USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 972 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 164 ASN : amide:sc= -2.07! C(o=-2!,f=-3.9!) USER MOD Set 1.2: A 167 ASN : amide:sc= 0.0327 X(o=-2,f=-2.1) USER MOD Set 2.1: A 68 TYR OH : rot 23:sc= -0.248 USER MOD Set 2.2: A 157 HIS : no HD1:sc= -0.482 X(o=-0.73,f=-1) USER MOD Set 3.1: A 26 TYR OH : rot 143:sc= 0.0368 USER MOD Set 3.2: A 134 MET CE :methyl -133:sc= -1.87 (180deg=-5.06!) USER MOD Set 3.3: A 176 CYS SG : rot 2:sc= 0.669 USER MOD Set 4.1: A 126 CYS SG : rot 134:sc= -0.661 USER MOD Set 4.2: A 147 MET CE :methyl 165:sc= -0.236 (180deg=0) USER MOD Set 5.1: A 63 LYS NZ :NH3+ 159:sc= 0 (180deg=0) USER MOD Set 5.2: A 105 ASN : amide:sc= -1.42 K(o=-1.4,f=-7.1!) USER MOD Set 6.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 89 ASN : amide:sc= -3.49! K(o=-3.5!,f=-1.5) USER MOD Set 7.1: A 28 ASN : amide:sc= -1.89! C(o=-1.9!,f=-4.8!) USER MOD Set 7.2: A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 153:sc= -0.231 (180deg=-1.05) USER MOD Single : A 21 MET CE :methyl -107:sc= 0 (180deg=-0.416) USER MOD Single : A 22 GLN : amide:sc= 0.0865 K(o=0.087,f=-2.6!) USER MOD Single : A 23 GLN : amide:sc= -0.147 K(o=-0.15,f=-2.2!) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 67 GLN : amide:sc= 0.467 X(o=0.47,f=0) USER MOD Single : A 71 MET CE :methyl -153:sc= -0.334 (180deg=-1.28) USER MOD Single : A 80 MET CE :methyl 147:sc= -2.62 (180deg=-3.72!) USER MOD Single : A 82 THR OG1 : rot -140:sc= 0.181 USER MOD Single : A 84 ASN : amide:sc= -0.262 K(o=-0.26,f=-3.2) USER MOD Single : A 91 MET CE :methyl -119:sc= 0 (180deg=-0.0226) USER MOD Single : A 92 THR OG1 : rot -41:sc= 0.733 USER MOD Single : A 93 SER OG : rot 76:sc= 0.378 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot -136:sc= -2.47! USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0.186 X(o=0.19,f=0) USER MOD Single : A 104 MET CE :methyl -109:sc= -0.896 (180deg=-3.41!) USER MOD Single : A 110 THR OG1 : rot 67:sc= 1.14 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.01 K(o=-0.01,f=-2.5!) USER MOD Single : A 132 SER OG : rot -40:sc= -0.715 USER MOD Single : A 138 LYS NZ :NH3+ 142:sc= -0.275 (180deg=-1.94!) USER MOD Single : A 141 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-0.73) USER MOD Single : A 142 THR OG1 : rot 46:sc= 0.231 USER MOD Single : A 149 THR OG1 : rot -100:sc= 1.08 USER MOD Single : A 151 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 CYS SG : rot 180:sc=-0.00161 USER MOD Single : A 161 CYS SG : rot 160:sc= -3.05! USER MOD Single : A 169 SER OG : rot -34:sc= 0.852 USER MOD Single : A 173 GLN : amide:sc= 0.289 K(o=0.29,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -3.617 7.983 -11.678 1.00 0.00 N ATOM 214 CA LEU A 18 -4.186 6.716 -11.232 1.00 0.00 C ATOM 215 C LEU A 18 -4.200 5.696 -12.367 1.00 0.00 C ATOM 216 O LEU A 18 -3.913 4.518 -12.158 1.00 0.00 O ATOM 217 CB LEU A 18 -5.607 6.930 -10.706 1.00 0.00 C ATOM 218 CG LEU A 18 -5.722 7.395 -9.254 1.00 0.00 C ATOM 219 CD1 LEU A 18 -7.162 7.748 -8.919 1.00 0.00 C ATOM 220 CD2 LEU A 18 -5.200 6.323 -8.308 1.00 0.00 C ATOM 0 HA LEU A 18 -3.561 6.328 -10.427 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.102 7.664 -11.342 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.157 5.995 -10.812 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.112 8.290 -9.130 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.224 8.077 -7.882 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.502 8.550 -9.575 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.794 6.871 -9.060 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.289 6.671 -7.279 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.783 5.411 -8.435 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.153 6.118 -8.532 1.00 0.00 H new ATOM 232 N SER A 19 -4.533 6.159 -13.567 1.00 0.00 N ATOM 233 CA SER A 19 -4.586 5.287 -14.735 1.00 0.00 C ATOM 234 C SER A 19 -3.292 4.492 -14.877 1.00 0.00 C ATOM 235 O SER A 19 -3.261 3.284 -14.640 1.00 0.00 O ATOM 236 CB SER A 19 -4.835 6.109 -16.001 1.00 0.00 C ATOM 237 OG SER A 19 -6.213 6.394 -16.161 1.00 0.00 O ATOM 0 H SER A 19 -4.770 7.133 -13.756 1.00 0.00 H new ATOM 0 HA SER A 19 -5.410 4.586 -14.598 1.00 0.00 H new ATOM 0 HB2 SER A 19 -4.271 7.041 -15.950 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.470 5.563 -16.871 1.00 0.00 H new ATOM 0 HG SER A 19 -6.345 6.922 -16.976 1.00 0.00 H new ATOM 243 N LYS A 20 -2.223 5.178 -15.267 1.00 0.00 N ATOM 244 CA LYS A 20 -0.924 4.539 -15.441 1.00 0.00 C ATOM 245 C LYS A 20 -0.641 3.562 -14.304 1.00 0.00 C ATOM 246 O LYS A 20 0.020 2.543 -14.499 1.00 0.00 O ATOM 247 CB LYS A 20 0.182 5.594 -15.507 1.00 0.00 C ATOM 248 CG LYS A 20 0.259 6.474 -14.271 1.00 0.00 C ATOM 249 CD LYS A 20 1.669 6.992 -14.043 1.00 0.00 C ATOM 250 CE LYS A 20 2.495 6.017 -13.218 1.00 0.00 C ATOM 251 NZ LYS A 20 3.157 4.991 -14.071 1.00 0.00 N ATOM 0 H LYS A 20 -2.231 6.178 -15.469 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.944 3.983 -16.378 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.141 5.095 -15.647 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.020 6.224 -16.382 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.426 7.315 -14.379 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -0.067 5.907 -13.399 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.156 7.160 -15.004 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.626 7.955 -13.534 1.00 0.00 H new ATOM 0 HE2 LYS A 20 3.251 6.566 -12.657 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.853 5.523 -12.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.022 4.655 -13.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.509 4.191 -14.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.403 5.410 -14.990 1.00 0.00 H new ATOM 265 N MET A 21 -1.148 3.881 -13.117 1.00 0.00 N ATOM 266 CA MET A 21 -0.952 3.029 -11.949 1.00 0.00 C ATOM 267 C MET A 21 -1.861 1.806 -12.010 1.00 0.00 C ATOM 268 O MET A 21 -1.480 0.717 -11.581 1.00 0.00 O ATOM 269 CB MET A 21 -1.221 3.817 -10.666 1.00 0.00 C ATOM 270 CG MET A 21 -0.208 4.920 -10.406 1.00 0.00 C ATOM 271 SD MET A 21 1.432 4.279 -10.015 1.00 0.00 S ATOM 272 CE MET A 21 1.281 4.018 -8.249 1.00 0.00 C ATOM 0 H MET A 21 -1.697 4.722 -12.939 1.00 0.00 H new ATOM 0 HA MET A 21 0.084 2.689 -11.947 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.217 4.256 -10.721 1.00 0.00 H new ATOM 0 HB3 MET A 21 -1.222 3.129 -9.820 1.00 0.00 H new ATOM 0 HG2 MET A 21 -0.143 5.563 -11.284 1.00 0.00 H new ATOM 0 HG3 MET A 21 -0.557 5.542 -9.581 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.852 4.780 -7.718 1.00 0.00 H new ATOM 0 HE2 MET A 21 0.232 4.084 -7.960 1.00 0.00 H new ATOM 0 HE3 MET A 21 1.667 3.031 -7.993 1.00 0.00 H new ATOM 282 N GLN A 22 -3.064 1.994 -12.543 1.00 0.00 N ATOM 283 CA GLN A 22 -4.028 0.906 -12.657 1.00 0.00 C ATOM 284 C GLN A 22 -3.672 -0.016 -13.819 1.00 0.00 C ATOM 285 O GLN A 22 -4.182 -1.132 -13.916 1.00 0.00 O ATOM 286 CB GLN A 22 -5.439 1.464 -12.847 1.00 0.00 C ATOM 287 CG GLN A 22 -5.951 2.246 -11.648 1.00 0.00 C ATOM 288 CD GLN A 22 -7.170 3.084 -11.975 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.052 4.236 -12.394 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.352 2.510 -11.786 1.00 0.00 N ATOM 0 H GLN A 22 -3.394 2.890 -12.903 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.996 0.327 -11.734 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.450 2.111 -13.724 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.122 0.640 -13.051 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.197 1.552 -10.845 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.158 2.895 -11.277 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.404 1.553 -11.437 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.208 3.026 -11.990 1.00 0.00 H new ATOM 299 N GLN A 23 -2.794 0.459 -14.697 1.00 0.00 N ATOM 300 CA GLN A 23 -2.372 -0.324 -15.853 1.00 0.00 C ATOM 301 C GLN A 23 -1.185 -1.214 -15.503 1.00 0.00 C ATOM 302 O GLN A 23 -1.276 -2.440 -15.565 1.00 0.00 O ATOM 303 CB GLN A 23 -2.006 0.601 -17.015 1.00 0.00 C ATOM 304 CG GLN A 23 -3.211 1.237 -17.689 1.00 0.00 C ATOM 305 CD GLN A 23 -2.964 1.550 -19.152 1.00 0.00 C ATOM 306 OE1 GLN A 23 -2.085 0.963 -19.784 1.00 0.00 O ATOM 307 NE2 GLN A 23 -3.740 2.478 -19.699 1.00 0.00 N ATOM 0 H GLN A 23 -2.362 1.380 -14.630 1.00 0.00 H new ATOM 0 HA GLN A 23 -3.204 -0.961 -16.153 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.348 1.388 -16.648 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.443 0.034 -17.756 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -4.066 0.566 -17.604 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -3.473 2.156 -17.164 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -4.456 2.939 -19.138 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -3.620 2.730 -20.680 1.00 0.00 H new ATOM 316 N ASN A 24 -0.070 -0.589 -15.136 1.00 0.00 N ATOM 317 CA ASN A 24 1.136 -1.326 -14.777 1.00 0.00 C ATOM 318 C ASN A 24 1.380 -1.270 -13.272 1.00 0.00 C ATOM 319 O ASN A 24 1.574 -2.299 -12.625 1.00 0.00 O ATOM 320 CB ASN A 24 2.346 -0.758 -15.522 1.00 0.00 C ATOM 321 CG ASN A 24 2.277 -1.013 -17.015 1.00 0.00 C ATOM 322 OD1 ASN A 24 2.288 -2.160 -17.462 1.00 0.00 O ATOM 323 ND2 ASN A 24 2.205 0.060 -17.795 1.00 0.00 N ATOM 0 H ASN A 24 0.023 0.425 -15.080 1.00 0.00 H new ATOM 0 HA ASN A 24 0.995 -2.367 -15.066 1.00 0.00 H new ATOM 0 HB2 ASN A 24 2.409 0.315 -15.342 1.00 0.00 H new ATOM 0 HB3 ASN A 24 3.257 -1.203 -15.122 1.00 0.00 H new ATOM 0 HD21 ASN A 24 2.156 -0.048 -18.808 1.00 0.00 H new ATOM 0 HD22 ASN A 24 2.199 0.992 -17.381 1.00 0.00 H new ATOM 330 N GLY A 25 1.367 -0.061 -12.720 1.00 0.00 N ATOM 331 CA GLY A 25 1.587 0.107 -11.295 1.00 0.00 C ATOM 332 C GLY A 25 2.960 0.669 -10.983 1.00 0.00 C ATOM 333 O GLY A 25 3.613 1.248 -11.851 1.00 0.00 O ATOM 0 H GLY A 25 1.208 0.806 -13.234 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.825 0.772 -10.889 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.470 -0.855 -10.796 1.00 0.00 H new ATOM 337 N TYR A 26 3.398 0.500 -9.740 1.00 0.00 N ATOM 338 CA TYR A 26 4.700 0.998 -9.315 1.00 0.00 C ATOM 339 C TYR A 26 5.474 -0.077 -8.558 1.00 0.00 C ATOM 340 O TYR A 26 5.101 -0.463 -7.452 1.00 0.00 O ATOM 341 CB TYR A 26 4.532 2.237 -8.433 1.00 0.00 C ATOM 342 CG TYR A 26 5.842 2.877 -8.032 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.554 3.666 -8.928 1.00 0.00 C ATOM 344 CD2 TYR A 26 6.368 2.694 -6.760 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.752 4.253 -8.567 1.00 0.00 C ATOM 346 CE2 TYR A 26 7.564 3.278 -6.390 1.00 0.00 C ATOM 347 CZ TYR A 26 8.252 4.056 -7.297 1.00 0.00 C ATOM 348 OH TYR A 26 9.444 4.639 -6.932 1.00 0.00 O ATOM 0 H TYR A 26 2.870 0.022 -9.010 1.00 0.00 H new ATOM 0 HA TYR A 26 5.266 1.268 -10.206 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.926 2.971 -8.964 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.982 1.960 -7.533 1.00 0.00 H new ATOM 0 HD1 TYR A 26 6.164 3.823 -9.923 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.833 2.084 -6.047 1.00 0.00 H new ATOM 0 HE1 TYR A 26 8.293 4.862 -9.275 1.00 0.00 H new ATOM 0 HE2 TYR A 26 7.958 3.126 -5.396 1.00 0.00 H new ATOM 0 HH TYR A 26 9.394 4.927 -5.997 1.00 0.00 H new ATOM 358 N GLU A 27 6.556 -0.555 -9.166 1.00 0.00 N ATOM 359 CA GLU A 27 7.383 -1.586 -8.550 1.00 0.00 C ATOM 360 C GLU A 27 8.610 -0.972 -7.882 1.00 0.00 C ATOM 361 O GLU A 27 9.529 -0.507 -8.555 1.00 0.00 O ATOM 362 CB GLU A 27 7.819 -2.614 -9.597 1.00 0.00 C ATOM 363 CG GLU A 27 6.756 -3.653 -9.910 1.00 0.00 C ATOM 364 CD GLU A 27 7.303 -4.831 -10.692 1.00 0.00 C ATOM 365 OE1 GLU A 27 8.259 -5.471 -10.206 1.00 0.00 O ATOM 366 OE2 GLU A 27 6.777 -5.112 -11.789 1.00 0.00 O ATOM 0 H GLU A 27 6.879 -0.245 -10.082 1.00 0.00 H new ATOM 0 HA GLU A 27 6.787 -2.086 -7.786 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.087 -2.093 -10.516 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.717 -3.121 -9.244 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.319 -4.012 -8.978 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.953 -3.185 -10.479 1.00 0.00 H new ATOM 373 N ASN A 28 8.617 -0.974 -6.553 1.00 0.00 N ATOM 374 CA ASN A 28 9.729 -0.417 -5.793 1.00 0.00 C ATOM 375 C ASN A 28 11.031 -1.142 -6.123 1.00 0.00 C ATOM 376 O ASN A 28 11.216 -2.315 -5.800 1.00 0.00 O ATOM 377 CB ASN A 28 9.447 -0.510 -4.292 1.00 0.00 C ATOM 378 CG ASN A 28 10.182 0.552 -3.498 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.211 1.068 -3.935 1.00 0.00 O ATOM 380 ND2 ASN A 28 9.656 0.883 -2.325 1.00 0.00 N ATOM 0 H ASN A 28 7.864 -1.356 -5.980 1.00 0.00 H new ATOM 0 HA ASN A 28 9.837 0.631 -6.071 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.375 -0.411 -4.120 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.738 -1.496 -3.931 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.106 1.592 -1.746 1.00 0.00 H new ATOM 0 HD22 ASN A 28 8.801 0.429 -2.003 1.00 0.00 H new ATOM 387 N PRO A 29 11.955 -0.427 -6.781 1.00 0.00 N ATOM 388 CA PRO A 29 13.256 -0.981 -7.168 1.00 0.00 C ATOM 389 C PRO A 29 14.162 -1.229 -5.967 1.00 0.00 C ATOM 390 O PRO A 29 15.072 -2.057 -6.021 1.00 0.00 O ATOM 391 CB PRO A 29 13.850 0.103 -8.071 1.00 0.00 C ATOM 392 CG PRO A 29 13.189 1.364 -7.631 1.00 0.00 C ATOM 393 CD PRO A 29 11.803 0.977 -7.198 1.00 0.00 C ATOM 0 HA PRO A 29 13.156 -1.952 -7.653 1.00 0.00 H new ATOM 0 HB2 PRO A 29 14.933 0.163 -7.959 1.00 0.00 H new ATOM 0 HB3 PRO A 29 13.650 -0.103 -9.122 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.739 1.827 -6.811 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.155 2.091 -8.443 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.448 1.603 -6.379 1.00 0.00 H new ATOM 0 HD3 PRO A 29 11.085 1.079 -8.012 1.00 0.00 H new ATOM 401 N THR A 30 13.906 -0.506 -4.880 1.00 0.00 N ATOM 402 CA THR A 30 14.699 -0.647 -3.665 1.00 0.00 C ATOM 403 C THR A 30 14.605 -2.063 -3.109 1.00 0.00 C ATOM 404 O THR A 30 15.606 -2.640 -2.682 1.00 0.00 O ATOM 405 CB THR A 30 14.247 0.350 -2.581 1.00 0.00 C ATOM 406 OG1 THR A 30 14.395 1.692 -3.057 1.00 0.00 O ATOM 407 CG2 THR A 30 15.055 0.166 -1.306 1.00 0.00 C ATOM 0 H THR A 30 13.156 0.182 -4.817 1.00 0.00 H new ATOM 0 HA THR A 30 15.733 -0.434 -3.935 1.00 0.00 H new ATOM 0 HB THR A 30 13.197 0.159 -2.357 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.104 2.319 -2.363 1.00 0.00 H new ATOM 0 HG21 THR A 30 14.718 0.881 -0.555 1.00 0.00 H new ATOM 0 HG22 THR A 30 14.916 -0.848 -0.930 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.111 0.333 -1.517 1.00 0.00 H new ATOM 824 N VAL A 61 3.834 15.090 9.044 1.00 0.00 N ATOM 825 CA VAL A 61 3.230 13.781 8.821 1.00 0.00 C ATOM 826 C VAL A 61 1.875 13.910 8.135 1.00 0.00 C ATOM 827 O VAL A 61 1.132 14.860 8.383 1.00 0.00 O ATOM 828 CB VAL A 61 3.053 13.013 10.144 1.00 0.00 C ATOM 829 CG1 VAL A 61 2.430 13.909 11.203 1.00 0.00 C ATOM 830 CG2 VAL A 61 2.210 11.765 9.926 1.00 0.00 C ATOM 0 HA VAL A 61 3.909 13.225 8.174 1.00 0.00 H new ATOM 0 HB VAL A 61 4.036 12.703 10.498 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.313 13.349 12.131 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.076 14.769 11.378 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.454 14.252 10.861 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.095 11.234 10.871 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.228 12.051 9.548 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.702 11.115 9.202 1.00 0.00 H new ATOM 840 N GLN A 62 1.560 12.949 7.273 1.00 0.00 N ATOM 841 CA GLN A 62 0.293 12.956 6.551 1.00 0.00 C ATOM 842 C GLN A 62 -0.654 11.897 7.105 1.00 0.00 C ATOM 843 O GLN A 62 -0.300 10.722 7.203 1.00 0.00 O ATOM 844 CB GLN A 62 0.531 12.715 5.060 1.00 0.00 C ATOM 845 CG GLN A 62 0.877 13.978 4.287 1.00 0.00 C ATOM 846 CD GLN A 62 1.201 13.702 2.832 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.331 13.783 1.965 1.00 0.00 O ATOM 848 NE2 GLN A 62 2.458 13.373 2.557 1.00 0.00 N ATOM 0 H GLN A 62 2.164 12.156 7.057 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.168 13.935 6.684 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.339 11.994 4.942 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.363 12.267 4.626 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.040 14.674 4.343 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.730 14.466 4.759 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.147 13.318 3.307 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.735 13.176 1.595 1.00 0.00 H new ATOM 857 N LYS A 63 -1.861 12.320 7.466 1.00 0.00 N ATOM 858 CA LYS A 63 -2.861 11.409 8.009 1.00 0.00 C ATOM 859 C LYS A 63 -4.082 11.335 7.098 1.00 0.00 C ATOM 860 O LYS A 63 -4.779 12.330 6.896 1.00 0.00 O ATOM 861 CB LYS A 63 -3.283 11.858 9.410 1.00 0.00 C ATOM 862 CG LYS A 63 -2.427 11.272 10.520 1.00 0.00 C ATOM 863 CD LYS A 63 -2.815 11.834 11.877 1.00 0.00 C ATOM 864 CE LYS A 63 -1.665 11.739 12.868 1.00 0.00 C ATOM 865 NZ LYS A 63 -1.635 10.419 13.558 1.00 0.00 N ATOM 0 H LYS A 63 -2.170 13.289 7.392 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.416 10.416 8.071 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.237 12.946 9.463 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.322 11.574 9.576 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.534 10.187 10.530 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.377 11.486 10.323 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -3.118 12.875 11.768 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -3.677 11.290 12.264 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.721 11.897 12.346 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -1.757 12.534 13.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -0.682 10.248 13.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -2.324 10.419 14.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -1.878 9.668 12.881 1.00 0.00 H new ATOM 879 N PHE A 64 -4.337 10.151 6.551 1.00 0.00 N ATOM 880 CA PHE A 64 -5.474 9.948 5.661 1.00 0.00 C ATOM 881 C PHE A 64 -6.520 9.048 6.313 1.00 0.00 C ATOM 882 O PHE A 64 -6.184 8.075 6.987 1.00 0.00 O ATOM 883 CB PHE A 64 -5.011 9.336 4.338 1.00 0.00 C ATOM 884 CG PHE A 64 -4.109 10.237 3.543 1.00 0.00 C ATOM 885 CD1 PHE A 64 -2.737 10.209 3.735 1.00 0.00 C ATOM 886 CD2 PHE A 64 -4.633 11.111 2.605 1.00 0.00 C ATOM 887 CE1 PHE A 64 -1.904 11.036 3.005 1.00 0.00 C ATOM 888 CE2 PHE A 64 -3.805 11.941 1.873 1.00 0.00 C ATOM 889 CZ PHE A 64 -2.439 11.904 2.074 1.00 0.00 C ATOM 0 H PHE A 64 -3.771 9.317 6.709 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.928 10.919 5.464 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.489 8.401 4.542 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.885 9.088 3.736 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.314 9.533 4.463 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -5.700 11.144 2.444 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.836 11.003 3.163 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.226 12.618 1.144 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.791 12.553 1.504 1.00 0.00 H new ATOM 899 N ARG A 65 -7.790 9.382 6.106 1.00 0.00 N ATOM 900 CA ARG A 65 -8.886 8.606 6.675 1.00 0.00 C ATOM 901 C ARG A 65 -9.379 7.555 5.684 1.00 0.00 C ATOM 902 O ARG A 65 -10.238 7.832 4.846 1.00 0.00 O ATOM 903 CB ARG A 65 -10.039 9.528 7.073 1.00 0.00 C ATOM 904 CG ARG A 65 -10.950 8.940 8.138 1.00 0.00 C ATOM 905 CD ARG A 65 -11.878 9.993 8.721 1.00 0.00 C ATOM 906 NE ARG A 65 -13.125 10.101 7.969 1.00 0.00 N ATOM 907 CZ ARG A 65 -14.011 11.074 8.150 1.00 0.00 C ATOM 908 NH1 ARG A 65 -13.788 12.019 9.053 1.00 0.00 N ATOM 909 NH2 ARG A 65 -15.123 11.105 7.426 1.00 0.00 N ATOM 0 H ARG A 65 -8.085 10.184 5.549 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.514 8.096 7.564 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.630 10.471 7.437 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.631 9.758 6.187 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.541 8.132 7.707 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.347 8.504 8.934 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.101 9.745 9.759 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -11.373 10.959 8.726 1.00 0.00 H new ATOM 0 HE ARG A 65 -13.327 9.390 7.266 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -12.934 12.000 9.611 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -14.470 12.765 9.190 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -15.298 10.381 6.729 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -15.802 11.853 7.566 1.00 0.00 H new ATOM 923 N VAL A 66 -8.829 6.349 5.785 1.00 0.00 N ATOM 924 CA VAL A 66 -9.213 5.257 4.899 1.00 0.00 C ATOM 925 C VAL A 66 -9.796 4.089 5.687 1.00 0.00 C ATOM 926 O VAL A 66 -9.966 4.172 6.903 1.00 0.00 O ATOM 927 CB VAL A 66 -8.013 4.757 4.073 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.417 5.893 3.255 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.964 4.134 4.981 1.00 0.00 C ATOM 0 H VAL A 66 -8.116 6.104 6.472 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.972 5.650 4.223 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.364 3.990 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.570 5.521 2.678 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.173 6.288 2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.080 6.685 3.924 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.123 3.786 4.381 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.615 4.878 5.698 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.401 3.291 5.517 1.00 0.00 H new ATOM 939 N GLN A 67 -10.099 3.002 4.985 1.00 0.00 N ATOM 940 CA GLN A 67 -10.663 1.817 5.620 1.00 0.00 C ATOM 941 C GLN A 67 -9.744 0.613 5.440 1.00 0.00 C ATOM 942 O GLN A 67 -8.852 0.622 4.591 1.00 0.00 O ATOM 943 CB GLN A 67 -12.044 1.509 5.038 1.00 0.00 C ATOM 944 CG GLN A 67 -13.174 2.262 5.722 1.00 0.00 C ATOM 945 CD GLN A 67 -14.419 2.354 4.862 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.510 3.196 3.969 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.387 1.484 5.128 1.00 0.00 N ATOM 0 H GLN A 67 -9.964 2.917 3.978 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.762 2.020 6.686 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.045 1.755 3.976 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.232 0.438 5.117 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.421 1.765 6.660 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.836 3.267 5.973 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.269 0.803 5.878 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.249 1.497 4.582 1.00 0.00 H new ATOM 956 N TYR A 68 -9.965 -0.420 6.245 1.00 0.00 N ATOM 957 CA TYR A 68 -9.155 -1.630 6.177 1.00 0.00 C ATOM 958 C TYR A 68 -9.959 -2.793 5.606 1.00 0.00 C ATOM 959 O TYR A 68 -11.063 -3.086 6.067 1.00 0.00 O ATOM 960 CB TYR A 68 -8.627 -1.994 7.566 1.00 0.00 C ATOM 961 CG TYR A 68 -7.290 -2.699 7.540 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.083 -3.808 6.729 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.233 -2.257 8.327 1.00 0.00 C ATOM 964 CE1 TYR A 68 -5.863 -4.456 6.702 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.010 -2.897 8.305 1.00 0.00 C ATOM 966 CZ TYR A 68 -4.829 -3.996 7.491 1.00 0.00 C ATOM 967 OH TYR A 68 -3.612 -4.638 7.468 1.00 0.00 O ATOM 0 H TYR A 68 -10.699 -0.444 6.953 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.312 -1.435 5.514 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.537 -1.085 8.161 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.355 -2.632 8.066 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.890 -4.170 6.109 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.371 -1.398 8.967 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -5.720 -5.318 6.067 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.199 -2.539 8.922 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.520 -5.134 6.628 1.00 0.00 H new ATOM 977 N LEU A 69 -9.398 -3.453 4.599 1.00 0.00 N ATOM 978 CA LEU A 69 -10.062 -4.586 3.963 1.00 0.00 C ATOM 979 C LEU A 69 -9.540 -5.906 4.521 1.00 0.00 C ATOM 980 O LEU A 69 -10.314 -6.758 4.955 1.00 0.00 O ATOM 981 CB LEU A 69 -9.851 -4.541 2.448 1.00 0.00 C ATOM 982 CG LEU A 69 -10.898 -3.765 1.648 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.622 -2.271 1.717 1.00 0.00 C ATOM 984 CD2 LEU A 69 -10.923 -4.239 0.202 1.00 0.00 C ATOM 0 H LEU A 69 -8.485 -3.224 4.205 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.128 -4.518 4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.873 -4.102 2.250 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.823 -5.565 2.075 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.877 -3.953 2.088 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.377 -1.735 1.142 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.656 -1.942 2.756 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.635 -2.064 1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.674 -3.676 -0.353 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.944 -4.081 -0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.169 -5.300 0.171 1.00 0.00 H new ATOM 996 N GLY A 70 -8.220 -6.068 4.508 1.00 0.00 N ATOM 997 CA GLY A 70 -7.617 -7.286 5.017 1.00 0.00 C ATOM 998 C GLY A 70 -6.462 -7.764 4.160 1.00 0.00 C ATOM 999 O GLY A 70 -6.275 -7.290 3.039 1.00 0.00 O ATOM 0 H GLY A 70 -7.558 -5.378 4.154 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.264 -7.115 6.034 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.374 -8.068 5.069 1.00 0.00 H new ATOM 1003 N MET A 71 -5.684 -8.703 4.687 1.00 0.00 N ATOM 1004 CA MET A 71 -4.541 -9.244 3.962 1.00 0.00 C ATOM 1005 C MET A 71 -4.969 -10.385 3.045 1.00 0.00 C ATOM 1006 O MET A 71 -5.916 -11.114 3.344 1.00 0.00 O ATOM 1007 CB MET A 71 -3.474 -9.736 4.942 1.00 0.00 C ATOM 1008 CG MET A 71 -2.086 -9.837 4.330 1.00 0.00 C ATOM 1009 SD MET A 71 -1.888 -11.302 3.297 1.00 0.00 S ATOM 1010 CE MET A 71 -2.127 -12.603 4.506 1.00 0.00 C ATOM 0 H MET A 71 -5.824 -9.105 5.614 1.00 0.00 H new ATOM 0 HA MET A 71 -4.121 -8.446 3.349 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.437 -9.059 5.796 1.00 0.00 H new ATOM 0 HB3 MET A 71 -3.766 -10.715 5.323 1.00 0.00 H new ATOM 0 HG2 MET A 71 -1.891 -8.947 3.732 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.342 -9.856 5.127 1.00 0.00 H new ATOM 0 HE1 MET A 71 -1.592 -13.498 4.188 1.00 0.00 H new ATOM 0 HE2 MET A 71 -1.745 -12.276 5.473 1.00 0.00 H new ATOM 0 HE3 MET A 71 -3.190 -12.828 4.593 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.267 -10.535 1.927 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.576 -11.588 0.965 1.00 0.00 C ATOM 1022 C LEU A 72 -3.298 -12.188 0.387 1.00 0.00 C ATOM 1023 O LEU A 72 -2.420 -11.482 -0.108 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.450 -11.036 -0.162 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.455 -12.013 -0.772 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.735 -13.112 -1.539 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.343 -12.610 0.311 1.00 0.00 C ATOM 0 H LEU A 72 -3.480 -9.941 1.664 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.122 -12.375 1.486 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.997 -10.174 0.219 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.798 -10.674 -0.957 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.086 -11.465 -1.471 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.467 -13.797 -1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.143 -12.669 -2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.078 -13.658 -0.862 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.052 -13.303 -0.141 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.726 -13.143 1.035 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.887 -11.812 0.816 1.00 0.00 H new ATOM 1039 N PRO A 73 -3.191 -13.524 0.447 1.00 0.00 N ATOM 1040 CA PRO A 73 -2.026 -14.249 -0.068 1.00 0.00 C ATOM 1041 C PRO A 73 -1.949 -14.214 -1.591 1.00 0.00 C ATOM 1042 O PRO A 73 -2.894 -14.599 -2.279 1.00 0.00 O ATOM 1043 CB PRO A 73 -2.254 -15.681 0.423 1.00 0.00 C ATOM 1044 CG PRO A 73 -3.730 -15.792 0.596 1.00 0.00 C ATOM 1045 CD PRO A 73 -4.200 -14.429 1.024 1.00 0.00 C ATOM 0 HA PRO A 73 -1.089 -13.811 0.274 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.884 -16.410 -0.298 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.730 -15.866 1.361 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.210 -16.096 -0.334 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -3.980 -16.544 1.345 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.199 -14.211 0.646 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.244 -14.342 2.110 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.817 -13.751 -2.111 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.616 -13.668 -3.552 1.00 0.00 C ATOM 1055 C VAL A 74 0.314 -14.772 -4.043 1.00 0.00 C ATOM 1056 O VAL A 74 0.823 -15.566 -3.251 1.00 0.00 O ATOM 1057 CB VAL A 74 -0.031 -12.302 -3.959 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -1.114 -11.235 -3.956 1.00 0.00 C ATOM 1059 CG2 VAL A 74 1.113 -11.915 -3.034 1.00 0.00 C ATOM 0 H VAL A 74 -0.025 -13.428 -1.555 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.595 -13.789 -4.015 1.00 0.00 H new ATOM 0 HB VAL A 74 0.363 -12.383 -4.972 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.682 -10.277 -4.246 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.897 -11.509 -4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.541 -11.153 -2.956 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.514 -10.948 -3.336 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.747 -11.852 -2.009 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.899 -12.668 -3.093 1.00 0.00 H new ATOM 1069 N ASP A 75 0.531 -14.817 -5.352 1.00 0.00 N ATOM 1070 CA ASP A 75 1.400 -15.824 -5.949 1.00 0.00 C ATOM 1071 C ASP A 75 2.796 -15.260 -6.195 1.00 0.00 C ATOM 1072 O ASP A 75 3.793 -15.976 -6.093 1.00 0.00 O ATOM 1073 CB ASP A 75 0.803 -16.331 -7.263 1.00 0.00 C ATOM 1074 CG ASP A 75 -0.277 -17.373 -7.044 1.00 0.00 C ATOM 1075 OD1 ASP A 75 -1.440 -16.981 -6.816 1.00 0.00 O ATOM 1076 OD2 ASP A 75 0.042 -18.579 -7.100 1.00 0.00 O ATOM 0 H ASP A 75 0.117 -14.168 -6.021 1.00 0.00 H new ATOM 0 HA ASP A 75 1.481 -16.657 -5.251 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.386 -15.490 -7.817 1.00 0.00 H new ATOM 0 HB3 ASP A 75 1.595 -16.757 -7.878 1.00 0.00 H new ATOM 1081 N ARG A 76 2.860 -13.973 -6.520 1.00 0.00 N ATOM 1082 CA ARG A 76 4.133 -13.313 -6.782 1.00 0.00 C ATOM 1083 C ARG A 76 4.208 -11.969 -6.063 1.00 0.00 C ATOM 1084 O ARG A 76 3.195 -11.395 -5.662 1.00 0.00 O ATOM 1085 CB ARG A 76 4.326 -13.111 -8.286 1.00 0.00 C ATOM 1086 CG ARG A 76 3.022 -12.958 -9.053 1.00 0.00 C ATOM 1087 CD ARG A 76 3.251 -12.998 -10.555 1.00 0.00 C ATOM 1088 NE ARG A 76 2.120 -12.447 -11.296 1.00 0.00 N ATOM 1089 CZ ARG A 76 1.876 -12.717 -12.574 1.00 0.00 C ATOM 1090 NH1 ARG A 76 2.680 -13.528 -13.248 1.00 0.00 N ATOM 1091 NH2 ARG A 76 0.827 -12.176 -13.179 1.00 0.00 N ATOM 0 H ARG A 76 2.045 -13.366 -6.608 1.00 0.00 H new ATOM 0 HA ARG A 76 4.930 -13.952 -6.403 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.940 -12.225 -8.449 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.878 -13.960 -8.690 1.00 0.00 H new ATOM 0 HG2 ARG A 76 2.335 -13.755 -8.767 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.547 -12.015 -8.781 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.153 -12.436 -10.799 1.00 0.00 H new ATOM 0 HD3 ARG A 76 3.422 -14.028 -10.868 1.00 0.00 H new ATOM 0 HE ARG A 76 1.482 -11.820 -10.806 1.00 0.00 H new ATOM 0 HH11 ARG A 76 3.487 -13.946 -12.785 1.00 0.00 H new ATOM 0 HH12 ARG A 76 2.491 -13.734 -14.229 1.00 0.00 H new ATOM 0 HH21 ARG A 76 0.207 -11.552 -12.663 1.00 0.00 H new ATOM 0 HH22 ARG A 76 0.641 -12.384 -14.160 1.00 0.00 H new ATOM 1105 N PRO A 77 5.435 -11.455 -5.896 1.00 0.00 N ATOM 1106 CA PRO A 77 5.671 -10.173 -5.225 1.00 0.00 C ATOM 1107 C PRO A 77 5.181 -8.988 -6.049 1.00 0.00 C ATOM 1108 O PRO A 77 4.931 -7.908 -5.515 1.00 0.00 O ATOM 1109 CB PRO A 77 7.194 -10.127 -5.075 1.00 0.00 C ATOM 1110 CG PRO A 77 7.709 -10.997 -6.169 1.00 0.00 C ATOM 1111 CD PRO A 77 6.687 -12.085 -6.349 1.00 0.00 C ATOM 0 HA PRO A 77 5.133 -10.103 -4.280 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.570 -9.108 -5.169 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.507 -10.494 -4.097 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.841 -10.429 -7.090 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.682 -11.415 -5.910 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.622 -12.407 -7.388 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.930 -12.967 -5.757 1.00 0.00 H new ATOM 1119 N VAL A 78 5.043 -9.198 -7.355 1.00 0.00 N ATOM 1120 CA VAL A 78 4.581 -8.147 -8.253 1.00 0.00 C ATOM 1121 C VAL A 78 3.576 -8.690 -9.263 1.00 0.00 C ATOM 1122 O VAL A 78 3.382 -9.900 -9.373 1.00 0.00 O ATOM 1123 CB VAL A 78 5.754 -7.499 -9.012 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.742 -6.877 -8.036 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.444 -8.524 -9.900 1.00 0.00 C ATOM 0 H VAL A 78 5.245 -10.086 -7.814 1.00 0.00 H new ATOM 0 HA VAL A 78 4.098 -7.392 -7.633 1.00 0.00 H new ATOM 0 HB VAL A 78 5.360 -6.707 -9.648 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.564 -6.424 -8.590 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.237 -6.112 -7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.133 -7.649 -7.373 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.270 -8.049 -10.429 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.827 -9.339 -9.285 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.730 -8.919 -10.622 1.00 0.00 H new ATOM 1135 N GLY A 79 2.937 -7.786 -10.000 1.00 0.00 N ATOM 1136 CA GLY A 79 1.960 -8.193 -10.992 1.00 0.00 C ATOM 1137 C GLY A 79 0.596 -7.579 -10.748 1.00 0.00 C ATOM 1138 O GLY A 79 -0.060 -7.882 -9.751 1.00 0.00 O ATOM 0 H GLY A 79 3.079 -6.779 -9.927 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.312 -7.907 -11.983 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.872 -9.279 -10.987 1.00 0.00 H new ATOM 1142 N MET A 80 0.167 -6.712 -11.660 1.00 0.00 N ATOM 1143 CA MET A 80 -1.128 -6.054 -11.538 1.00 0.00 C ATOM 1144 C MET A 80 -2.250 -7.079 -11.407 1.00 0.00 C ATOM 1145 O MET A 80 -3.068 -7.004 -10.490 1.00 0.00 O ATOM 1146 CB MET A 80 -1.383 -5.155 -12.750 1.00 0.00 C ATOM 1147 CG MET A 80 -0.875 -3.733 -12.569 1.00 0.00 C ATOM 1148 SD MET A 80 -2.082 -2.660 -11.769 1.00 0.00 S ATOM 1149 CE MET A 80 -1.769 -3.026 -10.044 1.00 0.00 C ATOM 0 H MET A 80 0.697 -6.449 -12.491 1.00 0.00 H new ATOM 0 HA MET A 80 -1.112 -5.442 -10.636 1.00 0.00 H new ATOM 0 HB2 MET A 80 -0.905 -5.594 -13.625 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.454 -5.127 -12.952 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.039 -3.751 -11.975 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.615 -3.318 -13.543 1.00 0.00 H new ATOM 0 HE1 MET A 80 -1.944 -2.132 -9.445 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.438 -3.821 -9.714 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.735 -3.348 -9.922 1.00 0.00 H new ATOM 1159 N ASP A 81 -2.281 -8.036 -12.328 1.00 0.00 N ATOM 1160 CA ASP A 81 -3.302 -9.077 -12.314 1.00 0.00 C ATOM 1161 C ASP A 81 -3.394 -9.729 -10.939 1.00 0.00 C ATOM 1162 O ASP A 81 -4.469 -10.151 -10.509 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.996 -10.135 -13.375 1.00 0.00 C ATOM 1164 CG ASP A 81 -4.250 -10.795 -13.914 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -5.164 -11.077 -13.111 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -4.318 -11.031 -15.139 1.00 0.00 O ATOM 0 H ASP A 81 -1.611 -8.112 -13.093 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.262 -8.613 -12.541 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.450 -9.673 -14.198 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.344 -10.896 -12.947 1.00 0.00 H new ATOM 1171 N THR A 82 -2.260 -9.811 -10.251 1.00 0.00 N ATOM 1172 CA THR A 82 -2.211 -10.414 -8.925 1.00 0.00 C ATOM 1173 C THR A 82 -2.811 -9.485 -7.876 1.00 0.00 C ATOM 1174 O THR A 82 -3.602 -9.911 -7.033 1.00 0.00 O ATOM 1175 CB THR A 82 -0.767 -10.764 -8.519 1.00 0.00 C ATOM 1176 OG1 THR A 82 -0.204 -11.686 -9.458 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.728 -11.366 -7.123 1.00 0.00 C ATOM 0 H THR A 82 -1.362 -9.467 -10.591 1.00 0.00 H new ATOM 0 HA THR A 82 -2.799 -11.331 -8.973 1.00 0.00 H new ATOM 0 HB THR A 82 -0.181 -9.845 -8.517 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.329 -12.355 -8.980 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.302 -11.605 -6.858 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.130 -10.650 -6.406 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.328 -12.276 -7.102 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.432 -8.213 -7.933 1.00 0.00 N ATOM 1186 CA LEU A 83 -2.934 -7.222 -6.987 1.00 0.00 C ATOM 1187 C LEU A 83 -4.453 -7.115 -7.065 1.00 0.00 C ATOM 1188 O LEU A 83 -5.146 -7.234 -6.055 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.301 -5.857 -7.265 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.234 -4.895 -6.079 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -0.938 -5.087 -5.307 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.367 -3.455 -6.552 1.00 0.00 C ATOM 0 H LEU A 83 -1.779 -7.843 -8.624 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.662 -7.545 -5.982 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.288 -6.017 -7.635 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.861 -5.376 -8.067 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.066 -5.115 -5.411 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.909 -4.393 -4.467 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -0.884 -6.110 -4.935 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.091 -4.895 -5.965 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.317 -2.784 -5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.556 -3.222 -7.242 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.323 -3.325 -7.059 1.00 0.00 H new ATOM 1204 N ASN A 84 -4.965 -6.893 -8.271 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.403 -6.773 -8.481 1.00 0.00 C ATOM 1206 C ASN A 84 -7.148 -7.927 -7.818 1.00 0.00 C ATOM 1207 O ASN A 84 -8.287 -7.772 -7.378 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.720 -6.740 -9.978 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.583 -5.349 -10.567 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.524 -4.556 -10.539 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.407 -5.048 -11.105 1.00 0.00 N ATOM 0 H ASN A 84 -4.405 -6.793 -9.118 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.735 -5.840 -8.025 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -6.051 -7.422 -10.503 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.735 -7.102 -10.140 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.256 -4.128 -11.518 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.655 -5.737 -11.106 1.00 0.00 H new ATOM 1218 N SER A 85 -6.497 -9.083 -7.749 1.00 0.00 N ATOM 1219 CA SER A 85 -7.098 -10.265 -7.142 1.00 0.00 C ATOM 1220 C SER A 85 -7.344 -10.045 -5.653 1.00 0.00 C ATOM 1221 O SER A 85 -8.395 -10.408 -5.125 1.00 0.00 O ATOM 1222 CB SER A 85 -6.198 -11.485 -7.348 1.00 0.00 C ATOM 1223 OG SER A 85 -6.885 -12.684 -7.036 1.00 0.00 O ATOM 0 H SER A 85 -5.552 -9.227 -8.106 1.00 0.00 H new ATOM 0 HA SER A 85 -8.057 -10.445 -7.628 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.855 -11.517 -8.382 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.311 -11.397 -6.721 1.00 0.00 H new ATOM 0 HG SER A 85 -6.289 -13.449 -7.177 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.365 -9.448 -4.980 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.474 -9.178 -3.552 1.00 0.00 C ATOM 1231 C ALA A 86 -7.640 -8.240 -3.258 1.00 0.00 C ATOM 1232 O ALA A 86 -8.469 -8.518 -2.391 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.174 -8.588 -3.026 1.00 0.00 C ATOM 0 H ALA A 86 -5.488 -9.142 -5.401 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.664 -10.122 -3.042 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.270 -8.391 -1.958 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.360 -9.293 -3.194 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.960 -7.656 -3.549 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.698 -7.130 -3.985 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.763 -6.152 -3.802 1.00 0.00 C ATOM 1241 C ILE A 87 -10.136 -6.805 -3.925 1.00 0.00 C ATOM 1242 O ILE A 87 -10.965 -6.702 -3.022 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.659 -5.007 -4.827 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.351 -4.236 -4.631 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -9.854 -4.074 -4.702 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -6.897 -3.494 -5.869 1.00 0.00 C ATOM 0 H ILE A 87 -7.020 -6.885 -4.707 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.646 -5.743 -2.799 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.661 -5.435 -5.830 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.477 -3.524 -3.816 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.570 -4.933 -4.328 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.766 -3.270 -5.433 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.772 -4.632 -4.885 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.881 -3.650 -3.698 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -5.965 -2.970 -5.658 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.739 -4.204 -6.681 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.660 -2.773 -6.161 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.367 -7.478 -5.047 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.639 -8.149 -5.287 1.00 0.00 C ATOM 1260 C GLU A 88 -11.870 -9.258 -4.264 1.00 0.00 C ATOM 1261 O GLU A 88 -13.001 -9.508 -3.849 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.677 -8.730 -6.702 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.476 -7.690 -7.792 1.00 0.00 C ATOM 1264 CD GLU A 88 -10.926 -8.286 -9.073 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -11.212 -9.471 -9.346 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -10.210 -7.569 -9.802 1.00 0.00 O ATOM 0 H GLU A 88 -9.690 -7.573 -5.804 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.434 -7.411 -5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.905 -9.494 -6.793 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.635 -9.226 -6.857 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.427 -7.201 -8.002 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.794 -6.919 -7.432 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.790 -9.920 -3.864 1.00 0.00 N ATOM 1274 CA ASN A 89 -10.875 -11.004 -2.891 1.00 0.00 C ATOM 1275 C ASN A 89 -11.585 -10.541 -1.623 1.00 0.00 C ATOM 1276 O ASN A 89 -12.643 -11.062 -1.265 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.475 -11.518 -2.547 1.00 0.00 C ATOM 1278 CG ASN A 89 -9.036 -12.650 -3.456 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -9.776 -13.609 -3.674 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -7.825 -12.542 -3.991 1.00 0.00 N ATOM 0 H ASN A 89 -9.846 -9.726 -4.198 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.454 -11.814 -3.335 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.761 -10.698 -2.622 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.460 -11.860 -1.512 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.474 -13.272 -4.611 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.246 -11.729 -3.782 1.00 0.00 H new ATOM 1287 N LEU A 90 -10.997 -9.561 -0.946 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.573 -9.027 0.283 1.00 0.00 C ATOM 1289 C LEU A 90 -12.928 -8.380 0.013 1.00 0.00 C ATOM 1290 O LEU A 90 -13.909 -8.662 0.699 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.624 -8.006 0.914 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.384 -8.578 1.602 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -9.778 -9.358 2.847 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.601 -9.462 0.642 1.00 0.00 C ATOM 0 H LEU A 90 -10.121 -9.120 -1.227 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.718 -9.855 0.977 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.297 -7.315 0.137 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.184 -7.423 1.645 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.744 -7.749 1.904 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.883 -9.758 3.324 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.295 -8.697 3.542 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.438 -10.179 2.568 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.722 -9.860 1.149 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.232 -10.286 0.309 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -8.287 -8.874 -0.220 1.00 0.00 H new ATOM 1306 N MET A 91 -12.973 -7.512 -0.992 1.00 0.00 N ATOM 1307 CA MET A 91 -14.208 -6.827 -1.355 1.00 0.00 C ATOM 1308 C MET A 91 -15.407 -7.761 -1.223 1.00 0.00 C ATOM 1309 O MET A 91 -16.396 -7.431 -0.568 1.00 0.00 O ATOM 1310 CB MET A 91 -14.119 -6.293 -2.786 1.00 0.00 C ATOM 1311 CG MET A 91 -13.217 -5.077 -2.926 1.00 0.00 C ATOM 1312 SD MET A 91 -14.067 -3.534 -2.541 1.00 0.00 S ATOM 1313 CE MET A 91 -14.976 -3.261 -4.061 1.00 0.00 C ATOM 0 H MET A 91 -12.169 -7.266 -1.569 1.00 0.00 H new ATOM 0 HA MET A 91 -14.344 -5.990 -0.670 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.751 -7.085 -3.438 1.00 0.00 H new ATOM 0 HB3 MET A 91 -15.120 -6.034 -3.132 1.00 0.00 H new ATOM 0 HG2 MET A 91 -12.358 -5.189 -2.265 1.00 0.00 H new ATOM 0 HG3 MET A 91 -12.832 -5.031 -3.945 1.00 0.00 H new ATOM 0 HE1 MET A 91 -14.657 -2.321 -4.512 1.00 0.00 H new ATOM 0 HE2 MET A 91 -14.781 -4.080 -4.753 1.00 0.00 H new ATOM 0 HE3 MET A 91 -16.043 -3.216 -3.844 1.00 0.00 H new ATOM 1323 N THR A 92 -15.313 -8.930 -1.849 1.00 0.00 N ATOM 1324 CA THR A 92 -16.389 -9.911 -1.802 1.00 0.00 C ATOM 1325 C THR A 92 -16.506 -10.534 -0.416 1.00 0.00 C ATOM 1326 O THR A 92 -17.593 -10.919 0.013 1.00 0.00 O ATOM 1327 CB THR A 92 -16.175 -11.030 -2.839 1.00 0.00 C ATOM 1328 OG1 THR A 92 -15.115 -11.895 -2.415 1.00 0.00 O ATOM 1329 CG2 THR A 92 -15.845 -10.447 -4.205 1.00 0.00 C ATOM 0 H THR A 92 -14.502 -9.220 -2.395 1.00 0.00 H new ATOM 0 HA THR A 92 -17.311 -9.379 -2.037 1.00 0.00 H new ATOM 0 HB THR A 92 -17.100 -11.602 -2.920 1.00 0.00 H new ATOM 0 HG1 THR A 92 -14.384 -11.359 -2.043 1.00 0.00 H new ATOM 0 HG21 THR A 92 -15.698 -11.256 -4.920 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.667 -9.813 -4.538 1.00 0.00 H new ATOM 0 HG23 THR A 92 -14.933 -9.853 -4.137 1.00 0.00 H new ATOM 1337 N SER A 93 -15.378 -10.630 0.281 1.00 0.00 N ATOM 1338 CA SER A 93 -15.354 -11.209 1.619 1.00 0.00 C ATOM 1339 C SER A 93 -16.143 -10.346 2.600 1.00 0.00 C ATOM 1340 O SER A 93 -17.032 -10.834 3.296 1.00 0.00 O ATOM 1341 CB SER A 93 -13.911 -11.363 2.105 1.00 0.00 C ATOM 1342 OG SER A 93 -13.240 -12.389 1.393 1.00 0.00 O ATOM 0 H SER A 93 -14.469 -10.314 -0.059 1.00 0.00 H new ATOM 0 HA SER A 93 -15.821 -12.193 1.570 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.379 -10.420 1.979 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.905 -11.592 3.171 1.00 0.00 H new ATOM 0 HG SER A 93 -12.997 -12.063 0.501 1.00 0.00 H new ATOM 1348 N SER A 94 -15.810 -9.060 2.647 1.00 0.00 N ATOM 1349 CA SER A 94 -16.484 -8.129 3.544 1.00 0.00 C ATOM 1350 C SER A 94 -17.130 -6.991 2.760 1.00 0.00 C ATOM 1351 O SER A 94 -16.671 -6.630 1.676 1.00 0.00 O ATOM 1352 CB SER A 94 -15.493 -7.562 4.563 1.00 0.00 C ATOM 1353 OG SER A 94 -14.885 -8.599 5.314 1.00 0.00 O ATOM 0 H SER A 94 -15.078 -8.639 2.075 1.00 0.00 H new ATOM 0 HA SER A 94 -17.266 -8.674 4.072 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.726 -6.985 4.047 1.00 0.00 H new ATOM 0 HB3 SER A 94 -16.010 -6.877 5.235 1.00 0.00 H new ATOM 0 HG SER A 94 -14.255 -8.211 5.957 1.00 0.00 H new ATOM 1359 N SER A 95 -18.199 -6.430 3.316 1.00 0.00 N ATOM 1360 CA SER A 95 -18.912 -5.335 2.668 1.00 0.00 C ATOM 1361 C SER A 95 -18.140 -4.027 2.806 1.00 0.00 C ATOM 1362 O SER A 95 -17.225 -3.914 3.623 1.00 0.00 O ATOM 1363 CB SER A 95 -20.310 -5.181 3.271 1.00 0.00 C ATOM 1364 OG SER A 95 -20.245 -5.052 4.681 1.00 0.00 O ATOM 0 H SER A 95 -18.590 -6.716 4.214 1.00 0.00 H new ATOM 0 HA SER A 95 -19.005 -5.572 1.608 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.799 -4.305 2.845 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.920 -6.046 3.009 1.00 0.00 H new ATOM 0 HG SER A 95 -20.937 -5.610 5.093 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.514 -3.038 2.000 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.859 -1.736 2.031 1.00 0.00 C ATOM 1372 C LYS A 96 -17.978 -1.100 3.412 1.00 0.00 C ATOM 1373 O LYS A 96 -17.111 -0.332 3.827 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.471 -0.810 0.977 1.00 0.00 C ATOM 1375 CG LYS A 96 -17.837 0.570 0.938 1.00 0.00 C ATOM 1376 CD LYS A 96 -18.104 1.269 -0.384 1.00 0.00 C ATOM 1377 CE LYS A 96 -17.500 2.665 -0.408 1.00 0.00 C ATOM 1378 NZ LYS A 96 -18.304 3.631 0.392 1.00 0.00 N ATOM 0 H LYS A 96 -19.268 -3.114 1.317 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.802 -1.883 1.808 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.371 -1.274 -0.004 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.538 -0.705 1.173 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.229 1.175 1.756 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.762 0.482 1.093 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -17.689 0.678 -1.200 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.179 1.334 -0.552 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.483 2.628 -0.017 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -17.433 3.014 -1.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.860 4.570 0.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -19.267 3.686 0.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.347 3.312 1.381 1.00 0.00 H new ATOM 1392 N GLU A 97 -19.056 -1.426 4.119 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.285 -0.886 5.453 1.00 0.00 C ATOM 1394 C GLU A 97 -18.564 -1.719 6.509 1.00 0.00 C ATOM 1395 O GLU A 97 -18.176 -1.208 7.559 1.00 0.00 O ATOM 1396 CB GLU A 97 -20.784 -0.841 5.759 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.467 -2.195 5.652 1.00 0.00 C ATOM 1398 CD GLU A 97 -22.945 -2.130 5.983 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -23.279 -1.851 7.154 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.769 -2.357 5.073 1.00 0.00 O ATOM 0 H GLU A 97 -19.783 -2.061 3.790 1.00 0.00 H new ATOM 0 HA GLU A 97 -18.885 0.128 5.480 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -20.929 -0.448 6.765 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.266 -0.145 5.073 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.342 -2.582 4.641 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -20.978 -2.899 6.326 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.390 -3.004 6.222 1.00 0.00 N ATOM 1408 CA ASP A 98 -17.716 -3.909 7.146 1.00 0.00 C ATOM 1409 C ASP A 98 -16.302 -3.424 7.447 1.00 0.00 C ATOM 1410 O ASP A 98 -15.830 -3.520 8.580 1.00 0.00 O ATOM 1411 CB ASP A 98 -17.670 -5.323 6.565 1.00 0.00 C ATOM 1412 CG ASP A 98 -18.971 -6.075 6.768 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -19.714 -5.730 7.710 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -19.247 -7.007 5.984 1.00 0.00 O ATOM 0 H ASP A 98 -18.706 -3.443 5.357 1.00 0.00 H new ATOM 0 HA ASP A 98 -18.281 -3.925 8.078 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -17.448 -5.268 5.499 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -16.856 -5.878 7.032 1.00 0.00 H new ATOM 1419 N TRP A 99 -15.631 -2.903 6.426 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.269 -2.403 6.581 1.00 0.00 C ATOM 1421 C TRP A 99 -14.206 -1.321 7.653 1.00 0.00 C ATOM 1422 O TRP A 99 -14.836 -0.269 7.545 1.00 0.00 O ATOM 1423 CB TRP A 99 -13.751 -1.853 5.251 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.145 -2.686 4.070 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.302 -4.043 4.039 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.429 -2.218 2.747 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.667 -4.445 2.777 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.752 -3.345 1.966 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.444 -0.956 2.147 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -15.085 -3.245 0.618 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.774 -0.859 0.808 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -15.091 -1.997 0.056 1.00 0.00 C ATOM 0 H TRP A 99 -16.007 -2.816 5.482 1.00 0.00 H new ATOM 0 HA TRP A 99 -13.636 -3.234 6.893 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.128 -0.840 5.114 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -12.664 -1.786 5.293 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -14.160 -4.702 4.882 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.846 -5.407 2.490 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.202 -0.072 2.719 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.330 -4.121 0.036 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.788 0.111 0.334 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.345 -1.888 -0.988 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.427 -1.582 8.714 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.263 -0.641 9.826 1.00 0.00 C ATOM 1445 C PRO A 100 -12.469 0.598 9.424 1.00 0.00 C ATOM 1446 O PRO A 100 -11.489 0.506 8.684 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.493 -1.455 10.868 1.00 0.00 C ATOM 1448 CG PRO A 100 -11.763 -2.487 10.080 1.00 0.00 C ATOM 1449 CD PRO A 100 -12.647 -2.816 8.909 1.00 0.00 C ATOM 0 HA PRO A 100 -14.220 -0.261 10.184 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -11.803 -0.826 11.431 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.169 -1.913 11.590 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -10.796 -2.111 9.746 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.569 -3.374 10.684 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.064 -3.067 8.023 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.291 -3.670 9.119 1.00 0.00 H new ATOM 1457 N SER A 101 -12.897 1.755 9.917 1.00 0.00 N ATOM 1458 CA SER A 101 -12.227 3.013 9.607 1.00 0.00 C ATOM 1459 C SER A 101 -10.881 3.102 10.319 1.00 0.00 C ATOM 1460 O SER A 101 -10.789 2.886 11.528 1.00 0.00 O ATOM 1461 CB SER A 101 -13.109 4.197 10.009 1.00 0.00 C ATOM 1462 OG SER A 101 -14.118 4.433 9.042 1.00 0.00 O ATOM 0 H SER A 101 -13.705 1.848 10.533 1.00 0.00 H new ATOM 0 HA SER A 101 -12.052 3.048 8.532 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.568 4.000 10.978 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.494 5.090 10.123 1.00 0.00 H new ATOM 0 HG SER A 101 -14.669 5.193 9.323 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.837 3.421 9.561 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.495 3.540 10.118 1.00 0.00 C ATOM 1470 C VAL A 102 -7.793 4.790 9.599 1.00 0.00 C ATOM 1471 O VAL A 102 -8.236 5.406 8.630 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.637 2.306 9.783 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.248 1.051 10.386 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.478 2.161 8.277 1.00 0.00 C ATOM 0 H VAL A 102 -9.895 3.602 8.559 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.607 3.613 11.200 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.647 2.444 10.218 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.628 0.189 10.139 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.305 1.158 11.469 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.250 0.904 9.983 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.869 1.284 8.058 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.459 2.045 7.817 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.992 3.050 7.875 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.695 5.159 10.250 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.931 6.336 9.854 1.00 0.00 C ATOM 1486 C ASN A 103 -4.559 5.939 9.317 1.00 0.00 C ATOM 1487 O ASN A 103 -3.753 5.339 10.027 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.770 7.289 11.040 1.00 0.00 C ATOM 1489 CG ASN A 103 -6.992 8.162 11.251 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -7.032 9.310 10.809 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -7.997 7.619 11.929 1.00 0.00 N ATOM 0 H ASN A 103 -6.314 4.660 11.054 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.480 6.844 9.061 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.580 6.711 11.944 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.898 7.923 10.878 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.846 8.158 12.102 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.920 6.663 12.277 1.00 0.00 H new ATOM 1498 N MET A 104 -4.301 6.279 8.058 1.00 0.00 N ATOM 1499 CA MET A 104 -3.026 5.960 7.427 1.00 0.00 C ATOM 1500 C MET A 104 -2.005 7.066 7.672 1.00 0.00 C ATOM 1501 O MET A 104 -2.314 8.249 7.537 1.00 0.00 O ATOM 1502 CB MET A 104 -3.216 5.749 5.923 1.00 0.00 C ATOM 1503 CG MET A 104 -2.036 5.067 5.251 1.00 0.00 C ATOM 1504 SD MET A 104 -2.388 4.587 3.549 1.00 0.00 S ATOM 1505 CE MET A 104 -3.546 3.245 3.809 1.00 0.00 C ATOM 0 H MET A 104 -4.958 6.775 7.455 1.00 0.00 H new ATOM 0 HA MET A 104 -2.650 5.039 7.872 1.00 0.00 H new ATOM 0 HB2 MET A 104 -4.112 5.151 5.759 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.386 6.715 5.448 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.177 5.738 5.265 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.758 4.182 5.824 1.00 0.00 H new ATOM 0 HE1 MET A 104 -3.068 2.298 3.557 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.855 3.228 4.854 1.00 0.00 H new ATOM 0 HE3 MET A 104 -4.420 3.391 3.175 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.788 6.673 8.034 1.00 0.00 N ATOM 1516 CA ASN A 105 0.277 7.633 8.299 1.00 0.00 C ATOM 1517 C ASN A 105 1.421 7.465 7.303 1.00 0.00 C ATOM 1518 O ASN A 105 1.908 6.356 7.081 1.00 0.00 O ATOM 1519 CB ASN A 105 0.801 7.463 9.727 1.00 0.00 C ATOM 1520 CG ASN A 105 -0.269 7.722 10.770 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.463 7.658 10.479 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.156 8.015 11.993 1.00 0.00 N ATOM 0 H ASN A 105 -0.515 5.697 8.150 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.135 8.636 8.187 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.188 6.452 9.851 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.635 8.146 9.889 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.518 8.198 12.737 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.156 8.057 12.189 1.00 0.00 H new ATOM 1529 N VAL A 106 1.845 8.574 6.705 1.00 0.00 N ATOM 1530 CA VAL A 106 2.932 8.551 5.733 1.00 0.00 C ATOM 1531 C VAL A 106 4.151 9.303 6.255 1.00 0.00 C ATOM 1532 O VAL A 106 4.869 9.947 5.491 1.00 0.00 O ATOM 1533 CB VAL A 106 2.497 9.168 4.391 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.524 8.868 3.308 1.00 0.00 C ATOM 1535 CG2 VAL A 106 1.122 8.655 3.989 1.00 0.00 C ATOM 0 H VAL A 106 1.452 9.500 6.877 1.00 0.00 H new ATOM 0 HA VAL A 106 3.194 7.505 5.575 1.00 0.00 H new ATOM 0 HB VAL A 106 2.435 10.250 4.511 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.200 9.312 2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.488 9.288 3.594 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.620 7.789 3.187 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.831 9.102 3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.154 7.570 3.886 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.395 8.925 4.755 1.00 0.00 H new ATOM 1545 N ALA A 107 4.379 9.216 7.561 1.00 0.00 N ATOM 1546 CA ALA A 107 5.513 9.886 8.185 1.00 0.00 C ATOM 1547 C ALA A 107 6.805 9.113 7.949 1.00 0.00 C ATOM 1548 O ALA A 107 6.790 7.892 7.791 1.00 0.00 O ATOM 1549 CB ALA A 107 5.266 10.063 9.676 1.00 0.00 C ATOM 0 H ALA A 107 3.793 8.688 8.208 1.00 0.00 H new ATOM 0 HA ALA A 107 5.620 10.869 7.726 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.121 10.565 10.129 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.370 10.665 9.827 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.130 9.086 10.141 1.00 0.00 H new ATOM 1555 N ASP A 108 7.923 9.831 7.925 1.00 0.00 N ATOM 1556 CA ASP A 108 9.225 9.211 7.708 1.00 0.00 C ATOM 1557 C ASP A 108 9.152 8.167 6.598 1.00 0.00 C ATOM 1558 O ASP A 108 9.655 7.053 6.746 1.00 0.00 O ATOM 1559 CB ASP A 108 9.728 8.566 9.000 1.00 0.00 C ATOM 1560 CG ASP A 108 11.242 8.541 9.084 1.00 0.00 C ATOM 1561 OD1 ASP A 108 11.885 8.175 8.078 1.00 0.00 O ATOM 1562 OD2 ASP A 108 11.783 8.886 10.155 1.00 0.00 O ATOM 0 H ASP A 108 7.954 10.842 8.053 1.00 0.00 H new ATOM 0 HA ASP A 108 9.924 9.990 7.404 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.329 9.112 9.855 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.347 7.547 9.066 1.00 0.00 H new ATOM 1567 N ALA A 109 8.522 8.534 5.488 1.00 0.00 N ATOM 1568 CA ALA A 109 8.384 7.630 4.353 1.00 0.00 C ATOM 1569 C ALA A 109 8.020 6.222 4.814 1.00 0.00 C ATOM 1570 O ALA A 109 8.485 5.232 4.247 1.00 0.00 O ATOM 1571 CB ALA A 109 9.669 7.605 3.538 1.00 0.00 C ATOM 0 H ALA A 109 8.099 9.452 5.350 1.00 0.00 H new ATOM 0 HA ALA A 109 7.575 7.999 3.723 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.551 6.926 2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.886 8.608 3.170 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.492 7.264 4.166 1.00 0.00 H new ATOM 1577 N THR A 110 7.186 6.139 5.846 1.00 0.00 N ATOM 1578 CA THR A 110 6.762 4.853 6.384 1.00 0.00 C ATOM 1579 C THR A 110 5.243 4.728 6.375 1.00 0.00 C ATOM 1580 O THR A 110 4.527 5.711 6.565 1.00 0.00 O ATOM 1581 CB THR A 110 7.274 4.650 7.823 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.673 4.945 7.891 1.00 0.00 O ATOM 1583 CG2 THR A 110 7.029 3.222 8.287 1.00 0.00 C ATOM 0 H THR A 110 6.791 6.948 6.326 1.00 0.00 H new ATOM 0 HA THR A 110 7.191 4.084 5.742 1.00 0.00 H new ATOM 0 HB THR A 110 6.728 5.328 8.479 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.814 5.901 7.728 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.398 3.102 9.305 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.960 3.009 8.261 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.553 2.530 7.627 1.00 0.00 H new ATOM 1591 N VAL A 111 4.756 3.511 6.154 1.00 0.00 N ATOM 1592 CA VAL A 111 3.321 3.256 6.122 1.00 0.00 C ATOM 1593 C VAL A 111 2.845 2.628 7.427 1.00 0.00 C ATOM 1594 O VAL A 111 3.201 1.494 7.750 1.00 0.00 O ATOM 1595 CB VAL A 111 2.941 2.331 4.951 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.451 2.022 4.975 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.342 2.958 3.624 1.00 0.00 C ATOM 0 H VAL A 111 5.334 2.686 5.994 1.00 0.00 H new ATOM 0 HA VAL A 111 2.831 4.220 5.987 1.00 0.00 H new ATOM 0 HB VAL A 111 3.484 1.393 5.062 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.202 1.367 4.140 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.197 1.527 5.912 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.886 2.950 4.890 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.066 2.290 2.808 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.828 3.912 3.502 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.420 3.122 3.610 1.00 0.00 H new ATOM 1607 N THR A 112 2.036 3.371 8.175 1.00 0.00 N ATOM 1608 CA THR A 112 1.511 2.888 9.446 1.00 0.00 C ATOM 1609 C THR A 112 -0.009 3.001 9.491 1.00 0.00 C ATOM 1610 O THR A 112 -0.560 4.101 9.507 1.00 0.00 O ATOM 1611 CB THR A 112 2.108 3.667 10.633 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.500 3.915 10.406 1.00 0.00 O ATOM 1613 CG2 THR A 112 1.930 2.895 11.931 1.00 0.00 C ATOM 0 H THR A 112 1.730 4.311 7.922 1.00 0.00 H new ATOM 0 HA THR A 112 1.797 1.840 9.529 1.00 0.00 H new ATOM 0 HB THR A 112 1.580 4.617 10.718 1.00 0.00 H new ATOM 0 HG1 THR A 112 3.872 4.412 11.164 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.359 3.465 12.755 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.868 2.734 12.116 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.435 1.932 11.854 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.682 1.854 9.513 1.00 0.00 N ATOM 1622 CA VAL A 113 -2.139 1.824 9.559 1.00 0.00 C ATOM 1623 C VAL A 113 -2.647 1.984 10.988 1.00 0.00 C ATOM 1624 O VAL A 113 -2.922 0.998 11.673 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.692 0.512 8.972 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.208 0.473 9.087 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.254 0.350 7.525 1.00 0.00 C ATOM 0 H VAL A 113 -0.241 0.934 9.500 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.492 2.660 8.956 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.287 -0.322 9.545 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.581 -0.461 8.667 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.495 0.539 10.136 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.636 1.313 8.540 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.654 -0.582 7.126 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.628 1.187 6.936 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.165 0.329 7.475 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.770 3.230 11.430 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.247 3.519 12.777 1.00 0.00 C ATOM 1639 C ILE A 114 -4.745 3.259 12.897 1.00 0.00 C ATOM 1640 O ILE A 114 -5.479 3.333 11.912 1.00 0.00 O ATOM 1641 CB ILE A 114 -2.957 4.977 13.177 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.502 5.335 12.867 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.258 5.192 14.653 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.501 4.573 13.707 1.00 0.00 C ATOM 0 H ILE A 114 -2.546 4.056 10.875 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.709 2.853 13.451 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.605 5.633 12.595 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.304 5.139 11.813 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.358 6.404 13.024 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -3.048 6.228 14.920 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.308 4.974 14.846 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.634 4.529 15.252 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.509 4.877 13.434 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.672 4.789 14.762 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.618 3.504 13.532 1.00 0.00 H new ATOM 1656 N SER A 115 -5.192 2.955 14.111 1.00 0.00 N ATOM 1657 CA SER A 115 -6.603 2.682 14.361 1.00 0.00 C ATOM 1658 C SER A 115 -7.362 3.972 14.656 1.00 0.00 C ATOM 1659 O SER A 115 -6.784 4.949 15.130 1.00 0.00 O ATOM 1660 CB SER A 115 -6.756 1.707 15.530 1.00 0.00 C ATOM 1661 OG SER A 115 -8.032 1.091 15.516 1.00 0.00 O ATOM 0 H SER A 115 -4.598 2.891 14.937 1.00 0.00 H new ATOM 0 HA SER A 115 -7.025 2.230 13.463 1.00 0.00 H new ATOM 0 HB2 SER A 115 -5.980 0.944 15.475 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.615 2.238 16.471 1.00 0.00 H new ATOM 0 HG SER A 115 -8.104 0.471 16.272 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.660 3.965 14.372 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.499 5.135 14.606 1.00 0.00 C ATOM 1669 C GLU A 116 -9.767 5.323 16.096 1.00 0.00 C ATOM 1670 O GLU A 116 -9.699 6.437 16.615 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.824 5.000 13.852 1.00 0.00 C ATOM 1672 CG GLU A 116 -10.789 5.587 12.451 1.00 0.00 C ATOM 1673 CD GLU A 116 -11.166 7.055 12.425 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -10.613 7.824 13.239 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -12.014 7.436 11.591 1.00 0.00 O ATOM 0 H GLU A 116 -9.154 3.163 13.980 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.966 6.011 14.236 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.090 3.945 13.788 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.610 5.493 14.424 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -9.789 5.465 12.035 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.471 5.029 11.810 1.00 0.00 H new ATOM 1682 N LYS A 117 -10.072 4.225 16.780 1.00 0.00 N ATOM 1683 CA LYS A 117 -10.349 4.266 18.210 1.00 0.00 C ATOM 1684 C LYS A 117 -9.089 4.606 19.000 1.00 0.00 C ATOM 1685 O LYS A 117 -9.128 5.405 19.935 1.00 0.00 O ATOM 1686 CB LYS A 117 -10.911 2.923 18.681 1.00 0.00 C ATOM 1687 CG LYS A 117 -12.350 2.684 18.257 1.00 0.00 C ATOM 1688 CD LYS A 117 -12.955 1.494 18.983 1.00 0.00 C ATOM 1689 CE LYS A 117 -14.238 1.026 18.314 1.00 0.00 C ATOM 1690 NZ LYS A 117 -15.057 0.174 19.220 1.00 0.00 N ATOM 0 H LYS A 117 -10.133 3.295 16.366 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.090 5.046 18.388 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.287 2.120 18.289 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -10.848 2.873 19.768 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -12.943 3.576 18.461 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -12.390 2.514 17.181 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -12.235 0.676 19.005 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -13.161 1.765 20.019 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -14.822 1.892 18.003 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -13.994 0.466 17.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -15.923 -0.125 18.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -14.509 -0.666 19.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.312 0.716 20.070 1.00 0.00 H new ATOM 1704 N ASN A 118 -7.973 3.996 18.615 1.00 0.00 N ATOM 1705 CA ASN A 118 -6.701 4.236 19.287 1.00 0.00 C ATOM 1706 C ASN A 118 -5.667 4.790 18.311 1.00 0.00 C ATOM 1707 O ASN A 118 -5.609 4.379 17.153 1.00 0.00 O ATOM 1708 CB ASN A 118 -6.181 2.942 19.917 1.00 0.00 C ATOM 1709 CG ASN A 118 -6.975 2.537 21.144 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -8.206 2.526 21.125 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -6.272 2.201 22.219 1.00 0.00 N ATOM 0 H ASN A 118 -7.923 3.332 17.842 1.00 0.00 H new ATOM 0 HA ASN A 118 -6.867 4.974 20.072 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -6.222 2.140 19.180 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.134 3.070 20.191 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -6.751 1.919 23.074 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -5.253 2.225 22.190 1.00 0.00 H new ATOM 1718 N GLU A 119 -4.852 5.725 18.790 1.00 0.00 N ATOM 1719 CA GLU A 119 -3.820 6.336 17.959 1.00 0.00 C ATOM 1720 C GLU A 119 -2.474 5.650 18.172 1.00 0.00 C ATOM 1721 O GLU A 119 -1.606 5.682 17.301 1.00 0.00 O ATOM 1722 CB GLU A 119 -3.700 7.829 18.273 1.00 0.00 C ATOM 1723 CG GLU A 119 -3.131 8.647 17.126 1.00 0.00 C ATOM 1724 CD GLU A 119 -3.206 10.140 17.381 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -4.300 10.625 17.741 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -2.173 10.823 17.221 1.00 0.00 O ATOM 0 H GLU A 119 -4.886 6.076 19.747 1.00 0.00 H new ATOM 0 HA GLU A 119 -4.109 6.214 16.915 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -4.685 8.218 18.532 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -3.066 7.958 19.150 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.092 8.362 16.962 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.675 8.411 16.211 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.309 5.031 19.338 1.00 0.00 N ATOM 1734 CA GLU A 120 -1.068 4.339 19.665 1.00 0.00 C ATOM 1735 C GLU A 120 -1.235 2.829 19.525 1.00 0.00 C ATOM 1736 O GLU A 120 -0.722 2.060 20.338 1.00 0.00 O ATOM 1737 CB GLU A 120 -0.627 4.685 21.089 1.00 0.00 C ATOM 1738 CG GLU A 120 -0.160 6.122 21.250 1.00 0.00 C ATOM 1739 CD GLU A 120 0.839 6.288 22.378 1.00 0.00 C ATOM 1740 OE1 GLU A 120 0.501 5.933 23.526 1.00 0.00 O ATOM 1741 OE2 GLU A 120 1.959 6.773 22.113 1.00 0.00 O ATOM 0 H GLU A 120 -3.018 4.995 20.070 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.301 4.669 18.964 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -1.457 4.503 21.772 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.180 4.014 21.383 1.00 0.00 H new ATOM 0 HG2 GLU A 120 0.292 6.460 20.317 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.023 6.762 21.437 1.00 0.00 H new ATOM 1748 N GLU A 121 -1.955 2.412 18.489 1.00 0.00 N ATOM 1749 CA GLU A 121 -2.190 0.994 18.243 1.00 0.00 C ATOM 1750 C GLU A 121 -1.323 0.490 17.093 1.00 0.00 C ATOM 1751 O GLU A 121 -0.976 -0.689 17.033 1.00 0.00 O ATOM 1752 CB GLU A 121 -3.667 0.746 17.929 1.00 0.00 C ATOM 1753 CG GLU A 121 -3.978 -0.696 17.567 1.00 0.00 C ATOM 1754 CD GLU A 121 -4.042 -1.602 18.781 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -5.128 -1.707 19.388 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -3.004 -2.206 19.125 1.00 0.00 O ATOM 0 H GLU A 121 -2.386 3.036 17.806 1.00 0.00 H new ATOM 0 HA GLU A 121 -1.921 0.446 19.146 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.267 1.032 18.793 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -3.968 1.392 17.104 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.930 -0.736 17.038 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.216 -1.067 16.881 1.00 0.00 H new ATOM 1763 N VAL A 122 -0.976 1.394 16.181 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.149 1.042 15.033 1.00 0.00 C ATOM 1765 C VAL A 122 -0.452 -0.372 14.550 1.00 0.00 C ATOM 1766 O VAL A 122 0.446 -1.209 14.445 1.00 0.00 O ATOM 1767 CB VAL A 122 1.351 1.148 15.368 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.692 0.283 16.572 1.00 0.00 C ATOM 1769 CG2 VAL A 122 2.194 0.757 14.164 1.00 0.00 C ATOM 0 H VAL A 122 -1.255 2.375 16.215 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.388 1.752 14.241 1.00 0.00 H new ATOM 0 HB VAL A 122 1.577 2.184 15.620 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.756 0.371 16.794 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.113 0.615 17.434 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.452 -0.757 16.352 1.00 0.00 H new ATOM 0 HG21 VAL A 122 3.251 0.838 14.418 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.967 -0.270 13.879 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.969 1.423 13.331 1.00 0.00 H new ATOM 1779 N LEU A 123 -1.721 -0.632 14.257 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.143 -1.946 13.784 1.00 0.00 C ATOM 1781 C LEU A 123 -1.080 -2.569 12.885 1.00 0.00 C ATOM 1782 O LEU A 123 -0.589 -3.665 13.155 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.467 -1.835 13.025 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.628 -1.200 13.790 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -5.582 -0.504 12.832 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.364 -2.249 14.611 1.00 0.00 C ATOM 0 H LEU A 123 -2.476 0.049 14.338 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.281 -2.590 14.652 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.295 -1.255 12.118 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -3.768 -2.835 12.712 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.222 -0.453 14.472 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.402 -0.058 13.395 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.048 0.276 12.289 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.981 -1.230 12.124 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.187 -1.778 15.149 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.757 -3.020 13.948 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.676 -2.701 15.325 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.726 -1.861 11.817 1.00 0.00 N ATOM 1799 CA VAL A 124 0.282 -2.342 10.881 1.00 0.00 C ATOM 1800 C VAL A 124 1.404 -1.324 10.709 1.00 0.00 C ATOM 1801 O VAL A 124 1.169 -0.117 10.742 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.333 -2.649 9.502 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.755 -2.983 8.494 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.339 -3.786 9.609 1.00 0.00 C ATOM 0 H VAL A 124 -1.123 -0.952 11.579 1.00 0.00 H new ATOM 0 HA VAL A 124 0.691 -3.261 11.302 1.00 0.00 H new ATOM 0 HB VAL A 124 -0.858 -1.760 9.152 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.301 -3.197 7.526 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.434 -2.136 8.397 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.311 -3.856 8.835 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.764 -3.990 8.626 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.839 -4.680 9.981 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.136 -3.503 10.297 1.00 0.00 H new ATOM 1814 N GLU A 125 2.624 -1.821 10.525 1.00 0.00 N ATOM 1815 CA GLU A 125 3.782 -0.953 10.349 1.00 0.00 C ATOM 1816 C GLU A 125 4.705 -1.493 9.260 1.00 0.00 C ATOM 1817 O GLU A 125 5.423 -2.472 9.469 1.00 0.00 O ATOM 1818 CB GLU A 125 4.552 -0.819 11.664 1.00 0.00 C ATOM 1819 CG GLU A 125 5.584 0.296 11.655 1.00 0.00 C ATOM 1820 CD GLU A 125 6.026 0.694 13.050 1.00 0.00 C ATOM 1821 OE1 GLU A 125 5.235 1.349 13.759 1.00 0.00 O ATOM 1822 OE2 GLU A 125 7.164 0.348 13.431 1.00 0.00 O ATOM 0 H GLU A 125 2.835 -2.818 10.494 1.00 0.00 H new ATOM 0 HA GLU A 125 3.424 0.030 10.044 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.844 -0.640 12.473 1.00 0.00 H new ATOM 0 HB3 GLU A 125 5.052 -1.763 11.880 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.453 -0.023 11.080 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.168 1.167 11.148 1.00 0.00 H new ATOM 1829 N CYS A 126 4.680 -0.848 8.099 1.00 0.00 N ATOM 1830 CA CYS A 126 5.513 -1.264 6.976 1.00 0.00 C ATOM 1831 C CYS A 126 6.270 -0.075 6.392 1.00 0.00 C ATOM 1832 O CYS A 126 5.719 1.017 6.252 1.00 0.00 O ATOM 1833 CB CYS A 126 4.656 -1.920 5.893 1.00 0.00 C ATOM 1834 SG CYS A 126 5.580 -2.990 4.766 1.00 0.00 S ATOM 0 H CYS A 126 4.093 -0.036 7.911 1.00 0.00 H new ATOM 0 HA CYS A 126 6.239 -1.990 7.343 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.871 -2.506 6.371 1.00 0.00 H new ATOM 0 HB3 CYS A 126 4.163 -1.140 5.313 1.00 0.00 H new ATOM 0 HG CYS A 126 4.941 -4.112 4.611 1.00 0.00 H new ATOM 1840 N ARG A 127 7.537 -0.295 6.054 1.00 0.00 N ATOM 1841 CA ARG A 127 8.370 0.759 5.488 1.00 0.00 C ATOM 1842 C ARG A 127 8.288 0.757 3.964 1.00 0.00 C ATOM 1843 O ARG A 127 7.843 -0.217 3.357 1.00 0.00 O ATOM 1844 CB ARG A 127 9.824 0.581 5.931 1.00 0.00 C ATOM 1845 CG ARG A 127 9.969 0.044 7.345 1.00 0.00 C ATOM 1846 CD ARG A 127 11.239 0.554 8.007 1.00 0.00 C ATOM 1847 NE ARG A 127 12.440 0.058 7.341 1.00 0.00 N ATOM 1848 CZ ARG A 127 13.639 0.615 7.477 1.00 0.00 C ATOM 1849 NH1 ARG A 127 13.795 1.680 8.251 1.00 0.00 N ATOM 1850 NH2 ARG A 127 14.685 0.105 6.839 1.00 0.00 N ATOM 0 H ARG A 127 8.008 -1.193 6.162 1.00 0.00 H new ATOM 0 HA ARG A 127 8.000 1.717 5.854 1.00 0.00 H new ATOM 0 HB2 ARG A 127 10.325 -0.098 5.241 1.00 0.00 H new ATOM 0 HB3 ARG A 127 10.336 1.541 5.862 1.00 0.00 H new ATOM 0 HG2 ARG A 127 9.104 0.340 7.938 1.00 0.00 H new ATOM 0 HG3 ARG A 127 9.982 -1.046 7.322 1.00 0.00 H new ATOM 0 HD2 ARG A 127 11.242 1.644 7.995 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.251 0.247 9.053 1.00 0.00 H new ATOM 0 HE ARG A 127 12.354 -0.761 6.739 1.00 0.00 H new ATOM 0 HH11 ARG A 127 12.994 2.074 8.744 1.00 0.00 H new ATOM 0 HH12 ARG A 127 14.716 2.105 8.354 1.00 0.00 H new ATOM 0 HH21 ARG A 127 14.569 -0.715 6.244 1.00 0.00 H new ATOM 0 HH22 ARG A 127 15.605 0.533 6.944 1.00 0.00 H new ATOM 1864 N VAL A 128 8.718 1.856 3.352 1.00 0.00 N ATOM 1865 CA VAL A 128 8.693 1.982 1.900 1.00 0.00 C ATOM 1866 C VAL A 128 9.753 1.097 1.254 1.00 0.00 C ATOM 1867 O VAL A 128 9.536 0.535 0.180 1.00 0.00 O ATOM 1868 CB VAL A 128 8.920 3.441 1.459 1.00 0.00 C ATOM 1869 CG1 VAL A 128 7.742 4.312 1.869 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.219 3.977 2.043 1.00 0.00 C ATOM 0 H VAL A 128 9.088 2.672 3.840 1.00 0.00 H new ATOM 0 HA VAL A 128 7.705 1.660 1.571 1.00 0.00 H new ATOM 0 HB VAL A 128 8.999 3.466 0.372 1.00 0.00 H new ATOM 0 HG11 VAL A 128 7.920 5.339 1.549 1.00 0.00 H new ATOM 0 HG12 VAL A 128 6.832 3.938 1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.629 4.284 2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.364 5.008 1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.172 3.939 3.131 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.053 3.368 1.695 1.00 0.00 H new ATOM 1880 N ARG A 129 10.900 0.977 1.915 1.00 0.00 N ATOM 1881 CA ARG A 129 11.994 0.160 1.404 1.00 0.00 C ATOM 1882 C ARG A 129 11.601 -1.314 1.368 1.00 0.00 C ATOM 1883 O ARG A 129 11.988 -2.048 0.459 1.00 0.00 O ATOM 1884 CB ARG A 129 13.243 0.346 2.268 1.00 0.00 C ATOM 1885 CG ARG A 129 13.607 1.802 2.507 1.00 0.00 C ATOM 1886 CD ARG A 129 14.268 2.420 1.285 1.00 0.00 C ATOM 1887 NE ARG A 129 15.694 2.113 1.220 1.00 0.00 N ATOM 1888 CZ ARG A 129 16.564 2.814 0.502 1.00 0.00 C ATOM 1889 NH1 ARG A 129 16.156 3.856 -0.208 1.00 0.00 N ATOM 1890 NH2 ARG A 129 17.847 2.473 0.494 1.00 0.00 N ATOM 0 H ARG A 129 11.096 1.435 2.805 1.00 0.00 H new ATOM 0 HA ARG A 129 12.213 0.484 0.387 1.00 0.00 H new ATOM 0 HB2 ARG A 129 13.085 -0.143 3.229 1.00 0.00 H new ATOM 0 HB3 ARG A 129 14.084 -0.156 1.789 1.00 0.00 H new ATOM 0 HG2 ARG A 129 12.709 2.366 2.760 1.00 0.00 H new ATOM 0 HG3 ARG A 129 14.280 1.874 3.361 1.00 0.00 H new ATOM 0 HD2 ARG A 129 13.777 2.054 0.383 1.00 0.00 H new ATOM 0 HD3 ARG A 129 14.131 3.501 1.306 1.00 0.00 H new ATOM 0 HE ARG A 129 16.041 1.317 1.755 1.00 0.00 H new ATOM 0 HH11 ARG A 129 15.171 4.122 -0.204 1.00 0.00 H new ATOM 0 HH12 ARG A 129 16.827 4.392 -0.758 1.00 0.00 H new ATOM 0 HH21 ARG A 129 18.165 1.672 1.040 1.00 0.00 H new ATOM 0 HH22 ARG A 129 18.515 3.012 -0.058 1.00 0.00 H new ATOM 1904 N PHE A 130 10.831 -1.740 2.364 1.00 0.00 N ATOM 1905 CA PHE A 130 10.387 -3.126 2.448 1.00 0.00 C ATOM 1906 C PHE A 130 9.301 -3.413 1.415 1.00 0.00 C ATOM 1907 O PHE A 130 9.165 -4.540 0.936 1.00 0.00 O ATOM 1908 CB PHE A 130 9.865 -3.433 3.853 1.00 0.00 C ATOM 1909 CG PHE A 130 10.950 -3.759 4.838 1.00 0.00 C ATOM 1910 CD1 PHE A 130 11.901 -2.811 5.180 1.00 0.00 C ATOM 1911 CD2 PHE A 130 11.019 -5.013 5.423 1.00 0.00 C ATOM 1912 CE1 PHE A 130 12.901 -3.109 6.086 1.00 0.00 C ATOM 1913 CE2 PHE A 130 12.017 -5.317 6.330 1.00 0.00 C ATOM 1914 CZ PHE A 130 12.958 -4.363 6.663 1.00 0.00 C ATOM 0 H PHE A 130 10.502 -1.145 3.124 1.00 0.00 H new ATOM 0 HA PHE A 130 11.242 -3.768 2.238 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.300 -2.575 4.218 1.00 0.00 H new ATOM 0 HB3 PHE A 130 9.171 -4.272 3.799 1.00 0.00 H new ATOM 0 HD1 PHE A 130 11.860 -1.828 4.734 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.284 -5.762 5.167 1.00 0.00 H new ATOM 0 HE1 PHE A 130 13.638 -2.362 6.343 1.00 0.00 H new ATOM 0 HE2 PHE A 130 12.061 -6.299 6.777 1.00 0.00 H new ATOM 0 HZ PHE A 130 13.737 -4.597 7.373 1.00 0.00 H new ATOM 1924 N LEU A 131 8.530 -2.386 1.076 1.00 0.00 N ATOM 1925 CA LEU A 131 7.454 -2.526 0.100 1.00 0.00 C ATOM 1926 C LEU A 131 7.969 -3.157 -1.190 1.00 0.00 C ATOM 1927 O LEU A 131 9.012 -2.764 -1.712 1.00 0.00 O ATOM 1928 CB LEU A 131 6.830 -1.162 -0.199 1.00 0.00 C ATOM 1929 CG LEU A 131 5.362 -1.175 -0.625 1.00 0.00 C ATOM 1930 CD1 LEU A 131 4.697 0.152 -0.292 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.240 -1.477 -2.112 1.00 0.00 C ATOM 0 H LEU A 131 8.629 -1.447 1.462 1.00 0.00 H new ATOM 0 HA LEU A 131 6.693 -3.181 0.525 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.924 -0.539 0.690 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.412 -0.683 -0.987 1.00 0.00 H new ATOM 0 HG LEU A 131 4.851 -1.963 -0.072 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.653 0.124 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.751 0.327 0.783 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.210 0.958 -0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.188 -1.482 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.767 -0.713 -2.683 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.678 -2.453 -2.322 1.00 0.00 H new ATOM 1943 N SER A 132 7.228 -4.136 -1.700 1.00 0.00 N ATOM 1944 CA SER A 132 7.610 -4.822 -2.928 1.00 0.00 C ATOM 1945 C SER A 132 6.928 -4.190 -4.138 1.00 0.00 C ATOM 1946 O SER A 132 7.589 -3.762 -5.084 1.00 0.00 O ATOM 1947 CB SER A 132 7.248 -6.306 -2.842 1.00 0.00 C ATOM 1948 OG SER A 132 5.843 -6.486 -2.783 1.00 0.00 O ATOM 0 H SER A 132 6.360 -4.471 -1.282 1.00 0.00 H new ATOM 0 HA SER A 132 8.689 -4.725 -3.049 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.649 -6.832 -3.708 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.712 -6.746 -1.959 1.00 0.00 H new ATOM 0 HG SER A 132 5.449 -5.799 -2.206 1.00 0.00 H new ATOM 1954 N PHE A 133 5.601 -4.136 -4.100 1.00 0.00 N ATOM 1955 CA PHE A 133 4.828 -3.557 -5.193 1.00 0.00 C ATOM 1956 C PHE A 133 3.585 -2.847 -4.663 1.00 0.00 C ATOM 1957 O PHE A 133 3.013 -3.247 -3.650 1.00 0.00 O ATOM 1958 CB PHE A 133 4.422 -4.645 -6.189 1.00 0.00 C ATOM 1959 CG PHE A 133 3.503 -4.153 -7.272 1.00 0.00 C ATOM 1960 CD1 PHE A 133 3.923 -3.183 -8.167 1.00 0.00 C ATOM 1961 CD2 PHE A 133 2.220 -4.661 -7.393 1.00 0.00 C ATOM 1962 CE1 PHE A 133 3.081 -2.728 -9.164 1.00 0.00 C ATOM 1963 CE2 PHE A 133 1.373 -4.211 -8.389 1.00 0.00 C ATOM 1964 CZ PHE A 133 1.804 -3.243 -9.274 1.00 0.00 C ATOM 0 H PHE A 133 5.038 -4.486 -3.325 1.00 0.00 H new ATOM 0 HA PHE A 133 5.455 -2.824 -5.701 1.00 0.00 H new ATOM 0 HB2 PHE A 133 5.320 -5.061 -6.646 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.933 -5.456 -5.650 1.00 0.00 H new ATOM 0 HD1 PHE A 133 4.921 -2.777 -8.085 1.00 0.00 H new ATOM 0 HD2 PHE A 133 1.877 -5.417 -6.702 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.421 -1.971 -9.856 1.00 0.00 H new ATOM 0 HE2 PHE A 133 0.376 -4.616 -8.475 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.143 -2.889 -10.052 1.00 0.00 H new ATOM 1974 N MET A 134 3.175 -1.790 -5.357 1.00 0.00 N ATOM 1975 CA MET A 134 2.000 -1.024 -4.957 1.00 0.00 C ATOM 1976 C MET A 134 1.286 -0.448 -6.176 1.00 0.00 C ATOM 1977 O MET A 134 1.887 0.262 -6.981 1.00 0.00 O ATOM 1978 CB MET A 134 2.400 0.105 -4.006 1.00 0.00 C ATOM 1979 CG MET A 134 3.342 1.121 -4.631 1.00 0.00 C ATOM 1980 SD MET A 134 3.871 2.389 -3.462 1.00 0.00 S ATOM 1981 CE MET A 134 5.623 2.033 -3.347 1.00 0.00 C ATOM 0 H MET A 134 3.638 -1.445 -6.198 1.00 0.00 H new ATOM 0 HA MET A 134 1.316 -1.698 -4.442 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.500 0.618 -3.665 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.876 -0.325 -3.124 1.00 0.00 H new ATOM 0 HG2 MET A 134 4.219 0.605 -5.023 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.847 1.597 -5.478 1.00 0.00 H new ATOM 0 HE1 MET A 134 5.923 2.018 -2.299 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.827 1.061 -3.797 1.00 0.00 H new ATOM 0 HE3 MET A 134 6.186 2.803 -3.875 1.00 0.00 H new ATOM 1991 N GLY A 135 0.000 -0.760 -6.306 1.00 0.00 N ATOM 1992 CA GLY A 135 -0.773 -0.266 -7.430 1.00 0.00 C ATOM 1993 C GLY A 135 -2.248 -0.131 -7.104 1.00 0.00 C ATOM 1994 O GLY A 135 -2.669 -0.397 -5.979 1.00 0.00 O ATOM 0 H GLY A 135 -0.520 -1.346 -5.653 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.382 0.704 -7.738 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.651 -0.942 -8.276 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.034 0.286 -8.091 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.470 0.456 -7.904 1.00 0.00 C ATOM 2000 C VAL A 136 -5.257 -0.537 -8.753 1.00 0.00 C ATOM 2001 O VAL A 136 -4.923 -0.780 -9.911 1.00 0.00 O ATOM 2002 CB VAL A 136 -4.917 1.887 -8.261 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.411 2.053 -8.030 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.127 2.907 -7.456 1.00 0.00 C ATOM 0 H VAL A 136 -2.701 0.512 -9.028 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.676 0.271 -6.850 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.717 2.059 -9.319 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.708 3.070 -8.287 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -6.957 1.346 -8.655 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.640 1.862 -6.982 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.455 3.912 -7.720 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.294 2.739 -6.392 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.065 2.802 -7.678 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.305 -1.107 -8.167 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.124 -2.067 -8.884 1.00 0.00 C ATOM 2016 C GLY A 137 -8.024 -1.410 -9.911 1.00 0.00 C ATOM 2017 O GLY A 137 -7.808 -0.259 -10.291 1.00 0.00 O ATOM 0 H GLY A 137 -6.602 -0.921 -7.209 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.478 -2.791 -9.382 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.735 -2.622 -8.172 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.037 -2.141 -10.363 1.00 0.00 N ATOM 2022 CA LYS A 138 -9.974 -1.623 -11.352 1.00 0.00 C ATOM 2023 C LYS A 138 -10.557 -0.288 -10.903 1.00 0.00 C ATOM 2024 O LYS A 138 -10.646 0.657 -11.687 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.102 -2.629 -11.593 1.00 0.00 C ATOM 2026 CG LYS A 138 -10.793 -3.640 -12.684 1.00 0.00 C ATOM 2027 CD LYS A 138 -12.029 -4.433 -13.075 1.00 0.00 C ATOM 2028 CE LYS A 138 -12.254 -5.612 -12.141 1.00 0.00 C ATOM 2029 NZ LYS A 138 -12.859 -5.187 -10.848 1.00 0.00 N ATOM 0 H LYS A 138 -9.230 -3.095 -10.059 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.430 -1.467 -12.283 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -11.308 -3.161 -10.664 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -12.010 -2.087 -11.858 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -10.399 -3.123 -13.559 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -10.016 -4.322 -12.340 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -12.902 -3.781 -13.056 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -11.923 -4.793 -14.098 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -12.905 -6.340 -12.625 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -11.304 -6.111 -11.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -13.549 -5.900 -10.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -12.112 -5.091 -10.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -13.339 -4.273 -10.973 1.00 0.00 H new ATOM 2043 N ASP A 139 -10.952 -0.216 -9.636 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.524 1.005 -9.081 1.00 0.00 C ATOM 2045 C ASP A 139 -10.427 1.943 -8.586 1.00 0.00 C ATOM 2046 O ASP A 139 -9.316 1.509 -8.281 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.482 0.671 -7.937 1.00 0.00 C ATOM 2048 CG ASP A 139 -13.900 0.436 -8.418 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.553 1.415 -8.837 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.357 -0.725 -8.375 1.00 0.00 O ATOM 0 H ASP A 139 -10.886 -0.989 -8.974 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.078 1.509 -9.872 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.126 -0.218 -7.417 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -12.477 1.486 -7.214 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.747 3.231 -8.510 1.00 0.00 N ATOM 2056 CA VAL A 140 -9.789 4.231 -8.052 1.00 0.00 C ATOM 2057 C VAL A 140 -9.774 4.320 -6.531 1.00 0.00 C ATOM 2058 O VAL A 140 -8.901 4.961 -5.944 1.00 0.00 O ATOM 2059 CB VAL A 140 -10.108 5.621 -8.634 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -9.963 5.613 -10.148 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.506 6.061 -8.226 1.00 0.00 C ATOM 0 H VAL A 140 -11.662 3.607 -8.760 1.00 0.00 H new ATOM 0 HA VAL A 140 -8.807 3.915 -8.404 1.00 0.00 H new ATOM 0 HB VAL A 140 -9.394 6.338 -8.229 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -10.192 6.604 -10.541 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -8.941 5.345 -10.414 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -10.652 4.885 -10.576 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -11.715 7.045 -8.646 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -12.237 5.344 -8.600 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.569 6.109 -7.139 1.00 0.00 H new ATOM 2071 N HIS A 141 -10.745 3.672 -5.895 1.00 0.00 N ATOM 2072 CA HIS A 141 -10.842 3.677 -4.440 1.00 0.00 C ATOM 2073 C HIS A 141 -10.305 2.374 -3.855 1.00 0.00 C ATOM 2074 O HIS A 141 -10.588 2.033 -2.706 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.293 3.884 -4.005 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.039 4.865 -4.856 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -13.673 4.515 -6.030 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -13.251 6.193 -4.697 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.242 5.584 -6.556 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -14.001 6.616 -5.767 1.00 0.00 N ATOM 0 H HIS A 141 -11.476 3.137 -6.365 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.236 4.501 -4.063 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -12.812 2.926 -4.030 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.308 4.227 -2.971 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -12.896 6.805 -3.881 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -14.808 5.610 -7.475 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.320 7.572 -5.927 1.00 0.00 H new ATOM 2088 N THR A 142 -9.527 1.649 -4.653 1.00 0.00 N ATOM 2089 CA THR A 142 -8.952 0.383 -4.216 1.00 0.00 C ATOM 2090 C THR A 142 -7.434 0.392 -4.355 1.00 0.00 C ATOM 2091 O THR A 142 -6.901 0.307 -5.462 1.00 0.00 O ATOM 2092 CB THR A 142 -9.523 -0.801 -5.018 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.478 -0.509 -6.420 1.00 0.00 O ATOM 2094 CG2 THR A 142 -10.956 -1.096 -4.602 1.00 0.00 C ATOM 0 H THR A 142 -9.281 1.917 -5.606 1.00 0.00 H new ATOM 0 HA THR A 142 -9.217 0.261 -3.166 1.00 0.00 H new ATOM 0 HB THR A 142 -8.913 -1.680 -4.810 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.600 -0.138 -6.649 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.338 -1.936 -5.182 1.00 0.00 H new ATOM 0 HG22 THR A 142 -10.983 -1.346 -3.541 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.576 -0.218 -4.784 1.00 0.00 H new ATOM 2102 N PHE A 143 -6.741 0.495 -3.226 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.283 0.515 -3.222 1.00 0.00 C ATOM 2104 C PHE A 143 -4.725 -0.603 -2.347 1.00 0.00 C ATOM 2105 O PHE A 143 -5.150 -0.782 -1.205 1.00 0.00 O ATOM 2106 CB PHE A 143 -4.771 1.870 -2.727 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.295 1.888 -2.449 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.381 1.852 -3.490 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -2.822 1.942 -1.148 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -1.022 1.868 -3.238 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.464 1.959 -0.890 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.563 1.923 -1.936 1.00 0.00 C ATOM 0 H PHE A 143 -7.166 0.566 -2.301 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.940 0.357 -4.245 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.001 2.631 -3.473 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.307 2.142 -1.818 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.734 1.811 -4.510 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.522 1.971 -0.326 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.320 1.838 -4.058 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.108 2.000 0.129 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.498 1.938 -1.737 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.772 -1.353 -2.890 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.155 -2.452 -2.159 1.00 0.00 C ATOM 2124 C ALA A 144 -1.643 -2.465 -2.359 1.00 0.00 C ATOM 2125 O ALA A 144 -1.142 -2.052 -3.405 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.758 -3.780 -2.594 1.00 0.00 C ATOM 0 H ALA A 144 -3.410 -1.219 -3.834 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.353 -2.305 -1.097 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.288 -4.592 -2.040 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.829 -3.776 -2.393 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.590 -3.924 -3.661 1.00 0.00 H new ATOM 2132 N PHE A 145 -0.922 -2.941 -1.350 1.00 0.00 N ATOM 2133 CA PHE A 145 0.534 -3.006 -1.415 1.00 0.00 C ATOM 2134 C PHE A 145 1.044 -4.337 -0.871 1.00 0.00 C ATOM 2135 O PHE A 145 0.507 -4.868 0.102 1.00 0.00 O ATOM 2136 CB PHE A 145 1.153 -1.849 -0.627 1.00 0.00 C ATOM 2137 CG PHE A 145 0.815 -1.873 0.836 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.409 -2.794 1.684 1.00 0.00 C ATOM 2139 CD2 PHE A 145 -0.097 -0.973 1.365 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.101 -2.818 3.031 1.00 0.00 C ATOM 2141 CE2 PHE A 145 -0.409 -0.992 2.711 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.190 -1.916 3.545 1.00 0.00 C ATOM 0 H PHE A 145 -1.321 -3.287 -0.478 1.00 0.00 H new ATOM 0 HA PHE A 145 0.830 -2.924 -2.461 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.236 -1.880 -0.742 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.814 -0.906 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.122 -3.502 1.287 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.569 -0.249 0.718 1.00 0.00 H new ATOM 0 HE1 PHE A 145 1.572 -3.541 3.681 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -1.121 -0.285 3.111 1.00 0.00 H new ATOM 0 HZ PHE A 145 -0.054 -1.933 4.597 1.00 0.00 H new ATOM 2152 N ILE A 146 2.082 -4.870 -1.506 1.00 0.00 N ATOM 2153 CA ILE A 146 2.665 -6.138 -1.086 1.00 0.00 C ATOM 2154 C ILE A 146 3.976 -5.920 -0.339 1.00 0.00 C ATOM 2155 O ILE A 146 4.828 -5.146 -0.773 1.00 0.00 O ATOM 2156 CB ILE A 146 2.920 -7.066 -2.288 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.602 -7.409 -2.984 1.00 0.00 C ATOM 2158 CG2 ILE A 146 3.633 -8.333 -1.838 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.751 -7.668 -4.467 1.00 0.00 C ATOM 0 H ILE A 146 2.537 -4.443 -2.313 1.00 0.00 H new ATOM 0 HA ILE A 146 1.944 -6.611 -0.419 1.00 0.00 H new ATOM 0 HB ILE A 146 3.561 -6.546 -3.000 1.00 0.00 H new ATOM 0 HG12 ILE A 146 1.170 -8.291 -2.511 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.898 -6.590 -2.835 1.00 0.00 H new ATOM 0 HG21 ILE A 146 3.806 -8.979 -2.699 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.588 -8.071 -1.383 1.00 0.00 H new ATOM 0 HG23 ILE A 146 3.016 -8.858 -1.109 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.777 -7.905 -4.895 1.00 0.00 H new ATOM 0 HD12 ILE A 146 2.154 -6.779 -4.953 1.00 0.00 H new ATOM 0 HD13 ILE A 146 2.430 -8.506 -4.624 1.00 0.00 H new ATOM 2171 N MET A 147 4.132 -6.610 0.787 1.00 0.00 N ATOM 2172 CA MET A 147 5.342 -6.493 1.593 1.00 0.00 C ATOM 2173 C MET A 147 5.873 -7.870 1.977 1.00 0.00 C ATOM 2174 O MET A 147 5.165 -8.872 1.868 1.00 0.00 O ATOM 2175 CB MET A 147 5.064 -5.671 2.853 1.00 0.00 C ATOM 2176 CG MET A 147 4.291 -6.433 3.917 1.00 0.00 C ATOM 2177 SD MET A 147 3.399 -5.342 5.042 1.00 0.00 S ATOM 2178 CE MET A 147 4.343 -5.563 6.548 1.00 0.00 C ATOM 0 H MET A 147 3.436 -7.255 1.161 1.00 0.00 H new ATOM 0 HA MET A 147 6.099 -5.984 0.996 1.00 0.00 H new ATOM 0 HB2 MET A 147 6.012 -5.335 3.274 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.503 -4.778 2.578 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.584 -7.107 3.434 1.00 0.00 H new ATOM 0 HG3 MET A 147 4.982 -7.052 4.489 1.00 0.00 H new ATOM 0 HE1 MET A 147 4.093 -4.771 7.254 1.00 0.00 H new ATOM 0 HE2 MET A 147 4.104 -6.531 6.989 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.408 -5.522 6.319 1.00 0.00 H new ATOM 2188 N ASP A 148 7.122 -7.913 2.427 1.00 0.00 N ATOM 2189 CA ASP A 148 7.748 -9.168 2.829 1.00 0.00 C ATOM 2190 C ASP A 148 7.646 -9.367 4.338 1.00 0.00 C ATOM 2191 O ASP A 148 7.934 -8.458 5.117 1.00 0.00 O ATOM 2192 CB ASP A 148 9.215 -9.191 2.397 1.00 0.00 C ATOM 2193 CG ASP A 148 9.957 -10.399 2.934 1.00 0.00 C ATOM 2194 OD1 ASP A 148 10.348 -10.375 4.120 1.00 0.00 O ATOM 2195 OD2 ASP A 148 10.148 -11.368 2.169 1.00 0.00 O ATOM 0 H ASP A 148 7.721 -7.093 2.523 1.00 0.00 H new ATOM 0 HA ASP A 148 7.219 -9.984 2.337 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.270 -9.188 1.308 1.00 0.00 H new ATOM 0 HB3 ASP A 148 9.707 -8.282 2.743 1.00 0.00 H new ATOM 2200 N THR A 149 7.232 -10.564 4.744 1.00 0.00 N ATOM 2201 CA THR A 149 7.089 -10.882 6.159 1.00 0.00 C ATOM 2202 C THR A 149 8.046 -11.995 6.571 1.00 0.00 C ATOM 2203 O THR A 149 8.608 -11.971 7.666 1.00 0.00 O ATOM 2204 CB THR A 149 5.648 -11.309 6.496 1.00 0.00 C ATOM 2205 OG1 THR A 149 5.301 -12.487 5.761 1.00 0.00 O ATOM 2206 CG2 THR A 149 4.664 -10.195 6.173 1.00 0.00 C ATOM 0 H THR A 149 6.990 -11.328 4.113 1.00 0.00 H new ATOM 0 HA THR A 149 7.330 -9.975 6.713 1.00 0.00 H new ATOM 0 HB THR A 149 5.596 -11.520 7.564 1.00 0.00 H new ATOM 0 HG1 THR A 149 4.766 -12.239 4.978 1.00 0.00 H new ATOM 0 HG21 THR A 149 3.653 -10.520 6.419 1.00 0.00 H new ATOM 0 HG22 THR A 149 4.913 -9.309 6.757 1.00 0.00 H new ATOM 0 HG23 THR A 149 4.720 -9.957 5.111 1.00 0.00 H new ATOM 2214 N GLY A 150 8.228 -12.971 5.687 1.00 0.00 N ATOM 2215 CA GLY A 150 9.119 -14.080 5.977 1.00 0.00 C ATOM 2216 C GLY A 150 10.218 -14.226 4.944 1.00 0.00 C ATOM 2217 O GLY A 150 10.763 -13.234 4.463 1.00 0.00 O ATOM 0 H GLY A 150 7.774 -13.014 4.775 1.00 0.00 H new ATOM 0 HA2 GLY A 150 9.566 -13.935 6.961 1.00 0.00 H new ATOM 0 HA3 GLY A 150 8.542 -15.004 6.022 1.00 0.00 H new ATOM 2221 N ASN A 151 10.546 -15.468 4.604 1.00 0.00 N ATOM 2222 CA ASN A 151 11.590 -15.741 3.623 1.00 0.00 C ATOM 2223 C ASN A 151 11.146 -15.321 2.225 1.00 0.00 C ATOM 2224 O ASN A 151 11.735 -14.426 1.620 1.00 0.00 O ATOM 2225 CB ASN A 151 11.950 -17.228 3.631 1.00 0.00 C ATOM 2226 CG ASN A 151 12.579 -17.664 4.940 1.00 0.00 C ATOM 2227 OD1 ASN A 151 13.515 -17.033 5.432 1.00 0.00 O ATOM 2228 ND2 ASN A 151 12.067 -18.749 5.510 1.00 0.00 N ATOM 0 H ASN A 151 10.104 -16.301 4.993 1.00 0.00 H new ATOM 0 HA ASN A 151 12.471 -15.159 3.895 1.00 0.00 H new ATOM 0 HB2 ASN A 151 11.051 -17.817 3.449 1.00 0.00 H new ATOM 0 HB3 ASN A 151 12.639 -17.436 2.813 1.00 0.00 H new ATOM 0 HD21 ASN A 151 12.450 -19.091 6.392 1.00 0.00 H new ATOM 0 HD22 ASN A 151 11.291 -19.240 5.066 1.00 0.00 H new ATOM 2235 N GLN A 152 10.105 -15.974 1.720 1.00 0.00 N ATOM 2236 CA GLN A 152 9.583 -15.668 0.393 1.00 0.00 C ATOM 2237 C GLN A 152 8.079 -15.419 0.445 1.00 0.00 C ATOM 2238 O GLN A 152 7.406 -15.409 -0.586 1.00 0.00 O ATOM 2239 CB GLN A 152 9.889 -16.812 -0.575 1.00 0.00 C ATOM 2240 CG GLN A 152 11.305 -16.780 -1.126 1.00 0.00 C ATOM 2241 CD GLN A 152 11.780 -18.141 -1.596 1.00 0.00 C ATOM 2242 OE1 GLN A 152 11.811 -18.420 -2.795 1.00 0.00 O ATOM 2243 NE2 GLN A 152 12.152 -18.998 -0.653 1.00 0.00 N ATOM 0 H GLN A 152 9.606 -16.718 2.209 1.00 0.00 H new ATOM 0 HA GLN A 152 10.072 -14.761 0.038 1.00 0.00 H new ATOM 0 HB2 GLN A 152 9.728 -17.762 -0.065 1.00 0.00 H new ATOM 0 HB3 GLN A 152 9.184 -16.773 -1.405 1.00 0.00 H new ATOM 0 HG2 GLN A 152 11.351 -16.076 -1.957 1.00 0.00 H new ATOM 0 HG3 GLN A 152 11.982 -16.409 -0.356 1.00 0.00 H new ATOM 0 HE21 GLN A 152 12.110 -18.725 0.329 1.00 0.00 H new ATOM 0 HE22 GLN A 152 12.479 -19.929 -0.910 1.00 0.00 H new ATOM 2252 N ARG A 153 7.558 -15.218 1.651 1.00 0.00 N ATOM 2253 CA ARG A 153 6.134 -14.971 1.836 1.00 0.00 C ATOM 2254 C ARG A 153 5.774 -13.542 1.439 1.00 0.00 C ATOM 2255 O ARG A 153 6.561 -12.615 1.636 1.00 0.00 O ATOM 2256 CB ARG A 153 5.736 -15.222 3.292 1.00 0.00 C ATOM 2257 CG ARG A 153 5.542 -16.692 3.625 1.00 0.00 C ATOM 2258 CD ARG A 153 4.520 -16.882 4.735 1.00 0.00 C ATOM 2259 NE ARG A 153 4.797 -18.072 5.536 1.00 0.00 N ATOM 2260 CZ ARG A 153 5.771 -18.141 6.437 1.00 0.00 C ATOM 2261 NH1 ARG A 153 6.556 -17.095 6.651 1.00 0.00 N ATOM 2262 NH2 ARG A 153 5.960 -19.259 7.126 1.00 0.00 N ATOM 0 H ARG A 153 8.101 -15.221 2.514 1.00 0.00 H new ATOM 0 HA ARG A 153 5.585 -15.658 1.192 1.00 0.00 H new ATOM 0 HB2 ARG A 153 6.503 -14.808 3.946 1.00 0.00 H new ATOM 0 HB3 ARG A 153 4.812 -14.685 3.505 1.00 0.00 H new ATOM 0 HG2 ARG A 153 5.216 -17.228 2.734 1.00 0.00 H new ATOM 0 HG3 ARG A 153 6.495 -17.126 3.928 1.00 0.00 H new ATOM 0 HD2 ARG A 153 4.518 -16.003 5.380 1.00 0.00 H new ATOM 0 HD3 ARG A 153 3.523 -16.961 4.301 1.00 0.00 H new ATOM 0 HE ARG A 153 4.211 -18.895 5.396 1.00 0.00 H new ATOM 0 HH11 ARG A 153 6.413 -16.234 6.123 1.00 0.00 H new ATOM 0 HH12 ARG A 153 7.303 -17.151 7.343 1.00 0.00 H new ATOM 0 HH21 ARG A 153 5.357 -20.066 6.964 1.00 0.00 H new ATOM 0 HH22 ARG A 153 6.708 -19.312 7.818 1.00 0.00 H new ATOM 2276 N PHE A 154 4.581 -13.371 0.880 1.00 0.00 N ATOM 2277 CA PHE A 154 4.117 -12.056 0.453 1.00 0.00 C ATOM 2278 C PHE A 154 2.691 -11.801 0.931 1.00 0.00 C ATOM 2279 O PHE A 154 1.778 -12.569 0.630 1.00 0.00 O ATOM 2280 CB PHE A 154 4.186 -11.937 -1.071 1.00 0.00 C ATOM 2281 CG PHE A 154 5.359 -12.653 -1.676 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.647 -12.399 -1.231 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.175 -13.579 -2.689 1.00 0.00 C ATOM 2284 CE1 PHE A 154 7.728 -13.056 -1.787 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.253 -14.240 -3.249 1.00 0.00 C ATOM 2286 CZ PHE A 154 7.531 -13.978 -2.796 1.00 0.00 C ATOM 0 H PHE A 154 3.917 -14.127 0.712 1.00 0.00 H new ATOM 0 HA PHE A 154 4.770 -11.306 0.898 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.267 -12.335 -1.500 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.234 -10.883 -1.343 1.00 0.00 H new ATOM 0 HD1 PHE A 154 6.807 -11.680 -0.441 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.177 -13.788 -3.046 1.00 0.00 H new ATOM 0 HE1 PHE A 154 8.727 -12.848 -1.432 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.096 -14.960 -4.039 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.375 -14.493 -3.230 1.00 0.00 H new ATOM 2296 N GLU A 155 2.508 -10.716 1.678 1.00 0.00 N ATOM 2297 CA GLU A 155 1.194 -10.360 2.199 1.00 0.00 C ATOM 2298 C GLU A 155 0.640 -9.131 1.484 1.00 0.00 C ATOM 2299 O GLU A 155 1.244 -8.058 1.513 1.00 0.00 O ATOM 2300 CB GLU A 155 1.271 -10.097 3.704 1.00 0.00 C ATOM 2301 CG GLU A 155 1.610 -11.332 4.522 1.00 0.00 C ATOM 2302 CD GLU A 155 2.525 -12.288 3.782 1.00 0.00 C ATOM 2303 OE1 GLU A 155 3.694 -11.924 3.539 1.00 0.00 O ATOM 2304 OE2 GLU A 155 2.071 -13.403 3.447 1.00 0.00 O ATOM 0 H GLU A 155 3.253 -10.069 1.935 1.00 0.00 H new ATOM 0 HA GLU A 155 0.521 -11.198 2.019 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.022 -9.330 3.892 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.315 -9.698 4.044 1.00 0.00 H new ATOM 0 HG2 GLU A 155 2.086 -11.027 5.454 1.00 0.00 H new ATOM 0 HG3 GLU A 155 0.689 -11.850 4.790 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.512 -9.296 0.843 1.00 0.00 N ATOM 2312 CA CYS A 156 -1.148 -8.201 0.119 1.00 0.00 C ATOM 2313 C CYS A 156 -2.278 -7.589 0.941 1.00 0.00 C ATOM 2314 O CYS A 156 -3.310 -8.222 1.166 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.688 -8.695 -1.223 1.00 0.00 C ATOM 2316 SG CYS A 156 -1.930 -7.388 -2.449 1.00 0.00 S ATOM 0 H CYS A 156 -1.024 -10.177 0.810 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.396 -7.432 -0.061 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -0.999 -9.436 -1.629 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.639 -9.202 -1.056 1.00 0.00 H new ATOM 0 HG CYS A 156 -2.387 -7.906 -3.551 1.00 0.00 H new ATOM 2322 N HIS A 157 -2.075 -6.355 1.390 1.00 0.00 N ATOM 2323 CA HIS A 157 -3.076 -5.657 2.189 1.00 0.00 C ATOM 2324 C HIS A 157 -3.828 -4.633 1.344 1.00 0.00 C ATOM 2325 O HIS A 157 -3.220 -3.785 0.691 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.416 -4.965 3.382 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.706 -5.909 4.304 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -2.298 -6.454 5.424 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.447 -6.404 4.266 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -1.432 -7.243 6.036 1.00 0.00 C ATOM 2331 NE2 HIS A 157 -0.302 -7.230 5.353 1.00 0.00 N ATOM 0 H HIS A 157 -1.226 -5.817 1.214 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.790 -6.394 2.556 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.705 -4.225 3.015 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.177 -4.424 3.944 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.304 -6.189 3.520 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -1.617 -7.803 6.941 1.00 0.00 H new ATOM 0 HE2 HIS A 157 0.542 -7.750 5.594 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.154 -4.719 1.361 1.00 0.00 N ATOM 2340 CA VAL A 158 -5.990 -3.799 0.598 1.00 0.00 C ATOM 2341 C VAL A 158 -6.570 -2.711 1.493 1.00 0.00 C ATOM 2342 O VAL A 158 -6.837 -2.940 2.673 1.00 0.00 O ATOM 2343 CB VAL A 158 -7.143 -4.541 -0.105 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -7.936 -3.585 -0.982 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.607 -5.707 -0.921 1.00 0.00 C ATOM 0 H VAL A 158 -5.673 -5.416 1.895 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.350 -3.340 -0.156 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.814 -4.939 0.656 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.746 -4.126 -1.471 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.352 -2.787 -0.367 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.279 -3.155 -1.738 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.435 -6.220 -1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.914 -5.335 -1.675 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -6.087 -6.403 -0.263 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.764 -1.526 0.925 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.313 -0.400 1.672 1.00 0.00 C ATOM 2357 C PHE A 159 -8.168 0.486 0.770 1.00 0.00 C ATOM 2358 O PHE A 159 -7.794 0.777 -0.366 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.185 0.425 2.295 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.263 -0.382 3.165 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.210 -1.090 2.610 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.451 -0.431 4.537 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.359 -1.833 3.407 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.603 -1.172 5.339 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.557 -1.874 4.773 1.00 0.00 C ATOM 0 H PHE A 159 -6.549 -1.320 -0.051 1.00 0.00 H new ATOM 0 HA PHE A 159 -7.945 -0.797 2.467 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.605 0.892 1.499 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.619 1.230 2.888 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.052 -1.061 1.542 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.268 0.115 4.984 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.541 -2.380 2.962 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -4.758 -1.202 6.407 1.00 0.00 H new ATOM 0 HZ PHE A 159 -2.895 -2.454 5.398 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.316 0.910 1.285 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.225 1.763 0.526 1.00 0.00 C ATOM 2377 C TRP A 160 -9.868 3.234 0.706 1.00 0.00 C ATOM 2378 O TRP A 160 -9.928 3.765 1.816 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.670 1.518 0.963 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.678 2.214 0.098 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.207 3.457 0.295 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.277 1.704 -1.098 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -14.100 3.751 -0.707 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -14.161 2.693 -1.575 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -13.153 0.511 -1.814 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -14.914 2.521 -2.733 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -13.902 0.342 -2.963 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.773 1.343 -3.414 1.00 0.00 C ATOM 0 H TRP A 160 -9.640 0.678 2.224 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.125 1.511 -0.530 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -11.869 0.446 0.951 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -11.792 1.853 1.993 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -12.960 4.112 1.117 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.632 4.617 -0.791 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.483 -0.266 -1.475 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.586 3.291 -3.082 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -13.815 -0.577 -3.523 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -15.344 1.181 -4.316 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.499 3.887 -0.390 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.132 5.299 -0.352 1.00 0.00 C ATOM 2401 C CYS A 161 -10.195 6.155 -1.033 1.00 0.00 C ATOM 2402 O CYS A 161 -10.740 5.776 -2.069 1.00 0.00 O ATOM 2403 CB CYS A 161 -7.777 5.513 -1.027 1.00 0.00 C ATOM 2404 SG CYS A 161 -6.371 4.888 -0.076 1.00 0.00 S ATOM 0 H CYS A 161 -9.446 3.462 -1.316 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.061 5.603 0.692 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -7.788 5.026 -2.002 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -7.636 6.579 -1.205 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.353 4.719 -0.867 1.00 0.00 H new ATOM 2410 N GLU A 162 -10.484 7.310 -0.442 1.00 0.00 N ATOM 2411 CA GLU A 162 -11.484 8.219 -0.992 1.00 0.00 C ATOM 2412 C GLU A 162 -11.049 9.672 -0.825 1.00 0.00 C ATOM 2413 O GLU A 162 -10.283 10.018 0.075 1.00 0.00 O ATOM 2414 CB GLU A 162 -12.836 7.998 -0.309 1.00 0.00 C ATOM 2415 CG GLU A 162 -12.739 7.853 1.200 1.00 0.00 C ATOM 2416 CD GLU A 162 -12.225 9.110 1.875 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -12.954 10.124 1.877 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -11.093 9.079 2.403 1.00 0.00 O ATOM 0 H GLU A 162 -10.041 7.638 0.416 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.584 8.008 -2.057 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.493 8.835 -0.544 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.300 7.103 -0.722 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -13.722 7.605 1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -12.078 7.020 1.439 1.00 0.00 H new ATOM 2425 N PRO A 163 -11.547 10.544 -1.714 1.00 0.00 N ATOM 2426 CA PRO A 163 -12.459 10.143 -2.790 1.00 0.00 C ATOM 2427 C PRO A 163 -11.763 9.304 -3.857 1.00 0.00 C ATOM 2428 O PRO A 163 -12.387 8.874 -4.826 1.00 0.00 O ATOM 2429 CB PRO A 163 -12.921 11.479 -3.379 1.00 0.00 C ATOM 2430 CG PRO A 163 -11.824 12.434 -3.058 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.259 11.988 -1.738 1.00 0.00 C ATOM 0 HA PRO A 163 -13.273 9.518 -2.423 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.078 11.404 -4.455 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -13.866 11.799 -2.940 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.058 12.424 -3.834 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.201 13.455 -2.996 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.189 12.186 -1.672 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -11.731 12.506 -0.903 1.00 0.00 H new ATOM 2439 N ASN A 164 -10.468 9.073 -3.670 1.00 0.00 N ATOM 2440 CA ASN A 164 -9.688 8.284 -4.617 1.00 0.00 C ATOM 2441 C ASN A 164 -8.274 8.049 -4.094 1.00 0.00 C ATOM 2442 O ASN A 164 -7.764 8.823 -3.285 1.00 0.00 O ATOM 2443 CB ASN A 164 -9.631 8.988 -5.974 1.00 0.00 C ATOM 2444 CG ASN A 164 -8.947 10.339 -5.896 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -8.721 10.871 -4.810 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -8.613 10.900 -7.053 1.00 0.00 N ATOM 0 H ASN A 164 -9.936 9.421 -2.872 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.178 7.318 -4.737 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -9.101 8.356 -6.686 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -10.644 9.118 -6.356 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -8.149 11.809 -7.064 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -8.820 10.422 -7.930 1.00 0.00 H new ATOM 2453 N ALA A 165 -7.647 6.975 -4.562 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.292 6.639 -4.144 1.00 0.00 C ATOM 2455 C ALA A 165 -5.291 7.678 -4.639 1.00 0.00 C ATOM 2456 O ALA A 165 -4.222 7.851 -4.055 1.00 0.00 O ATOM 2457 CB ALA A 165 -5.911 5.255 -4.650 1.00 0.00 C ATOM 0 H ALA A 165 -8.056 6.323 -5.231 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.265 6.636 -3.054 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -4.896 5.017 -4.330 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -6.602 4.516 -4.244 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -5.961 5.239 -5.739 1.00 0.00 H new ATOM 2463 N ALA A 166 -5.645 8.366 -5.719 1.00 0.00 N ATOM 2464 CA ALA A 166 -4.779 9.389 -6.291 1.00 0.00 C ATOM 2465 C ALA A 166 -4.089 10.199 -5.198 1.00 0.00 C ATOM 2466 O ALA A 166 -2.931 10.590 -5.338 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.577 10.306 -7.206 1.00 0.00 C ATOM 0 H ALA A 166 -6.526 8.233 -6.216 1.00 0.00 H new ATOM 0 HA ALA A 166 -4.008 8.890 -6.878 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -4.917 11.065 -7.626 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -6.017 9.721 -8.013 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -6.369 10.790 -6.635 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.810 10.448 -4.109 1.00 0.00 N ATOM 2474 CA ASN A 167 -4.268 11.213 -2.992 1.00 0.00 C ATOM 2475 C ASN A 167 -3.262 10.382 -2.201 1.00 0.00 C ATOM 2476 O ASN A 167 -2.170 10.852 -1.878 1.00 0.00 O ATOM 2477 CB ASN A 167 -5.396 11.680 -2.071 1.00 0.00 C ATOM 2478 CG ASN A 167 -6.119 12.898 -2.614 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -5.557 13.992 -2.673 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -7.372 12.713 -3.012 1.00 0.00 N ATOM 0 H ASN A 167 -5.770 10.131 -3.977 1.00 0.00 H new ATOM 0 HA ASN A 167 -3.754 12.085 -3.397 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -6.110 10.868 -1.935 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -4.986 11.912 -1.088 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -7.909 13.496 -3.385 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -7.797 11.788 -2.945 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.636 9.145 -1.894 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.767 8.247 -1.143 1.00 0.00 C ATOM 2489 C VAL A 168 -1.664 7.681 -2.030 1.00 0.00 C ATOM 2490 O VAL A 168 -0.479 7.905 -1.784 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.562 7.082 -0.525 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -2.629 6.119 0.194 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.630 7.609 0.422 1.00 0.00 C ATOM 0 H VAL A 168 -4.536 8.741 -2.154 1.00 0.00 H new ATOM 0 HA VAL A 168 -2.320 8.836 -0.342 1.00 0.00 H new ATOM 0 HB VAL A 168 -4.057 6.537 -1.329 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.210 5.303 0.624 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -1.906 5.716 -0.515 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -2.102 6.648 0.989 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.182 6.772 0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -4.158 8.179 1.222 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -5.316 8.254 -0.126 1.00 0.00 H new ATOM 2503 N SER A 169 -2.061 6.946 -3.063 1.00 0.00 N ATOM 2504 CA SER A 169 -1.106 6.344 -3.986 1.00 0.00 C ATOM 2505 C SER A 169 0.030 7.312 -4.299 1.00 0.00 C ATOM 2506 O SER A 169 1.187 6.910 -4.418 1.00 0.00 O ATOM 2507 CB SER A 169 -1.808 5.927 -5.280 1.00 0.00 C ATOM 2508 OG SER A 169 -2.515 7.015 -5.850 1.00 0.00 O ATOM 0 H SER A 169 -3.038 6.753 -3.282 1.00 0.00 H new ATOM 0 HA SER A 169 -0.685 5.459 -3.509 1.00 0.00 H new ATOM 0 HB2 SER A 169 -1.072 5.554 -5.993 1.00 0.00 H new ATOM 0 HB3 SER A 169 -2.498 5.108 -5.076 1.00 0.00 H new ATOM 0 HG SER A 169 -2.868 7.586 -5.136 1.00 0.00 H new ATOM 2514 N GLU A 170 -0.310 8.591 -4.432 1.00 0.00 N ATOM 2515 CA GLU A 170 0.682 9.617 -4.732 1.00 0.00 C ATOM 2516 C GLU A 170 1.568 9.889 -3.520 1.00 0.00 C ATOM 2517 O GLU A 170 2.793 9.821 -3.606 1.00 0.00 O ATOM 2518 CB GLU A 170 -0.007 10.909 -5.175 1.00 0.00 C ATOM 2519 CG GLU A 170 0.950 12.073 -5.371 1.00 0.00 C ATOM 2520 CD GLU A 170 1.566 12.094 -6.756 1.00 0.00 C ATOM 2521 OE1 GLU A 170 0.886 12.548 -7.700 1.00 0.00 O ATOM 2522 OE2 GLU A 170 2.727 11.657 -6.896 1.00 0.00 O ATOM 0 H GLU A 170 -1.263 8.941 -4.337 1.00 0.00 H new ATOM 0 HA GLU A 170 1.311 9.252 -5.544 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.539 10.726 -6.109 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.755 11.185 -4.432 1.00 0.00 H new ATOM 0 HG2 GLU A 170 0.418 13.009 -5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 170 1.743 12.016 -4.625 1.00 0.00 H new ATOM 2529 N ALA A 171 0.938 10.199 -2.392 1.00 0.00 N ATOM 2530 CA ALA A 171 1.667 10.480 -1.162 1.00 0.00 C ATOM 2531 C ALA A 171 2.704 9.398 -0.879 1.00 0.00 C ATOM 2532 O ALA A 171 3.838 9.694 -0.503 1.00 0.00 O ATOM 2533 CB ALA A 171 0.702 10.607 0.007 1.00 0.00 C ATOM 0 H ALA A 171 -0.076 10.262 -2.305 1.00 0.00 H new ATOM 0 HA ALA A 171 2.193 11.426 -1.289 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.261 10.817 0.919 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.003 11.421 -0.185 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.150 9.675 0.126 1.00 0.00 H new ATOM 2539 N VAL A 172 2.308 8.143 -1.061 1.00 0.00 N ATOM 2540 CA VAL A 172 3.203 7.016 -0.826 1.00 0.00 C ATOM 2541 C VAL A 172 4.306 6.963 -1.877 1.00 0.00 C ATOM 2542 O VAL A 172 5.459 6.665 -1.565 1.00 0.00 O ATOM 2543 CB VAL A 172 2.438 5.680 -0.832 1.00 0.00 C ATOM 2544 CG1 VAL A 172 3.390 4.518 -0.596 1.00 0.00 C ATOM 2545 CG2 VAL A 172 1.332 5.695 0.212 1.00 0.00 C ATOM 0 H VAL A 172 1.372 7.880 -1.371 1.00 0.00 H new ATOM 0 HA VAL A 172 3.649 7.165 0.157 1.00 0.00 H new ATOM 0 HB VAL A 172 1.979 5.548 -1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.831 3.582 -0.604 1.00 0.00 H new ATOM 0 HG12 VAL A 172 4.142 4.498 -1.385 1.00 0.00 H new ATOM 0 HG13 VAL A 172 3.880 4.640 0.370 1.00 0.00 H new ATOM 0 HG21 VAL A 172 0.802 4.743 0.194 1.00 0.00 H new ATOM 0 HG22 VAL A 172 1.766 5.850 1.200 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.635 6.503 -0.008 1.00 0.00 H new ATOM 2555 N GLN A 173 3.945 7.253 -3.122 1.00 0.00 N ATOM 2556 CA GLN A 173 4.905 7.237 -4.219 1.00 0.00 C ATOM 2557 C GLN A 173 6.017 8.254 -3.984 1.00 0.00 C ATOM 2558 O GLN A 173 7.196 7.953 -4.172 1.00 0.00 O ATOM 2559 CB GLN A 173 4.201 7.532 -5.545 1.00 0.00 C ATOM 2560 CG GLN A 173 4.989 7.084 -6.765 1.00 0.00 C ATOM 2561 CD GLN A 173 4.231 7.299 -8.061 1.00 0.00 C ATOM 2562 OE1 GLN A 173 3.534 8.300 -8.227 1.00 0.00 O ATOM 2563 NE2 GLN A 173 4.364 6.357 -8.987 1.00 0.00 N ATOM 0 H GLN A 173 2.995 7.502 -3.397 1.00 0.00 H new ATOM 0 HA GLN A 173 5.350 6.243 -4.265 1.00 0.00 H new ATOM 0 HB2 GLN A 173 3.229 7.038 -5.549 1.00 0.00 H new ATOM 0 HB3 GLN A 173 4.014 8.603 -5.617 1.00 0.00 H new ATOM 0 HG2 GLN A 173 5.931 7.630 -6.805 1.00 0.00 H new ATOM 0 HG3 GLN A 173 5.237 6.027 -6.665 1.00 0.00 H new ATOM 0 HE21 GLN A 173 4.952 5.544 -8.806 1.00 0.00 H new ATOM 0 HE22 GLN A 173 3.878 6.447 -9.879 1.00 0.00 H new ATOM 2572 N ALA A 174 5.635 9.458 -3.571 1.00 0.00 N ATOM 2573 CA ALA A 174 6.600 10.518 -3.308 1.00 0.00 C ATOM 2574 C ALA A 174 7.603 10.094 -2.240 1.00 0.00 C ATOM 2575 O ALA A 174 8.796 10.377 -2.349 1.00 0.00 O ATOM 2576 CB ALA A 174 5.883 11.791 -2.886 1.00 0.00 C ATOM 0 H ALA A 174 4.663 9.724 -3.411 1.00 0.00 H new ATOM 0 HA ALA A 174 7.150 10.712 -4.229 1.00 0.00 H new ATOM 0 HB1 ALA A 174 6.616 12.574 -2.693 1.00 0.00 H new ATOM 0 HB2 ALA A 174 5.211 12.111 -3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 174 5.307 11.601 -1.980 1.00 0.00 H new ATOM 2582 N ALA A 175 7.111 9.415 -1.209 1.00 0.00 N ATOM 2583 CA ALA A 175 7.965 8.952 -0.123 1.00 0.00 C ATOM 2584 C ALA A 175 9.173 8.192 -0.660 1.00 0.00 C ATOM 2585 O ALA A 175 10.314 8.485 -0.299 1.00 0.00 O ATOM 2586 CB ALA A 175 7.172 8.076 0.836 1.00 0.00 C ATOM 0 H ALA A 175 6.126 9.174 -1.103 1.00 0.00 H new ATOM 0 HA ALA A 175 8.329 9.826 0.417 1.00 0.00 H new ATOM 0 HB1 ALA A 175 7.823 7.737 1.642 1.00 0.00 H new ATOM 0 HB2 ALA A 175 6.345 8.650 1.254 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.779 7.212 0.300 1.00 0.00 H new ATOM 2592 N CYS A 176 8.916 7.215 -1.522 1.00 0.00 N ATOM 2593 CA CYS A 176 9.983 6.411 -2.108 1.00 0.00 C ATOM 2594 C CYS A 176 10.618 7.131 -3.292 1.00 0.00 C ATOM 2595 O CYS A 176 11.601 6.660 -3.863 1.00 0.00 O ATOM 2596 CB CYS A 176 9.440 5.052 -2.553 1.00 0.00 C ATOM 2597 SG CYS A 176 8.029 5.154 -3.679 1.00 0.00 S ATOM 0 H CYS A 176 7.978 6.960 -1.831 1.00 0.00 H new ATOM 0 HA CYS A 176 10.748 6.257 -1.347 1.00 0.00 H new ATOM 0 HB2 CYS A 176 10.240 4.495 -3.040 1.00 0.00 H new ATOM 0 HB3 CYS A 176 9.147 4.483 -1.671 1.00 0.00 H new ATOM 0 HG CYS A 176 7.759 6.402 -3.925 1.00 0.00 H new