 1074 C CYS A 65 1.852 6.978 9.274 1.00 22.33 C ATOM 1075 O CYS A 65 2.720 6.546 10.044 1.00 51.41 O ATOM 1076 CB CYS A 65 1.344 5.571 7.349 1.00 13.24 C ATOM 1077 SG CYS A 65 0.085 4.784 6.264 1.00 61.35 S ATOM 0 H CYS A 65 -0.466 7.255 7.511 1.00 75.51 H new ATOM 0 HA CYS A 65 0.581 5.239 9.328 1.00 4.54 H new ATOM 0 HB2 CYS A 65 1.798 6.404 6.812 1.00 13.24 H new ATOM 0 HB3 CYS A 65 2.137 4.849 7.546 1.00 13.24 H new ATOM 1082 N LEU A 66 1.767 8.240 8.924 1.00 43.22 N ATOM 1083 CA LEU A 66 2.689 9.201 9.372 1.00 30.31 C ATOM 1084 C LEU A 66 2.473 9.517 10.817 1.00 74.53 C ATOM 1085 O LEU A 66 1.443 10.045 11.215 1.00 2.35 O ATOM 1086 CB LEU A 66 2.602 10.446 8.500 1.00 13.43 C ATOM 1087 CG LEU A 66 3.004 10.219 7.040 1.00 14.32 C ATOM 1088 CD1 LEU A 66 2.621 11.374 6.148 1.00 4.31 C ATOM 1089 CD2 LEU A 66 4.499 9.998 6.966 1.00 42.00 C ATOM 0 H LEU A 66 1.040 8.611 8.313 1.00 43.22 H new ATOM 0 HA LEU A 66 3.697 8.795 9.284 1.00 30.31 H new ATOM 0 HB2 LEU A 66 1.581 10.826 8.529 1.00 13.43 H new ATOM 0 HB3 LEU A 66 3.242 11.219 8.925 1.00 13.43 H new ATOM 0 HG LEU A 66 2.465 9.342 6.682 1.00 14.32 H new ATOM 0 HD11 LEU A 66 2.929 11.161 5.124 1.00 4.31 H new ATOM 0 HD12 LEU A 66 1.541 11.516 6.180 1.00 4.31 H new ATOM 0 HD13 LEU A 66 3.116 12.281 6.495 1.00 4.31 H new ATOM 0 HD21 LEU A 66 4.792 9.836 5.929 1.00 42.00 H new ATOM 0 HD22 LEU A 66 5.016 10.875 7.356 1.00 42.00 H new ATOM 0 HD23 LEU A 66 4.767 9.124 7.560 1.00 42.00 H new ATOM 1101 N ASN A 67 3.450 9.121 11.590 1.00 75.13 N ATOM 1102 CA ASN A 67 3.587 9.413 13.000 1.00 13.23 C ATOM 1103 C ASN A 67 2.558 8.688 13.865 1.00 11.34 C ATOM 1104 O ASN A 67 2.464 8.940 15.065 1.00 31.44 O ATOM 1105 CB ASN A 67 3.548 10.922 13.248 1.00 53.01 C ATOM 1106 CG ASN A 67 4.484 11.726 12.334 1.00 22.32 C ATOM 1107 OD1 ASN A 67 4.214 12.892 12.030 1.00 73.41 O ATOM 1108 ND2 ASN A 67 5.559 11.119 11.864 1.00 33.42 N ATOM 0 H ASN A 67 4.219 8.552 11.235 1.00 75.13 H new ATOM 0 HA ASN A 67 4.562 9.032 13.303 1.00 13.23 H new ATOM 0 HB2 ASN A 67 2.527 11.277 13.109 1.00 53.01 H new ATOM 0 HB3 ASN A 67 3.815 11.117 14.287 1.00 53.01 H new ATOM 0 HD21 ASN A 67 6.190 11.614 11.234 1.00 33.42 H new ATOM 0 HD22 ASN A 67 5.758 10.155 12.131 1.00 33.42 H new ATOM 1300 N CYS C 211 -2.273 -7.320 12.200 1.00 63.54 N ATOM 1301 CA CYS C 211 -0.878 -7.222 12.542 1.00 61.11 C ATOM 1302 C CYS C 211 -0.679 -6.819 13.994 1.00 64.04 C ATOM 1303 O CYS C 211 -0.928 -5.676 14.381 1.00 64.23 O ATOM 1304 CB CYS C 211 -0.163 -6.262 11.599 1.00 75.44 C ATOM 1305 SG CYS C 211 -0.276 -6.740 9.852 1.00 11.42 S ATOM 0 HA CYS C 211 -0.437 -8.212 12.424 1.00 61.11 H new ATOM 0 HB2 CYS C 211 -0.584 -5.264 11.722 1.00 75.44 H new ATOM 0 HB3 CYS C 211 0.888 -6.202 11.883 1.00 75.44 H new ATOM 1310 N ARG C 212 -0.285 -7.785 14.807 1.00 24.11 N ATOM 1311 CA ARG C 212 0.042 -7.526 16.209 1.00 32.11 C ATOM 1312 C ARG C 212 1.553 -7.403 16.353 1.00 75.30 C ATOM 1313 O ARG C 212 2.075 -7.014 17.399 1.00 20.34 O ATOM 1314 CB ARG C 212 -0.456 -8.664 17.090 1.00 50.23 C ATOM 1315 CG ARG C 212 -1.942 -8.921 16.990 1.00 32.14 C ATOM 1316 CD ARG C 212 -2.356 -10.053 17.896 1.00 12.24 C ATOM 1317 NE ARG C 212 -3.778 -10.378 17.755 1.00 2.02 N ATOM 1318 CZ ARG C 212 -4.453 -11.185 18.568 1.00 55.31 C ATOM 1319 NH1 ARG C 212 -3.854 -11.707 19.631 1.00 63.13 N ATOM 1320 NH2 ARG C 212 -5.735 -11.466 18.319 1.00 73.43 N ATOM 0 H ARG C 212 -0.182 -8.760 14.524 1.00 24.11 H new ATOM 0 HA ARG C 212 -0.442 -6.601 16.522 1.00 32.11 H new ATOM 0 HB2 ARG C 212 0.078 -9.576 16.822 1.00 50.23 H new ATOM 0 HB3 ARG C 212 -0.206 -8.441 18.127 1.00 50.23 H new ATOM 0 HG2 ARG C 212 -2.490 -8.017 17.257 1.00 32.14 H new ATOM 0 HG3 ARG C 212 -2.205 -9.160 15.960 1.00 32.14 H new ATOM 0 HD2 ARG C 212 -1.758 -10.936 17.669 1.00 12.24 H new ATOM 0 HD3 ARG C 212 -2.147 -9.784 18.931 1.00 12.24 H new ATOM 0 HE ARG C 212 -4.286 -9.955 16.978 1.00 2.02 H new ATOM 0 HH11 ARG C 212 -2.876 -11.489 19.824 1.00 63.13 H new ATOM 0 HH12 ARG C 212 -4.371 -12.326 20.255 1.00 63.13 H new ATOM 0 HH21 ARG C 212 -6.197 -11.061 17.505 1.00 73.43 H new ATOM 0 HH22 ARG C 212 -6.252 -12.085 18.943 1.00 73.43 H new ATOM 1334 N PHE C 213 2.234 -7.732 15.291 1.00 74.02 N ATOM 1335 CA PHE C 213 3.669 -7.714 15.236 1.00 61.04 C ATOM 1336 C PHE C 213 4.064 -7.088 13.935 1.00 72.14 C ATOM 1337 O PHE C 213 3.247 -7.047 13.001 1.00 22.05 O ATOM 1338 CB PHE C 213 4.241 -9.148 15.300 1.00 43.31 C ATOM 1339 CG PHE C 213 3.908 -10.009 14.095 1.00 22.42 C ATOM 1340 CD1 PHE C 213 2.676 -10.618 13.973 1.00 61.34 C ATOM 1341 CD2 PHE C 213 4.838 -10.190 13.078 1.00 0.31 C ATOM 1342 CE1 PHE C 213 2.374 -11.387 12.871 1.00 23.32 C ATOM 1343 CE2 PHE C 213 4.539 -10.957 11.975 1.00 74.53 C ATOM 1344 CZ PHE C 213 3.304 -11.556 11.871 1.00 42.12 C ATOM 0 H PHE C 213 1.796 -8.027 14.419 1.00 74.02 H new ATOM 0 HA PHE C 213 4.061 -7.153 16.084 1.00 61.04 H new ATOM 0 HB2 PHE C 213 5.325 -9.090 15.402 1.00 43.31 H new ATOM 0 HB3 PHE C 213 3.862 -9.638 16.197 1.00 43.31 H new ATOM 0 HD1 PHE C 213 1.939 -10.490 14.752 1.00 61.34 H new ATOM 0 HD2 PHE C 213 5.809 -9.722 13.154 1.00 0.31 H new ATOM 0 HE1 PHE C 213 1.405 -11.858 12.792 1.00 23.32 H new ATOM 0 HE2 PHE C 213 5.272 -11.089 11.193 1.00 74.53 H new ATOM 0 HZ PHE C 213 3.065 -12.157 11.006 1.00 42.12 H new ATOM 1354 N PHE C 214 5.254 -6.587 13.849 1.00 13.31 N ATOM 1355 CA PHE C 214 5.705 -6.081 12.599 1.00 43.45 C ATOM 1356 C PHE C 214 7.074 -6.663 12.314 1.00 10.42 C ATOM 1357 O PHE C 214 7.850 -6.928 13.236 1.00 73.33 O ATOM 1358 CB PHE C 214 5.745 -4.535 12.566 1.00 10.42 C ATOM 1359 CG PHE C 214 6.952 -3.895 13.202 1.00 40.24 C ATOM 1360 CD1 PHE C 214 7.056 -3.725 14.569 1.00 75.43 C ATOM 1361 CD2 PHE C 214 7.992 -3.463 12.395 1.00 11.21 C ATOM 1362 CE1 PHE C 214 8.179 -3.132 15.119 1.00 61.41 C ATOM 1363 CE2 PHE C 214 9.104 -2.876 12.922 1.00 21.14 C ATOM 1364 CZ PHE C 214 9.207 -2.704 14.291 1.00 31.02 C ATOM 0 H PHE C 214 5.920 -6.519 14.618 1.00 13.31 H new ATOM 0 HA PHE C 214 4.998 -6.381 11.826 1.00 43.45 H new ATOM 0 HB2 PHE C 214 5.691 -4.211 11.527 1.00 10.42 H new ATOM 0 HB3 PHE C 214 4.852 -4.157 13.064 1.00 10.42 H new ATOM 0 HD1 PHE C 214 6.255 -4.057 15.213 1.00 75.43 H new ATOM 0 HD2 PHE C 214 7.920 -3.594 11.325 1.00 11.21 H new ATOM 0 HE1 PHE C 214 8.255 -3.003 16.189 1.00 61.41 H new ATOM 0 HE2 PHE C 214 9.902 -2.546 12.273 1.00 21.14 H new ATOM 0 HZ PHE C 214 10.085 -2.238 14.714 1.00 31.02 H new ATOM 1374 N GLU C 215 7.347 -6.891 11.082 1.00 35.54 N ATOM 1375 CA GLU C 215 8.601 -7.392 10.661 1.00 2.44 C ATOM 1376 C GLU C 215 9.560 -6.224 10.595 1.00 44.55 C ATOM 1377 O GLU C 215 9.243 -5.191 10.008 1.00 72.43 O ATOM 1378 CB GLU C 215 8.424 -8.021 9.279 1.00 52.23 C ATOM 1379 CG GLU C 215 9.664 -8.650 8.688 1.00 2.53 C ATOM 1380 CD GLU C 215 10.197 -9.764 9.528 1.00 41.13 C ATOM 1381 OE1 GLU C 215 9.594 -10.867 9.537 1.00 13.33 O ATOM 1382 OE2 GLU C 215 11.236 -9.566 10.188 1.00 14.21 O ATOM 0 H GLU C 215 6.688 -6.730 10.320 1.00 35.54 H new ATOM 0 HA GLU C 215 8.989 -8.146 11.346 1.00 2.44 H new ATOM 0 HB2 GLU C 215 7.646 -8.782 9.342 1.00 52.23 H new ATOM 0 HB3 GLU C 215 8.064 -7.254 8.593 1.00 52.23 H new ATOM 0 HG2 GLU C 215 9.436 -9.028 7.691 1.00 2.53 H new ATOM 0 HG3 GLU C 215 10.434 -7.887 8.571 1.00 2.53 H new ATOM 1389 N SER C 216 10.708 -6.369 11.188 1.00 22.43 N ATOM 1390 CA SER C 216 11.666 -5.302 11.182 1.00 53.34 C ATOM 1391 C SER C 216 12.622 -5.475 10.018 1.00 51.23 C ATOM 1392 O SER C 216 13.307 -4.532 9.611 1.00 71.32 O ATOM 1393 CB SER C 216 12.421 -5.272 12.503 1.00 42.32 C ATOM 1394 OG SER C 216 11.512 -5.207 13.597 1.00 55.52 O ATOM 0 H SER C 216 11.004 -7.212 11.680 1.00 22.43 H new ATOM 0 HA SER C 216 11.146 -4.351 11.064 1.00 53.34 H new ATOM 0 HB2 SER C 216 13.044 -6.162 12.593 1.00 42.32 H new ATOM 0 HB3 SER C 216 13.090 -4.411 12.527 1.00 42.32 H new ATOM 0 HG SER C 216 10.858 -4.495 13.437 1.00 55.52 H new ATOM 1400 N HIS C 217 12.653 -6.670 9.465 1.00 24.34 N ATOM 1401 CA HIS C 217 13.529 -6.950 8.366 1.00 60.10 C ATOM 1402 C HIS C 217 12.838 -6.607 7.055 1.00 42.14 C ATOM 1403 O HIS C 217 12.169 -7.443 6.451 1.00 34.04 O ATOM 1404 CB HIS C 217 13.996 -8.420 8.390 1.00 52.34 C ATOM 1405 CG HIS C 217 15.042 -8.764 7.365 1.00 23.32 C ATOM 1406 ND1 HIS C 217 16.374 -8.893 7.674 1.00 61.12 N ATOM 1407 CD2 HIS C 217 14.941 -9.026 6.041 1.00 71.54 C ATOM 1408 CE1 HIS C 217 17.046 -9.212 6.592 1.00 3.43 C ATOM 1409 NE2 HIS C 217 16.201 -9.299 5.588 1.00 54.13 N ATOM 0 H HIS C 217 12.078 -7.458 9.765 1.00 24.34 H new ATOM 0 HA HIS C 217 14.420 -6.329 8.459 1.00 60.10 H new ATOM 0 HB2 HIS C 217 14.390 -8.646 9.381 1.00 52.34 H new ATOM 0 HB3 HIS C 217 13.130 -9.065 8.236 1.00 52.34 H new ATOM 0 HD2 HIS C 217 14.035 -9.020 5.453 1.00 71.54 H new ATOM 0 HE1 HIS C 217 18.112 -9.375 6.536 1.00 3.43 H new ATOM 0 HE2 HIS C 217 16.447 -9.533 4.626 1.00 54.13 H new ATOM 1418 N VAL C 218 12.961 -5.368 6.660 1.00 50.21 N ATOM 1419 CA VAL C 218 12.389 -4.892 5.429 1.00 61.34 C ATOM 1420 C VAL C 218 13.260 -3.779 4.859 1.00 1.22 C ATOM 1421 O VAL C 218 13.750 -2.919 5.598 1.00 14.41 O ATOM 1422 CB VAL C 218 10.905 -4.393 5.610 1.00 25.21 C ATOM 1423 CG1 VAL C 218 10.811 -3.244 6.610 1.00 72.41 C ATOM 1424 CG2 VAL C 218 10.306 -3.999 4.262 1.00 53.14 C ATOM 0 H VAL C 218 13.465 -4.655 7.188 1.00 50.21 H new ATOM 0 HA VAL C 218 12.357 -5.729 4.732 1.00 61.34 H new ATOM 0 HB VAL C 218 10.324 -5.220 6.018 1.00 25.21 H new ATOM 0 HG11 VAL C 218 9.772 -2.929 6.706 1.00 72.41 H new ATOM 0 HG12 VAL C 218 11.181 -3.575 7.580 1.00 72.41 H new ATOM 0 HG13 VAL C 218 11.413 -2.406 6.259 1.00 72.41 H new ATOM 0 HG21 VAL C 218 9.281 -3.657 4.405 1.00 53.14 H new ATOM 0 HG22 VAL C 218 10.898 -3.197 3.821 1.00 53.14 H new ATOM 0 HG23 VAL C 218 10.311 -4.862 3.596 1.00 53.14 H new ATOM 1434 N ALA C 219 13.479 -3.816 3.573 1.00 33.10 N ATOM 1435 CA ALA C 219 14.266 -2.811 2.912 1.00 72.41 C ATOM 1436 C ALA C 219 13.533 -2.329 1.685 1.00 34.41 C ATOM 1437 O ALA C 219 12.862 -3.114 1.015 1.00 73.42 O ATOM 1438 CB ALA C 219 15.635 -3.363 2.536 1.00 44.25 C ATOM 0 H ALA C 219 13.118 -4.542 2.955 1.00 33.10 H new ATOM 0 HA ALA C 219 14.418 -1.972 3.591 1.00 72.41 H new ATOM 0 HB1 ALA C 219 16.216 -2.587 2.037 1.00 44.25 H new ATOM 0 HB2 ALA C 219 16.158 -3.684 3.437 1.00 44.25 H new ATOM 0 HB3 ALA C 219 15.513 -4.213 1.865 1.00 44.25 H new ATOM 1444 N ARG C 220 13.667 -1.056 1.386 1.00 31.40 N ATOM 1445 CA ARG C 220 12.997 -0.434 0.244 1.00 63.44 C ATOM 1446 C ARG C 220 13.560 -0.979 -1.079 1.00 62.31 C ATOM 1447 O ARG C 220 12.904 -0.942 -2.117 1.00 20.20 O ATOM 1448 CB ARG C 220 13.156 1.085 0.331 1.00 1.45 C ATOM 1449 CG ARG C 220 12.444 1.879 -0.751 1.00 0.32 C ATOM 1450 CD ARG C 220 12.557 3.368 -0.474 1.00 72.42 C ATOM 1451 NE ARG C 220 11.892 4.201 -1.491 1.00 33.32 N ATOM 1452 CZ ARG C 220 11.613 5.510 -1.336 1.00 35.43 C ATOM 1453 NH1 ARG C 220 11.881 6.125 -0.183 1.00 63.44 N ATOM 1454 NH2 ARG C 220 11.053 6.193 -2.326 1.00 50.14 N ATOM 0 H ARG C 220 14.245 -0.412 1.926 1.00 31.40 H new ATOM 0 HA ARG C 220 11.935 -0.678 0.270 1.00 63.44 H new ATOM 0 HB2 ARG C 220 12.788 1.416 1.302 1.00 1.45 H new ATOM 0 HB3 ARG C 220 14.219 1.325 0.294 1.00 1.45 H new ATOM 0 HG2 ARG C 220 12.877 1.650 -1.724 1.00 0.32 H new ATOM 0 HG3 ARG C 220 11.394 1.589 -0.793 1.00 0.32 H new ATOM 0 HD2 ARG C 220 12.123 3.583 0.502 1.00 72.42 H new ATOM 0 HD3 ARG C 220 13.611 3.642 -0.422 1.00 72.42 H new ATOM 0 HE ARG C 220 11.625 3.758 -2.370 1.00 33.32 H new ATOM 0 HH11 ARG C 220 12.300 5.604 0.588 1.00 63.44 H new ATOM 0 HH12 ARG C 220 11.667 7.116 -0.072 1.00 63.44 H new ATOM 0 HH21 ARG C 220 10.833 5.727 -3.206 1.00 50.14 H new ATOM 0 HH22 ARG C 220 10.843 7.184 -2.207 1.00 50.14 H new ATOM 1468 N ALA C 221 14.762 -1.485 -1.026 1.00 20.00 N ATOM 1469 CA ALA C 221 15.389 -2.109 -2.177 1.00 44.54 C ATOM 1470 C ALA C 221 14.900 -3.554 -2.349 1.00 2.05 C ATOM 1471 O ALA C 221 15.166 -4.197 -3.372 1.00 72.55 O ATOM 1472 CB ALA C 221 16.905 -2.072 -2.045 1.00 53.41 C ATOM 0 H ALA C 221 15.341 -1.480 -0.186 1.00 20.00 H new ATOM 0 HA ALA C 221 15.105 -1.545 -3.065 1.00 44.54 H new ATOM 0 HB1 ALA C 221 17.358 -2.544 -2.917 1.00 53.41 H new ATOM 0 HB2 ALA C 221 17.239 -1.037 -1.978 1.00 53.41 H new ATOM 0 HB3 ALA C 221 17.205 -2.609 -1.145 1.00 53.41 H new ATOM 1478 N ASN C 222 14.201 -4.069 -1.345 1.00 54.22 N ATOM 1479 CA ASN C 222 13.728 -5.416 -1.367 1.00 11.45 C ATOM 1480 C ASN C 222 12.218 -5.450 -1.606 1.00 3.34 C ATOM 1481 O ASN C 222 11.713 -6.375 -2.189 1.00 34.21 O ATOM 1482 CB ASN C 222 14.115 -6.108 -0.048 1.00 1.24 C ATOM 1483 CG ASN C 222 13.738 -7.578 0.019 1.00 45.31 C ATOM 1484 OD1 ASN C 222 13.615 -8.263 -0.997 1.00 30.55 O ATOM 1485 ND2 ASN C 222 13.619 -8.085 1.211 1.00 75.32 N ATOM 0 H ASN C 222 13.955 -3.552 -0.501 1.00 54.22 H new ATOM 0 HA ASN C 222 14.193 -5.958 -2.190 1.00 11.45 H new ATOM 0 HB2 ASN C 222 15.191 -6.014 0.096 1.00 1.24 H new ATOM 0 HB3 ASN C 222 13.635 -5.584 0.779 1.00 1.24 H new ATOM 0 HD21 ASN C 222 13.418 -9.078 1.325 1.00 75.32 H new ATOM 0 HD22 ASN C 222 13.727 -7.489 2.032 1.00 75.32 H new ATOM 1492 N VAL C 223 11.508 -4.424 -1.157 1.00 40.31 N ATOM 1493 CA VAL C 223 10.076 -4.340 -1.342 1.00 71.31 C ATOM 1494 C VAL C 223 9.654 -4.288 -2.821 1.00 50.52 C ATOM 1495 O VAL C 223 10.266 -3.615 -3.641 1.00 50.54 O ATOM 1496 CB VAL C 223 9.481 -3.149 -0.571 1.00 11.21 C ATOM 1497 CG1 VAL C 223 9.669 -3.332 0.898 1.00 73.41 C ATOM 1498 CG2 VAL C 223 10.069 -1.839 -1.045 1.00 44.04 C ATOM 0 H VAL C 223 11.912 -3.632 -0.657 1.00 40.31 H new ATOM 0 HA VAL C 223 9.670 -5.265 -0.932 1.00 71.31 H new ATOM 0 HB VAL C 223 8.410 -3.113 -0.773 1.00 11.21 H new ATOM 0 HG11 VAL C 223 9.242 -2.481 1.428 1.00 73.41 H new ATOM 0 HG12 VAL C 223 9.169 -4.246 1.218 1.00 73.41 H new ATOM 0 HG13 VAL C 223 10.733 -3.403 1.123 1.00 73.41 H new ATOM 0 HG21 VAL C 223 9.628 -1.017 -0.481 1.00 44.04 H new ATOM 0 HG22 VAL C 223 11.148 -1.848 -0.891 1.00 44.04 H new ATOM 0 HG23 VAL C 223 9.855 -1.707 -2.106 1.00 44.04 H new ATOM 1508 N LYS C 224 8.635 -5.047 -3.126 1.00 34.14 N ATOM 1509 CA LYS C 224 8.027 -5.110 -4.449 1.00 20.35 C ATOM 1510 C LYS C 224 6.838 -4.198 -4.463 1.00 31.20 C ATOM 1511 O LYS C 224 6.474 -3.617 -5.492 1.00 33.24 O ATOM 1512 CB LYS C 224 7.498 -6.494 -4.676 1.00 1.13 C ATOM 1513 CG LYS C 224 8.497 -7.578 -4.512 1.00 74.14 C ATOM 1514 CD LYS C 224 7.811 -8.916 -4.520 1.00 42.33 C ATOM 1515 CE LYS C 224 7.174 -9.236 -5.864 1.00 42.13 C ATOM 1516 NZ LYS C 224 6.524 -10.560 -5.870 1.00 53.33 N ATOM 0 H LYS C 224 8.184 -5.661 -2.447 1.00 34.14 H new ATOM 0 HA LYS C 224 8.764 -4.836 -5.204 1.00 20.35 H new ATOM 0 HB2 LYS C 224 6.674 -6.671 -3.984 1.00 1.13 H new ATOM 0 HB3 LYS C 224 7.085 -6.549 -5.683 1.00 1.13 H new ATOM 0 HG2 LYS C 224 9.231 -7.532 -5.316 1.00 74.14 H new ATOM 0 HG3 LYS C 224 9.040 -7.444 -3.577 1.00 74.14 H new ATOM 0 HD2 LYS C 224 8.534 -9.693 -4.270 1.00 42.33 H new ATOM 0 HD3 LYS C 224 7.045 -8.932 -3.745 1.00 42.33 H new ATOM 0 HE2 LYS C 224 6.437 -8.470 -6.107 1.00 42.13 H new ATOM 0 HE3 LYS C 224 7.936 -9.203 -6.643 1.00 42.13 H new ATOM 0 HZ1 LYS C 224 6.104 -10.736 -6.805 1.00 53.33 H new ATOM 0 HZ2 LYS C 224 7.231 -11.295 -5.664 1.00 53.33 H new ATOM 0 HZ3 LYS C 224 5.779 -10.584 -5.145 1.00 53.33 H new ATOM 1530 N HIS C 225 6.194 -4.129 -3.318 1.00 32.33 N ATOM 1531 CA HIS C 225 5.047 -3.270 -3.113 1.00 51.31 C ATOM 1532 C HIS C 225 4.636 -3.270 -1.650 1.00 22.22 C ATOM 1533 O HIS C 225 5.033 -4.166 -0.889 1.00 24.52 O ATOM 1534 CB HIS C 225 3.837 -3.661 -4.031 1.00 33.23 C ATOM 1535 CG HIS C 225 3.246 -5.022 -3.809 1.00 74.40 C ATOM 1536 ND1 HIS C 225 3.422 -6.076 -4.674 1.00 61.44 N ATOM 1537 CD2 HIS C 225 2.436 -5.476 -2.834 1.00 72.14 C ATOM 1538 CE1 HIS C 225 2.749 -7.110 -4.236 1.00 4.20 C ATOM 1539 NE2 HIS C 225 2.140 -6.777 -3.121 1.00 51.10 N ATOM 0 H HIS C 225 6.454 -4.673 -2.495 1.00 32.33 H new ATOM 0 HA HIS C 225 5.346 -2.261 -3.395 1.00 51.31 H new ATOM 0 HB2 HIS C 225 3.050 -2.920 -3.893 1.00 33.23 H new ATOM 0 HB3 HIS C 225 4.160 -3.594 -5.070 1.00 33.23 H new ATOM 0 HD1 HIS C 225 3.987 -6.056 -5.523 1.00 61.44 H new ATOM 0 HD2 HIS C 225 2.085 -4.914 -1.981 1.00 72.14 H new ATOM 0 HE1 HIS C 225 2.702 -8.078 -4.713 1.00 4.20 H new ATOM 1548 N LEU C 226 3.833 -2.299 -1.284 1.00 62.33 N ATOM 1549 CA LEU C 226 3.314 -2.157 0.068 1.00 62.23 C ATOM 1550 C LEU C 226 1.819 -2.378 0.037 1.00 70.33 C ATOM 1551 O LEU C 226 1.185 -2.158 -0.983 1.00 44.24 O ATOM 1552 CB LEU C 226 3.568 -0.739 0.621 1.00 43.03 C ATOM 1553 CG LEU C 226 5.004 -0.256 0.748 1.00 23.21 C ATOM 1554 CD1 LEU C 226 5.012 1.129 1.342 1.00 43.04 C ATOM 1555 CD2 LEU C 226 5.816 -1.177 1.621 1.00 33.53 C ATOM 0 H LEU C 226 3.513 -1.571 -1.923 1.00 62.33 H new ATOM 0 HA LEU C 226 3.818 -2.884 0.705 1.00 62.23 H new ATOM 0 HB2 LEU C 226 3.036 -0.034 -0.018 1.00 43.03 H new ATOM 0 HB3 LEU C 226 3.110 -0.682 1.609 1.00 43.03 H new ATOM 0 HG LEU C 226 5.451 -0.245 -0.246 1.00 23.21 H new ATOM 0 HD11 LEU C 226 6.040 1.479 1.435 1.00 43.04 H new ATOM 0 HD12 LEU C 226 4.455 1.806 0.694 1.00 43.04 H new ATOM 0 HD13 LEU C 226 4.547 1.105 2.327 1.00 43.04 H new ATOM 0 HD21 LEU C 226 6.838 -0.804 1.692 1.00 33.53 H new ATOM 0 HD22 LEU C 226 5.375 -1.217 2.617 1.00 33.53 H new ATOM 0 HD23 LEU C 226 5.824 -2.177 1.187 1.00 33.53 H new ATOM 1567 N LYS C 227 1.287 -2.847 1.116 1.00 2.12 N ATOM 1568 CA LYS C 227 -0.130 -3.039 1.293 1.00 13.21 C ATOM 1569 C LYS C 227 -0.606 -2.367 2.538 1.00 21.40 C ATOM 1570 O LYS C 227 -0.121 -2.658 3.602 1.00 62.32 O ATOM 1571 CB LYS C 227 -0.474 -4.503 1.371 1.00 63.22 C ATOM 1572 CG LYS C 227 -0.522 -5.193 0.042 1.00 60.40 C ATOM 1573 CD LYS C 227 -0.708 -6.683 0.205 1.00 21.33 C ATOM 1574 CE LYS C 227 -1.924 -7.035 1.069 1.00 23.32 C ATOM 1575 NZ LYS C 227 -2.081 -8.497 1.268 1.00 12.21 N ATOM 0 H LYS C 227 1.837 -3.119 1.931 1.00 2.12 H new ATOM 0 HA LYS C 227 -0.625 -2.598 0.428 1.00 13.21 H new ATOM 0 HB2 LYS C 227 0.260 -5.004 2.002 1.00 63.22 H new ATOM 0 HB3 LYS C 227 -1.442 -4.612 1.860 1.00 63.22 H new ATOM 0 HG2 LYS C 227 -1.339 -4.785 -0.553 1.00 60.40 H new ATOM 0 HG3 LYS C 227 0.400 -4.997 -0.506 1.00 60.40 H new ATOM 0 HD2 LYS C 227 -0.821 -7.141 -0.778 1.00 21.33 H new ATOM 0 HD3 LYS C 227 0.188 -7.110 0.655 1.00 21.33 H new ATOM 0 HE2 LYS C 227 -1.828 -6.549 2.040 1.00 23.32 H new ATOM 0 HE3 LYS C 227 -2.825 -6.637 0.601 1.00 23.32 H new ATOM 0 HZ1 LYS C 227 -2.917 -8.679 1.859 1.00 12.21 H new ATOM 0 HZ2 LYS C 227 -2.201 -8.962 0.345 1.00 12.21 H new ATOM 0 HZ3 LYS C 227 -1.235 -8.876 1.740 1.00 12.21 H new ATOM 1589 N ILE C 228 -1.540 -1.484 2.408 1.00 42.44 N ATOM 1590 CA ILE C 228 -2.093 -0.817 3.553 1.00 74.11 C ATOM 1591 C ILE C 228 -3.452 -1.443 3.819 1.00 22.54 C ATOM 1592 O ILE C 228 -4.342 -1.307 3.001 1.00 25.41 O ATOM 1593 CB ILE C 228 -2.314 0.680 3.251 1.00 1.11 C ATOM 1594 CG1 ILE C 228 -1.031 1.340 2.734 1.00 51.35 C ATOM 1595 CG2 ILE C 228 -2.763 1.390 4.517 1.00 74.21 C ATOM 1596 CD1 ILE C 228 0.036 1.493 3.765 1.00 50.20 C ATOM 0 H ILE C 228 -1.943 -1.202 1.515 1.00 42.44 H new ATOM 0 HA ILE C 228 -1.416 -0.914 4.402 1.00 74.11 H new ATOM 0 HB ILE C 228 -3.079 0.761 2.479 1.00 1.11 H new ATOM 0 HG12 ILE C 228 -0.639 0.748 1.907 1.00 51.35 H new ATOM 0 HG13 ILE C 228 -1.277 2.323 2.334 1.00 51.35 H new ATOM 0 HG21 ILE C 228 -2.919 2.448 4.305 1.00 74.21 H new ATOM 0 HG22 ILE C 228 -3.695 0.949 4.870 1.00 74.21 H new ATOM 0 HG23 ILE C 228 -1.997 1.283 5.285 1.00 74.21 H new ATOM 0 HD11 ILE C 228 0.909 1.968 3.317 1.00 50.20 H new ATOM 0 HD12 ILE C 228 -0.334 2.111 4.583 1.00 50.20 H new ATOM 0 HD13 ILE C 228 0.314 0.512 4.149 1.00 50.20 H new ATOM 1608 N LEU C 229 -3.609 -2.123 4.935 1.00 1.33 N ATOM 1609 CA LEU C 229 -4.875 -2.793 5.266 1.00 32.51 C ATOM 1610 C LEU C 229 -5.844 -1.810 5.864 1.00 44.32 C ATOM 1611 O LEU C 229 -5.474 -1.018 6.742 1.00 20.23 O ATOM 1612 CB LEU C 229 -4.693 -3.999 6.227 1.00 51.41 C ATOM 1613 CG LEU C 229 -3.940 -5.251 5.721 1.00 13.40 C ATOM 1614 CD1 LEU C 229 -2.488 -4.957 5.365 1.00 53.42 C ATOM 1615 CD2 LEU C 229 -4.019 -6.352 6.766 1.00 3.01 C ATOM 0 H LEU C 229 -2.879 -2.234 5.639 1.00 1.33 H new ATOM 0 HA LEU C 229 -5.270 -3.187 4.330 1.00 32.51 H new ATOM 0 HB2 LEU C 229 -4.173 -3.638 7.114 1.00 51.41 H new ATOM 0 HB3 LEU C 229 -5.685 -4.318 6.547 1.00 51.41 H new ATOM 0 HG LEU C 229 -4.427 -5.578 4.802 1.00 13.40 H new ATOM 0 HD11 LEU C 229 -2.007 -5.871 5.016 1.00 53.42 H new ATOM 0 HD12 LEU C 229 -2.452 -4.204 4.578 1.00 53.42 H new ATOM 0 HD13 LEU C 229 -1.965 -4.586 6.247 1.00 53.42 H new ATOM 0 HD21 LEU C 229 -3.488 -7.233 6.407 1.00 3.01 H new ATOM 0 HD22 LEU C 229 -3.563 -6.006 7.694 1.00 3.01 H new ATOM 0 HD23 LEU C 229 -5.063 -6.607 6.948 1.00 3.01 H new ATOM 1627 N ASN C 230 -7.080 -1.859 5.418 1.00 73.54 N ATOM 1628 CA ASN C 230 -8.052 -0.900 5.865 1.00 60.44 C ATOM 1629 C ASN C 230 -8.668 -1.349 7.175 1.00 22.31 C ATOM 1630 O ASN C 230 -9.471 -2.276 7.216 1.00 4.35 O ATOM 1631 CB ASN C 230 -9.118 -0.738 4.759 1.00 4.05 C ATOM 1632 CG ASN C 230 -10.118 0.379 4.990 1.00 30.41 C ATOM 1633 OD1 ASN C 230 -9.852 1.340 5.707 1.00 63.23 O ATOM 1634 ND2 ASN C 230 -11.217 0.309 4.307 1.00 74.21 N ATOM 0 H ASN C 230 -7.429 -2.548 4.752 1.00 73.54 H new ATOM 0 HA ASN C 230 -7.580 0.065 6.048 1.00 60.44 H new ATOM 0 HB2 ASN C 230 -8.611 -0.561 3.810 1.00 4.05 H new ATOM 0 HB3 ASN C 230 -9.662 -1.677 4.659 1.00 4.05 H new ATOM 0 HD21 ASN C 230 -11.896 1.069 4.354 1.00 74.21 H new ATOM 0 HD22 ASN C 230 -11.403 -0.506 3.722 1.00 74.21 H new ATOM 1641 N THR C 231 -8.281 -0.692 8.243 1.00 34.20 N ATOM 1642 CA THR C 231 -8.780 -1.004 9.559 1.00 23.52 C ATOM 1643 C THR C 231 -9.461 0.211 10.185 1.00 53.35 C ATOM 1644 O THR C 231 -8.940 1.327 10.093 1.00 63.43 O ATOM 1645 CB THR C 231 -7.667 -1.564 10.486 1.00 45.03 C ATOM 1646 OG1 THR C 231 -6.553 -0.661 10.537 1.00 70.22 O ATOM 1647 CG2 THR C 231 -7.194 -2.934 10.009 1.00 64.21 C ATOM 0 H THR C 231 -7.610 0.076 8.222 1.00 34.20 H new ATOM 0 HA THR C 231 -9.525 -1.791 9.445 1.00 23.52 H new ATOM 0 HB THR C 231 -8.090 -1.669 11.485 1.00 45.03 H new ATOM 0 HG1 THR C 231 -6.818 0.159 11.003 1.00 70.22 H new ATOM 0 HG21 THR C 231 -6.415 -3.302 10.676 1.00 64.21 H new ATOM 0 HG22 THR C 231 -8.033 -3.630 10.012 1.00 64.21 H new ATOM 0 HG23 THR C 231 -6.796 -2.850 8.998 1.00 64.21 H new ATOM 1655 N PRO C 232 -10.615 0.031 10.829 1.00 24.24 N ATOM 1656 CA PRO C 232 -11.342 1.138 11.443 1.00 54.15 C ATOM 1657 C PRO C 232 -10.888 1.434 12.888 1.00 21.30 C ATOM 1658 O PRO C 232 -11.408 2.334 13.536 1.00 55.21 O ATOM 1659 CB PRO C 232 -12.782 0.631 11.433 1.00 52.43 C ATOM 1660 CG PRO C 232 -12.669 -0.858 11.580 1.00 74.43 C ATOM 1661 CD PRO C 232 -11.334 -1.259 10.989 1.00 54.04 C ATOM 0 HA PRO C 232 -11.184 2.076 10.911 1.00 54.15 H new ATOM 0 HB2 PRO C 232 -13.359 1.066 12.249 1.00 52.43 H new ATOM 0 HB3 PRO C 232 -13.289 0.899 10.506 1.00 52.43 H new ATOM 0 HG2 PRO C 232 -12.730 -1.148 12.629 1.00 74.43 H new ATOM 0 HG3 PRO C 232 -13.487 -1.360 11.063 1.00 74.43 H new ATOM 0 HD2 PRO C 232 -10.793 -1.939 11.647 1.00 54.04 H new ATOM 0 HD3 PRO C 232 -11.457 -1.770 10.034 1.00 54.04 H new ATOM 1669 N ASN C 233 -9.914 0.687 13.374 1.00 1.35 N ATOM 1670 CA ASN C 233 -9.472 0.834 14.769 1.00 62.45 C ATOM 1671 C ASN C 233 -7.955 1.079 14.867 1.00 35.13 C ATOM 1672 O ASN C 233 -7.439 1.475 15.915 1.00 32.13 O ATOM 1673 CB ASN C 233 -9.876 -0.425 15.552 1.00 65.21 C ATOM 1674 CG ASN C 233 -9.525 -0.424 17.042 1.00 10.24 C ATOM 1675 OD1 ASN C 233 -9.486 0.617 17.705 1.00 12.22 O ATOM 1676 ND2 ASN C 233 -9.288 -1.595 17.575 1.00 74.52 N ATOM 0 H ASN C 233 -9.412 -0.022 12.840 1.00 1.35 H new ATOM 0 HA ASN C 233 -9.958 1.709 15.201 1.00 62.45 H new ATOM 0 HB2 ASN C 233 -10.953 -0.562 15.452 1.00 65.21 H new ATOM 0 HB3 ASN C 233 -9.400 -1.288 15.086 1.00 65.21 H new ATOM 0 HD21 ASN C 233 -9.063 -1.668 18.567 1.00 74.52 H new ATOM 0 HD22 ASN C 233 -9.329 -2.435 16.998 1.00 74.52 H new ATOM 1683 N CYS C 234 -7.251 0.899 13.780 1.00 51.33 N ATOM 1684 CA CYS C 234 -5.811 1.084 13.794 1.00 34.13 C ATOM 1685 C CYS C 234 -5.423 2.109 12.775 1.00 43.23 C ATOM 1686 O CYS C 234 -6.174 2.361 11.815 1.00 42.53 O ATOM 1687 CB CYS C 234 -5.088 -0.240 13.530 1.00 54.22 C ATOM 1688 SG CYS C 234 -5.422 -1.517 14.776 1.00 70.24 S ATOM 0 H CYS C 234 -7.641 0.627 12.878 1.00 51.33 H new ATOM 0 HA CYS C 234 -5.513 1.435 14.782 1.00 34.13 H new ATOM 0 HB2 CYS C 234 -5.383 -0.615 12.550 1.00 54.22 H new ATOM 0 HB3 CYS C 234 -4.014 -0.056 13.491 1.00 54.22 H new ATOM 0 HG CYS C 234 -4.772 -2.601 14.471 1.00 70.24 H new ATOM 1693 N ALA C 235 -4.290 2.725 12.973 1.00 21.44 N ATOM 1694 CA ALA C 235 -3.839 3.735 12.082 1.00 54.03 C ATOM 1695 C ALA C 235 -2.774 3.199 11.157 1.00 1.04 C ATOM 1696 O ALA C 235 -1.594 3.150 11.513 1.00 24.03 O ATOM 1697 CB ALA C 235 -3.347 4.955 12.844 1.00 41.33 C ATOM 0 H ALA C 235 -3.663 2.536 13.755 1.00 21.44 H new ATOM 0 HA ALA C 235 -4.685 4.048 11.470 1.00 54.03 H new ATOM 0 HB1 ALA C 235 -3.008 5.713 12.138 1.00 41.33 H new ATOM 0 HB2 ALA C 235 -4.160 5.359 13.447 1.00 41.33 H new ATOM 0 HB3 ALA C 235 -2.520 4.669 13.494 1.00 41.33 H new ATOM 1703 N CYS C 236 -3.227 2.722 10.002 1.00 4.21 N ATOM 1704 CA CYS C 236 -2.376 2.263 8.920 1.00 63.40 C ATOM 1705 C CYS C 236 -1.663 0.928 9.239 1.00 54.01 C ATOM 1706 O CYS C 236 -0.758 0.862 10.066 1.00 20.21 O ATOM 1707 CB CYS C 236 -1.382 3.369 8.521 1.00 64.24 C ATOM 1708 SG CYS C 236 -0.303 2.981 7.120 1.00 24.41 S ATOM 0 H CYS C 236 -4.222 2.644 9.791 1.00 4.21 H new ATOM 0 HA CYS C 236 -3.018 2.051 8.065 1.00 63.40 H new ATOM 0 HB2 CYS C 236 -1.946 4.271 8.284 1.00 64.24 H new ATOM 0 HB3 CYS C 236 -0.758 3.601 9.384 1.00 64.24 H new ATOM 1713 N GLN C 237 -2.130 -0.133 8.621 1.00 63.51 N ATOM 1714 CA GLN C 237 -1.493 -1.445 8.719 1.00 74.41 C ATOM 1715 C GLN C 237 -0.747 -1.679 7.416 1.00 22.31 C ATOM 1716 O GLN C 237 -1.364 -1.685 6.364 1.00 74.35 O ATOM 1717 CB GLN C 237 -2.577 -2.514 8.885 1.00 54.32 C ATOM 1718 CG GLN C 237 -3.386 -2.415 10.164 1.00 32.30 C ATOM 1719 CD GLN C 237 -2.588 -2.774 11.386 1.00 53.13 C ATOM 1720 OE1 GLN C 237 -2.566 -3.938 11.810 1.00 12.51 O ATOM 1721 NE2 GLN C 237 -1.920 -1.813 11.947 1.00 22.42 N ATOM 0 H GLN C 237 -2.963 -0.120 8.033 1.00 63.51 H new ATOM 0 HA GLN C 237 -0.813 -1.492 9.569 1.00 74.41 H new ATOM 0 HB2 GLN C 237 -3.258 -2.453 8.036 1.00 54.32 H new ATOM 0 HB3 GLN C 237 -2.106 -3.496 8.846 1.00 54.32 H new ATOM 0 HG2 GLN C 237 -3.767 -1.399 10.270 1.00 32.30 H new ATOM 0 HG3 GLN C 237 -4.251 -3.074 10.094 1.00 32.30 H new ATOM 0 HE21 GLN C 237 -1.967 -0.869 11.565 1.00 22.42 H new ATOM 0 HE22 GLN C 237 -1.348 -2.002 12.770 1.00 22.42 H new ATOM 1730 N ILE C 238 0.551 -1.863 7.470 1.00 12.04 N ATOM 1731 CA ILE C 238 1.327 -1.974 6.253 1.00 32.32 C ATOM 1732 C ILE C 238 1.985 -3.328 6.099 1.00 23.22 C ATOM 1733 O ILE C 238 2.654 -3.813 6.983 1.00 43.22 O ATOM 1734 CB ILE C 238 2.418 -0.887 6.180 1.00 22.24 C ATOM 1735 CG1 ILE C 238 1.806 0.460 6.493 1.00 41.24 C ATOM 1736 CG2 ILE C 238 3.089 -0.865 4.797 1.00 71.30 C ATOM 1737 CD1 ILE C 238 2.705 1.613 6.232 1.00 30.03 C ATOM 0 H ILE C 238 1.090 -1.939 8.333 1.00 12.04 H new ATOM 0 HA ILE C 238 0.614 -1.841 5.440 1.00 32.32 H new ATOM 0 HB ILE C 238 3.189 -1.115 6.916 1.00 22.24 H new ATOM 0 HG12 ILE C 238 0.898 0.580 5.902 1.00 41.24 H new ATOM 0 HG13 ILE C 238 1.508 0.476 7.541 1.00 41.24 H new ATOM 0 HG21 ILE C 238 3.854 -0.089 4.776 1.00 71.30 H new ATOM 0 HG22 ILE C 238 3.549 -1.833 4.601 1.00 71.30 H new ATOM 0 HG23 ILE C 238 2.340 -0.658 4.033 1.00 71.30 H new ATOM 0 HD11 ILE C 238 2.190 2.540 6.482 1.00 30.03 H new ATOM 0 HD12 ILE C 238 3.603 1.520 6.843 1.00 30.03 H new ATOM 0 HD13 ILE C 238 2.984 1.626 5.178 1.00 30.03 H new ATOM 1749 N VAL C 239 1.795 -3.906 4.969 1.00 72.33 N ATOM 1750 CA VAL C 239 2.412 -5.135 4.594 1.00 44.42 C ATOM 1751 C VAL C 239 3.407 -4.902 3.472 1.00 60.10 C ATOM 1752 O VAL C 239 3.123 -4.184 2.526 1.00 41.21 O ATOM 1753 CB VAL C 239 1.350 -6.220 4.220 1.00 72.20 C ATOM 1754 CG1 VAL C 239 1.937 -7.294 3.331 1.00 21.03 C ATOM 1755 CG2 VAL C 239 0.849 -6.881 5.483 1.00 64.22 C ATOM 0 H VAL C 239 1.182 -3.524 4.249 1.00 72.33 H new ATOM 0 HA VAL C 239 2.960 -5.522 5.453 1.00 44.42 H new ATOM 0 HB VAL C 239 0.542 -5.722 3.685 1.00 72.20 H new ATOM 0 HG11 VAL C 239 1.169 -8.029 3.093 1.00 21.03 H new ATOM 0 HG12 VAL C 239 2.305 -6.843 2.410 1.00 21.03 H new ATOM 0 HG13 VAL C 239 2.761 -7.785 3.849 1.00 21.03 H new ATOM 0 HG21 VAL C 239 0.108 -7.639 5.228 1.00 64.22 H new ATOM 0 HG22 VAL C 239 1.684 -7.351 6.004 1.00 64.22 H new ATOM 0 HG23 VAL C 239 0.393 -6.131 6.130 1.00 64.22 H new ATOM 1765 N ALA C 240 4.565 -5.486 3.595 1.00 1.20 N ATOM 1766 CA ALA C 240 5.575 -5.378 2.594 1.00 74.41 C ATOM 1767 C ALA C 240 5.784 -6.708 1.915 1.00 33.44 C ATOM 1768 O ALA C 240 5.874 -7.746 2.576 1.00 53.12 O ATOM 1769 CB ALA C 240 6.873 -4.953 3.228 1.00 30.55 C ATOM 0 H ALA C 240 4.832 -6.053 4.400 1.00 1.20 H new ATOM 0 HA ALA C 240 5.255 -4.640 1.859 1.00 74.41 H new ATOM 0 HB1 ALA C 240 7.643 -4.871 2.461 1.00 30.55 H new ATOM 0 HB2 ALA C 240 6.741 -3.986 3.714 1.00 30.55 H new ATOM 0 HB3 ALA C 240 7.176 -5.693 3.969 1.00 30.55 H new ATOM 1775 N ARG C 241 5.818 -6.702 0.608 1.00 75.12 N ATOM 1776 CA ARG C 241 6.199 -7.883 -0.109 1.00 41.43 C ATOM 1777 C ARG C 241 7.558 -7.714 -0.612 1.00 33.21 C ATOM 1778 O ARG C 241 7.873 -6.696 -1.210 1.00 24.35 O ATOM 1779 CB ARG C 241 5.248 -8.321 -1.210 1.00 23.00 C ATOM 1780 CG ARG C 241 4.015 -9.008 -0.695 1.00 62.51 C ATOM 1781 CD ARG C 241 3.277 -9.702 -1.811 1.00 63.11 C ATOM 1782 NE ARG C 241 2.164 -10.508 -1.314 1.00 52.15 N ATOM 1783 CZ ARG C 241 1.582 -11.509 -1.984 1.00 34.42 C ATOM 1784 NH1 ARG C 241 1.974 -11.817 -3.216 1.00 2.04 N ATOM 1785 NH2 ARG C 241 0.611 -12.203 -1.408 1.00 34.33 N ATOM 0 H ARG C 241 5.588 -5.897 0.025 1.00 75.12 H new ATOM 0 HA ARG C 241 6.149 -8.703 0.607 1.00 41.43 H new ATOM 0 HB2 ARG C 241 4.952 -7.449 -1.793 1.00 23.00 H new ATOM 0 HB3 ARG C 241 5.774 -8.994 -1.888 1.00 23.00 H new ATOM 0 HG2 ARG C 241 4.291 -9.734 0.070 1.00 62.51 H new ATOM 0 HG3 ARG C 241 3.360 -8.278 -0.219 1.00 62.51 H new ATOM 0 HD2 ARG C 241 2.901 -8.959 -2.514 1.00 63.11 H new ATOM 0 HD3 ARG C 241 3.969 -10.340 -2.361 1.00 63.11 H new ATOM 0 HE ARG C 241 1.803 -10.291 -0.385 1.00 52.15 H new ATOM 0 HH11 ARG C 241 2.725 -11.288 -3.659 1.00 2.04 H new ATOM 0 HH12 ARG C 241 1.524 -12.582 -3.718 1.00 2.04 H new ATOM 0 HH21 ARG C 241 0.312 -11.972 -0.460 1.00 34.33 H new ATOM 0 HH22 ARG C 241 0.162 -12.968 -1.912 1.00 34.33 H new ATOM 1799 N LEU C 242 8.368 -8.675 -0.361 1.00 10.10 N ATOM 1800 CA LEU C 242 9.760 -8.568 -0.673 1.00 23.32 C ATOM 1801 C LEU C 242 10.093 -9.370 -1.913 1.00 12.21 C ATOM 1802 O LEU C 242 9.461 -10.395 -2.184 1.00 23.21 O ATOM 1803 CB LEU C 242 10.593 -9.010 0.520 1.00 25.22 C ATOM 1804 CG LEU C 242 10.176 -8.396 1.867 1.00 13.43 C ATOM 1805 CD1 LEU C 242 11.028 -8.939 2.997 1.00 5.35 C ATOM 1806 CD2 LEU C 242 10.249 -6.876 1.821 1.00 0.14 C ATOM 0 H LEU C 242 8.094 -9.560 0.066 1.00 10.10 H new ATOM 0 HA LEU C 242 9.999 -7.526 -0.887 1.00 23.32 H new ATOM 0 HB2 LEU C 242 10.538 -10.096 0.600 1.00 25.22 H new ATOM 0 HB3 LEU C 242 11.636 -8.757 0.330 1.00 25.22 H new ATOM 0 HG LEU C 242 9.140 -8.679 2.056 1.00 13.43 H new ATOM 0 HD11 LEU C 242 10.713 -8.489 3.939 1.00 5.35 H new ATOM 0 HD12 LEU C 242 10.910 -10.021 3.054 1.00 5.35 H new ATOM 0 HD13 LEU C 242 12.075 -8.698 2.812 1.00 5.35 H new ATOM 0 HD21 LEU C 242 9.949 -6.468 2.786 1.00 0.14 H new ATOM 0 HD22 LEU C 242 11.270 -6.567 1.598 1.00 0.14 H new ATOM 0 HD23 LEU C 242 9.580 -6.503 1.046 1.00 0.14 H new ATOM 1818 N LYS C 243 11.069 -8.889 -2.645 1.00 41.33 N ATOM 1819 CA LYS C 243 11.526 -9.444 -3.911 1.00 13.20 C ATOM 1820 C LYS C 243 11.911 -10.921 -3.774 1.00 54.32 C ATOM 1821 O LYS C 243 11.268 -11.800 -4.366 1.00 64.12 O ATOM 1822 CB LYS C 243 12.710 -8.598 -4.410 1.00 62.30 C ATOM 1823 CG LYS C 243 13.294 -9.016 -5.733 1.00 64.21 C ATOM 1824 CD LYS C 243 14.448 -8.112 -6.122 1.00 32.43 C ATOM 1825 CE LYS C 243 15.078 -8.543 -7.430 1.00 51.31 C ATOM 1826 NZ LYS C 243 14.113 -8.517 -8.551 1.00 45.51 N ATOM 0 H LYS C 243 11.596 -8.061 -2.367 1.00 41.33 H new ATOM 0 HA LYS C 243 10.715 -9.407 -4.639 1.00 13.20 H new ATOM 0 HB2 LYS C 243 12.385 -7.560 -4.488 1.00 62.30 H new ATOM 0 HB3 LYS C 243 13.499 -8.630 -3.658 1.00 62.30 H new ATOM 0 HG2 LYS C 243 13.639 -10.048 -5.673 1.00 64.21 H new ATOM 0 HG3 LYS C 243 12.523 -8.981 -6.503 1.00 64.21 H new ATOM 0 HD2 LYS C 243 14.093 -7.085 -6.210 1.00 32.43 H new ATOM 0 HD3 LYS C 243 15.201 -8.123 -5.334 1.00 32.43 H new ATOM 0 HE2 LYS C 243 15.917 -7.887 -7.660 1.00 51.31 H new ATOM 0 HE3 LYS C 243 15.481 -9.550 -7.323 1.00 51.31 H new ATOM 0 HZ1 LYS C 243 14.624 -8.619 -9.451 1.00 45.51 H new ATOM 0 HZ2 LYS C 243 13.437 -9.300 -8.446 1.00 45.51 H new ATOM 0 HZ3 LYS C 243 13.599 -7.613 -8.545 1.00 45.51 H new ATOM 1882 N ARG C 247 8.863 -13.287 1.133 1.00 64.45 N ATOM 1883 CA ARG C 247 7.611 -13.110 0.378 1.00 30.22 C ATOM 1884 C ARG C 247 6.762 -11.955 0.838 1.00 61.11 C ATOM 1885 O ARG C 247 6.783 -10.889 0.242 1.00 52.13 O ATOM 1886 CB ARG C 247 6.820 -14.413 0.286 1.00 42.03 C ATOM 1887 CG ARG C 247 7.578 -15.515 -0.420 1.00 52.43 C ATOM 1888 CD ARG C 247 6.803 -16.810 -0.445 1.00 73.24 C ATOM 1889 NE ARG C 247 7.589 -17.892 -1.052 1.00 51.51 N ATOM 1890 CZ ARG C 247 7.364 -19.197 -0.862 1.00 63.01 C ATOM 1891 NH1 ARG C 247 6.335 -19.596 -0.122 1.00 52.20 N ATOM 1892 NH2 ARG C 247 8.167 -20.101 -1.414 1.00 42.43 N ATOM 0 HA ARG C 247 7.919 -12.836 -0.631 1.00 30.22 H new ATOM 0 HB2 ARG C 247 6.559 -14.745 1.291 1.00 42.03 H new ATOM 0 HB3 ARG C 247 5.884 -14.227 -0.241 1.00 42.03 H new ATOM 0 HG2 ARG C 247 7.799 -15.206 -1.441 1.00 52.43 H new ATOM 0 HG3 ARG C 247 8.534 -15.674 0.079 1.00 52.43 H new ATOM 0 HD2 ARG C 247 6.522 -17.088 0.571 1.00 73.24 H new ATOM 0 HD3 ARG C 247 5.878 -16.672 -1.005 1.00 73.24 H new ATOM 0 HE ARG C 247 8.363 -17.629 -1.663 1.00 51.51 H new ATOM 0 HH11 ARG C 247 5.715 -18.907 0.303 1.00 52.20 H new ATOM 0 HH12 ARG C 247 6.166 -20.592 0.021 1.00 52.20 H new ATOM 0 HH21 ARG C 247 8.957 -19.800 -1.984 1.00 42.43 H new ATOM 0 HH22 ARG C 247 7.993 -21.095 -1.267 1.00 42.43 H new ATOM 1906 N GLN C 248 6.066 -12.160 1.884 1.00 21.22 N ATOM 1907 CA GLN C 248 5.152 -11.176 2.424 1.00 12.44 C ATOM 1908 C GLN C 248 5.334 -11.063 3.929 1.00 22.10 C ATOM 1909 O GLN C 248 5.403 -12.073 4.634 1.00 54.34 O ATOM 1910 CB GLN C 248 3.709 -11.565 2.079 1.00 30.51 C ATOM 1911 CG GLN C 248 2.663 -10.607 2.608 1.00 14.32 C ATOM 1912 CD GLN C 248 1.262 -10.973 2.179 1.00 31.12 C ATOM 1913 OE1 GLN C 248 0.780 -10.522 1.131 1.00 74.10 O ATOM 1914 NE2 GLN C 248 0.607 -11.779 2.956 1.00 21.52 N ATOM 0 H GLN C 248 6.099 -13.028 2.418 1.00 21.22 H new ATOM 0 HA GLN C 248 5.367 -10.204 1.980 1.00 12.44 H new ATOM 0 HB2 GLN C 248 3.611 -11.629 0.995 1.00 30.51 H new ATOM 0 HB3 GLN C 248 3.508 -12.560 2.477 1.00 30.51 H new ATOM 0 HG2 GLN C 248 2.711 -10.589 3.697 1.00 14.32 H new ATOM 0 HG3 GLN C 248 2.892 -9.599 2.262 1.00 14.32 H new ATOM 0 HE21 GLN C 248 1.041 -12.128 3.811 1.00 21.52 H new ATOM 0 HE22 GLN C 248 -0.342 -12.064 2.712 1.00 21.52 H new ATOM 1923 N VAL C 249 5.420 -9.843 4.413 1.00 42.53 N ATOM 1924 CA VAL C 249 5.630 -9.565 5.817 1.00 61.44 C ATOM 1925 C VAL C 249 4.772 -8.380 6.203 1.00 72.21 C ATOM 1926 O VAL C 249 4.438 -7.571 5.353 1.00 54.41 O ATOM 1927 CB VAL C 249 7.135 -9.222 6.120 1.00 4.22 C ATOM 1928 CG1 VAL C 249 8.047 -10.372 5.755 1.00 13.54 C ATOM 1929 CG2 VAL C 249 7.587 -7.961 5.390 1.00 33.42 C ATOM 0 H VAL C 249 5.345 -9.006 3.835 1.00 42.53 H new ATOM 0 HA VAL C 249 5.362 -10.452 6.390 1.00 61.44 H new ATOM 0 HB VAL C 249 7.203 -9.043 7.193 1.00 4.22 H new ATOM 0 HG11 VAL C 249 9.079 -10.102 5.977 1.00 13.54 H new ATOM 0 HG12 VAL C 249 7.770 -11.254 6.333 1.00 13.54 H new ATOM 0 HG13 VAL C 249 7.950 -10.590 4.692 1.00 13.54 H new ATOM 0 HG21 VAL C 249 8.632 -7.759 5.626 1.00 33.42 H new ATOM 0 HG22 VAL C 249 7.479 -8.104 4.315 1.00 33.42 H new ATOM 0 HG23 VAL C 249 6.974 -7.117 5.707 1.00 33.42 H new ATOM 1939 N CYS C 250 4.403 -8.266 7.442 1.00 20.14 N ATOM 1940 CA CYS C 250 3.676 -7.091 7.847 1.00 11.31 C ATOM 1941 C CYS C 250 4.630 -6.213 8.593 1.00 53.01 C ATOM 1942 O CYS C 250 5.271 -6.660 9.514 1.00 12.21 O ATOM 1943 CB CYS C 250 2.441 -7.421 8.696 1.00 41.34 C ATOM 1944 SG CYS C 250 1.415 -5.966 9.073 1.00 63.14 S ATOM 0 H CYS C 250 4.584 -8.949 8.177 1.00 20.14 H new ATOM 0 HA CYS C 250 3.289 -6.582 6.964 1.00 11.31 H new ATOM 0 HB2 CYS C 250 1.834 -8.158 8.170 1.00 41.34 H new ATOM 0 HB3 CYS C 250 2.763 -7.881 9.630 1.00 41.34 H new ATOM 1949 N ILE C 251 4.733 -4.990 8.184 1.00 71.25 N ATOM 1950 CA ILE C 251 5.674 -4.052 8.732 1.00 54.40 C ATOM 1951 C ILE C 251 4.951 -2.926 9.449 1.00 33.32 C ATOM 1952 O ILE C 251 3.750 -3.008 9.665 1.00 42.04 O ATOM 1953 CB ILE C 251 6.597 -3.499 7.634 1.00 1.15 C ATOM 1954 CG1 ILE C 251 5.802 -2.936 6.464 1.00 10.10 C ATOM 1955 CG2 ILE C 251 7.547 -4.576 7.168 1.00 43.23 C ATOM 1956 CD1 ILE C 251 6.662 -2.277 5.425 1.00 40.33 C ATOM 0 H ILE C 251 4.153 -4.600 7.441 1.00 71.25 H new ATOM 0 HA ILE C 251 6.294 -4.576 9.460 1.00 54.40 H new ATOM 0 HB ILE C 251 7.174 -2.677 8.058 1.00 1.15 H new ATOM 0 HG12 ILE C 251 5.234 -3.741 5.998 1.00 10.10 H new ATOM 0 HG13 ILE C 251 5.079 -2.212 6.840 1.00 10.10 H new ATOM 0 HG21 ILE C 251 8.197 -4.176 6.390 1.00 43.23 H new ATOM 0 HG22 ILE C 251 8.153 -4.915 8.008 1.00 43.23 H new ATOM 0 HG23 ILE C 251 6.978 -5.415 6.769 1.00 43.23 H new ATOM 0 HD11 ILE C 251 6.033 -1.898 4.619 1.00 40.33 H new ATOM 0 HD12 ILE C 251 7.210 -1.451 5.877 1.00 40.33 H new ATOM 0 HD13 ILE C 251 7.368 -3.004 5.023 1.00 40.33 H new ATOM 1968 N ASP C 252 5.669 -1.896 9.833 1.00 63.55 N ATOM 1969 CA ASP C 252 5.070 -0.811 10.594 1.00 61.34 C ATOM 1970 C ASP C 252 5.198 0.522 9.863 1.00 51.43 C ATOM 1971 O ASP C 252 6.228 0.814 9.283 1.00 31.34 O ATOM 1972 CB ASP C 252 5.727 -0.719 11.962 1.00 52.42 C ATOM 1973 CG ASP C 252 5.110 0.341 12.850 1.00 2.44 C ATOM 1974 OD1 ASP C 252 4.086 0.073 13.518 1.00 42.31 O ATOM 1975 OD2 ASP C 252 5.647 1.439 12.905 1.00 34.24 O ATOM 0 H ASP C 252 6.663 -1.782 9.635 1.00 63.55 H new ATOM 0 HA ASP C 252 4.008 -1.026 10.711 1.00 61.34 H new ATOM 0 HB2 ASP C 252 5.655 -1.687 12.458 1.00 52.42 H new ATOM 0 HB3 ASP C 252 6.788 -0.505 11.835 1.00 52.42 H new ATOM 1980 N PRO C 253 4.144 1.335 9.866 1.00 42.42 N ATOM 1981 CA PRO C 253 4.143 2.647 9.212 1.00 60.13 C ATOM 1982 C PRO C 253 5.130 3.665 9.766 1.00 70.33 C ATOM 1983 O PRO C 253 5.398 4.655 9.108 1.00 44.15 O ATOM 1984 CB PRO C 253 2.738 3.171 9.385 1.00 71.44 C ATOM 1985 CG PRO C 253 2.020 2.248 10.287 1.00 20.13 C ATOM 1986 CD PRO C 253 2.840 1.009 10.453 1.00 72.23 C ATOM 0 HA PRO C 253 4.458 2.512 8.177 1.00 60.13 H new ATOM 0 HB2 PRO C 253 2.754 4.178 9.803 1.00 71.44 H new ATOM 0 HB3 PRO C 253 2.232 3.234 8.421 1.00 71.44 H new ATOM 0 HG2 PRO C 253 1.849 2.721 11.254 1.00 20.13 H new ATOM 0 HG3 PRO C 253 1.041 2.002 9.875 1.00 20.13 H new ATOM 0 HD2 PRO C 253 2.937 0.738 11.504 1.00 72.23 H new ATOM 0 HD3 PRO C 253 2.380 0.161 9.946 1.00 72.23 H new ATOM 1994 N LYS C 254 5.659 3.451 10.951 1.00 21.44 N ATOM 1995 CA LYS C 254 6.591 4.399 11.521 1.00 31.20 C ATOM 1996 C LYS C 254 7.987 4.275 10.959 1.00 32.32 C ATOM 1997 O LYS C 254 8.874 5.081 11.291 1.00 30.53 O ATOM 1998 CB LYS C 254 6.603 4.298 12.993 1.00 31.11 C ATOM 1999 CG LYS C 254 5.247 4.582 13.554 1.00 21.50 C ATOM 2000 CD LYS C 254 5.310 4.753 15.004 1.00 34.35 C ATOM 2001 CE LYS C 254 5.768 3.491 15.724 1.00 1.12 C ATOM 2002 NZ LYS C 254 5.815 3.685 17.184 1.00 50.53 N ATOM 0 H LYS C 254 5.462 2.637 11.534 1.00 21.44 H new ATOM 0 HA LYS C 254 6.237 5.390 11.237 1.00 31.20 H new ATOM 0 HB2 LYS C 254 6.923 3.300 13.291 1.00 31.11 H new ATOM 0 HB3 LYS C 254 7.327 5.001 13.405 1.00 31.11 H new ATOM 0 HG2 LYS C 254 4.840 5.483 13.095 1.00 21.50 H new ATOM 0 HG3 LYS C 254 4.569 3.765 13.309 1.00 21.50 H new ATOM 0 HD2 LYS C 254 5.992 5.569 15.240 1.00 34.35 H new ATOM 0 HD3 LYS C 254 4.327 5.042 15.375 1.00 34.35 H new ATOM 0 HE2 LYS C 254 5.091 2.670 15.487 1.00 1.12 H new ATOM 0 HE3 LYS C 254 6.755 3.204 15.363 1.00 1.12 H new ATOM 0 HZ1 LYS C 254 6.131 2.806 17.641 1.00 50.53 H new ATOM 0 HZ2 LYS C 254 6.480 4.452 17.411 1.00 50.53 H new ATOM 0 HZ3 LYS C 254 4.867 3.935 17.532 1.00 50.53 H new ATOM 2016 N LEU C 255 8.199 3.263 10.127 1.00 73.50 N ATOM 2017 CA LEU C 255 9.454 3.088 9.433 1.00 13.41 C ATOM 2018 C LEU C 255 9.645 4.303 8.531 1.00 21.14 C ATOM 2019 O LEU C 255 8.796 4.593 7.686 1.00 54.30 O ATOM 2020 CB LEU C 255 9.408 1.802 8.601 1.00 31.41 C ATOM 2021 CG LEU C 255 9.143 0.499 9.377 1.00 64.41 C ATOM 2022 CD1 LEU C 255 8.970 -0.669 8.425 1.00 3.03 C ATOM 2023 CD2 LEU C 255 10.258 0.213 10.368 1.00 53.41 C ATOM 0 H LEU C 255 7.504 2.546 9.919 1.00 73.50 H new ATOM 0 HA LEU C 255 10.284 3.004 10.135 1.00 13.41 H new ATOM 0 HB2 LEU C 255 8.633 1.912 7.842 1.00 31.41 H new ATOM 0 HB3 LEU C 255 10.357 1.700 8.075 1.00 31.41 H new ATOM 0 HG LEU C 255 8.217 0.630 9.937 1.00 64.41 H new ATOM 0 HD11 LEU C 255 8.784 -1.579 8.996 1.00 3.03 H new ATOM 0 HD12 LEU C 255 8.126 -0.477 7.763 1.00 3.03 H new ATOM 0 HD13 LEU C 255 9.876 -0.792 7.831 1.00 3.03 H new ATOM 0 HD21 LEU C 255 10.043 -0.713 10.901 1.00 53.41 H new ATOM 0 HD22 LEU C 255 11.203 0.113 9.834 1.00 53.41 H new ATOM 0 HD23 LEU C 255 10.330 1.034 11.082 1.00 53.41 H new ATOM 2035 N LYS C 256 10.736 5.010 8.718 1.00 24.12 N ATOM 2036 CA LYS C 256 10.940 6.277 8.044 1.00 63.11 C ATOM 2037 C LYS C 256 10.976 6.142 6.513 1.00 22.01 C ATOM 2038 O LYS C 256 10.477 7.025 5.819 1.00 63.14 O ATOM 2039 CB LYS C 256 12.152 7.034 8.663 1.00 71.01 C ATOM 2040 CG LYS C 256 12.390 8.490 8.191 1.00 51.41 C ATOM 2041 CD LYS C 256 13.062 8.610 6.830 1.00 70.44 C ATOM 2042 CE LYS C 256 14.451 8.000 6.838 1.00 55.33 C ATOM 2043 NZ LYS C 256 15.152 8.229 5.568 1.00 30.23 N ATOM 0 H LYS C 256 11.500 4.730 9.333 1.00 24.12 H new ATOM 0 HA LYS C 256 10.067 6.905 8.220 1.00 63.11 H new ATOM 0 HB2 LYS C 256 12.026 7.046 9.746 1.00 71.01 H new ATOM 0 HB3 LYS C 256 13.054 6.459 8.453 1.00 71.01 H new ATOM 0 HG2 LYS C 256 11.432 9.009 8.156 1.00 51.41 H new ATOM 0 HG3 LYS C 256 13.003 9.003 8.932 1.00 51.41 H new ATOM 0 HD2 LYS C 256 12.450 8.114 6.076 1.00 70.44 H new ATOM 0 HD3 LYS C 256 13.127 9.661 6.547 1.00 70.44 H new ATOM 0 HE2 LYS C 256 15.031 8.427 7.656 1.00 55.33 H new ATOM 0 HE3 LYS C 256 14.377 6.929 7.025 1.00 55.33 H new ATOM 0 HZ1 LYS C 256 16.098 7.798 5.611 1.00 30.23 H new ATOM 0 HZ2 LYS C 256 14.611 7.800 4.790 1.00 30.23 H new ATOM 0 HZ3 LYS C 256 15.245 9.251 5.402 1.00 30.23 H new ATOM 2057 N TRP C 257 11.503 5.028 5.975 1.00 50.11 N ATOM 2058 CA TRP C 257 11.520 4.890 4.515 1.00 75.24 C ATOM 2059 C TRP C 257 10.085 4.722 4.004 1.00 1.11 C ATOM 2060 O TRP C 257 9.747 5.190 2.927 1.00 62.13 O ATOM 2061 CB TRP C 257 12.454 3.744 3.992 1.00 71.02 C ATOM 2062 CG TRP C 257 11.946 2.331 4.129 1.00 64.01 C ATOM 2063 CD1 TRP C 257 12.291 1.404 5.062 1.00 4.51 C ATOM 2064 CD2 TRP C 257 11.016 1.690 3.254 1.00 60.31 C ATOM 2065 NE1 TRP C 257 11.615 0.226 4.825 1.00 14.45 N ATOM 2066 CE2 TRP C 257 10.824 0.389 3.716 1.00 71.25 C ATOM 2067 CE3 TRP C 257 10.320 2.114 2.123 1.00 70.32 C ATOM 2068 CZ2 TRP C 257 9.965 -0.495 3.074 1.00 32.10 C ATOM 2069 CZ3 TRP C 257 9.482 1.249 1.498 1.00 23.11 C ATOM 2070 CH2 TRP C 257 9.307 -0.032 1.967 1.00 11.32 C ATOM 0 H TRP C 257 11.902 4.250 6.499 1.00 50.11 H new ATOM 0 HA TRP C 257 11.952 5.806 4.112 1.00 75.24 H new ATOM 0 HB2 TRP C 257 12.660 3.929 2.938 1.00 71.02 H new ATOM 0 HB3 TRP C 257 13.405 3.815 4.520 1.00 71.02 H new ATOM 0 HD1 TRP C 257 12.990 1.566 5.869 1.00 4.51 H new ATOM 0 HE1 TRP C 257 11.690 -0.625 5.382 1.00 14.45 H new ATOM 0 HE3 TRP C 257 10.446 3.119 1.749 1.00 70.32 H new ATOM 0 HZ2 TRP C 257 9.823 -1.504 3.433 1.00 32.10 H new ATOM 0 HZ3 TRP C 257 8.944 1.571 0.619 1.00 23.11 H new ATOM 0 HH2 TRP C 257 8.630 -0.693 1.446 1.00 11.32 H new ATOM 2081 N ILE C 258 9.248 4.047 4.807 1.00 22.23 N ATOM 2082 CA ILE C 258 7.820 3.875 4.516 1.00 43.34 C ATOM 2083 C ILE C 258 7.164 5.217 4.392 1.00 61.11 C ATOM 2084 O ILE C 258 6.409 5.486 3.451 1.00 1.34 O ATOM 2085 CB ILE C 258 7.119 3.068 5.650 1.00 64.40 C ATOM 2086 CG1 ILE C 258 7.388 1.582 5.517 1.00 61.02 C ATOM 2087 CG2 ILE C 258 5.623 3.333 5.705 1.00 13.41 C ATOM 2088 CD1 ILE C 258 6.675 0.961 4.352 1.00 73.31 C ATOM 0 H ILE C 258 9.545 3.605 5.677 1.00 22.23 H new ATOM 0 HA ILE C 258 7.725 3.326 3.579 1.00 43.34 H new ATOM 0 HB ILE C 258 7.549 3.415 6.589 1.00 64.40 H new ATOM 0 HG12 ILE C 258 8.460 1.420 5.408 1.00 61.02 H new ATOM 0 HG13 ILE C 258 7.081 1.079 6.434 1.00 61.02 H new ATOM 0 HG21 ILE C 258 5.179 2.748 6.511 1.00 13.41 H new ATOM 0 HG22 ILE C 258 5.448 4.393 5.887 1.00 13.41 H new ATOM 0 HG23 ILE C 258 5.168 3.048 4.757 1.00 13.41 H new ATOM 0 HD11 ILE C 258 6.907 -0.103 4.309 1.00 73.31 H new ATOM 0 HD12 ILE C 258 5.600 1.094 4.471 1.00 73.31 H new ATOM 0 HD13 ILE C 258 7.000 1.441 3.429 1.00 73.31 H new ATOM 2100 N GLN C 259 7.472 6.054 5.330 1.00 43.42 N ATOM 2101 CA GLN C 259 6.934 7.355 5.372 1.00 32.54 C ATOM 2102 C GLN C 259 7.392 8.188 4.197 1.00 21.14 C ATOM 2103 O GLN C 259 6.656 9.004 3.708 1.00 1.23 O ATOM 2104 CB GLN C 259 7.221 7.986 6.704 1.00 42.32 C ATOM 2105 CG GLN C 259 6.635 7.139 7.807 1.00 1.31 C ATOM 2106 CD GLN C 259 6.640 7.764 9.146 1.00 22.23 C ATOM 2107 OE1 GLN C 259 5.683 7.370 9.928 1.00 53.41 O flip ATOM 2108 NE2 GLN C 259 7.498 8.580 9.485 1.00 52.22 N flip ATOM 0 H GLN C 259 8.114 5.840 6.094 1.00 43.42 H new ATOM 0 HA GLN C 259 5.850 7.296 5.273 1.00 32.54 H new ATOM 0 HB2 GLN C 259 8.297 8.088 6.844 1.00 42.32 H new ATOM 0 HB3 GLN C 259 6.798 8.990 6.740 1.00 42.32 H new ATOM 0 HG2 GLN C 259 5.608 6.887 7.544 1.00 1.31 H new ATOM 0 HG3 GLN C 259 7.189 6.202 7.858 1.00 1.31 H new ATOM 0 HE21 GLN C 259 8.229 8.854 8.828 1.00 52.22 H new ATOM 0 HE22 GLN C 259 7.478 8.981 10.422 1.00 52.22 H new ATOM 2117 N GLU C 260 8.594 7.945 3.724 1.00 33.43 N ATOM 2118 CA GLU C 260 9.083 8.632 2.538 1.00 10.44 C ATOM 2119 C GLU C 260 8.413 8.073 1.297 1.00 23.32 C ATOM 2120 O GLU C 260 8.190 8.788 0.335 1.00 61.41 O ATOM 2121 CB GLU C 260 10.577 8.467 2.375 1.00 15.22 C ATOM 2122 CG GLU C 260 11.411 8.982 3.503 1.00 32.34 C ATOM 2123 CD GLU C 260 12.876 8.859 3.193 1.00 53.24 C ATOM 2124 OE1 GLU C 260 13.445 9.782 2.575 1.00 55.22 O ATOM 2125 OE2 GLU C 260 13.486 7.836 3.546 1.00 53.13 O ATOM 0 H GLU C 260 9.251 7.282 4.135 1.00 33.43 H new ATOM 0 HA GLU C 260 8.849 9.689 2.661 1.00 10.44 H new ATOM 0 HB2 GLU C 260 10.795 7.408 2.240 1.00 15.22 H new ATOM 0 HB3 GLU C 260 10.883 8.974 1.460 1.00 15.22 H new ATOM 0 HG2 GLU C 260 11.163 10.026 3.695 1.00 32.34 H new ATOM 0 HG3 GLU C 260 11.181 8.427 4.412 1.00 32.34 H new ATOM 2132 N TYR C 261 8.095 6.784 1.339 1.00 1.01 N ATOM 2133 CA TYR C 261 7.485 6.076 0.208 1.00 44.43 C ATOM 2134 C TYR C 261 6.151 6.736 -0.102 1.00 50.43 C ATOM 2135 O TYR C 261 5.848 7.061 -1.243 1.00 11.13 O ATOM 2136 CB TYR C 261 7.265 4.598 0.582 1.00 12.51 C ATOM 2137 CG TYR C 261 7.372 3.624 -0.549 1.00 12.43 C ATOM 2138 CD1 TYR C 261 8.600 3.310 -1.115 1.00 41.20 C ATOM 2139 CD2 TYR C 261 6.265 2.980 -1.015 1.00 13.41 C ATOM 2140 CE1 TYR C 261 8.693 2.378 -2.118 1.00 73.01 C ATOM 2141 CE2 TYR C 261 6.350 2.056 -2.016 1.00 72.10 C ATOM 2142 CZ TYR C 261 7.554 1.757 -2.559 1.00 21.25 C ATOM 2143 OH TYR C 261 7.620 0.832 -3.543 1.00 33.11 O ATOM 0 H TYR C 261 8.251 6.195 2.157 1.00 1.01 H new ATOM 0 HA TYR C 261 8.136 6.122 -0.665 1.00 44.43 H new ATOM 0 HB2 TYR C 261 7.992 4.323 1.346 1.00 12.51 H new ATOM 0 HB3 TYR C 261 6.277 4.498 1.032 1.00 12.51 H new ATOM 0 HD1 TYR C 261 9.493 3.805 -0.762 1.00 41.20 H new ATOM 0 HD2 TYR C 261 5.301 3.205 -0.583 1.00 13.41 H new ATOM 0 HE1 TYR C 261 9.651 2.137 -2.554 1.00 73.01 H new ATOM 0 HE2 TYR C 261 5.458 1.564 -2.375 1.00 72.10 H new ATOM 0 HH TYR C 261 8.548 0.536 -3.652 1.00 33.11 H new ATOM 2153 N LEU C 262 5.383 6.962 0.944 1.00 70.42 N ATOM 2154 CA LEU C 262 4.115 7.605 0.843 1.00 53.13 C ATOM 2155 C LEU C 262 4.253 9.113 0.601 1.00 24.20 C ATOM 2156 O LEU C 262 3.391 9.734 -0.018 1.00 51.15 O ATOM 2157 CB LEU C 262 3.195 7.194 1.998 1.00 74.30 C ATOM 2158 CG LEU C 262 3.713 7.351 3.416 1.00 64.24 C ATOM 2159 CD1 LEU C 262 3.562 8.756 3.897 1.00 15.45 C ATOM 2160 CD2 LEU C 262 3.062 6.359 4.364 1.00 12.32 C ATOM 0 H LEU C 262 5.637 6.696 1.895 1.00 70.42 H new ATOM 0 HA LEU C 262 3.605 7.250 -0.053 1.00 53.13 H new ATOM 0 HB2 LEU C 262 2.275 7.772 1.913 1.00 74.30 H new ATOM 0 HB3 LEU C 262 2.928 6.147 1.855 1.00 74.30 H new ATOM 0 HG LEU C 262 4.779 7.125 3.401 1.00 64.24 H new ATOM 0 HD11 LEU C 262 3.942 8.835 4.915 1.00 15.45 H new ATOM 0 HD12 LEU C 262 4.125 9.426 3.247 1.00 15.45 H new ATOM 0 HD13 LEU C 262 2.508 9.035 3.881 1.00 15.45 H new ATOM 0 HD21 LEU C 262 3.458 6.502 5.369 1.00 12.32 H new ATOM 0 HD22 LEU C 262 1.984 6.518 4.373 1.00 12.32 H new ATOM 0 HD23 LEU C 262 3.276 5.343 4.031 1.00 12.32 H new ATOM 2172 N GLU C 263 5.357 9.697 1.086 1.00 61.45 N ATOM 2173 CA GLU C 263 5.702 11.090 0.775 1.00 62.40 C ATOM 2174 C GLU C 263 5.862 11.290 -0.715 1.00 34.23 C ATOM 2175 O GLU C 263 5.657 12.384 -1.227 1.00 4.11 O ATOM 2176 CB GLU C 263 6.962 11.540 1.502 1.00 72.41 C ATOM 2177 CG GLU C 263 6.766 11.866 2.969 1.00 50.40 C ATOM 2178 CD GLU C 263 6.024 13.157 3.201 1.00 4.31 C ATOM 2179 OE1 GLU C 263 6.444 14.201 2.649 1.00 64.54 O ATOM 2180 OE2 GLU C 263 5.065 13.176 3.976 1.00 52.44 O ATOM 0 H GLU C 263 6.026 9.226 1.695 1.00 61.45 H new ATOM 0 HA GLU C 263 4.875 11.707 1.126 1.00 62.40 H new ATOM 0 HB2 GLU C 263 7.714 10.756 1.416 1.00 72.41 H new ATOM 0 HB3 GLU C 263 7.360 12.421 0.998 1.00 72.41 H new ATOM 0 HG2 GLU C 263 6.220 11.051 3.445 1.00 50.40 H new ATOM 0 HG3 GLU C 263 7.740 11.923 3.454 1.00 50.40 H new ATOM 2187 N LYS C 264 6.214 10.226 -1.415 1.00 33.55 N ATOM 2188 CA LYS C 264 6.372 10.281 -2.850 1.00 73.34 C ATOM 2189 C LYS C 264 5.004 10.354 -3.529 1.00 21.21 C ATOM 2190 O LYS C 264 4.909 10.676 -4.698 1.00 71.31 O ATOM 2191 CB LYS C 264 7.135 9.064 -3.379 1.00 45.35 C ATOM 2192 CG LYS C 264 8.476 8.779 -2.700 1.00 64.42 C ATOM 2193 CD LYS C 264 9.459 9.948 -2.754 1.00 52.23 C ATOM 2194 CE LYS C 264 9.828 10.351 -4.169 1.00 53.04 C ATOM 2195 NZ LYS C 264 10.880 11.396 -4.181 1.00 11.52 N ATOM 0 H LYS C 264 6.396 9.310 -1.006 1.00 33.55 H new ATOM 0 HA LYS C 264 6.948 11.176 -3.082 1.00 73.34 H new ATOM 0 HB2 LYS C 264 6.500 8.185 -3.272 1.00 45.35 H new ATOM 0 HB3 LYS C 264 7.310 9.203 -4.446 1.00 45.35 H new ATOM 0 HG2 LYS C 264 8.296 8.517 -1.658 1.00 64.42 H new ATOM 0 HG3 LYS C 264 8.934 7.910 -3.173 1.00 64.42 H new ATOM 0 HD2 LYS C 264 9.023 10.805 -2.241 1.00 52.23 H new ATOM 0 HD3 LYS C 264 10.365 9.678 -2.212 1.00 52.23 H new ATOM 0 HE2 LYS C 264 10.177 9.476 -4.718 1.00 53.04 H new ATOM 0 HE3 LYS C 264 8.942 10.720 -4.686 1.00 53.04 H new ATOM 0 HZ1 LYS C 264 11.108 11.648 -5.164 1.00 11.52 H new ATOM 0 HZ2 LYS C 264 10.537 12.239 -3.678 1.00 11.52 H new ATOM 0 HZ3 LYS C 264 11.734 11.035 -3.709 1.00 11.52 H new ATOM 2209 N CYS C 265 3.958 10.036 -2.794 1.00 2.13 N ATOM 2210 CA CYS C 265 2.607 10.122 -3.314 1.00 21.14 C ATOM 2211 C CYS C 265 2.080 11.506 -3.032 1.00 12.24 C ATOM 2212 O CYS C 265 1.179 12.012 -3.708 1.00 64.10 O ATOM 2213 CB CYS C 265 1.724 9.137 -2.592 1.00 30.33 C ATOM 2214 SG CYS C 265 2.427 7.449 -2.478 1.00 63.52 S ATOM 0 H CYS C 265 4.018 9.713 -1.828 1.00 2.13 H new ATOM 0 HA CYS C 265 2.611 9.908 -4.383 1.00 21.14 H new ATOM 0 HB2 CYS C 265 1.531 9.508 -1.585 1.00 30.33 H new ATOM 0 HB3 CYS C 265 0.762 9.085 -3.102 1.00 30.33 H new ATOM 2219 N LEU C 266 2.649 12.118 -2.024 1.00 64.32 N ATOM 2220 CA LEU C 266 2.234 13.390 -1.588 1.00 74.01 C ATOM 2221 C LEU C 266 2.703 14.485 -2.486 1.00 42.00 C ATOM 2222 O LEU C 266 3.905 14.752 -2.633 1.00 72.22 O ATOM 2223 CB LEU C 266 2.640 13.615 -0.148 1.00 73.21 C ATOM 2224 CG LEU C 266 1.929 12.701 0.845 1.00 13.31 C ATOM 2225 CD1 LEU C 266 2.559 12.750 2.209 1.00 72.22 C ATOM 2226 CD2 LEU C 266 0.463 13.104 0.935 1.00 64.24 C ATOM 0 H LEU C 266 3.423 11.725 -1.488 1.00 64.32 H new ATOM 0 HA LEU C 266 1.145 13.416 -1.638 1.00 74.01 H new ATOM 0 HB2 LEU C 266 3.716 13.467 -0.057 1.00 73.21 H new ATOM 0 HB3 LEU C 266 2.437 14.652 0.119 1.00 73.21 H new ATOM 0 HG LEU C 266 2.017 11.676 0.484 1.00 13.31 H new ATOM 0 HD11 LEU C 266 2.020 12.084 2.883 1.00 72.22 H new ATOM 0 HD12 LEU C 266 3.600 12.433 2.141 1.00 72.22 H new ATOM 0 HD13 LEU C 266 2.515 13.769 2.594 1.00 72.22 H new ATOM 0 HD21 LEU C 266 -0.050 12.454 1.644 1.00 64.24 H new ATOM 0 HD22 LEU C 266 0.390 14.138 1.272 1.00 64.24 H new ATOM 0 HD23 LEU C 266 -0.001 13.009 -0.047 1.00 64.24 H new ATOM 2238 N ASN C 267 1.720 15.080 -3.109 1.00 13.21 N ATOM 2239 CA ASN C 267 1.828 16.256 -3.928 1.00 45.24 C ATOM 2240 C ASN C 267 2.530 15.998 -5.246 1.00 2.50 C ATOM 2241 O ASN C 267 2.936 16.937 -5.933 1.00 74.22 O ATOM 2242 CB ASN C 267 2.475 17.402 -3.159 1.00 1.40 C ATOM 2243 CG ASN C 267 1.838 17.659 -1.787 1.00 33.12 C ATOM 2244 OD1 ASN C 267 0.575 17.299 -1.622 1.00 2.22 O flip ATOM 2245 ND2 ASN C 267 2.501 18.153 -0.877 1.00 32.42 N flip ATOM 0 H ASN C 267 0.762 14.733 -3.054 1.00 13.21 H new ATOM 0 HA ASN C 267 0.811 16.552 -4.184 1.00 45.24 H new ATOM 0 HB2 ASN C 267 3.534 17.185 -3.023 1.00 1.40 H new ATOM 0 HB3 ASN C 267 2.410 18.311 -3.756 1.00 1.40 H new ATOM 0 HD21 ASN C 267 3.472 18.419 -1.040 1.00 32.42 H new ATOM 0 HD22 ASN C 267 2.080 18.297 0.041 1.00 32.42 H new ATOM 2252 N LYS C 268 2.628 14.746 -5.627 1.00 3.34 N ATOM 2253 CA LYS C 268 3.236 14.394 -6.887 1.00 4.11 C ATOM 2254 C LYS C 268 2.197 13.821 -7.822 1.00 3.52 C ATOM 2255 O LYS C 268 1.549 14.622 -8.548 1.00 38.06 O ATOM 2256 CB LYS C 268 4.403 13.424 -6.696 1.00 60.34 C ATOM 2257 CG LYS C 268 5.550 14.002 -5.892 1.00 4.03 C ATOM 2258 CD LYS C 268 6.682 13.010 -5.760 1.00 54.15 C ATOM 2259 CE LYS C 268 7.850 13.600 -5.001 1.00 22.43 C ATOM 2260 NZ LYS C 268 8.410 14.779 -5.691 1.00 63.05 N ATOM 2261 OXT LYS C 268 2.001 12.586 -7.834 1.00 38.06 O ATOM 0 H LYS C 268 2.293 13.953 -5.080 1.00 3.34 H new ATOM 0 HA LYS C 268 3.644 15.301 -7.334 1.00 4.11 H new ATOM 0 HB2 LYS C 268 4.039 12.525 -6.199 1.00 60.34 H new ATOM 0 HB3 LYS C 268 4.774 13.119 -7.674 1.00 60.34 H new ATOM 0 HG2 LYS C 268 5.913 14.910 -6.374 1.00 4.03 H new ATOM 0 HG3 LYS C 268 5.196 14.287 -4.901 1.00 4.03 H new ATOM 0 HD2 LYS C 268 6.327 12.117 -5.246 1.00 54.15 H new ATOM 0 HD3 LYS C 268 7.011 12.698 -6.751 1.00 54.15 H new ATOM 0 HE2 LYS C 268 7.527 13.884 -3.999 1.00 22.43 H new ATOM 0 HE3 LYS C 268 8.627 12.844 -4.883 1.00 22.43 H new ATOM 0 HZ1 LYS C 268 9.352 14.992 -5.305 1.00 63.05 H new ATOM 0 HZ2 LYS C 268 8.489 14.580 -6.709 1.00 63.05 H new ATOM 0 HZ3 LYS C 268 7.784 15.596 -5.546 1.00 63.05 H new