USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 949 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 28 ASN : amide:sc= 0.939 K(o=0.51,f=-2.3!) USER MOD Set 1.2: A 143 MET CE :methyl -164:sc= -0.361 (180deg=-1.04) USER MOD Set 1.3: A 185 CYS SG : rot -105:sc= -0.0708 USER MOD Set 2.1: A 93 ASN : amide:sc= -0.607 K(o=-0.79,f=-5.7!) USER MOD Set 2.2: A 147 LYS NZ :NH3+ 157:sc= -0.185 (180deg=-1.22) USER MOD Set 3.1: A 77 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 166 HIS :FLIP no HE2:sc= -0.0812 F(o=-0.94,f=-0.081) USER MOD Set 4.1: A 17 HIS : no HE2:sc=-0.00254 X(o=-0.15,f=-0.11) USER MOD Set 4.2: A 21 MET CE :methyl -137:sc= -0.145 (180deg=-0.0413) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0.065 X(o=0.065,f=0) USER MOD Single : A 23 GLN : amide:sc= -0.354 X(o=-0.35,f=-0.39) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN :FLIP amide:sc= -0.108 F(o=-0.69,f=-0.11) USER MOD Single : A 72 LYS NZ :NH3+ -168:sc= -0.0126 (180deg=-0.151) USER MOD Single : A 76 GLN : amide:sc= 0.346 X(o=0.35,f=-0.004) USER MOD Single : A 80 MET CE :methyl -110:sc= -7.73! (180deg=-13.7!) USER MOD Single : A 89 MET CE :methyl 156:sc= -3.27 (180deg=-4.04!) USER MOD Single : A 91 THR OG1 : rot -97:sc= 0.105 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.0253 X(o=-0.025,f=-0.23) USER MOD Single : A 100 MET CE :methyl 155:sc= -0.87 (180deg=-1.03) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 79:sc= 1.21 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 99:sc= 0.795 USER MOD Single : A 105 LYS NZ :NH3+ -117:sc= 1.16 (180deg=-0.21) USER MOD Single : A 110 SER OG : rot 15:sc= -0.172 USER MOD Single : A 112 ASN : amide:sc= -1.84 X(o=-1.8,f=-2.2!) USER MOD Single : A 113 MET CE :methyl -133:sc= -0.334 (180deg=-1.07) USER MOD Single : A 114 ASN : amide:sc= -4.4! C(o=-4.4!,f=-13!) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0722 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 ASN : amide:sc= -0.53 K(o=-0.53,f=-4.2!) USER MOD Single : A 135 CYS SG : rot 96:sc= -1.12 USER MOD Single : A 141 SER OG : rot -10:sc= -1.4! USER MOD Single : A 150 HIS :FLIP no HE2:sc= -0.777 F(o=-1.9!,f=-0.78) USER MOD Single : A 151 THR OG1 : rot -31:sc= 0.498 USER MOD Single : A 156 MET CE :methyl 158:sc= 0 (180deg=-0.291) USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 CYS SG : rot 180:sc= -0.753 USER MOD Single : A 170 CYS SG : rot 180:sc= -2.22 USER MOD Single : A 173 ASN : amide:sc= 0.175 K(o=0.17,f=-4.9!) USER MOD Single : A 176 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.11) USER MOD Single : A 178 SER OG : rot 98:sc= 1.22 USER MOD Single : A 182 GLN : amide:sc= -0.0709 K(o=-0.071,f=-0.72) USER MOD ----------------------------------------------------------------- ATOM 196 N HIS A 17 14.924 6.072 -7.249 1.00 0.00 N ATOM 197 CA HIS A 17 13.515 6.213 -6.896 1.00 0.00 C ATOM 198 C HIS A 17 13.266 5.756 -5.462 1.00 0.00 C ATOM 199 O HIS A 17 12.685 6.487 -4.658 1.00 0.00 O ATOM 200 CB HIS A 17 12.644 5.406 -7.859 1.00 0.00 C ATOM 201 CG HIS A 17 11.316 5.019 -7.284 1.00 0.00 C ATOM 202 ND1 HIS A 17 10.296 5.922 -7.071 1.00 0.00 N ATOM 203 CD2 HIS A 17 10.843 3.817 -6.879 1.00 0.00 C ATOM 204 CE1 HIS A 17 9.254 5.293 -6.558 1.00 0.00 C ATOM 205 NE2 HIS A 17 9.560 4.014 -6.432 1.00 0.00 N ATOM 0 HA HIS A 17 13.250 7.267 -6.974 1.00 0.00 H new ATOM 0 HB2 HIS A 17 12.482 5.989 -8.765 1.00 0.00 H new ATOM 0 HB3 HIS A 17 13.181 4.504 -8.152 1.00 0.00 H new ATOM 0 HD1 HIS A 17 10.339 6.920 -7.277 1.00 0.00 H new ATOM 0 HD2 HIS A 17 11.376 2.878 -6.903 1.00 0.00 H new ATOM 0 HE1 HIS A 17 8.312 5.747 -6.288 1.00 0.00 H new ATOM 213 N LEU A 18 13.708 4.544 -5.147 1.00 0.00 N ATOM 214 CA LEU A 18 13.533 3.989 -3.809 1.00 0.00 C ATOM 215 C LEU A 18 14.163 4.895 -2.757 1.00 0.00 C ATOM 216 O LEU A 18 13.512 5.282 -1.787 1.00 0.00 O ATOM 217 CB LEU A 18 14.150 2.591 -3.731 1.00 0.00 C ATOM 218 CG LEU A 18 13.507 1.523 -4.617 1.00 0.00 C ATOM 219 CD1 LEU A 18 14.516 0.440 -4.964 1.00 0.00 C ATOM 220 CD2 LEU A 18 12.291 0.920 -3.928 1.00 0.00 C ATOM 0 H LEU A 18 14.190 3.926 -5.800 1.00 0.00 H new ATOM 0 HA LEU A 18 12.464 3.919 -3.608 1.00 0.00 H new ATOM 0 HB2 LEU A 18 15.205 2.666 -3.994 1.00 0.00 H new ATOM 0 HB3 LEU A 18 14.103 2.252 -2.696 1.00 0.00 H new ATOM 0 HG LEU A 18 13.178 1.995 -5.543 1.00 0.00 H new ATOM 0 HD11 LEU A 18 14.041 -0.311 -5.595 1.00 0.00 H new ATOM 0 HD12 LEU A 18 15.356 0.883 -5.498 1.00 0.00 H new ATOM 0 HD13 LEU A 18 14.875 -0.030 -4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 18 11.846 0.162 -4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 18 12.596 0.462 -2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 18 11.559 1.703 -3.730 1.00 0.00 H new ATOM 232 N SER A 19 15.433 5.231 -2.957 1.00 0.00 N ATOM 233 CA SER A 19 16.152 6.091 -2.024 1.00 0.00 C ATOM 234 C SER A 19 15.224 7.149 -1.434 1.00 0.00 C ATOM 235 O SER A 19 15.180 7.347 -0.220 1.00 0.00 O ATOM 236 CB SER A 19 17.332 6.766 -2.726 1.00 0.00 C ATOM 237 OG SER A 19 18.257 5.806 -3.206 1.00 0.00 O ATOM 0 H SER A 19 15.985 4.921 -3.756 1.00 0.00 H new ATOM 0 HA SER A 19 16.528 5.469 -1.212 1.00 0.00 H new ATOM 0 HB2 SER A 19 16.968 7.371 -3.556 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.832 7.443 -2.034 1.00 0.00 H new ATOM 0 HG SER A 19 19.001 6.263 -3.652 1.00 0.00 H new ATOM 243 N LYS A 20 14.482 7.827 -2.303 1.00 0.00 N ATOM 244 CA LYS A 20 13.552 8.864 -1.872 1.00 0.00 C ATOM 245 C LYS A 20 12.548 8.310 -0.866 1.00 0.00 C ATOM 246 O LYS A 20 12.294 8.920 0.172 1.00 0.00 O ATOM 247 CB LYS A 20 12.814 9.449 -3.077 1.00 0.00 C ATOM 248 CG LYS A 20 13.662 10.395 -3.910 1.00 0.00 C ATOM 249 CD LYS A 20 12.858 11.018 -5.038 1.00 0.00 C ATOM 250 CE LYS A 20 11.866 12.046 -4.515 1.00 0.00 C ATOM 251 NZ LYS A 20 11.407 12.971 -5.588 1.00 0.00 N ATOM 0 H LYS A 20 14.507 7.677 -3.312 1.00 0.00 H new ATOM 0 HA LYS A 20 14.126 9.654 -1.388 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.466 8.633 -3.711 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.929 9.980 -2.727 1.00 0.00 H new ATOM 0 HG2 LYS A 20 14.065 11.181 -3.272 1.00 0.00 H new ATOM 0 HG3 LYS A 20 14.513 9.854 -4.324 1.00 0.00 H new ATOM 0 HD2 LYS A 20 13.534 11.493 -5.749 1.00 0.00 H new ATOM 0 HD3 LYS A 20 12.323 10.237 -5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.005 11.534 -4.085 1.00 0.00 H new ATOM 0 HE3 LYS A 20 12.328 12.621 -3.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.732 13.656 -5.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 12.225 13.479 -5.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 10.943 12.425 -6.342 1.00 0.00 H new ATOM 265 N MET A 21 11.981 7.150 -1.181 1.00 0.00 N ATOM 266 CA MET A 21 11.006 6.513 -0.303 1.00 0.00 C ATOM 267 C MET A 21 11.568 6.348 1.105 1.00 0.00 C ATOM 268 O MET A 21 10.855 6.527 2.092 1.00 0.00 O ATOM 269 CB MET A 21 10.596 5.150 -0.864 1.00 0.00 C ATOM 270 CG MET A 21 9.875 5.234 -2.199 1.00 0.00 C ATOM 271 SD MET A 21 9.066 3.687 -2.651 1.00 0.00 S ATOM 272 CE MET A 21 7.551 4.298 -3.385 1.00 0.00 C ATOM 0 H MET A 21 12.180 6.632 -2.037 1.00 0.00 H new ATOM 0 HA MET A 21 10.127 7.156 -0.251 1.00 0.00 H new ATOM 0 HB2 MET A 21 11.486 4.531 -0.979 1.00 0.00 H new ATOM 0 HB3 MET A 21 9.951 4.649 -0.143 1.00 0.00 H new ATOM 0 HG2 MET A 21 9.131 6.029 -2.156 1.00 0.00 H new ATOM 0 HG3 MET A 21 10.589 5.507 -2.976 1.00 0.00 H new ATOM 0 HE1 MET A 21 6.711 3.696 -3.039 1.00 0.00 H new ATOM 0 HE2 MET A 21 7.398 5.337 -3.092 1.00 0.00 H new ATOM 0 HE3 MET A 21 7.621 4.234 -4.471 1.00 0.00 H new ATOM 282 N GLN A 22 12.850 6.007 1.189 1.00 0.00 N ATOM 283 CA GLN A 22 13.506 5.818 2.477 1.00 0.00 C ATOM 284 C GLN A 22 13.642 7.143 3.220 1.00 0.00 C ATOM 285 O GLN A 22 13.434 7.210 4.431 1.00 0.00 O ATOM 286 CB GLN A 22 14.886 5.186 2.283 1.00 0.00 C ATOM 287 CG GLN A 22 14.841 3.821 1.614 1.00 0.00 C ATOM 288 CD GLN A 22 16.185 3.120 1.628 1.00 0.00 C ATOM 289 OE1 GLN A 22 17.206 3.702 1.261 1.00 0.00 O ATOM 290 NE2 GLN A 22 16.192 1.862 2.053 1.00 0.00 N ATOM 0 H GLN A 22 13.454 5.856 0.381 1.00 0.00 H new ATOM 0 HA GLN A 22 12.888 5.149 3.075 1.00 0.00 H new ATOM 0 HB2 GLN A 22 15.502 5.856 1.683 1.00 0.00 H new ATOM 0 HB3 GLN A 22 15.372 5.090 3.254 1.00 0.00 H new ATOM 0 HG2 GLN A 22 14.105 3.197 2.120 1.00 0.00 H new ATOM 0 HG3 GLN A 22 14.506 3.937 0.583 1.00 0.00 H new ATOM 0 HE21 GLN A 22 15.322 1.418 2.348 1.00 0.00 H new ATOM 0 HE22 GLN A 22 17.067 1.339 2.085 1.00 0.00 H new ATOM 299 N GLN A 23 13.991 8.194 2.485 1.00 0.00 N ATOM 300 CA GLN A 23 14.155 9.517 3.075 1.00 0.00 C ATOM 301 C GLN A 23 12.949 9.883 3.934 1.00 0.00 C ATOM 302 O GLN A 23 13.064 10.038 5.149 1.00 0.00 O ATOM 303 CB GLN A 23 14.353 10.566 1.979 1.00 0.00 C ATOM 304 CG GLN A 23 15.693 10.460 1.270 1.00 0.00 C ATOM 305 CD GLN A 23 16.841 10.202 2.227 1.00 0.00 C ATOM 306 OE1 GLN A 23 17.082 10.981 3.150 1.00 0.00 O ATOM 307 NE2 GLN A 23 17.556 9.104 2.012 1.00 0.00 N ATOM 0 H GLN A 23 14.165 8.155 1.481 1.00 0.00 H new ATOM 0 HA GLN A 23 15.039 9.496 3.712 1.00 0.00 H new ATOM 0 HB2 GLN A 23 13.554 10.467 1.244 1.00 0.00 H new ATOM 0 HB3 GLN A 23 14.261 11.560 2.418 1.00 0.00 H new ATOM 0 HG2 GLN A 23 15.649 9.655 0.536 1.00 0.00 H new ATOM 0 HG3 GLN A 23 15.883 11.382 0.721 1.00 0.00 H new ATOM 0 HE21 GLN A 23 17.321 8.486 1.235 1.00 0.00 H new ATOM 0 HE22 GLN A 23 18.340 8.878 2.624 1.00 0.00 H new ATOM 316 N ASN A 24 11.792 10.021 3.293 1.00 0.00 N ATOM 317 CA ASN A 24 10.565 10.370 3.999 1.00 0.00 C ATOM 318 C ASN A 24 9.433 9.417 3.625 1.00 0.00 C ATOM 319 O ASN A 24 8.657 8.992 4.481 1.00 0.00 O ATOM 320 CB ASN A 24 10.160 11.810 3.680 1.00 0.00 C ATOM 321 CG ASN A 24 11.056 12.827 4.363 1.00 0.00 C ATOM 322 OD1 ASN A 24 10.756 13.296 5.461 1.00 0.00 O ATOM 323 ND2 ASN A 24 12.161 13.171 3.713 1.00 0.00 N ATOM 0 H ASN A 24 11.679 9.896 2.287 1.00 0.00 H new ATOM 0 HA ASN A 24 10.753 10.281 5.069 1.00 0.00 H new ATOM 0 HB2 ASN A 24 10.196 11.964 2.602 1.00 0.00 H new ATOM 0 HB3 ASN A 24 9.128 11.972 3.991 1.00 0.00 H new ATOM 0 HD21 ASN A 24 12.803 13.850 4.122 1.00 0.00 H new ATOM 0 HD22 ASN A 24 12.369 12.756 2.805 1.00 0.00 H new ATOM 330 N GLY A 25 9.345 9.086 2.341 1.00 0.00 N ATOM 331 CA GLY A 25 8.306 8.186 1.876 1.00 0.00 C ATOM 332 C GLY A 25 7.327 8.866 0.939 1.00 0.00 C ATOM 333 O GLY A 25 7.429 10.067 0.688 1.00 0.00 O ATOM 0 H GLY A 25 9.975 9.425 1.614 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.765 7.339 1.365 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.765 7.786 2.734 1.00 0.00 H new ATOM 337 N TYR A 26 6.377 8.096 0.420 1.00 0.00 N ATOM 338 CA TYR A 26 5.378 8.631 -0.498 1.00 0.00 C ATOM 339 C TYR A 26 3.971 8.221 -0.071 1.00 0.00 C ATOM 340 O TYR A 26 3.505 7.131 -0.400 1.00 0.00 O ATOM 341 CB TYR A 26 5.652 8.145 -1.923 1.00 0.00 C ATOM 342 CG TYR A 26 4.583 8.545 -2.915 1.00 0.00 C ATOM 343 CD1 TYR A 26 4.637 9.769 -3.569 1.00 0.00 C ATOM 344 CD2 TYR A 26 3.520 7.697 -3.199 1.00 0.00 C ATOM 345 CE1 TYR A 26 3.663 10.139 -4.475 1.00 0.00 C ATOM 346 CE2 TYR A 26 2.541 8.057 -4.105 1.00 0.00 C ATOM 347 CZ TYR A 26 2.617 9.279 -4.740 1.00 0.00 C ATOM 348 OH TYR A 26 1.645 9.643 -5.644 1.00 0.00 O ATOM 0 H TYR A 26 6.278 7.101 0.619 1.00 0.00 H new ATOM 0 HA TYR A 26 5.444 9.719 -0.473 1.00 0.00 H new ATOM 0 HB2 TYR A 26 6.611 8.542 -2.255 1.00 0.00 H new ATOM 0 HB3 TYR A 26 5.742 7.059 -1.917 1.00 0.00 H new ATOM 0 HD1 TYR A 26 5.456 10.443 -3.365 1.00 0.00 H new ATOM 0 HD2 TYR A 26 3.458 6.740 -2.703 1.00 0.00 H new ATOM 0 HE1 TYR A 26 3.719 11.096 -4.973 1.00 0.00 H new ATOM 0 HE2 TYR A 26 1.721 7.386 -4.315 1.00 0.00 H new ATOM 0 HH TYR A 26 0.981 8.926 -5.717 1.00 0.00 H new ATOM 358 N GLU A 27 3.302 9.104 0.663 1.00 0.00 N ATOM 359 CA GLU A 27 1.949 8.835 1.135 1.00 0.00 C ATOM 360 C GLU A 27 0.946 8.912 -0.013 1.00 0.00 C ATOM 361 O GLU A 27 1.307 9.227 -1.146 1.00 0.00 O ATOM 362 CB GLU A 27 1.561 9.827 2.233 1.00 0.00 C ATOM 363 CG GLU A 27 1.704 11.282 1.817 1.00 0.00 C ATOM 364 CD GLU A 27 0.883 11.620 0.588 1.00 0.00 C ATOM 365 OE1 GLU A 27 -0.329 11.318 0.583 1.00 0.00 O ATOM 366 OE2 GLU A 27 1.452 12.187 -0.368 1.00 0.00 O ATOM 0 H GLU A 27 3.674 10.011 0.944 1.00 0.00 H new ATOM 0 HA GLU A 27 1.929 7.825 1.544 1.00 0.00 H new ATOM 0 HB2 GLU A 27 0.528 9.642 2.529 1.00 0.00 H new ATOM 0 HB3 GLU A 27 2.182 9.646 3.110 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.397 11.924 2.643 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.754 11.498 1.619 1.00 0.00 H new ATOM 373 N ASN A 28 -0.315 8.622 0.290 1.00 0.00 N ATOM 374 CA ASN A 28 -1.370 8.658 -0.716 1.00 0.00 C ATOM 375 C ASN A 28 -2.134 9.977 -0.657 1.00 0.00 C ATOM 376 O ASN A 28 -2.914 10.231 0.262 1.00 0.00 O ATOM 377 CB ASN A 28 -2.335 7.487 -0.515 1.00 0.00 C ATOM 378 CG ASN A 28 -3.016 7.071 -1.804 1.00 0.00 C ATOM 379 OD1 ASN A 28 -2.455 7.217 -2.890 1.00 0.00 O ATOM 380 ND2 ASN A 28 -4.231 6.548 -1.689 1.00 0.00 N ATOM 0 H ASN A 28 -0.631 8.360 1.224 1.00 0.00 H new ATOM 0 HA ASN A 28 -0.904 8.572 -1.698 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.790 6.637 -0.105 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.091 7.765 0.219 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -4.738 6.248 -2.522 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -4.657 6.446 -0.768 1.00 0.00 H new ATOM 939 N VAL A 70 -3.132 -6.613 -16.276 1.00 0.00 N ATOM 940 CA VAL A 70 -2.821 -6.787 -14.862 1.00 0.00 C ATOM 941 C VAL A 70 -1.357 -7.162 -14.663 1.00 0.00 C ATOM 942 O VAL A 70 -0.765 -7.852 -15.492 1.00 0.00 O ATOM 943 CB VAL A 70 -3.709 -7.870 -14.221 1.00 0.00 C ATOM 944 CG1 VAL A 70 -3.664 -9.151 -15.040 1.00 0.00 C ATOM 945 CG2 VAL A 70 -3.280 -8.129 -12.785 1.00 0.00 C ATOM 0 HA VAL A 70 -3.017 -5.832 -14.375 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.738 -7.512 -14.209 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.297 -9.905 -14.572 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.024 -8.951 -16.049 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.638 -9.517 -15.087 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.918 -8.897 -12.347 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.244 -8.467 -12.770 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.370 -7.209 -12.207 1.00 0.00 H new ATOM 955 N GLN A 71 -0.780 -6.703 -13.557 1.00 0.00 N ATOM 956 CA GLN A 71 0.616 -6.990 -13.249 1.00 0.00 C ATOM 957 C GLN A 71 0.725 -7.996 -12.107 1.00 0.00 C ATOM 958 O GLN A 71 -0.060 -7.964 -11.160 1.00 0.00 O ATOM 959 CB GLN A 71 1.355 -5.702 -12.883 1.00 0.00 C ATOM 960 CG GLN A 71 1.372 -4.671 -14.000 1.00 0.00 C ATOM 961 CD GLN A 71 1.448 -3.249 -13.480 1.00 0.00 C ATOM 962 OE1 GLN A 71 2.635 -2.839 -13.049 1.00 0.00 O flip ATOM 963 NE2 GLN A 71 0.451 -2.526 -13.467 1.00 0.00 N flip ATOM 0 H GLN A 71 -1.257 -6.131 -12.860 1.00 0.00 H new ATOM 0 HA GLN A 71 1.076 -7.424 -14.137 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.887 -5.263 -12.002 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.382 -5.947 -12.611 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.224 -4.861 -14.652 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.474 -4.784 -14.608 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.442 -2.882 -13.808 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.518 -1.571 -13.115 1.00 0.00 H new ATOM 972 N LYS A 72 1.705 -8.888 -12.204 1.00 0.00 N ATOM 973 CA LYS A 72 1.919 -9.904 -11.180 1.00 0.00 C ATOM 974 C LYS A 72 3.391 -9.979 -10.787 1.00 0.00 C ATOM 975 O LYS A 72 4.230 -10.429 -11.567 1.00 0.00 O ATOM 976 CB LYS A 72 1.443 -11.270 -11.679 1.00 0.00 C ATOM 977 CG LYS A 72 -0.058 -11.350 -11.893 1.00 0.00 C ATOM 978 CD LYS A 72 -0.502 -12.770 -12.202 1.00 0.00 C ATOM 979 CE LYS A 72 -2.003 -12.846 -12.439 1.00 0.00 C ATOM 980 NZ LYS A 72 -2.777 -12.476 -11.222 1.00 0.00 N ATOM 0 H LYS A 72 2.364 -8.928 -12.982 1.00 0.00 H new ATOM 0 HA LYS A 72 1.340 -9.624 -10.300 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.948 -11.501 -12.617 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.740 -12.034 -10.960 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.573 -10.993 -11.001 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.345 -10.691 -12.713 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.025 -13.133 -13.084 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.230 -13.426 -11.375 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.275 -12.181 -13.258 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -2.271 -13.857 -12.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -3.776 -12.732 -11.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.395 -12.985 -10.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -2.701 -11.451 -11.060 1.00 0.00 H new ATOM 994 N PHE A 73 3.698 -9.535 -9.572 1.00 0.00 N ATOM 995 CA PHE A 73 5.069 -9.553 -9.076 1.00 0.00 C ATOM 996 C PHE A 73 5.249 -10.631 -8.012 1.00 0.00 C ATOM 997 O PHE A 73 4.301 -10.996 -7.316 1.00 0.00 O ATOM 998 CB PHE A 73 5.443 -8.185 -8.501 1.00 0.00 C ATOM 999 CG PHE A 73 5.511 -7.098 -9.535 1.00 0.00 C ATOM 1000 CD1 PHE A 73 4.369 -6.412 -9.914 1.00 0.00 C ATOM 1001 CD2 PHE A 73 6.718 -6.761 -10.126 1.00 0.00 C ATOM 1002 CE1 PHE A 73 4.429 -5.412 -10.866 1.00 0.00 C ATOM 1003 CE2 PHE A 73 6.784 -5.762 -11.079 1.00 0.00 C ATOM 1004 CZ PHE A 73 5.638 -5.085 -11.448 1.00 0.00 C ATOM 0 H PHE A 73 3.016 -9.159 -8.913 1.00 0.00 H new ATOM 0 HA PHE A 73 5.729 -9.781 -9.913 1.00 0.00 H new ATOM 0 HB2 PHE A 73 4.713 -7.907 -7.741 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.409 -8.261 -8.002 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.421 -6.661 -9.461 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.618 -7.285 -9.839 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.531 -4.886 -11.155 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.731 -5.511 -11.535 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.687 -4.302 -12.190 1.00 0.00 H new ATOM 1014 N ARG A 74 6.471 -11.138 -7.892 1.00 0.00 N ATOM 1015 CA ARG A 74 6.776 -12.177 -6.915 1.00 0.00 C ATOM 1016 C ARG A 74 7.262 -11.564 -5.605 1.00 0.00 C ATOM 1017 O ARG A 74 8.174 -10.737 -5.595 1.00 0.00 O ATOM 1018 CB ARG A 74 7.834 -13.133 -7.468 1.00 0.00 C ATOM 1019 CG ARG A 74 7.993 -14.404 -6.649 1.00 0.00 C ATOM 1020 CD ARG A 74 9.029 -14.232 -5.550 1.00 0.00 C ATOM 1021 NE ARG A 74 8.985 -15.325 -4.581 1.00 0.00 N ATOM 1022 CZ ARG A 74 9.987 -15.620 -3.761 1.00 0.00 C ATOM 1023 NH1 ARG A 74 11.106 -14.909 -3.791 1.00 0.00 N ATOM 1024 NH2 ARG A 74 9.872 -16.629 -2.907 1.00 0.00 N ATOM 0 H ARG A 74 7.267 -10.846 -8.459 1.00 0.00 H new ATOM 0 HA ARG A 74 5.861 -12.736 -6.718 1.00 0.00 H new ATOM 0 HB2 ARG A 74 7.571 -13.401 -8.491 1.00 0.00 H new ATOM 0 HB3 ARG A 74 8.792 -12.616 -7.510 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.034 -14.676 -6.207 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.287 -15.225 -7.303 1.00 0.00 H new ATOM 0 HD2 ARG A 74 10.023 -14.181 -5.994 1.00 0.00 H new ATOM 0 HD3 ARG A 74 8.860 -13.285 -5.037 1.00 0.00 H new ATOM 0 HE ARG A 74 8.139 -15.892 -4.532 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.199 -14.132 -4.446 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.873 -15.139 -3.159 1.00 0.00 H new ATOM 0 HH21 ARG A 74 9.013 -17.179 -2.880 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.642 -16.855 -2.278 1.00 0.00 H new ATOM 1038 N VAL A 75 6.647 -11.975 -4.500 1.00 0.00 N ATOM 1039 CA VAL A 75 7.018 -11.468 -3.185 1.00 0.00 C ATOM 1040 C VAL A 75 6.540 -12.404 -2.080 1.00 0.00 C ATOM 1041 O VAL A 75 5.858 -13.393 -2.344 1.00 0.00 O ATOM 1042 CB VAL A 75 6.435 -10.063 -2.940 1.00 0.00 C ATOM 1043 CG1 VAL A 75 7.037 -9.059 -3.911 1.00 0.00 C ATOM 1044 CG2 VAL A 75 4.919 -10.088 -3.058 1.00 0.00 C ATOM 0 H VAL A 75 5.889 -12.658 -4.490 1.00 0.00 H new ATOM 0 HA VAL A 75 8.106 -11.411 -3.163 1.00 0.00 H new ATOM 0 HB VAL A 75 6.693 -9.753 -1.927 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.614 -8.072 -3.723 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.118 -9.022 -3.773 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.812 -9.362 -4.934 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.524 -9.088 -2.882 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.637 -10.419 -4.058 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.508 -10.776 -2.319 1.00 0.00 H new ATOM 1054 N GLN A 76 6.903 -12.083 -0.842 1.00 0.00 N ATOM 1055 CA GLN A 76 6.511 -12.896 0.303 1.00 0.00 C ATOM 1056 C GLN A 76 5.690 -12.079 1.295 1.00 0.00 C ATOM 1057 O GLN A 76 5.835 -10.859 1.380 1.00 0.00 O ATOM 1058 CB GLN A 76 7.749 -13.468 0.996 1.00 0.00 C ATOM 1059 CG GLN A 76 8.186 -14.816 0.446 1.00 0.00 C ATOM 1060 CD GLN A 76 9.610 -15.169 0.829 1.00 0.00 C ATOM 1061 OE1 GLN A 76 10.561 -14.511 0.404 1.00 0.00 O ATOM 1062 NE2 GLN A 76 9.765 -16.211 1.637 1.00 0.00 N ATOM 0 H GLN A 76 7.467 -11.267 -0.607 1.00 0.00 H new ATOM 0 HA GLN A 76 5.894 -13.718 -0.061 1.00 0.00 H new ATOM 0 HB2 GLN A 76 8.571 -12.760 0.895 1.00 0.00 H new ATOM 0 HB3 GLN A 76 7.544 -13.569 2.062 1.00 0.00 H new ATOM 0 HG2 GLN A 76 7.512 -15.590 0.814 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.098 -14.807 -0.640 1.00 0.00 H new ATOM 0 HE21 GLN A 76 8.949 -16.728 1.965 1.00 0.00 H new ATOM 0 HE22 GLN A 76 10.700 -16.495 1.930 1.00 0.00 H new ATOM 1071 N TYR A 77 4.828 -12.759 2.042 1.00 0.00 N ATOM 1072 CA TYR A 77 3.981 -12.096 3.027 1.00 0.00 C ATOM 1073 C TYR A 77 4.505 -12.328 4.441 1.00 0.00 C ATOM 1074 O TYR A 77 4.570 -13.464 4.913 1.00 0.00 O ATOM 1075 CB TYR A 77 2.542 -12.600 2.915 1.00 0.00 C ATOM 1076 CG TYR A 77 1.596 -11.959 3.906 1.00 0.00 C ATOM 1077 CD1 TYR A 77 1.710 -10.613 4.233 1.00 0.00 C ATOM 1078 CD2 TYR A 77 0.591 -12.699 4.515 1.00 0.00 C ATOM 1079 CE1 TYR A 77 0.849 -10.023 5.138 1.00 0.00 C ATOM 1080 CE2 TYR A 77 -0.275 -12.117 5.421 1.00 0.00 C ATOM 1081 CZ TYR A 77 -0.142 -10.779 5.729 1.00 0.00 C ATOM 1082 OH TYR A 77 -1.002 -10.196 6.631 1.00 0.00 O ATOM 0 H TYR A 77 4.697 -13.769 1.985 1.00 0.00 H new ATOM 0 HA TYR A 77 4.001 -11.025 2.823 1.00 0.00 H new ATOM 0 HB2 TYR A 77 2.178 -12.413 1.905 1.00 0.00 H new ATOM 0 HB3 TYR A 77 2.532 -13.680 3.062 1.00 0.00 H new ATOM 0 HD1 TYR A 77 2.485 -10.018 3.772 1.00 0.00 H new ATOM 0 HD2 TYR A 77 0.484 -13.747 4.277 1.00 0.00 H new ATOM 0 HE1 TYR A 77 0.951 -8.976 5.381 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -1.052 -12.706 5.885 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.641 -10.865 6.953 1.00 0.00 H new ATOM 1092 N LEU A 78 4.876 -11.244 5.113 1.00 0.00 N ATOM 1093 CA LEU A 78 5.394 -11.328 6.474 1.00 0.00 C ATOM 1094 C LEU A 78 4.257 -11.471 7.481 1.00 0.00 C ATOM 1095 O LEU A 78 4.210 -12.432 8.247 1.00 0.00 O ATOM 1096 CB LEU A 78 6.227 -10.087 6.801 1.00 0.00 C ATOM 1097 CG LEU A 78 7.617 -10.026 6.168 1.00 0.00 C ATOM 1098 CD1 LEU A 78 7.530 -9.528 4.734 1.00 0.00 C ATOM 1099 CD2 LEU A 78 8.539 -9.136 6.989 1.00 0.00 C ATOM 0 H LEU A 78 4.828 -10.297 4.738 1.00 0.00 H new ATOM 0 HA LEU A 78 6.028 -12.212 6.542 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.668 -9.206 6.487 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.340 -10.024 7.883 1.00 0.00 H new ATOM 0 HG LEU A 78 8.033 -11.033 6.156 1.00 0.00 H new ATOM 0 HD11 LEU A 78 8.529 -9.491 4.300 1.00 0.00 H new ATOM 0 HD12 LEU A 78 6.906 -10.205 4.151 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.092 -8.530 4.721 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.524 -9.105 6.523 1.00 0.00 H new ATOM 0 HD22 LEU A 78 8.127 -8.128 7.034 1.00 0.00 H new ATOM 0 HD23 LEU A 78 8.628 -9.537 7.999 1.00 0.00 H new ATOM 1111 N GLY A 79 3.340 -10.508 7.472 1.00 0.00 N ATOM 1112 CA GLY A 79 2.215 -10.546 8.387 1.00 0.00 C ATOM 1113 C GLY A 79 1.450 -9.238 8.422 1.00 0.00 C ATOM 1114 O GLY A 79 1.695 -8.347 7.609 1.00 0.00 O ATOM 0 H GLY A 79 3.357 -9.702 6.847 1.00 0.00 H new ATOM 0 HA2 GLY A 79 1.540 -11.350 8.094 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.574 -10.780 9.389 1.00 0.00 H new ATOM 1118 N MET A 80 0.521 -9.122 9.364 1.00 0.00 N ATOM 1119 CA MET A 80 -0.282 -7.912 9.501 1.00 0.00 C ATOM 1120 C MET A 80 0.105 -7.141 10.759 1.00 0.00 C ATOM 1121 O MET A 80 -0.313 -7.487 11.864 1.00 0.00 O ATOM 1122 CB MET A 80 -1.771 -8.264 9.542 1.00 0.00 C ATOM 1123 CG MET A 80 -2.681 -7.099 9.187 1.00 0.00 C ATOM 1124 SD MET A 80 -3.227 -6.178 10.638 1.00 0.00 S ATOM 1125 CE MET A 80 -1.951 -4.925 10.743 1.00 0.00 C ATOM 0 H MET A 80 0.305 -9.851 10.044 1.00 0.00 H new ATOM 0 HA MET A 80 -0.089 -7.279 8.635 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.961 -9.086 8.852 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.024 -8.621 10.540 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.155 -6.425 8.510 1.00 0.00 H new ATOM 0 HG3 MET A 80 -3.552 -7.474 8.650 1.00 0.00 H new ATOM 0 HE1 MET A 80 -1.324 -5.116 11.614 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.338 -4.953 9.842 1.00 0.00 H new ATOM 0 HE3 MET A 80 -2.413 -3.942 10.837 1.00 0.00 H new ATOM 1135 N LEU A 81 0.907 -6.097 10.583 1.00 0.00 N ATOM 1136 CA LEU A 81 1.351 -5.276 11.705 1.00 0.00 C ATOM 1137 C LEU A 81 0.631 -3.932 11.716 1.00 0.00 C ATOM 1138 O LEU A 81 0.678 -3.167 10.753 1.00 0.00 O ATOM 1139 CB LEU A 81 2.863 -5.057 11.634 1.00 0.00 C ATOM 1140 CG LEU A 81 3.590 -4.955 12.976 1.00 0.00 C ATOM 1141 CD1 LEU A 81 3.118 -3.733 13.748 1.00 0.00 C ATOM 1142 CD2 LEU A 81 3.378 -6.220 13.794 1.00 0.00 C ATOM 0 H LEU A 81 1.263 -5.799 9.675 1.00 0.00 H new ATOM 0 HA LEU A 81 1.109 -5.804 12.628 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.303 -5.877 11.067 1.00 0.00 H new ATOM 0 HB3 LEU A 81 3.052 -4.143 11.071 1.00 0.00 H new ATOM 0 HG LEU A 81 4.657 -4.846 12.782 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.646 -3.677 14.700 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.322 -2.834 13.166 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.046 -3.810 13.932 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.902 -6.130 14.745 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.313 -6.360 13.978 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.767 -7.078 13.245 1.00 0.00 H new ATOM 1154 N PRO A 82 -0.052 -3.635 12.832 1.00 0.00 N ATOM 1155 CA PRO A 82 -0.793 -2.381 12.996 1.00 0.00 C ATOM 1156 C PRO A 82 0.131 -1.174 13.122 1.00 0.00 C ATOM 1157 O PRO A 82 1.292 -1.306 13.507 1.00 0.00 O ATOM 1158 CB PRO A 82 -1.571 -2.597 14.297 1.00 0.00 C ATOM 1159 CG PRO A 82 -0.773 -3.602 15.053 1.00 0.00 C ATOM 1160 CD PRO A 82 -0.151 -4.500 14.019 1.00 0.00 C ATOM 0 HA PRO A 82 -1.426 -2.166 12.135 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.671 -1.668 14.858 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.580 -2.960 14.100 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.008 -3.117 15.659 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.406 -4.171 15.734 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.827 -4.861 14.336 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.767 -5.378 13.826 1.00 0.00 H new ATOM 1168 N VAL A 83 -0.394 0.003 12.795 1.00 0.00 N ATOM 1169 CA VAL A 83 0.383 1.234 12.873 1.00 0.00 C ATOM 1170 C VAL A 83 -0.355 2.301 13.674 1.00 0.00 C ATOM 1171 O VAL A 83 -1.585 2.298 13.744 1.00 0.00 O ATOM 1172 CB VAL A 83 0.700 1.788 11.471 1.00 0.00 C ATOM 1173 CG1 VAL A 83 1.741 0.922 10.778 1.00 0.00 C ATOM 1174 CG2 VAL A 83 -0.569 1.882 10.637 1.00 0.00 C ATOM 0 H VAL A 83 -1.354 0.130 12.474 1.00 0.00 H new ATOM 0 HA VAL A 83 1.317 0.986 13.378 1.00 0.00 H new ATOM 0 HB VAL A 83 1.111 2.792 11.579 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.952 1.328 9.789 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.657 0.911 11.369 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.361 -0.095 10.679 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.327 2.275 9.650 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.011 0.891 10.535 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.279 2.547 11.128 1.00 0.00 H new ATOM 1184 N ASP A 84 0.402 3.211 14.276 1.00 0.00 N ATOM 1185 CA ASP A 84 -0.181 4.286 15.071 1.00 0.00 C ATOM 1186 C ASP A 84 -0.568 5.467 14.187 1.00 0.00 C ATOM 1187 O ASP A 84 -1.519 6.192 14.484 1.00 0.00 O ATOM 1188 CB ASP A 84 0.802 4.741 16.150 1.00 0.00 C ATOM 1189 CG ASP A 84 2.147 5.141 15.576 1.00 0.00 C ATOM 1190 OD1 ASP A 84 2.565 4.537 14.567 1.00 0.00 O ATOM 1191 OD2 ASP A 84 2.784 6.058 16.138 1.00 0.00 O ATOM 0 H ASP A 84 1.421 3.226 14.229 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.082 3.903 15.550 1.00 0.00 H new ATOM 0 HB2 ASP A 84 0.376 5.585 16.693 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.943 3.936 16.872 1.00 0.00 H new ATOM 1196 N ARG A 85 0.174 5.656 13.101 1.00 0.00 N ATOM 1197 CA ARG A 85 -0.090 6.751 12.175 1.00 0.00 C ATOM 1198 C ARG A 85 -0.292 6.226 10.756 1.00 0.00 C ATOM 1199 O ARG A 85 0.260 5.198 10.364 1.00 0.00 O ATOM 1200 CB ARG A 85 1.062 7.757 12.200 1.00 0.00 C ATOM 1201 CG ARG A 85 1.308 8.367 13.570 1.00 0.00 C ATOM 1202 CD ARG A 85 2.509 9.300 13.556 1.00 0.00 C ATOM 1203 NE ARG A 85 2.126 10.681 13.273 1.00 0.00 N ATOM 1204 CZ ARG A 85 1.992 11.169 12.045 1.00 0.00 C ATOM 1205 NH1 ARG A 85 2.207 10.393 10.992 1.00 0.00 N ATOM 1206 NH2 ARG A 85 1.640 12.436 11.869 1.00 0.00 N ATOM 0 H ARG A 85 0.963 5.065 12.840 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.005 7.250 12.493 1.00 0.00 H new ATOM 0 HB2 ARG A 85 1.973 7.262 11.863 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.851 8.556 11.489 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.422 8.917 13.889 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.471 7.573 14.299 1.00 0.00 H new ATOM 0 HD2 ARG A 85 3.015 9.254 14.521 1.00 0.00 H new ATOM 0 HD3 ARG A 85 3.223 8.961 12.805 1.00 0.00 H new ATOM 0 HE ARG A 85 1.952 11.304 14.061 1.00 0.00 H new ATOM 0 HH11 ARG A 85 2.476 9.418 11.123 1.00 0.00 H new ATOM 0 HH12 ARG A 85 2.103 10.771 10.050 1.00 0.00 H new ATOM 0 HH21 ARG A 85 1.472 13.036 12.677 1.00 0.00 H new ATOM 0 HH22 ARG A 85 1.537 12.810 10.926 1.00 0.00 H new ATOM 1220 N PRO A 86 -1.102 6.948 9.968 1.00 0.00 N ATOM 1221 CA PRO A 86 -1.395 6.575 8.581 1.00 0.00 C ATOM 1222 C PRO A 86 -0.187 6.749 7.666 1.00 0.00 C ATOM 1223 O PRO A 86 -0.089 6.105 6.622 1.00 0.00 O ATOM 1224 CB PRO A 86 -2.512 7.543 8.182 1.00 0.00 C ATOM 1225 CG PRO A 86 -2.325 8.724 9.070 1.00 0.00 C ATOM 1226 CD PRO A 86 -1.793 8.185 10.369 1.00 0.00 C ATOM 0 HA PRO A 86 -1.670 5.524 8.491 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.437 7.822 7.131 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -3.495 7.093 8.323 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.629 9.437 8.629 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -3.267 9.251 9.223 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.112 8.889 10.847 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -2.595 7.985 11.080 1.00 0.00 H new ATOM 1234 N VAL A 87 0.731 7.624 8.065 1.00 0.00 N ATOM 1235 CA VAL A 87 1.933 7.882 7.282 1.00 0.00 C ATOM 1236 C VAL A 87 3.150 8.056 8.184 1.00 0.00 C ATOM 1237 O VAL A 87 3.017 8.250 9.392 1.00 0.00 O ATOM 1238 CB VAL A 87 1.773 9.138 6.405 1.00 0.00 C ATOM 1239 CG1 VAL A 87 0.576 8.994 5.479 1.00 0.00 C ATOM 1240 CG2 VAL A 87 1.640 10.380 7.274 1.00 0.00 C ATOM 0 H VAL A 87 0.665 8.166 8.926 1.00 0.00 H new ATOM 0 HA VAL A 87 2.083 7.016 6.638 1.00 0.00 H new ATOM 0 HB VAL A 87 2.666 9.247 5.790 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.479 9.891 4.867 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.718 8.128 4.833 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.329 8.860 6.072 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.528 11.258 6.638 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.765 10.283 7.916 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.532 10.490 7.891 1.00 0.00 H new ATOM 1250 N GLY A 88 4.336 7.987 7.588 1.00 0.00 N ATOM 1251 CA GLY A 88 5.560 8.140 8.353 1.00 0.00 C ATOM 1252 C GLY A 88 6.460 6.923 8.256 1.00 0.00 C ATOM 1253 O GLY A 88 6.057 5.816 8.612 1.00 0.00 O ATOM 0 H GLY A 88 4.471 7.828 6.590 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.100 9.017 7.997 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.311 8.322 9.399 1.00 0.00 H new ATOM 1257 N MET A 89 7.680 7.129 7.773 1.00 0.00 N ATOM 1258 CA MET A 89 8.639 6.039 7.630 1.00 0.00 C ATOM 1259 C MET A 89 8.819 5.297 8.951 1.00 0.00 C ATOM 1260 O MET A 89 8.597 4.089 9.030 1.00 0.00 O ATOM 1261 CB MET A 89 9.987 6.577 7.146 1.00 0.00 C ATOM 1262 CG MET A 89 10.115 6.623 5.632 1.00 0.00 C ATOM 1263 SD MET A 89 10.802 5.103 4.947 1.00 0.00 S ATOM 1264 CE MET A 89 9.313 4.139 4.699 1.00 0.00 C ATOM 0 H MET A 89 8.029 8.040 7.474 1.00 0.00 H new ATOM 0 HA MET A 89 8.249 5.340 6.891 1.00 0.00 H new ATOM 0 HB2 MET A 89 10.133 7.581 7.545 1.00 0.00 H new ATOM 0 HB3 MET A 89 10.784 5.954 7.551 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.134 6.804 5.194 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.749 7.463 5.350 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.488 3.392 3.925 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.043 3.641 5.630 1.00 0.00 H new ATOM 0 HE3 MET A 89 8.501 4.797 4.391 1.00 0.00 H new ATOM 1274 N ASP A 90 9.222 6.028 9.985 1.00 0.00 N ATOM 1275 CA ASP A 90 9.431 5.439 11.302 1.00 0.00 C ATOM 1276 C ASP A 90 8.325 4.442 11.634 1.00 0.00 C ATOM 1277 O ASP A 90 8.592 3.331 12.092 1.00 0.00 O ATOM 1278 CB ASP A 90 9.486 6.532 12.370 1.00 0.00 C ATOM 1279 CG ASP A 90 10.875 7.119 12.527 1.00 0.00 C ATOM 1280 OD1 ASP A 90 11.467 7.525 11.505 1.00 0.00 O ATOM 1281 OD2 ASP A 90 11.370 7.172 13.672 1.00 0.00 O ATOM 0 H ASP A 90 9.410 7.029 9.936 1.00 0.00 H new ATOM 0 HA ASP A 90 10.382 4.907 11.288 1.00 0.00 H new ATOM 0 HB2 ASP A 90 8.786 7.326 12.109 1.00 0.00 H new ATOM 0 HB3 ASP A 90 9.159 6.120 13.325 1.00 0.00 H new ATOM 1286 N THR A 91 7.080 4.847 11.399 1.00 0.00 N ATOM 1287 CA THR A 91 5.933 3.991 11.675 1.00 0.00 C ATOM 1288 C THR A 91 5.990 2.713 10.847 1.00 0.00 C ATOM 1289 O THR A 91 5.734 1.620 11.354 1.00 0.00 O ATOM 1290 CB THR A 91 4.607 4.719 11.385 1.00 0.00 C ATOM 1291 OG1 THR A 91 4.431 5.802 12.305 1.00 0.00 O ATOM 1292 CG2 THR A 91 3.430 3.761 11.490 1.00 0.00 C ATOM 0 H THR A 91 6.841 5.763 11.018 1.00 0.00 H new ATOM 0 HA THR A 91 5.975 3.737 12.734 1.00 0.00 H new ATOM 0 HB THR A 91 4.647 5.110 10.368 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.862 5.511 13.048 1.00 0.00 H new ATOM 0 HG21 THR A 91 2.504 4.298 11.281 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.552 2.954 10.768 1.00 0.00 H new ATOM 0 HG23 THR A 91 3.389 3.344 12.496 1.00 0.00 H new ATOM 1300 N LEU A 92 6.328 2.855 9.570 1.00 0.00 N ATOM 1301 CA LEU A 92 6.419 1.710 8.670 1.00 0.00 C ATOM 1302 C LEU A 92 7.473 0.720 9.155 1.00 0.00 C ATOM 1303 O LEU A 92 7.189 -0.463 9.341 1.00 0.00 O ATOM 1304 CB LEU A 92 6.754 2.176 7.252 1.00 0.00 C ATOM 1305 CG LEU A 92 6.571 1.138 6.144 1.00 0.00 C ATOM 1306 CD1 LEU A 92 5.159 1.200 5.583 1.00 0.00 C ATOM 1307 CD2 LEU A 92 7.596 1.351 5.040 1.00 0.00 C ATOM 0 H LEU A 92 6.544 3.752 9.134 1.00 0.00 H new ATOM 0 HA LEU A 92 5.452 1.208 8.661 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.133 3.041 7.019 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.790 2.515 7.238 1.00 0.00 H new ATOM 0 HG LEU A 92 6.727 0.147 6.571 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.047 0.454 4.796 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.442 0.998 6.379 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.974 2.192 5.172 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.451 0.604 4.260 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.472 2.347 4.616 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.600 1.255 5.453 1.00 0.00 H new ATOM 1319 N ASN A 93 8.691 1.212 9.359 1.00 0.00 N ATOM 1320 CA ASN A 93 9.788 0.371 9.824 1.00 0.00 C ATOM 1321 C ASN A 93 9.398 -0.378 11.095 1.00 0.00 C ATOM 1322 O ASN A 93 9.511 -1.601 11.167 1.00 0.00 O ATOM 1323 CB ASN A 93 11.035 1.219 10.080 1.00 0.00 C ATOM 1324 CG ASN A 93 11.791 1.534 8.804 1.00 0.00 C ATOM 1325 OD1 ASN A 93 12.934 1.112 8.626 1.00 0.00 O ATOM 1326 ND2 ASN A 93 11.155 2.281 7.909 1.00 0.00 N ATOM 0 H ASN A 93 8.943 2.189 9.210 1.00 0.00 H new ATOM 0 HA ASN A 93 10.008 -0.360 9.046 1.00 0.00 H new ATOM 0 HB2 ASN A 93 10.744 2.150 10.566 1.00 0.00 H new ATOM 0 HB3 ASN A 93 11.695 0.692 10.769 1.00 0.00 H new ATOM 0 HD21 ASN A 93 11.614 2.527 7.032 1.00 0.00 H new ATOM 0 HD22 ASN A 93 10.208 2.609 8.099 1.00 0.00 H new ATOM 1333 N SER A 94 8.939 0.366 12.096 1.00 0.00 N ATOM 1334 CA SER A 94 8.535 -0.226 13.366 1.00 0.00 C ATOM 1335 C SER A 94 7.819 -1.554 13.143 1.00 0.00 C ATOM 1336 O SER A 94 8.106 -2.547 13.811 1.00 0.00 O ATOM 1337 CB SER A 94 7.625 0.734 14.135 1.00 0.00 C ATOM 1338 OG SER A 94 7.409 0.282 15.460 1.00 0.00 O ATOM 0 H SER A 94 8.838 1.380 12.052 1.00 0.00 H new ATOM 0 HA SER A 94 9.434 -0.412 13.954 1.00 0.00 H new ATOM 0 HB2 SER A 94 8.073 1.727 14.155 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.669 0.826 13.619 1.00 0.00 H new ATOM 0 HG SER A 94 6.826 0.914 15.930 1.00 0.00 H new ATOM 1344 N ALA A 95 6.884 -1.564 12.198 1.00 0.00 N ATOM 1345 CA ALA A 95 6.128 -2.770 11.884 1.00 0.00 C ATOM 1346 C ALA A 95 7.017 -3.821 11.229 1.00 0.00 C ATOM 1347 O ALA A 95 7.105 -4.955 11.701 1.00 0.00 O ATOM 1348 CB ALA A 95 4.951 -2.434 10.981 1.00 0.00 C ATOM 0 H ALA A 95 6.632 -0.750 11.637 1.00 0.00 H new ATOM 0 HA ALA A 95 5.749 -3.185 12.818 1.00 0.00 H new ATOM 0 HB1 ALA A 95 4.395 -3.344 10.754 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.296 -1.725 11.486 1.00 0.00 H new ATOM 0 HB3 ALA A 95 5.318 -1.993 10.054 1.00 0.00 H new ATOM 1354 N ILE A 96 7.675 -3.437 10.140 1.00 0.00 N ATOM 1355 CA ILE A 96 8.557 -4.347 9.421 1.00 0.00 C ATOM 1356 C ILE A 96 9.332 -5.238 10.385 1.00 0.00 C ATOM 1357 O ILE A 96 9.109 -6.447 10.444 1.00 0.00 O ATOM 1358 CB ILE A 96 9.556 -3.580 8.534 1.00 0.00 C ATOM 1359 CG1 ILE A 96 8.808 -2.741 7.496 1.00 0.00 C ATOM 1360 CG2 ILE A 96 10.511 -4.548 7.852 1.00 0.00 C ATOM 1361 CD1 ILE A 96 9.723 -1.969 6.570 1.00 0.00 C ATOM 0 H ILE A 96 7.614 -2.502 9.737 1.00 0.00 H new ATOM 0 HA ILE A 96 7.922 -4.966 8.788 1.00 0.00 H new ATOM 0 HB ILE A 96 10.139 -2.909 9.165 1.00 0.00 H new ATOM 0 HG12 ILE A 96 8.171 -3.396 6.901 1.00 0.00 H new ATOM 0 HG13 ILE A 96 8.151 -2.041 8.012 1.00 0.00 H new ATOM 0 HG21 ILE A 96 11.210 -3.991 7.229 1.00 0.00 H new ATOM 0 HG22 ILE A 96 11.064 -5.107 8.607 1.00 0.00 H new ATOM 0 HG23 ILE A 96 9.944 -5.241 7.230 1.00 0.00 H new ATOM 0 HD11 ILE A 96 9.125 -1.397 5.861 1.00 0.00 H new ATOM 0 HD12 ILE A 96 10.342 -1.288 7.154 1.00 0.00 H new ATOM 0 HD13 ILE A 96 10.362 -2.665 6.027 1.00 0.00 H new ATOM 1373 N GLU A 97 10.242 -4.632 11.141 1.00 0.00 N ATOM 1374 CA GLU A 97 11.050 -5.371 12.105 1.00 0.00 C ATOM 1375 C GLU A 97 10.171 -6.247 12.993 1.00 0.00 C ATOM 1376 O GLU A 97 10.404 -7.448 13.124 1.00 0.00 O ATOM 1377 CB GLU A 97 11.864 -4.406 12.968 1.00 0.00 C ATOM 1378 CG GLU A 97 12.996 -3.724 12.217 1.00 0.00 C ATOM 1379 CD GLU A 97 14.191 -4.635 12.011 1.00 0.00 C ATOM 1380 OE1 GLU A 97 15.066 -4.675 12.902 1.00 0.00 O ATOM 1381 OE2 GLU A 97 14.252 -5.306 10.960 1.00 0.00 O ATOM 0 H GLU A 97 10.438 -3.632 11.105 1.00 0.00 H new ATOM 0 HA GLU A 97 11.733 -6.015 11.550 1.00 0.00 H new ATOM 0 HB2 GLU A 97 11.198 -3.645 13.374 1.00 0.00 H new ATOM 0 HB3 GLU A 97 12.279 -4.951 13.816 1.00 0.00 H new ATOM 0 HG2 GLU A 97 12.631 -3.384 11.248 1.00 0.00 H new ATOM 0 HG3 GLU A 97 13.310 -2.837 12.768 1.00 0.00 H new ATOM 1388 N ASN A 98 9.160 -5.636 13.602 1.00 0.00 N ATOM 1389 CA ASN A 98 8.246 -6.359 14.479 1.00 0.00 C ATOM 1390 C ASN A 98 7.879 -7.715 13.883 1.00 0.00 C ATOM 1391 O ASN A 98 7.832 -8.723 14.590 1.00 0.00 O ATOM 1392 CB ASN A 98 6.979 -5.536 14.720 1.00 0.00 C ATOM 1393 CG ASN A 98 6.365 -5.804 16.080 1.00 0.00 C ATOM 1394 OD1 ASN A 98 6.262 -6.953 16.511 1.00 0.00 O ATOM 1395 ND2 ASN A 98 5.952 -4.743 16.763 1.00 0.00 N ATOM 0 H ASN A 98 8.953 -4.642 13.504 1.00 0.00 H new ATOM 0 HA ASN A 98 8.750 -6.524 15.431 1.00 0.00 H new ATOM 0 HB2 ASN A 98 7.216 -4.476 14.634 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.248 -5.763 13.944 1.00 0.00 H new ATOM 0 HD21 ASN A 98 5.530 -4.862 17.684 1.00 0.00 H new ATOM 0 HD22 ASN A 98 6.057 -3.809 16.367 1.00 0.00 H new ATOM 1402 N LEU A 99 7.622 -7.733 12.580 1.00 0.00 N ATOM 1403 CA LEU A 99 7.260 -8.965 11.889 1.00 0.00 C ATOM 1404 C LEU A 99 8.501 -9.789 11.560 1.00 0.00 C ATOM 1405 O LEU A 99 8.498 -11.012 11.692 1.00 0.00 O ATOM 1406 CB LEU A 99 6.491 -8.646 10.605 1.00 0.00 C ATOM 1407 CG LEU A 99 5.129 -7.976 10.789 1.00 0.00 C ATOM 1408 CD1 LEU A 99 4.594 -7.480 9.454 1.00 0.00 C ATOM 1409 CD2 LEU A 99 4.144 -8.939 11.435 1.00 0.00 C ATOM 0 H LEU A 99 7.658 -6.908 11.981 1.00 0.00 H new ATOM 0 HA LEU A 99 6.622 -9.550 12.551 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.111 -7.999 9.985 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.346 -9.574 10.052 1.00 0.00 H new ATOM 0 HG LEU A 99 5.254 -7.118 11.449 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.624 -7.006 9.604 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.290 -6.756 9.029 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.484 -8.322 8.770 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.180 -8.445 11.558 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.024 -9.817 10.800 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.522 -9.246 12.410 1.00 0.00 H new ATOM 1421 N MET A 100 9.560 -9.109 11.133 1.00 0.00 N ATOM 1422 CA MET A 100 10.809 -9.779 10.788 1.00 0.00 C ATOM 1423 C MET A 100 11.239 -10.732 11.899 1.00 0.00 C ATOM 1424 O MET A 100 11.624 -11.873 11.638 1.00 0.00 O ATOM 1425 CB MET A 100 11.911 -8.749 10.530 1.00 0.00 C ATOM 1426 CG MET A 100 11.759 -8.016 9.207 1.00 0.00 C ATOM 1427 SD MET A 100 13.196 -7.004 8.805 1.00 0.00 S ATOM 1428 CE MET A 100 13.775 -7.814 7.316 1.00 0.00 C ATOM 0 H MET A 100 9.579 -8.096 11.018 1.00 0.00 H new ATOM 0 HA MET A 100 10.643 -10.358 9.880 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.914 -8.021 11.341 1.00 0.00 H new ATOM 0 HB3 MET A 100 12.878 -9.251 10.549 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.596 -8.742 8.410 1.00 0.00 H new ATOM 0 HG3 MET A 100 10.873 -7.382 9.247 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.340 -7.104 6.712 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.417 -8.653 7.584 1.00 0.00 H new ATOM 0 HE3 MET A 100 12.921 -8.179 6.745 1.00 0.00 H new ATOM 1438 N THR A 101 11.172 -10.258 13.139 1.00 0.00 N ATOM 1439 CA THR A 101 11.556 -11.068 14.289 1.00 0.00 C ATOM 1440 C THR A 101 10.463 -12.069 14.644 1.00 0.00 C ATOM 1441 O THR A 101 10.744 -13.149 15.165 1.00 0.00 O ATOM 1442 CB THR A 101 11.853 -10.190 15.519 1.00 0.00 C ATOM 1443 OG1 THR A 101 12.231 -11.014 16.628 1.00 0.00 O ATOM 1444 CG2 THR A 101 10.639 -9.354 15.894 1.00 0.00 C ATOM 0 H THR A 101 10.855 -9.317 13.373 1.00 0.00 H new ATOM 0 HA THR A 101 12.461 -11.607 14.010 1.00 0.00 H new ATOM 0 HB THR A 101 12.674 -9.518 15.268 1.00 0.00 H new ATOM 0 HG1 THR A 101 12.420 -10.449 17.406 1.00 0.00 H new ATOM 0 HG21 THR A 101 10.873 -8.743 16.765 1.00 0.00 H new ATOM 0 HG22 THR A 101 10.370 -8.707 15.059 1.00 0.00 H new ATOM 0 HG23 THR A 101 9.802 -10.012 16.127 1.00 0.00 H new ATOM 1452 N SER A 102 9.217 -11.705 14.360 1.00 0.00 N ATOM 1453 CA SER A 102 8.081 -12.571 14.654 1.00 0.00 C ATOM 1454 C SER A 102 8.190 -13.887 13.889 1.00 0.00 C ATOM 1455 O SER A 102 8.094 -14.967 14.473 1.00 0.00 O ATOM 1456 CB SER A 102 6.771 -11.868 14.297 1.00 0.00 C ATOM 1457 OG SER A 102 6.413 -10.922 15.289 1.00 0.00 O ATOM 0 H SER A 102 8.968 -10.816 13.926 1.00 0.00 H new ATOM 0 HA SER A 102 8.088 -12.789 15.722 1.00 0.00 H new ATOM 0 HB2 SER A 102 6.874 -11.368 13.334 1.00 0.00 H new ATOM 0 HB3 SER A 102 5.976 -12.606 14.190 1.00 0.00 H new ATOM 0 HG SER A 102 6.943 -10.106 15.169 1.00 0.00 H new ATOM 1463 N SER A 103 8.391 -13.788 12.579 1.00 0.00 N ATOM 1464 CA SER A 103 8.509 -14.969 11.732 1.00 0.00 C ATOM 1465 C SER A 103 9.876 -15.018 11.055 1.00 0.00 C ATOM 1466 O SER A 103 10.695 -14.114 11.220 1.00 0.00 O ATOM 1467 CB SER A 103 7.403 -14.979 10.676 1.00 0.00 C ATOM 1468 OG SER A 103 6.213 -15.552 11.189 1.00 0.00 O ATOM 0 H SER A 103 8.476 -12.902 12.081 1.00 0.00 H new ATOM 0 HA SER A 103 8.404 -15.851 12.364 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.205 -13.960 10.342 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.734 -15.542 9.803 1.00 0.00 H new ATOM 0 HG SER A 103 5.521 -15.545 10.495 1.00 0.00 H new ATOM 1474 N SER A 104 10.113 -16.079 10.291 1.00 0.00 N ATOM 1475 CA SER A 104 11.381 -16.249 9.591 1.00 0.00 C ATOM 1476 C SER A 104 11.240 -15.887 8.116 1.00 0.00 C ATOM 1477 O SER A 104 10.142 -15.921 7.558 1.00 0.00 O ATOM 1478 CB SER A 104 11.875 -17.691 9.729 1.00 0.00 C ATOM 1479 OG SER A 104 11.885 -18.099 11.086 1.00 0.00 O ATOM 0 H SER A 104 9.444 -16.834 10.141 1.00 0.00 H new ATOM 0 HA SER A 104 12.110 -15.578 10.044 1.00 0.00 H new ATOM 0 HB2 SER A 104 11.233 -18.356 9.151 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.879 -17.776 9.313 1.00 0.00 H new ATOM 0 HG SER A 104 11.077 -18.620 11.277 1.00 0.00 H new ATOM 1485 N LYS A 105 12.358 -15.539 7.489 1.00 0.00 N ATOM 1486 CA LYS A 105 12.362 -15.171 6.078 1.00 0.00 C ATOM 1487 C LYS A 105 11.684 -16.244 5.234 1.00 0.00 C ATOM 1488 O LYS A 105 10.872 -15.939 4.361 1.00 0.00 O ATOM 1489 CB LYS A 105 13.796 -14.954 5.590 1.00 0.00 C ATOM 1490 CG LYS A 105 13.888 -14.562 4.126 1.00 0.00 C ATOM 1491 CD LYS A 105 15.210 -13.882 3.812 1.00 0.00 C ATOM 1492 CE LYS A 105 15.158 -13.150 2.480 1.00 0.00 C ATOM 1493 NZ LYS A 105 16.444 -12.463 2.174 1.00 0.00 N ATOM 0 H LYS A 105 13.274 -15.504 7.936 1.00 0.00 H new ATOM 0 HA LYS A 105 11.803 -14.241 5.970 1.00 0.00 H new ATOM 0 HB2 LYS A 105 14.263 -14.177 6.195 1.00 0.00 H new ATOM 0 HB3 LYS A 105 14.367 -15.869 5.749 1.00 0.00 H new ATOM 0 HG2 LYS A 105 13.778 -15.450 3.503 1.00 0.00 H new ATOM 0 HG3 LYS A 105 13.065 -13.893 3.875 1.00 0.00 H new ATOM 0 HD2 LYS A 105 15.455 -13.177 4.606 1.00 0.00 H new ATOM 0 HD3 LYS A 105 16.006 -14.626 3.789 1.00 0.00 H new ATOM 0 HE2 LYS A 105 14.927 -13.859 1.685 1.00 0.00 H new ATOM 0 HE3 LYS A 105 14.351 -12.418 2.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 16.286 -11.436 2.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 17.136 -12.672 2.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 16.809 -12.801 1.261 1.00 0.00 H new ATOM 1507 N GLU A 106 12.022 -17.502 5.500 1.00 0.00 N ATOM 1508 CA GLU A 106 11.444 -18.620 4.764 1.00 0.00 C ATOM 1509 C GLU A 106 9.993 -18.851 5.176 1.00 0.00 C ATOM 1510 O GLU A 106 9.130 -19.101 4.334 1.00 0.00 O ATOM 1511 CB GLU A 106 12.261 -19.892 5.001 1.00 0.00 C ATOM 1512 CG GLU A 106 13.717 -19.767 4.584 1.00 0.00 C ATOM 1513 CD GLU A 106 14.377 -21.114 4.359 1.00 0.00 C ATOM 1514 OE1 GLU A 106 14.066 -21.762 3.338 1.00 0.00 O ATOM 1515 OE2 GLU A 106 15.203 -21.519 5.203 1.00 0.00 O ATOM 0 H GLU A 106 12.693 -17.772 6.219 1.00 0.00 H new ATOM 0 HA GLU A 106 11.467 -18.374 3.702 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.216 -20.151 6.059 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.804 -20.715 4.452 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.780 -19.178 3.669 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.265 -19.222 5.352 1.00 0.00 H new ATOM 1522 N ASP A 107 9.732 -18.765 6.476 1.00 0.00 N ATOM 1523 CA ASP A 107 8.386 -18.964 7.000 1.00 0.00 C ATOM 1524 C ASP A 107 7.355 -18.240 6.140 1.00 0.00 C ATOM 1525 O ASP A 107 6.266 -18.758 5.892 1.00 0.00 O ATOM 1526 CB ASP A 107 8.300 -18.468 8.445 1.00 0.00 C ATOM 1527 CG ASP A 107 8.710 -19.530 9.446 1.00 0.00 C ATOM 1528 OD1 ASP A 107 8.207 -20.668 9.343 1.00 0.00 O ATOM 1529 OD2 ASP A 107 9.533 -19.223 10.335 1.00 0.00 O ATOM 0 H ASP A 107 10.435 -18.559 7.186 1.00 0.00 H new ATOM 0 HA ASP A 107 8.168 -20.032 6.976 1.00 0.00 H new ATOM 0 HB2 ASP A 107 8.940 -17.594 8.565 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.280 -18.148 8.656 1.00 0.00 H new ATOM 1534 N TRP A 108 7.706 -17.042 5.688 1.00 0.00 N ATOM 1535 CA TRP A 108 6.810 -16.247 4.855 1.00 0.00 C ATOM 1536 C TRP A 108 6.386 -17.025 3.614 1.00 0.00 C ATOM 1537 O TRP A 108 7.214 -17.479 2.824 1.00 0.00 O ATOM 1538 CB TRP A 108 7.489 -14.939 4.445 1.00 0.00 C ATOM 1539 CG TRP A 108 8.171 -14.241 5.583 1.00 0.00 C ATOM 1540 CD1 TRP A 108 7.802 -14.265 6.898 1.00 0.00 C ATOM 1541 CD2 TRP A 108 9.337 -13.414 5.506 1.00 0.00 C ATOM 1542 NE1 TRP A 108 8.670 -13.503 7.643 1.00 0.00 N ATOM 1543 CE2 TRP A 108 9.621 -12.971 6.812 1.00 0.00 C ATOM 1544 CE3 TRP A 108 10.171 -13.007 4.461 1.00 0.00 C ATOM 1545 CZ2 TRP A 108 10.701 -12.141 7.098 1.00 0.00 C ATOM 1546 CZ3 TRP A 108 11.243 -12.183 4.746 1.00 0.00 C ATOM 1547 CH2 TRP A 108 11.501 -11.758 6.056 1.00 0.00 C ATOM 0 H TRP A 108 8.604 -16.599 5.884 1.00 0.00 H new ATOM 0 HA TRP A 108 5.919 -16.018 5.439 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.221 -15.147 3.665 1.00 0.00 H new ATOM 0 HB3 TRP A 108 6.744 -14.271 4.013 1.00 0.00 H new ATOM 0 HD1 TRP A 108 6.953 -14.803 7.294 1.00 0.00 H new ATOM 0 HE1 TRP A 108 8.615 -13.357 8.651 1.00 0.00 H new ATOM 0 HE3 TRP A 108 9.981 -13.331 3.448 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 10.901 -11.811 8.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.893 -11.861 3.946 1.00 0.00 H new ATOM 0 HH2 TRP A 108 12.348 -11.116 6.247 1.00 0.00 H new ATOM 1558 N PRO A 109 5.066 -17.184 3.437 1.00 0.00 N ATOM 1559 CA PRO A 109 4.503 -17.907 2.292 1.00 0.00 C ATOM 1560 C PRO A 109 4.688 -17.151 0.981 1.00 0.00 C ATOM 1561 O PRO A 109 4.557 -15.928 0.935 1.00 0.00 O ATOM 1562 CB PRO A 109 3.017 -18.018 2.640 1.00 0.00 C ATOM 1563 CG PRO A 109 2.755 -16.872 3.555 1.00 0.00 C ATOM 1564 CD PRO A 109 4.022 -16.669 4.338 1.00 0.00 C ATOM 0 HA PRO A 109 4.992 -18.869 2.136 1.00 0.00 H new ATOM 0 HB2 PRO A 109 2.396 -17.961 1.746 1.00 0.00 H new ATOM 0 HB3 PRO A 109 2.794 -18.969 3.123 1.00 0.00 H new ATOM 0 HG2 PRO A 109 2.496 -15.975 2.993 1.00 0.00 H new ATOM 0 HG3 PRO A 109 1.917 -17.086 4.218 1.00 0.00 H new ATOM 0 HD2 PRO A 109 4.182 -15.618 4.579 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.002 -17.213 5.282 1.00 0.00 H new ATOM 1572 N SER A 110 4.993 -17.887 -0.083 1.00 0.00 N ATOM 1573 CA SER A 110 5.199 -17.286 -1.395 1.00 0.00 C ATOM 1574 C SER A 110 3.896 -16.710 -1.940 1.00 0.00 C ATOM 1575 O SER A 110 2.918 -17.432 -2.135 1.00 0.00 O ATOM 1576 CB SER A 110 5.760 -18.321 -2.372 1.00 0.00 C ATOM 1577 OG SER A 110 4.766 -19.258 -2.749 1.00 0.00 O ATOM 0 H SER A 110 5.103 -18.901 -0.062 1.00 0.00 H new ATOM 0 HA SER A 110 5.917 -16.474 -1.285 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.145 -17.817 -3.259 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.600 -18.842 -1.912 1.00 0.00 H new ATOM 0 HG SER A 110 3.883 -18.917 -2.496 1.00 0.00 H new ATOM 1583 N VAL A 111 3.889 -15.403 -2.184 1.00 0.00 N ATOM 1584 CA VAL A 111 2.707 -14.729 -2.707 1.00 0.00 C ATOM 1585 C VAL A 111 3.060 -13.846 -3.899 1.00 0.00 C ATOM 1586 O VAL A 111 4.232 -13.671 -4.229 1.00 0.00 O ATOM 1587 CB VAL A 111 2.028 -13.866 -1.626 1.00 0.00 C ATOM 1588 CG1 VAL A 111 1.471 -14.743 -0.515 1.00 0.00 C ATOM 1589 CG2 VAL A 111 3.007 -12.844 -1.070 1.00 0.00 C ATOM 0 H VAL A 111 4.689 -14.790 -2.028 1.00 0.00 H new ATOM 0 HA VAL A 111 2.015 -15.508 -3.028 1.00 0.00 H new ATOM 0 HB VAL A 111 1.197 -13.329 -2.082 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.995 -14.116 0.239 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.736 -15.433 -0.930 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.282 -15.309 -0.057 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.512 -12.243 -0.308 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.859 -13.360 -0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 111 3.353 -12.196 -1.875 1.00 0.00 H new ATOM 1599 N ASN A 112 2.037 -13.292 -4.541 1.00 0.00 N ATOM 1600 CA ASN A 112 2.240 -12.426 -5.698 1.00 0.00 C ATOM 1601 C ASN A 112 1.429 -11.141 -5.563 1.00 0.00 C ATOM 1602 O ASN A 112 0.390 -11.117 -4.904 1.00 0.00 O ATOM 1603 CB ASN A 112 1.848 -13.158 -6.983 1.00 0.00 C ATOM 1604 CG ASN A 112 2.944 -14.081 -7.480 1.00 0.00 C ATOM 1605 OD1 ASN A 112 4.081 -13.657 -7.689 1.00 0.00 O ATOM 1606 ND2 ASN A 112 2.606 -15.351 -7.671 1.00 0.00 N ATOM 0 H ASN A 112 1.060 -13.427 -4.281 1.00 0.00 H new ATOM 0 HA ASN A 112 3.297 -12.164 -5.745 1.00 0.00 H new ATOM 0 HB2 ASN A 112 0.942 -13.737 -6.806 1.00 0.00 H new ATOM 0 HB3 ASN A 112 1.613 -12.427 -7.757 1.00 0.00 H new ATOM 0 HD21 ASN A 112 3.301 -16.019 -8.004 1.00 0.00 H new ATOM 0 HD22 ASN A 112 1.651 -15.658 -7.485 1.00 0.00 H new ATOM 1613 N MET A 113 1.910 -10.075 -6.195 1.00 0.00 N ATOM 1614 CA MET A 113 1.229 -8.787 -6.147 1.00 0.00 C ATOM 1615 C MET A 113 0.438 -8.543 -7.429 1.00 0.00 C ATOM 1616 O MET A 113 1.010 -8.222 -8.470 1.00 0.00 O ATOM 1617 CB MET A 113 2.241 -7.659 -5.935 1.00 0.00 C ATOM 1618 CG MET A 113 1.601 -6.331 -5.561 1.00 0.00 C ATOM 1619 SD MET A 113 2.748 -5.218 -4.727 1.00 0.00 S ATOM 1620 CE MET A 113 3.087 -6.141 -3.230 1.00 0.00 C ATOM 0 H MET A 113 2.768 -10.078 -6.746 1.00 0.00 H new ATOM 0 HA MET A 113 0.533 -8.802 -5.309 1.00 0.00 H new ATOM 0 HB2 MET A 113 2.939 -7.951 -5.150 1.00 0.00 H new ATOM 0 HB3 MET A 113 2.824 -7.528 -6.847 1.00 0.00 H new ATOM 0 HG2 MET A 113 1.222 -5.848 -6.462 1.00 0.00 H new ATOM 0 HG3 MET A 113 0.744 -6.515 -4.914 1.00 0.00 H new ATOM 0 HE1 MET A 113 3.007 -5.479 -2.368 1.00 0.00 H new ATOM 0 HE2 MET A 113 2.366 -6.953 -3.132 1.00 0.00 H new ATOM 0 HE3 MET A 113 4.095 -6.554 -3.278 1.00 0.00 H new ATOM 1630 N ASN A 114 -0.879 -8.697 -7.344 1.00 0.00 N ATOM 1631 CA ASN A 114 -1.748 -8.494 -8.498 1.00 0.00 C ATOM 1632 C ASN A 114 -2.218 -7.044 -8.576 1.00 0.00 C ATOM 1633 O ASN A 114 -3.180 -6.655 -7.915 1.00 0.00 O ATOM 1634 CB ASN A 114 -2.956 -9.430 -8.424 1.00 0.00 C ATOM 1635 CG ASN A 114 -3.980 -9.138 -9.503 1.00 0.00 C ATOM 1636 OD1 ASN A 114 -3.904 -8.118 -10.187 1.00 0.00 O ATOM 1637 ND2 ASN A 114 -4.947 -10.035 -9.659 1.00 0.00 N ATOM 0 H ASN A 114 -1.368 -8.962 -6.489 1.00 0.00 H new ATOM 0 HA ASN A 114 -1.176 -8.721 -9.397 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -2.619 -10.462 -8.517 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.426 -9.335 -7.445 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -5.666 -9.892 -10.369 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -4.971 -10.867 -9.069 1.00 0.00 H new ATOM 1644 N VAL A 115 -1.531 -6.249 -9.390 1.00 0.00 N ATOM 1645 CA VAL A 115 -1.878 -4.843 -9.558 1.00 0.00 C ATOM 1646 C VAL A 115 -2.653 -4.618 -10.851 1.00 0.00 C ATOM 1647 O VAL A 115 -2.100 -4.727 -11.945 1.00 0.00 O ATOM 1648 CB VAL A 115 -0.622 -3.951 -9.563 1.00 0.00 C ATOM 1649 CG1 VAL A 115 -1.003 -2.494 -9.777 1.00 0.00 C ATOM 1650 CG2 VAL A 115 0.158 -4.123 -8.268 1.00 0.00 C ATOM 0 H VAL A 115 -0.731 -6.555 -9.944 1.00 0.00 H new ATOM 0 HA VAL A 115 -2.506 -4.569 -8.710 1.00 0.00 H new ATOM 0 HB VAL A 115 0.019 -4.259 -10.389 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.103 -1.879 -9.778 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.515 -2.389 -10.733 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.664 -2.169 -8.974 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.042 -3.486 -8.288 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.472 -3.843 -7.424 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.463 -5.164 -8.163 1.00 0.00 H new ATOM 1660 N ALA A 116 -3.938 -4.303 -10.718 1.00 0.00 N ATOM 1661 CA ALA A 116 -4.789 -4.060 -11.876 1.00 0.00 C ATOM 1662 C ALA A 116 -5.907 -3.080 -11.540 1.00 0.00 C ATOM 1663 O ALA A 116 -6.648 -3.275 -10.576 1.00 0.00 O ATOM 1664 CB ALA A 116 -5.369 -5.370 -12.389 1.00 0.00 C ATOM 0 H ALA A 116 -4.412 -4.210 -9.820 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.175 -3.615 -12.660 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -6.003 -5.173 -13.254 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -4.558 -6.039 -12.678 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -5.963 -5.838 -11.603 1.00 0.00 H new ATOM 1670 N ASP A 117 -6.023 -2.025 -12.339 1.00 0.00 N ATOM 1671 CA ASP A 117 -7.051 -1.014 -12.126 1.00 0.00 C ATOM 1672 C ASP A 117 -6.859 -0.318 -10.782 1.00 0.00 C ATOM 1673 O ASP A 117 -7.828 0.008 -10.097 1.00 0.00 O ATOM 1674 CB ASP A 117 -8.442 -1.648 -12.192 1.00 0.00 C ATOM 1675 CG ASP A 117 -9.499 -0.675 -12.675 1.00 0.00 C ATOM 1676 OD1 ASP A 117 -9.322 0.544 -12.469 1.00 0.00 O ATOM 1677 OD2 ASP A 117 -10.504 -1.132 -13.259 1.00 0.00 O ATOM 0 H ASP A 117 -5.417 -1.848 -13.140 1.00 0.00 H new ATOM 0 HA ASP A 117 -6.962 -0.269 -12.917 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.414 -2.510 -12.859 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -8.717 -2.018 -11.204 1.00 0.00 H new ATOM 1682 N ALA A 118 -5.603 -0.094 -10.412 1.00 0.00 N ATOM 1683 CA ALA A 118 -5.284 0.564 -9.151 1.00 0.00 C ATOM 1684 C ALA A 118 -5.786 -0.252 -7.964 1.00 0.00 C ATOM 1685 O ALA A 118 -6.346 0.295 -7.013 1.00 0.00 O ATOM 1686 CB ALA A 118 -5.878 1.964 -9.120 1.00 0.00 C ATOM 0 H ALA A 118 -4.789 -0.358 -10.967 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.199 0.640 -9.074 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.632 2.443 -8.172 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.468 2.552 -9.941 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.961 1.902 -9.224 1.00 0.00 H new ATOM 1692 N THR A 119 -5.582 -1.564 -8.025 1.00 0.00 N ATOM 1693 CA THR A 119 -6.016 -2.456 -6.957 1.00 0.00 C ATOM 1694 C THR A 119 -4.903 -3.419 -6.559 1.00 0.00 C ATOM 1695 O THR A 119 -4.479 -4.257 -7.356 1.00 0.00 O ATOM 1696 CB THR A 119 -7.258 -3.267 -7.371 1.00 0.00 C ATOM 1697 OG1 THR A 119 -8.335 -2.382 -7.695 1.00 0.00 O ATOM 1698 CG2 THR A 119 -7.686 -4.208 -6.256 1.00 0.00 C ATOM 0 H THR A 119 -5.119 -2.033 -8.803 1.00 0.00 H new ATOM 0 HA THR A 119 -6.271 -1.827 -6.104 1.00 0.00 H new ATOM 0 HB THR A 119 -7.001 -3.862 -8.248 1.00 0.00 H new ATOM 0 HG1 THR A 119 -9.120 -2.905 -7.959 1.00 0.00 H new ATOM 0 HG21 THR A 119 -8.565 -4.770 -6.572 1.00 0.00 H new ATOM 0 HG22 THR A 119 -6.874 -4.900 -6.032 1.00 0.00 H new ATOM 0 HG23 THR A 119 -7.926 -3.630 -5.364 1.00 0.00 H new ATOM 1706 N VAL A 120 -4.434 -3.295 -5.322 1.00 0.00 N ATOM 1707 CA VAL A 120 -3.371 -4.157 -4.817 1.00 0.00 C ATOM 1708 C VAL A 120 -3.943 -5.409 -4.163 1.00 0.00 C ATOM 1709 O VAL A 120 -4.403 -5.373 -3.021 1.00 0.00 O ATOM 1710 CB VAL A 120 -2.485 -3.417 -3.797 1.00 0.00 C ATOM 1711 CG1 VAL A 120 -1.404 -4.341 -3.259 1.00 0.00 C ATOM 1712 CG2 VAL A 120 -1.872 -2.175 -4.427 1.00 0.00 C ATOM 0 H VAL A 120 -4.773 -2.606 -4.651 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.762 -4.444 -5.674 1.00 0.00 H new ATOM 0 HB VAL A 120 -3.109 -3.102 -2.960 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -0.788 -3.801 -2.540 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.868 -5.197 -2.769 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -0.780 -4.689 -4.082 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -1.249 -1.664 -3.693 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -1.261 -2.464 -5.282 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -2.666 -1.505 -4.758 1.00 0.00 H new ATOM 1722 N THR A 121 -3.911 -6.519 -4.894 1.00 0.00 N ATOM 1723 CA THR A 121 -4.426 -7.784 -4.386 1.00 0.00 C ATOM 1724 C THR A 121 -3.317 -8.825 -4.274 1.00 0.00 C ATOM 1725 O THR A 121 -2.691 -9.188 -5.270 1.00 0.00 O ATOM 1726 CB THR A 121 -5.546 -8.338 -5.287 1.00 0.00 C ATOM 1727 OG1 THR A 121 -6.503 -7.310 -5.566 1.00 0.00 O ATOM 1728 CG2 THR A 121 -6.240 -9.518 -4.625 1.00 0.00 C ATOM 0 H THR A 121 -3.533 -6.567 -5.840 1.00 0.00 H new ATOM 0 HA THR A 121 -4.833 -7.583 -3.395 1.00 0.00 H new ATOM 0 HB THR A 121 -5.097 -8.679 -6.220 1.00 0.00 H new ATOM 0 HG1 THR A 121 -7.211 -7.669 -6.141 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.027 -9.892 -5.280 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.514 -10.310 -4.441 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.677 -9.199 -3.679 1.00 0.00 H new ATOM 1736 N VAL A 122 -3.080 -9.302 -3.057 1.00 0.00 N ATOM 1737 CA VAL A 122 -2.048 -10.303 -2.816 1.00 0.00 C ATOM 1738 C VAL A 122 -2.582 -11.711 -3.050 1.00 0.00 C ATOM 1739 O VAL A 122 -3.334 -12.244 -2.234 1.00 0.00 O ATOM 1740 CB VAL A 122 -1.497 -10.207 -1.381 1.00 0.00 C ATOM 1741 CG1 VAL A 122 -0.422 -11.258 -1.150 1.00 0.00 C ATOM 1742 CG2 VAL A 122 -0.956 -8.811 -1.110 1.00 0.00 C ATOM 0 H VAL A 122 -3.589 -9.011 -2.222 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.242 -10.102 -3.521 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.313 -10.397 -0.684 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.045 -11.175 -0.131 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -0.846 -12.251 -1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.396 -11.103 -1.854 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.571 -8.761 -0.092 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -0.153 -8.589 -1.813 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.756 -8.081 -1.231 1.00 0.00 H new ATOM 1752 N ILE A 123 -2.188 -12.309 -4.170 1.00 0.00 N ATOM 1753 CA ILE A 123 -2.627 -13.656 -4.511 1.00 0.00 C ATOM 1754 C ILE A 123 -1.524 -14.676 -4.249 1.00 0.00 C ATOM 1755 O ILE A 123 -0.386 -14.500 -4.682 1.00 0.00 O ATOM 1756 CB ILE A 123 -3.058 -13.752 -5.987 1.00 0.00 C ATOM 1757 CG1 ILE A 123 -3.995 -12.595 -6.342 1.00 0.00 C ATOM 1758 CG2 ILE A 123 -3.732 -15.089 -6.256 1.00 0.00 C ATOM 1759 CD1 ILE A 123 -5.348 -12.685 -5.672 1.00 0.00 C ATOM 0 H ILE A 123 -1.566 -11.882 -4.856 1.00 0.00 H new ATOM 0 HA ILE A 123 -3.484 -13.878 -3.875 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.170 -13.683 -6.616 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.521 -11.655 -6.060 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.135 -12.570 -7.423 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.031 -15.142 -7.303 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.036 -15.898 -6.036 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.613 -15.186 -5.622 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.959 -11.833 -5.969 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.843 -13.608 -5.973 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.219 -12.679 -4.590 1.00 0.00 H new ATOM 1771 N SER A 124 -1.870 -15.744 -3.537 1.00 0.00 N ATOM 1772 CA SER A 124 -0.909 -16.792 -3.214 1.00 0.00 C ATOM 1773 C SER A 124 -0.222 -17.306 -4.476 1.00 0.00 C ATOM 1774 O SER A 124 -0.858 -17.479 -5.515 1.00 0.00 O ATOM 1775 CB SER A 124 -1.606 -17.948 -2.493 1.00 0.00 C ATOM 1776 OG SER A 124 -0.938 -19.175 -2.733 1.00 0.00 O ATOM 0 H SER A 124 -2.809 -15.906 -3.173 1.00 0.00 H new ATOM 0 HA SER A 124 -0.152 -16.366 -2.556 1.00 0.00 H new ATOM 0 HB2 SER A 124 -1.634 -17.749 -1.422 1.00 0.00 H new ATOM 0 HB3 SER A 124 -2.640 -18.021 -2.831 1.00 0.00 H new ATOM 0 HG SER A 124 -1.402 -19.898 -2.260 1.00 0.00 H new ATOM 1782 N GLU A 125 1.082 -17.547 -4.376 1.00 0.00 N ATOM 1783 CA GLU A 125 1.856 -18.040 -5.509 1.00 0.00 C ATOM 1784 C GLU A 125 1.109 -19.156 -6.234 1.00 0.00 C ATOM 1785 O GLU A 125 0.714 -19.005 -7.391 1.00 0.00 O ATOM 1786 CB GLU A 125 3.222 -18.546 -5.040 1.00 0.00 C ATOM 1787 CG GLU A 125 4.136 -18.972 -6.177 1.00 0.00 C ATOM 1788 CD GLU A 125 3.925 -20.417 -6.585 1.00 0.00 C ATOM 1789 OE1 GLU A 125 3.014 -20.678 -7.399 1.00 0.00 O ATOM 1790 OE2 GLU A 125 4.671 -21.288 -6.090 1.00 0.00 O ATOM 0 H GLU A 125 1.624 -17.409 -3.523 1.00 0.00 H new ATOM 0 HA GLU A 125 2.002 -17.213 -6.204 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.713 -17.761 -4.465 1.00 0.00 H new ATOM 0 HB3 GLU A 125 3.076 -19.391 -4.367 1.00 0.00 H new ATOM 0 HG2 GLU A 125 3.964 -18.326 -7.038 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.174 -18.831 -5.876 1.00 0.00 H new ATOM 1797 N LYS A 126 0.919 -20.277 -5.547 1.00 0.00 N ATOM 1798 CA LYS A 126 0.220 -21.419 -6.123 1.00 0.00 C ATOM 1799 C LYS A 126 -1.266 -21.118 -6.293 1.00 0.00 C ATOM 1800 O LYS A 126 -1.751 -20.951 -7.411 1.00 0.00 O ATOM 1801 CB LYS A 126 0.403 -22.654 -5.238 1.00 0.00 C ATOM 1802 CG LYS A 126 1.671 -23.434 -5.537 1.00 0.00 C ATOM 1803 CD LYS A 126 1.903 -24.535 -4.516 1.00 0.00 C ATOM 1804 CE LYS A 126 3.337 -25.039 -4.556 1.00 0.00 C ATOM 1805 NZ LYS A 126 3.681 -25.829 -3.341 1.00 0.00 N ATOM 0 H LYS A 126 1.240 -20.419 -4.589 1.00 0.00 H new ATOM 0 HA LYS A 126 0.647 -21.617 -7.106 1.00 0.00 H new ATOM 0 HB2 LYS A 126 0.415 -22.343 -4.193 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -0.457 -23.312 -5.365 1.00 0.00 H new ATOM 0 HG2 LYS A 126 1.605 -23.869 -6.534 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.524 -22.755 -5.542 1.00 0.00 H new ATOM 0 HD2 LYS A 126 1.675 -24.161 -3.518 1.00 0.00 H new ATOM 0 HD3 LYS A 126 1.220 -25.362 -4.710 1.00 0.00 H new ATOM 0 HE2 LYS A 126 3.481 -25.656 -5.443 1.00 0.00 H new ATOM 0 HE3 LYS A 126 4.017 -24.192 -4.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 4.667 -26.155 -3.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 3.569 -25.233 -2.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.048 -26.652 -3.271 1.00 0.00 H new ATOM 1819 N ASN A 127 -1.983 -21.049 -5.176 1.00 0.00 N ATOM 1820 CA ASN A 127 -3.413 -20.766 -5.202 1.00 0.00 C ATOM 1821 C ASN A 127 -3.692 -19.428 -5.879 1.00 0.00 C ATOM 1822 O ASN A 127 -3.066 -18.418 -5.559 1.00 0.00 O ATOM 1823 CB ASN A 127 -3.979 -20.758 -3.780 1.00 0.00 C ATOM 1824 CG ASN A 127 -3.667 -22.037 -3.027 1.00 0.00 C ATOM 1825 OD1 ASN A 127 -2.869 -22.858 -3.479 1.00 0.00 O ATOM 1826 ND2 ASN A 127 -4.298 -22.211 -1.871 1.00 0.00 N ATOM 0 H ASN A 127 -1.597 -21.185 -4.242 1.00 0.00 H new ATOM 0 HA ASN A 127 -3.902 -21.552 -5.777 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -3.569 -19.909 -3.233 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.059 -20.619 -3.822 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -4.129 -23.052 -1.319 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -4.951 -21.503 -1.535 1.00 0.00 H new ATOM 1833 N GLU A 128 -4.635 -19.430 -6.816 1.00 0.00 N ATOM 1834 CA GLU A 128 -4.995 -18.215 -7.538 1.00 0.00 C ATOM 1835 C GLU A 128 -6.250 -17.582 -6.945 1.00 0.00 C ATOM 1836 O GLU A 128 -6.441 -16.368 -7.022 1.00 0.00 O ATOM 1837 CB GLU A 128 -5.219 -18.524 -9.020 1.00 0.00 C ATOM 1838 CG GLU A 128 -5.302 -17.284 -9.894 1.00 0.00 C ATOM 1839 CD GLU A 128 -5.365 -17.616 -11.373 1.00 0.00 C ATOM 1840 OE1 GLU A 128 -6.464 -17.958 -11.858 1.00 0.00 O ATOM 1841 OE2 GLU A 128 -4.315 -17.534 -12.044 1.00 0.00 O ATOM 0 H GLU A 128 -5.163 -20.258 -7.093 1.00 0.00 H new ATOM 0 HA GLU A 128 -4.171 -17.508 -7.441 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -4.407 -19.157 -9.378 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -6.140 -19.097 -9.128 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.184 -16.707 -9.617 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -4.435 -16.651 -9.704 1.00 0.00 H new ATOM 1848 N GLU A 129 -7.103 -18.413 -6.354 1.00 0.00 N ATOM 1849 CA GLU A 129 -8.340 -17.934 -5.749 1.00 0.00 C ATOM 1850 C GLU A 129 -8.211 -17.862 -4.230 1.00 0.00 C ATOM 1851 O GLU A 129 -9.141 -18.208 -3.501 1.00 0.00 O ATOM 1852 CB GLU A 129 -9.507 -18.847 -6.130 1.00 0.00 C ATOM 1853 CG GLU A 129 -9.330 -20.285 -5.672 1.00 0.00 C ATOM 1854 CD GLU A 129 -10.468 -21.183 -6.116 1.00 0.00 C ATOM 1855 OE1 GLU A 129 -11.627 -20.901 -5.746 1.00 0.00 O ATOM 1856 OE2 GLU A 129 -10.199 -22.169 -6.834 1.00 0.00 O ATOM 0 H GLU A 129 -6.960 -19.420 -6.281 1.00 0.00 H new ATOM 0 HA GLU A 129 -8.534 -16.931 -6.128 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -10.425 -18.448 -5.699 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -9.630 -18.832 -7.213 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.391 -20.674 -6.065 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -9.256 -20.310 -4.585 1.00 0.00 H new ATOM 1863 N GLU A 130 -7.051 -17.412 -3.761 1.00 0.00 N ATOM 1864 CA GLU A 130 -6.800 -17.297 -2.329 1.00 0.00 C ATOM 1865 C GLU A 130 -7.013 -15.863 -1.853 1.00 0.00 C ATOM 1866 O GLU A 130 -7.536 -15.630 -0.763 1.00 0.00 O ATOM 1867 CB GLU A 130 -5.376 -17.749 -2.001 1.00 0.00 C ATOM 1868 CG GLU A 130 -4.987 -17.529 -0.548 1.00 0.00 C ATOM 1869 CD GLU A 130 -5.662 -18.509 0.391 1.00 0.00 C ATOM 1870 OE1 GLU A 130 -6.779 -18.206 0.861 1.00 0.00 O ATOM 1871 OE2 GLU A 130 -5.074 -19.578 0.657 1.00 0.00 O ATOM 0 H GLU A 130 -6.271 -17.122 -4.351 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.507 -17.943 -1.809 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -5.276 -18.808 -2.239 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -4.677 -17.211 -2.641 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -3.906 -17.621 -0.447 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -5.249 -16.512 -0.256 1.00 0.00 H new ATOM 1878 N VAL A 131 -6.604 -14.904 -2.678 1.00 0.00 N ATOM 1879 CA VAL A 131 -6.750 -13.493 -2.343 1.00 0.00 C ATOM 1880 C VAL A 131 -6.427 -13.241 -0.875 1.00 0.00 C ATOM 1881 O VAL A 131 -7.179 -12.567 -0.169 1.00 0.00 O ATOM 1882 CB VAL A 131 -8.176 -12.991 -2.637 1.00 0.00 C ATOM 1883 CG1 VAL A 131 -9.198 -13.788 -1.841 1.00 0.00 C ATOM 1884 CG2 VAL A 131 -8.291 -11.505 -2.331 1.00 0.00 C ATOM 0 H VAL A 131 -6.169 -15.079 -3.584 1.00 0.00 H new ATOM 0 HA VAL A 131 -6.044 -12.945 -2.967 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.383 -13.138 -3.697 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -10.199 -13.419 -2.062 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.131 -14.841 -2.114 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.997 -13.676 -0.776 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.305 -11.167 -2.544 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.065 -11.332 -1.279 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -7.586 -10.950 -2.950 1.00 0.00 H new ATOM 1894 N LEU A 132 -5.303 -13.784 -0.421 1.00 0.00 N ATOM 1895 CA LEU A 132 -4.878 -13.617 0.965 1.00 0.00 C ATOM 1896 C LEU A 132 -5.207 -12.216 1.471 1.00 0.00 C ATOM 1897 O LEU A 132 -5.758 -12.051 2.559 1.00 0.00 O ATOM 1898 CB LEU A 132 -3.376 -13.879 1.093 1.00 0.00 C ATOM 1899 CG LEU A 132 -2.932 -15.333 0.935 1.00 0.00 C ATOM 1900 CD1 LEU A 132 -1.427 -15.413 0.738 1.00 0.00 C ATOM 1901 CD2 LEU A 132 -3.358 -16.155 2.143 1.00 0.00 C ATOM 0 H LEU A 132 -4.669 -14.344 -0.992 1.00 0.00 H new ATOM 0 HA LEU A 132 -5.420 -14.339 1.575 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -2.858 -13.279 0.345 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -3.048 -13.524 2.070 1.00 0.00 H new ATOM 0 HG LEU A 132 -3.416 -15.746 0.050 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -1.129 -16.456 0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -1.147 -14.859 -0.158 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -0.923 -14.982 1.603 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -3.034 -17.187 2.013 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -2.903 -15.742 3.043 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -4.443 -16.125 2.239 1.00 0.00 H new ATOM 1913 N VAL A 133 -4.867 -11.209 0.672 1.00 0.00 N ATOM 1914 CA VAL A 133 -5.130 -9.822 1.037 1.00 0.00 C ATOM 1915 C VAL A 133 -5.726 -9.050 -0.134 1.00 0.00 C ATOM 1916 O VAL A 133 -5.306 -9.216 -1.278 1.00 0.00 O ATOM 1917 CB VAL A 133 -3.845 -9.113 1.505 1.00 0.00 C ATOM 1918 CG1 VAL A 133 -4.119 -7.643 1.786 1.00 0.00 C ATOM 1919 CG2 VAL A 133 -3.274 -9.802 2.735 1.00 0.00 C ATOM 0 H VAL A 133 -4.409 -11.328 -0.232 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.846 -9.840 1.858 1.00 0.00 H new ATOM 0 HB VAL A 133 -3.105 -9.174 0.707 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -3.200 -7.158 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.479 -7.160 0.878 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.875 -7.557 2.567 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -2.367 -9.288 3.052 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -4.007 -9.774 3.541 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.038 -10.839 2.495 1.00 0.00 H new ATOM 1929 N GLU A 134 -6.709 -8.204 0.161 1.00 0.00 N ATOM 1930 CA GLU A 134 -7.364 -7.406 -0.868 1.00 0.00 C ATOM 1931 C GLU A 134 -7.311 -5.921 -0.520 1.00 0.00 C ATOM 1932 O GLU A 134 -8.040 -5.451 0.354 1.00 0.00 O ATOM 1933 CB GLU A 134 -8.818 -7.849 -1.041 1.00 0.00 C ATOM 1934 CG GLU A 134 -9.443 -7.390 -2.348 1.00 0.00 C ATOM 1935 CD GLU A 134 -10.820 -7.983 -2.575 1.00 0.00 C ATOM 1936 OE1 GLU A 134 -11.652 -7.924 -1.645 1.00 0.00 O ATOM 1937 OE2 GLU A 134 -11.067 -8.505 -3.682 1.00 0.00 O ATOM 0 H GLU A 134 -7.068 -8.054 1.104 1.00 0.00 H new ATOM 0 HA GLU A 134 -6.831 -7.561 -1.806 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -8.866 -8.937 -0.987 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -9.408 -7.462 -0.210 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -9.515 -6.302 -2.350 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -8.791 -7.668 -3.176 1.00 0.00 H new ATOM 1944 N CYS A 135 -6.444 -5.188 -1.210 1.00 0.00 N ATOM 1945 CA CYS A 135 -6.294 -3.756 -0.974 1.00 0.00 C ATOM 1946 C CYS A 135 -6.508 -2.968 -2.262 1.00 0.00 C ATOM 1947 O CYS A 135 -6.266 -3.473 -3.358 1.00 0.00 O ATOM 1948 CB CYS A 135 -4.909 -3.455 -0.402 1.00 0.00 C ATOM 1949 SG CYS A 135 -4.670 -1.730 0.085 1.00 0.00 S ATOM 0 H CYS A 135 -5.834 -5.562 -1.937 1.00 0.00 H new ATOM 0 HA CYS A 135 -7.051 -3.450 -0.252 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -4.739 -4.093 0.465 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -4.156 -3.719 -1.144 1.00 0.00 H new ATOM 0 HG CYS A 135 -4.900 -1.603 1.358 1.00 0.00 H new ATOM 1955 N ARG A 136 -6.965 -1.728 -2.121 1.00 0.00 N ATOM 1956 CA ARG A 136 -7.215 -0.870 -3.273 1.00 0.00 C ATOM 1957 C ARG A 136 -6.510 0.474 -3.114 1.00 0.00 C ATOM 1958 O ARG A 136 -6.653 1.144 -2.092 1.00 0.00 O ATOM 1959 CB ARG A 136 -8.718 -0.651 -3.457 1.00 0.00 C ATOM 1960 CG ARG A 136 -9.533 -1.932 -3.384 1.00 0.00 C ATOM 1961 CD ARG A 136 -10.968 -1.705 -3.835 1.00 0.00 C ATOM 1962 NE ARG A 136 -11.048 -1.349 -5.249 1.00 0.00 N ATOM 1963 CZ ARG A 136 -12.143 -1.503 -5.985 1.00 0.00 C ATOM 1964 NH1 ARG A 136 -13.245 -2.004 -5.443 1.00 0.00 N ATOM 1965 NH2 ARG A 136 -12.138 -1.156 -7.266 1.00 0.00 N ATOM 0 H ARG A 136 -7.170 -1.295 -1.220 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.816 -1.367 -4.157 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -9.072 0.039 -2.692 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.892 -0.174 -4.422 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.070 -2.695 -4.009 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.527 -2.311 -2.362 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.552 -2.608 -3.655 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -11.415 -0.912 -3.236 1.00 0.00 H new ATOM 0 HE ARG A 136 -10.217 -0.961 -5.696 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -13.253 -2.272 -4.459 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -14.085 -2.121 -6.010 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -11.293 -0.770 -7.687 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -12.980 -1.275 -7.830 1.00 0.00 H new ATOM 1979 N VAL A 137 -5.748 0.861 -4.132 1.00 0.00 N ATOM 1980 CA VAL A 137 -5.021 2.124 -4.105 1.00 0.00 C ATOM 1981 C VAL A 137 -5.840 3.215 -3.424 1.00 0.00 C ATOM 1982 O VAL A 137 -5.334 3.941 -2.567 1.00 0.00 O ATOM 1983 CB VAL A 137 -4.650 2.589 -5.527 1.00 0.00 C ATOM 1984 CG1 VAL A 137 -3.957 3.942 -5.483 1.00 0.00 C ATOM 1985 CG2 VAL A 137 -3.773 1.553 -6.213 1.00 0.00 C ATOM 0 H VAL A 137 -5.618 0.318 -4.986 1.00 0.00 H new ATOM 0 HA VAL A 137 -4.107 1.951 -3.537 1.00 0.00 H new ATOM 0 HB VAL A 137 -5.567 2.697 -6.107 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.703 4.254 -6.496 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -4.624 4.678 -5.033 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -3.047 3.866 -4.888 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -3.520 1.897 -7.216 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -2.859 1.411 -5.637 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -4.311 0.607 -6.279 1.00 0.00 H new ATOM 1995 N ARG A 138 -7.107 3.325 -3.809 1.00 0.00 N ATOM 1996 CA ARG A 138 -7.996 4.328 -3.236 1.00 0.00 C ATOM 1997 C ARG A 138 -7.968 4.270 -1.711 1.00 0.00 C ATOM 1998 O ARG A 138 -7.919 5.303 -1.042 1.00 0.00 O ATOM 1999 CB ARG A 138 -9.425 4.120 -3.739 1.00 0.00 C ATOM 2000 CG ARG A 138 -9.678 4.712 -5.116 1.00 0.00 C ATOM 2001 CD ARG A 138 -10.729 3.919 -5.878 1.00 0.00 C ATOM 2002 NE ARG A 138 -11.479 4.758 -6.809 1.00 0.00 N ATOM 2003 CZ ARG A 138 -12.402 5.634 -6.428 1.00 0.00 C ATOM 2004 NH1 ARG A 138 -12.687 5.785 -5.142 1.00 0.00 N ATOM 2005 NH2 ARG A 138 -13.042 6.362 -7.334 1.00 0.00 N ATOM 0 H ARG A 138 -7.541 2.731 -4.516 1.00 0.00 H new ATOM 0 HA ARG A 138 -7.647 5.311 -3.552 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -9.639 3.052 -3.767 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -10.120 4.566 -3.028 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -10.004 5.747 -5.014 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.748 4.726 -5.684 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.246 3.111 -6.427 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -11.418 3.457 -5.171 1.00 0.00 H new ATOM 0 HE ARG A 138 -11.283 4.666 -7.806 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -12.197 5.228 -4.442 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -13.396 6.458 -4.852 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -12.825 6.249 -8.324 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -13.751 7.034 -7.040 1.00 0.00 H new ATOM 2019 N PHE A 139 -8.001 3.058 -1.169 1.00 0.00 N ATOM 2020 CA PHE A 139 -7.981 2.866 0.276 1.00 0.00 C ATOM 2021 C PHE A 139 -6.586 3.119 0.840 1.00 0.00 C ATOM 2022 O PHE A 139 -6.435 3.596 1.966 1.00 0.00 O ATOM 2023 CB PHE A 139 -8.436 1.448 0.630 1.00 0.00 C ATOM 2024 CG PHE A 139 -9.928 1.281 0.633 1.00 0.00 C ATOM 2025 CD1 PHE A 139 -10.724 2.054 1.463 1.00 0.00 C ATOM 2026 CD2 PHE A 139 -10.536 0.351 -0.195 1.00 0.00 C ATOM 2027 CE1 PHE A 139 -12.097 1.902 1.468 1.00 0.00 C ATOM 2028 CE2 PHE A 139 -11.910 0.194 -0.194 1.00 0.00 C ATOM 2029 CZ PHE A 139 -12.691 0.971 0.638 1.00 0.00 C ATOM 0 H PHE A 139 -8.042 2.193 -1.709 1.00 0.00 H new ATOM 0 HA PHE A 139 -8.670 3.584 0.722 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -8.001 0.747 -0.083 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -8.047 1.185 1.614 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -10.266 2.784 2.114 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -9.930 -0.258 -0.849 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.706 2.511 2.120 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -12.371 -0.535 -0.843 1.00 0.00 H new ATOM 0 HZ PHE A 139 -13.764 0.851 0.640 1.00 0.00 H new ATOM 2039 N LEU A 140 -5.568 2.797 0.050 1.00 0.00 N ATOM 2040 CA LEU A 140 -4.183 2.989 0.468 1.00 0.00 C ATOM 2041 C LEU A 140 -4.005 4.338 1.157 1.00 0.00 C ATOM 2042 O LEU A 140 -4.538 5.352 0.706 1.00 0.00 O ATOM 2043 CB LEU A 140 -3.247 2.892 -0.737 1.00 0.00 C ATOM 2044 CG LEU A 140 -1.801 2.500 -0.434 1.00 0.00 C ATOM 2045 CD1 LEU A 140 -1.197 1.738 -1.603 1.00 0.00 C ATOM 2046 CD2 LEU A 140 -0.970 3.733 -0.113 1.00 0.00 C ATOM 0 H LEU A 140 -5.675 2.402 -0.884 1.00 0.00 H new ATOM 0 HA LEU A 140 -3.932 2.202 1.179 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -3.661 2.165 -1.435 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -3.242 3.856 -1.246 1.00 0.00 H new ATOM 0 HG LEU A 140 -1.798 1.847 0.439 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -0.167 1.468 -1.368 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -1.777 0.833 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.213 2.366 -2.494 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.056 3.435 0.100 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.981 4.411 -0.966 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -1.389 4.238 0.757 1.00 0.00 H new ATOM 2058 N SER A 141 -3.251 4.343 2.252 1.00 0.00 N ATOM 2059 CA SER A 141 -3.004 5.567 3.004 1.00 0.00 C ATOM 2060 C SER A 141 -1.562 6.033 2.825 1.00 0.00 C ATOM 2061 O SER A 141 -1.298 7.224 2.660 1.00 0.00 O ATOM 2062 CB SER A 141 -3.300 5.347 4.489 1.00 0.00 C ATOM 2063 OG SER A 141 -2.477 4.327 5.028 1.00 0.00 O ATOM 0 H SER A 141 -2.801 3.513 2.638 1.00 0.00 H new ATOM 0 HA SER A 141 -3.668 6.341 2.619 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.139 6.276 5.036 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.349 5.079 4.618 1.00 0.00 H new ATOM 0 HG SER A 141 -2.004 3.870 4.301 1.00 0.00 H new ATOM 2069 N PHE A 142 -0.632 5.084 2.860 1.00 0.00 N ATOM 2070 CA PHE A 142 0.784 5.395 2.703 1.00 0.00 C ATOM 2071 C PHE A 142 1.551 4.187 2.174 1.00 0.00 C ATOM 2072 O PHE A 142 1.049 3.064 2.191 1.00 0.00 O ATOM 2073 CB PHE A 142 1.380 5.847 4.038 1.00 0.00 C ATOM 2074 CG PHE A 142 2.876 5.725 4.099 1.00 0.00 C ATOM 2075 CD1 PHE A 142 3.687 6.735 3.607 1.00 0.00 C ATOM 2076 CD2 PHE A 142 3.470 4.600 4.648 1.00 0.00 C ATOM 2077 CE1 PHE A 142 5.064 6.624 3.661 1.00 0.00 C ATOM 2078 CE2 PHE A 142 4.846 4.484 4.705 1.00 0.00 C ATOM 2079 CZ PHE A 142 5.644 5.498 4.212 1.00 0.00 C ATOM 0 H PHE A 142 -0.834 4.093 2.996 1.00 0.00 H new ATOM 0 HA PHE A 142 0.874 6.206 1.980 1.00 0.00 H new ATOM 0 HB2 PHE A 142 1.101 6.885 4.219 1.00 0.00 H new ATOM 0 HB3 PHE A 142 0.942 5.255 4.841 1.00 0.00 H new ATOM 0 HD1 PHE A 142 3.239 7.618 3.177 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.851 3.805 5.036 1.00 0.00 H new ATOM 0 HE1 PHE A 142 5.686 7.417 3.273 1.00 0.00 H new ATOM 0 HE2 PHE A 142 5.297 3.602 5.135 1.00 0.00 H new ATOM 0 HZ PHE A 142 6.720 5.411 4.257 1.00 0.00 H new ATOM 2089 N MET A 143 2.771 4.427 1.703 1.00 0.00 N ATOM 2090 CA MET A 143 3.608 3.359 1.169 1.00 0.00 C ATOM 2091 C MET A 143 5.078 3.764 1.179 1.00 0.00 C ATOM 2092 O MET A 143 5.407 4.947 1.099 1.00 0.00 O ATOM 2093 CB MET A 143 3.174 3.005 -0.254 1.00 0.00 C ATOM 2094 CG MET A 143 3.282 4.167 -1.229 1.00 0.00 C ATOM 2095 SD MET A 143 3.543 3.625 -2.929 1.00 0.00 S ATOM 2096 CE MET A 143 1.863 3.638 -3.550 1.00 0.00 C ATOM 0 H MET A 143 3.201 5.351 1.680 1.00 0.00 H new ATOM 0 HA MET A 143 3.487 2.483 1.806 1.00 0.00 H new ATOM 0 HB2 MET A 143 3.786 2.179 -0.617 1.00 0.00 H new ATOM 0 HB3 MET A 143 2.143 2.653 -0.234 1.00 0.00 H new ATOM 0 HG2 MET A 143 2.372 4.765 -1.178 1.00 0.00 H new ATOM 0 HG3 MET A 143 4.106 4.814 -0.927 1.00 0.00 H new ATOM 0 HE1 MET A 143 1.813 3.067 -4.477 1.00 0.00 H new ATOM 0 HE2 MET A 143 1.199 3.189 -2.812 1.00 0.00 H new ATOM 0 HE3 MET A 143 1.553 4.666 -3.739 1.00 0.00 H new ATOM 2106 N GLY A 144 5.960 2.774 1.279 1.00 0.00 N ATOM 2107 CA GLY A 144 7.385 3.049 1.298 1.00 0.00 C ATOM 2108 C GLY A 144 8.218 1.785 1.388 1.00 0.00 C ATOM 2109 O GLY A 144 7.763 0.705 1.012 1.00 0.00 O ATOM 0 H GLY A 144 5.713 1.787 1.347 1.00 0.00 H new ATOM 0 HA2 GLY A 144 7.658 3.597 0.396 1.00 0.00 H new ATOM 0 HA3 GLY A 144 7.616 3.694 2.146 1.00 0.00 H new ATOM 2113 N VAL A 145 9.443 1.920 1.886 1.00 0.00 N ATOM 2114 CA VAL A 145 10.342 0.780 2.023 1.00 0.00 C ATOM 2115 C VAL A 145 11.094 0.830 3.349 1.00 0.00 C ATOM 2116 O VAL A 145 11.276 1.898 3.931 1.00 0.00 O ATOM 2117 CB VAL A 145 11.360 0.727 0.869 1.00 0.00 C ATOM 2118 CG1 VAL A 145 10.649 0.781 -0.474 1.00 0.00 C ATOM 2119 CG2 VAL A 145 12.367 1.860 0.995 1.00 0.00 C ATOM 0 H VAL A 145 9.836 2.807 2.201 1.00 0.00 H new ATOM 0 HA VAL A 145 9.724 -0.117 1.993 1.00 0.00 H new ATOM 0 HB VAL A 145 11.901 -0.217 0.928 1.00 0.00 H new ATOM 0 HG11 VAL A 145 11.385 0.742 -1.277 1.00 0.00 H new ATOM 0 HG12 VAL A 145 9.972 -0.068 -0.561 1.00 0.00 H new ATOM 0 HG13 VAL A 145 10.080 1.708 -0.547 1.00 0.00 H new ATOM 0 HG21 VAL A 145 13.079 1.807 0.171 1.00 0.00 H new ATOM 0 HG22 VAL A 145 11.845 2.816 0.963 1.00 0.00 H new ATOM 0 HG23 VAL A 145 12.900 1.770 1.942 1.00 0.00 H new ATOM 2129 N GLY A 146 11.530 -0.334 3.820 1.00 0.00 N ATOM 2130 CA GLY A 146 12.258 -0.402 5.073 1.00 0.00 C ATOM 2131 C GLY A 146 13.741 -0.142 4.897 1.00 0.00 C ATOM 2132 O GLY A 146 14.207 0.116 3.786 1.00 0.00 O ATOM 0 H GLY A 146 11.392 -1.232 3.356 1.00 0.00 H new ATOM 0 HA2 GLY A 146 11.845 0.327 5.770 1.00 0.00 H new ATOM 0 HA3 GLY A 146 12.115 -1.386 5.520 1.00 0.00 H new ATOM 2136 N LYS A 147 14.487 -0.208 5.995 1.00 0.00 N ATOM 2137 CA LYS A 147 15.926 0.022 5.958 1.00 0.00 C ATOM 2138 C LYS A 147 16.530 -0.515 4.665 1.00 0.00 C ATOM 2139 O LYS A 147 17.370 0.136 4.043 1.00 0.00 O ATOM 2140 CB LYS A 147 16.600 -0.640 7.162 1.00 0.00 C ATOM 2141 CG LYS A 147 16.257 0.016 8.488 1.00 0.00 C ATOM 2142 CD LYS A 147 16.460 -0.939 9.652 1.00 0.00 C ATOM 2143 CE LYS A 147 15.333 -1.957 9.741 1.00 0.00 C ATOM 2144 NZ LYS A 147 14.058 -1.334 10.192 1.00 0.00 N ATOM 0 H LYS A 147 14.118 -0.419 6.922 1.00 0.00 H new ATOM 0 HA LYS A 147 16.098 1.098 5.999 1.00 0.00 H new ATOM 0 HB2 LYS A 147 16.308 -1.690 7.199 1.00 0.00 H new ATOM 0 HB3 LYS A 147 17.681 -0.614 7.022 1.00 0.00 H new ATOM 0 HG2 LYS A 147 16.879 0.900 8.629 1.00 0.00 H new ATOM 0 HG3 LYS A 147 15.221 0.354 8.470 1.00 0.00 H new ATOM 0 HD2 LYS A 147 17.412 -1.458 9.537 1.00 0.00 H new ATOM 0 HD3 LYS A 147 16.515 -0.374 10.582 1.00 0.00 H new ATOM 0 HE2 LYS A 147 15.185 -2.422 8.766 1.00 0.00 H new ATOM 0 HE3 LYS A 147 15.614 -2.751 10.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 13.257 -1.919 9.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 14.053 -1.265 11.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 13.972 -0.382 9.782 1.00 0.00 H new ATOM 2158 N ASP A 148 16.097 -1.705 4.264 1.00 0.00 N ATOM 2159 CA ASP A 148 16.593 -2.329 3.043 1.00 0.00 C ATOM 2160 C ASP A 148 15.533 -2.295 1.946 1.00 0.00 C ATOM 2161 O ASP A 148 14.432 -2.817 2.117 1.00 0.00 O ATOM 2162 CB ASP A 148 17.015 -3.773 3.318 1.00 0.00 C ATOM 2163 CG ASP A 148 18.470 -3.883 3.729 1.00 0.00 C ATOM 2164 OD1 ASP A 148 19.338 -3.397 2.974 1.00 0.00 O ATOM 2165 OD2 ASP A 148 18.742 -4.456 4.805 1.00 0.00 O ATOM 0 H ASP A 148 15.403 -2.257 4.767 1.00 0.00 H new ATOM 0 HA ASP A 148 17.461 -1.764 2.702 1.00 0.00 H new ATOM 0 HB2 ASP A 148 16.386 -4.189 4.105 1.00 0.00 H new ATOM 0 HB3 ASP A 148 16.847 -4.374 2.424 1.00 0.00 H new ATOM 2170 N VAL A 149 15.874 -1.677 0.820 1.00 0.00 N ATOM 2171 CA VAL A 149 14.952 -1.575 -0.305 1.00 0.00 C ATOM 2172 C VAL A 149 14.250 -2.903 -0.562 1.00 0.00 C ATOM 2173 O VAL A 149 13.137 -2.938 -1.088 1.00 0.00 O ATOM 2174 CB VAL A 149 15.680 -1.134 -1.589 1.00 0.00 C ATOM 2175 CG1 VAL A 149 16.371 0.205 -1.379 1.00 0.00 C ATOM 2176 CG2 VAL A 149 16.679 -2.196 -2.025 1.00 0.00 C ATOM 0 H VAL A 149 16.782 -1.239 0.662 1.00 0.00 H new ATOM 0 HA VAL A 149 14.211 -0.821 -0.040 1.00 0.00 H new ATOM 0 HB VAL A 149 14.942 -1.014 -2.382 1.00 0.00 H new ATOM 0 HG11 VAL A 149 16.880 0.500 -2.297 1.00 0.00 H new ATOM 0 HG12 VAL A 149 15.630 0.960 -1.116 1.00 0.00 H new ATOM 0 HG13 VAL A 149 17.099 0.116 -0.573 1.00 0.00 H new ATOM 0 HG21 VAL A 149 17.185 -1.869 -2.933 1.00 0.00 H new ATOM 0 HG22 VAL A 149 17.415 -2.350 -1.235 1.00 0.00 H new ATOM 0 HG23 VAL A 149 16.154 -3.131 -2.219 1.00 0.00 H new ATOM 2186 N HIS A 150 14.907 -3.996 -0.188 1.00 0.00 N ATOM 2187 CA HIS A 150 14.345 -5.329 -0.377 1.00 0.00 C ATOM 2188 C HIS A 150 12.957 -5.427 0.249 1.00 0.00 C ATOM 2189 O HIS A 150 12.042 -6.012 -0.332 1.00 0.00 O ATOM 2190 CB HIS A 150 15.268 -6.385 0.232 1.00 0.00 C ATOM 2191 CG HIS A 150 16.543 -6.577 -0.529 1.00 0.00 C ATOM 2192 ND1 HIS A 150 16.868 -7.458 -1.505 1.00 0.00 N flip ATOM 2193 CD2 HIS A 150 17.669 -5.810 -0.318 1.00 0.00 C flip ATOM 2194 CE1 HIS A 150 18.170 -7.208 -1.862 1.00 0.00 C flip ATOM 2195 NE2 HIS A 150 18.630 -6.209 -1.131 1.00 0.00 N flip ATOM 0 H HIS A 150 15.829 -3.985 0.248 1.00 0.00 H new ATOM 0 HA HIS A 150 14.255 -5.510 -1.448 1.00 0.00 H new ATOM 0 HB2 HIS A 150 15.506 -6.100 1.257 1.00 0.00 H new ATOM 0 HB3 HIS A 150 14.737 -7.336 0.280 1.00 0.00 H new ATOM 0 HD1 HIS A 150 16.259 -8.174 -1.901 1.00 0.00 H new ATOM 0 HD2 HIS A 150 17.752 -5.008 0.400 1.00 0.00 H new ATOM 0 HE1 HIS A 150 18.727 -7.742 -2.618 1.00 0.00 H new ATOM 2204 N THR A 151 12.807 -4.851 1.437 1.00 0.00 N ATOM 2205 CA THR A 151 11.532 -4.875 2.142 1.00 0.00 C ATOM 2206 C THR A 151 10.625 -3.741 1.677 1.00 0.00 C ATOM 2207 O THR A 151 11.006 -2.571 1.718 1.00 0.00 O ATOM 2208 CB THR A 151 11.730 -4.766 3.666 1.00 0.00 C ATOM 2209 OG1 THR A 151 12.424 -3.554 3.984 1.00 0.00 O ATOM 2210 CG2 THR A 151 12.513 -5.958 4.196 1.00 0.00 C ATOM 0 H THR A 151 13.553 -4.362 1.931 1.00 0.00 H new ATOM 0 HA THR A 151 11.062 -5.831 1.911 1.00 0.00 H new ATOM 0 HB THR A 151 10.748 -4.757 4.139 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.029 -3.321 3.249 1.00 0.00 H new ATOM 0 HG21 THR A 151 12.641 -5.859 5.274 1.00 0.00 H new ATOM 0 HG22 THR A 151 11.969 -6.877 3.978 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.491 -5.993 3.717 1.00 0.00 H new ATOM 2218 N PHE A 152 9.422 -4.095 1.236 1.00 0.00 N ATOM 2219 CA PHE A 152 8.461 -3.106 0.763 1.00 0.00 C ATOM 2220 C PHE A 152 7.110 -3.290 1.448 1.00 0.00 C ATOM 2221 O PHE A 152 6.459 -4.323 1.294 1.00 0.00 O ATOM 2222 CB PHE A 152 8.294 -3.211 -0.755 1.00 0.00 C ATOM 2223 CG PHE A 152 7.046 -2.551 -1.268 1.00 0.00 C ATOM 2224 CD1 PHE A 152 6.927 -1.171 -1.267 1.00 0.00 C ATOM 2225 CD2 PHE A 152 5.993 -3.310 -1.752 1.00 0.00 C ATOM 2226 CE1 PHE A 152 5.779 -0.561 -1.738 1.00 0.00 C ATOM 2227 CE2 PHE A 152 4.844 -2.706 -2.224 1.00 0.00 C ATOM 2228 CZ PHE A 152 4.737 -1.329 -2.218 1.00 0.00 C ATOM 0 H PHE A 152 9.090 -5.059 1.196 1.00 0.00 H new ATOM 0 HA PHE A 152 8.844 -2.116 1.012 1.00 0.00 H new ATOM 0 HB2 PHE A 152 9.160 -2.760 -1.240 1.00 0.00 H new ATOM 0 HB3 PHE A 152 8.282 -4.263 -1.039 1.00 0.00 H new ATOM 0 HD1 PHE A 152 7.740 -0.565 -0.894 1.00 0.00 H new ATOM 0 HD2 PHE A 152 6.071 -4.387 -1.760 1.00 0.00 H new ATOM 0 HE1 PHE A 152 5.697 0.516 -1.730 1.00 0.00 H new ATOM 0 HE2 PHE A 152 4.030 -3.310 -2.597 1.00 0.00 H new ATOM 0 HZ PHE A 152 3.840 -0.854 -2.588 1.00 0.00 H new ATOM 2238 N ALA A 153 6.695 -2.280 2.206 1.00 0.00 N ATOM 2239 CA ALA A 153 5.422 -2.329 2.914 1.00 0.00 C ATOM 2240 C ALA A 153 4.530 -1.156 2.520 1.00 0.00 C ATOM 2241 O ALA A 153 4.989 -0.193 1.906 1.00 0.00 O ATOM 2242 CB ALA A 153 5.655 -2.336 4.418 1.00 0.00 C ATOM 0 H ALA A 153 7.222 -1.418 2.345 1.00 0.00 H new ATOM 0 HA ALA A 153 4.912 -3.250 2.632 1.00 0.00 H new ATOM 0 HB1 ALA A 153 4.696 -2.373 4.935 1.00 0.00 H new ATOM 0 HB2 ALA A 153 6.248 -3.209 4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 153 6.189 -1.431 4.708 1.00 0.00 H new ATOM 2248 N PHE A 154 3.253 -1.245 2.877 1.00 0.00 N ATOM 2249 CA PHE A 154 2.295 -0.191 2.560 1.00 0.00 C ATOM 2250 C PHE A 154 1.178 -0.142 3.597 1.00 0.00 C ATOM 2251 O PHE A 154 0.661 -1.177 4.019 1.00 0.00 O ATOM 2252 CB PHE A 154 1.704 -0.414 1.166 1.00 0.00 C ATOM 2253 CG PHE A 154 1.004 -1.735 1.016 1.00 0.00 C ATOM 2254 CD1 PHE A 154 -0.249 -1.936 1.571 1.00 0.00 C ATOM 2255 CD2 PHE A 154 1.599 -2.774 0.320 1.00 0.00 C ATOM 2256 CE1 PHE A 154 -0.896 -3.150 1.435 1.00 0.00 C ATOM 2257 CE2 PHE A 154 0.957 -3.990 0.180 1.00 0.00 C ATOM 2258 CZ PHE A 154 -0.292 -4.179 0.739 1.00 0.00 C ATOM 0 H PHE A 154 2.857 -2.036 3.386 1.00 0.00 H new ATOM 0 HA PHE A 154 2.822 0.763 2.575 1.00 0.00 H new ATOM 0 HB2 PHE A 154 1.000 0.388 0.946 1.00 0.00 H new ATOM 0 HB3 PHE A 154 2.502 -0.349 0.427 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -0.726 -1.135 2.116 1.00 0.00 H new ATOM 0 HD2 PHE A 154 2.576 -2.632 -0.118 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -1.873 -3.294 1.873 1.00 0.00 H new ATOM 0 HE2 PHE A 154 1.432 -4.792 -0.366 1.00 0.00 H new ATOM 0 HZ PHE A 154 -0.795 -5.129 0.632 1.00 0.00 H new ATOM 2268 N ILE A 155 0.810 1.069 4.004 1.00 0.00 N ATOM 2269 CA ILE A 155 -0.246 1.254 4.991 1.00 0.00 C ATOM 2270 C ILE A 155 -1.584 1.539 4.318 1.00 0.00 C ATOM 2271 O ILE A 155 -1.703 2.469 3.521 1.00 0.00 O ATOM 2272 CB ILE A 155 0.084 2.405 5.960 1.00 0.00 C ATOM 2273 CG1 ILE A 155 1.407 2.132 6.678 1.00 0.00 C ATOM 2274 CG2 ILE A 155 -1.042 2.591 6.966 1.00 0.00 C ATOM 2275 CD1 ILE A 155 1.955 3.335 7.414 1.00 0.00 C ATOM 0 H ILE A 155 1.228 1.936 3.665 1.00 0.00 H new ATOM 0 HA ILE A 155 -0.317 0.324 5.555 1.00 0.00 H new ATOM 0 HB ILE A 155 0.187 3.326 5.385 1.00 0.00 H new ATOM 0 HG12 ILE A 155 1.265 1.316 7.387 1.00 0.00 H new ATOM 0 HG13 ILE A 155 2.144 1.796 5.949 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -0.793 3.408 7.643 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -1.966 2.826 6.438 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -1.174 1.673 7.538 1.00 0.00 H new ATOM 0 HD11 ILE A 155 2.894 3.068 7.899 1.00 0.00 H new ATOM 0 HD12 ILE A 155 2.130 4.146 6.707 1.00 0.00 H new ATOM 0 HD13 ILE A 155 1.237 3.659 8.167 1.00 0.00 H new ATOM 2287 N MET A 156 -2.589 0.734 4.646 1.00 0.00 N ATOM 2288 CA MET A 156 -3.920 0.903 4.075 1.00 0.00 C ATOM 2289 C MET A 156 -4.960 1.111 5.172 1.00 0.00 C ATOM 2290 O MET A 156 -4.686 0.885 6.350 1.00 0.00 O ATOM 2291 CB MET A 156 -4.293 -0.315 3.227 1.00 0.00 C ATOM 2292 CG MET A 156 -4.536 -1.573 4.045 1.00 0.00 C ATOM 2293 SD MET A 156 -4.710 -3.046 3.019 1.00 0.00 S ATOM 2294 CE MET A 156 -6.477 -3.322 3.120 1.00 0.00 C ATOM 0 H MET A 156 -2.507 -0.041 5.304 1.00 0.00 H new ATOM 0 HA MET A 156 -3.906 1.789 3.440 1.00 0.00 H new ATOM 0 HB2 MET A 156 -5.190 -0.086 2.652 1.00 0.00 H new ATOM 0 HB3 MET A 156 -3.495 -0.506 2.510 1.00 0.00 H new ATOM 0 HG2 MET A 156 -3.709 -1.715 4.740 1.00 0.00 H new ATOM 0 HG3 MET A 156 -5.437 -1.444 4.644 1.00 0.00 H new ATOM 0 HE1 MET A 156 -6.801 -3.920 2.268 1.00 0.00 H new ATOM 0 HE2 MET A 156 -6.710 -3.850 4.044 1.00 0.00 H new ATOM 0 HE3 MET A 156 -6.996 -2.364 3.109 1.00 0.00 H new ATOM 2304 N ASP A 157 -6.153 1.542 4.776 1.00 0.00 N ATOM 2305 CA ASP A 157 -7.234 1.779 5.725 1.00 0.00 C ATOM 2306 C ASP A 157 -8.304 0.698 5.612 1.00 0.00 C ATOM 2307 O ASP A 157 -8.968 0.571 4.583 1.00 0.00 O ATOM 2308 CB ASP A 157 -7.856 3.156 5.489 1.00 0.00 C ATOM 2309 CG ASP A 157 -9.222 3.293 6.132 1.00 0.00 C ATOM 2310 OD1 ASP A 157 -10.213 2.845 5.518 1.00 0.00 O ATOM 2311 OD2 ASP A 157 -9.300 3.849 7.247 1.00 0.00 O ATOM 0 H ASP A 157 -6.395 1.734 3.804 1.00 0.00 H new ATOM 0 HA ASP A 157 -6.815 1.746 6.731 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -7.192 3.924 5.886 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -7.943 3.333 4.417 1.00 0.00 H new ATOM 2316 N THR A 158 -8.465 -0.081 6.677 1.00 0.00 N ATOM 2317 CA THR A 158 -9.452 -1.153 6.697 1.00 0.00 C ATOM 2318 C THR A 158 -10.793 -0.656 7.227 1.00 0.00 C ATOM 2319 O THR A 158 -11.835 -0.880 6.613 1.00 0.00 O ATOM 2320 CB THR A 158 -8.979 -2.337 7.562 1.00 0.00 C ATOM 2321 OG1 THR A 158 -8.753 -1.902 8.907 1.00 0.00 O ATOM 2322 CG2 THR A 158 -7.702 -2.942 6.998 1.00 0.00 C ATOM 0 H THR A 158 -7.924 0.011 7.537 1.00 0.00 H new ATOM 0 HA THR A 158 -9.573 -1.490 5.667 1.00 0.00 H new ATOM 0 HB THR A 158 -9.758 -3.099 7.554 1.00 0.00 H new ATOM 0 HG1 THR A 158 -8.454 -2.661 9.450 1.00 0.00 H new ATOM 0 HG21 THR A 158 -7.387 -3.776 7.625 1.00 0.00 H new ATOM 0 HG22 THR A 158 -7.885 -3.299 5.984 1.00 0.00 H new ATOM 0 HG23 THR A 158 -6.918 -2.185 6.980 1.00 0.00 H new ATOM 2368 N ARG A 162 -8.896 3.201 11.154 1.00 0.00 N ATOM 2369 CA ARG A 162 -7.923 2.134 11.357 1.00 0.00 C ATOM 2370 C ARG A 162 -6.982 2.023 10.161 1.00 0.00 C ATOM 2371 O ARG A 162 -7.397 2.183 9.013 1.00 0.00 O ATOM 2372 CB ARG A 162 -8.637 0.800 11.584 1.00 0.00 C ATOM 2373 CG ARG A 162 -9.029 0.558 13.032 1.00 0.00 C ATOM 2374 CD ARG A 162 -7.888 -0.068 13.820 1.00 0.00 C ATOM 2375 NE ARG A 162 -8.007 0.191 15.253 1.00 0.00 N ATOM 2376 CZ ARG A 162 -7.297 -0.448 16.176 1.00 0.00 C ATOM 2377 NH1 ARG A 162 -6.422 -1.378 15.818 1.00 0.00 N ATOM 2378 NH2 ARG A 162 -7.461 -0.157 17.460 1.00 0.00 N ATOM 0 HA ARG A 162 -7.333 2.377 12.241 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -9.533 0.767 10.964 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -7.989 -0.011 11.252 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -9.318 1.502 13.495 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -9.901 -0.095 13.070 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -7.874 -1.144 13.646 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -6.938 0.326 13.458 1.00 0.00 H new ATOM 0 HE ARG A 162 -8.671 0.901 15.561 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -6.293 -1.604 14.832 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -5.878 -1.867 16.529 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -8.133 0.558 17.739 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -6.915 -0.648 18.168 1.00 0.00 H new ATOM 2392 N PHE A 163 -5.712 1.748 10.439 1.00 0.00 N ATOM 2393 CA PHE A 163 -4.711 1.616 9.387 1.00 0.00 C ATOM 2394 C PHE A 163 -3.840 0.384 9.615 1.00 0.00 C ATOM 2395 O PHE A 163 -3.228 0.231 10.671 1.00 0.00 O ATOM 2396 CB PHE A 163 -3.834 2.869 9.328 1.00 0.00 C ATOM 2397 CG PHE A 163 -4.592 4.142 9.575 1.00 0.00 C ATOM 2398 CD1 PHE A 163 -5.740 4.432 8.857 1.00 0.00 C ATOM 2399 CD2 PHE A 163 -4.155 5.050 10.527 1.00 0.00 C ATOM 2400 CE1 PHE A 163 -6.440 5.602 9.083 1.00 0.00 C ATOM 2401 CE2 PHE A 163 -4.850 6.222 10.757 1.00 0.00 C ATOM 2402 CZ PHE A 163 -5.993 6.499 10.034 1.00 0.00 C ATOM 0 H PHE A 163 -5.352 1.612 11.384 1.00 0.00 H new ATOM 0 HA PHE A 163 -5.233 1.500 8.437 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -3.037 2.781 10.067 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -3.357 2.923 8.349 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -6.093 3.735 8.111 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -3.261 4.839 11.095 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -7.335 5.815 8.517 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -4.499 6.921 11.502 1.00 0.00 H new ATOM 0 HZ PHE A 163 -6.537 7.415 10.211 1.00 0.00 H new ATOM 2412 N GLU A 164 -3.792 -0.493 8.617 1.00 0.00 N ATOM 2413 CA GLU A 164 -2.999 -1.713 8.709 1.00 0.00 C ATOM 2414 C GLU A 164 -1.762 -1.626 7.819 1.00 0.00 C ATOM 2415 O GLU A 164 -1.795 -1.014 6.751 1.00 0.00 O ATOM 2416 CB GLU A 164 -3.841 -2.927 8.313 1.00 0.00 C ATOM 2417 CG GLU A 164 -4.910 -3.285 9.332 1.00 0.00 C ATOM 2418 CD GLU A 164 -5.597 -4.600 9.020 1.00 0.00 C ATOM 2419 OE1 GLU A 164 -5.619 -4.991 7.834 1.00 0.00 O ATOM 2420 OE2 GLU A 164 -6.112 -5.238 9.962 1.00 0.00 O ATOM 0 H GLU A 164 -4.293 -0.381 7.736 1.00 0.00 H new ATOM 0 HA GLU A 164 -2.674 -1.827 9.743 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -4.318 -2.730 7.353 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -3.183 -3.785 8.173 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -4.458 -3.342 10.322 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -5.655 -2.490 9.366 1.00 0.00 H new ATOM 2427 N CYS A 165 -0.674 -2.241 8.268 1.00 0.00 N ATOM 2428 CA CYS A 165 0.575 -2.233 7.514 1.00 0.00 C ATOM 2429 C CYS A 165 0.934 -3.637 7.041 1.00 0.00 C ATOM 2430 O CYS A 165 1.174 -4.534 7.850 1.00 0.00 O ATOM 2431 CB CYS A 165 1.708 -1.665 8.370 1.00 0.00 C ATOM 2432 SG CYS A 165 3.148 -1.121 7.422 1.00 0.00 S ATOM 0 H CYS A 165 -0.631 -2.751 9.150 1.00 0.00 H new ATOM 0 HA CYS A 165 0.438 -1.599 6.638 1.00 0.00 H new ATOM 0 HB2 CYS A 165 1.326 -0.822 8.946 1.00 0.00 H new ATOM 0 HB3 CYS A 165 2.023 -2.424 9.086 1.00 0.00 H new ATOM 0 HG CYS A 165 4.051 -0.655 8.233 1.00 0.00 H new ATOM 2438 N HIS A 166 0.967 -3.822 5.725 1.00 0.00 N ATOM 2439 CA HIS A 166 1.295 -5.119 5.143 1.00 0.00 C ATOM 2440 C HIS A 166 2.671 -5.086 4.484 1.00 0.00 C ATOM 2441 O HIS A 166 2.859 -4.450 3.447 1.00 0.00 O ATOM 2442 CB HIS A 166 0.236 -5.525 4.118 1.00 0.00 C ATOM 2443 CG HIS A 166 -1.102 -5.817 4.724 1.00 0.00 C ATOM 2444 ND1 HIS A 166 -2.295 -5.192 4.582 1.00 0.00 N flip ATOM 2445 CD2 HIS A 166 -1.322 -6.864 5.595 1.00 0.00 C flip ATOM 2446 CE1 HIS A 166 -3.203 -5.866 5.360 1.00 0.00 C flip ATOM 2447 NE2 HIS A 166 -2.591 -6.871 5.961 1.00 0.00 N flip ATOM 0 H HIS A 166 0.771 -3.091 5.042 1.00 0.00 H new ATOM 0 HA HIS A 166 1.313 -5.856 5.946 1.00 0.00 H new ATOM 0 HB2 HIS A 166 0.127 -4.726 3.384 1.00 0.00 H new ATOM 0 HB3 HIS A 166 0.582 -6.407 3.580 1.00 0.00 H new ATOM 0 HD1 HIS A 166 -2.484 -4.373 4.004 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -0.573 -7.568 5.926 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -4.248 -5.615 5.464 1.00 0.00 H new ATOM 2455 N VAL A 167 3.630 -5.775 5.094 1.00 0.00 N ATOM 2456 CA VAL A 167 4.989 -5.825 4.566 1.00 0.00 C ATOM 2457 C VAL A 167 5.158 -6.988 3.594 1.00 0.00 C ATOM 2458 O VAL A 167 4.573 -8.055 3.778 1.00 0.00 O ATOM 2459 CB VAL A 167 6.025 -5.961 5.697 1.00 0.00 C ATOM 2460 CG1 VAL A 167 7.435 -5.779 5.155 1.00 0.00 C ATOM 2461 CG2 VAL A 167 5.738 -4.959 6.805 1.00 0.00 C ATOM 0 H VAL A 167 3.492 -6.306 5.954 1.00 0.00 H new ATOM 0 HA VAL A 167 5.159 -4.886 4.038 1.00 0.00 H new ATOM 0 HB VAL A 167 5.949 -6.964 6.116 1.00 0.00 H new ATOM 0 HG11 VAL A 167 8.153 -5.878 5.969 1.00 0.00 H new ATOM 0 HG12 VAL A 167 7.635 -6.539 4.399 1.00 0.00 H new ATOM 0 HG13 VAL A 167 7.528 -4.789 4.708 1.00 0.00 H new ATOM 0 HG21 VAL A 167 6.480 -5.069 7.596 1.00 0.00 H new ATOM 0 HG22 VAL A 167 5.785 -3.947 6.402 1.00 0.00 H new ATOM 0 HG23 VAL A 167 4.744 -5.142 7.212 1.00 0.00 H new ATOM 2471 N PHE A 168 5.964 -6.774 2.559 1.00 0.00 N ATOM 2472 CA PHE A 168 6.211 -7.804 1.557 1.00 0.00 C ATOM 2473 C PHE A 168 7.655 -7.750 1.066 1.00 0.00 C ATOM 2474 O PHE A 168 8.196 -6.673 0.816 1.00 0.00 O ATOM 2475 CB PHE A 168 5.252 -7.637 0.376 1.00 0.00 C ATOM 2476 CG PHE A 168 3.805 -7.772 0.756 1.00 0.00 C ATOM 2477 CD1 PHE A 168 3.193 -9.014 0.772 1.00 0.00 C ATOM 2478 CD2 PHE A 168 3.058 -6.656 1.096 1.00 0.00 C ATOM 2479 CE1 PHE A 168 1.861 -9.141 1.120 1.00 0.00 C ATOM 2480 CE2 PHE A 168 1.726 -6.776 1.445 1.00 0.00 C ATOM 2481 CZ PHE A 168 1.127 -8.021 1.458 1.00 0.00 C ATOM 0 H PHE A 168 6.457 -5.897 2.392 1.00 0.00 H new ATOM 0 HA PHE A 168 6.040 -8.775 2.021 1.00 0.00 H new ATOM 0 HB2 PHE A 168 5.411 -6.658 -0.075 1.00 0.00 H new ATOM 0 HB3 PHE A 168 5.491 -8.381 -0.384 1.00 0.00 H new ATOM 0 HD1 PHE A 168 3.763 -9.893 0.510 1.00 0.00 H new ATOM 0 HD2 PHE A 168 3.522 -5.681 1.088 1.00 0.00 H new ATOM 0 HE1 PHE A 168 1.395 -10.115 1.128 1.00 0.00 H new ATOM 0 HE2 PHE A 168 1.154 -5.898 1.707 1.00 0.00 H new ATOM 0 HZ PHE A 168 0.087 -8.118 1.732 1.00 0.00 H new ATOM 2491 N TRP A 169 8.271 -8.918 0.931 1.00 0.00 N ATOM 2492 CA TRP A 169 9.653 -9.004 0.471 1.00 0.00 C ATOM 2493 C TRP A 169 9.719 -9.025 -1.052 1.00 0.00 C ATOM 2494 O TRP A 169 8.939 -9.718 -1.707 1.00 0.00 O ATOM 2495 CB TRP A 169 10.324 -10.256 1.040 1.00 0.00 C ATOM 2496 CG TRP A 169 11.820 -10.217 0.956 1.00 0.00 C ATOM 2497 CD1 TRP A 169 12.592 -10.599 -0.104 1.00 0.00 C ATOM 2498 CD2 TRP A 169 12.724 -9.773 1.974 1.00 0.00 C ATOM 2499 NE1 TRP A 169 13.921 -10.420 0.194 1.00 0.00 N ATOM 2500 CE2 TRP A 169 14.029 -9.913 1.462 1.00 0.00 C ATOM 2501 CE3 TRP A 169 12.558 -9.269 3.266 1.00 0.00 C ATOM 2502 CZ2 TRP A 169 15.159 -9.569 2.199 1.00 0.00 C ATOM 2503 CZ3 TRP A 169 13.681 -8.928 3.997 1.00 0.00 C ATOM 2504 CH2 TRP A 169 14.967 -9.078 3.462 1.00 0.00 C ATOM 0 H TRP A 169 7.837 -9.818 1.133 1.00 0.00 H new ATOM 0 HA TRP A 169 10.184 -8.121 0.827 1.00 0.00 H new ATOM 0 HB2 TRP A 169 10.029 -10.376 2.082 1.00 0.00 H new ATOM 0 HB3 TRP A 169 9.960 -11.131 0.502 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.213 -10.985 -1.039 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.701 -10.631 -0.428 1.00 0.00 H new ATOM 0 HE3 TRP A 169 11.571 -9.148 3.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.151 -9.685 1.789 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 13.565 -8.539 4.998 1.00 0.00 H new ATOM 0 HH2 TRP A 169 15.824 -8.801 4.058 1.00 0.00 H new ATOM 2515 N CYS A 170 10.652 -8.262 -1.610 1.00 0.00 N ATOM 2516 CA CYS A 170 10.818 -8.192 -3.057 1.00 0.00 C ATOM 2517 C CYS A 170 12.237 -8.582 -3.461 1.00 0.00 C ATOM 2518 O CYS A 170 13.189 -8.353 -2.716 1.00 0.00 O ATOM 2519 CB CYS A 170 10.501 -6.783 -3.561 1.00 0.00 C ATOM 2520 SG CYS A 170 8.747 -6.349 -3.483 1.00 0.00 S ATOM 0 H CYS A 170 11.305 -7.683 -1.082 1.00 0.00 H new ATOM 0 HA CYS A 170 10.123 -8.897 -3.512 1.00 0.00 H new ATOM 0 HB2 CYS A 170 11.069 -6.062 -2.973 1.00 0.00 H new ATOM 0 HB3 CYS A 170 10.841 -6.692 -4.593 1.00 0.00 H new ATOM 0 HG CYS A 170 8.579 -5.139 -3.928 1.00 0.00 H new ATOM 2526 N GLU A 171 12.368 -9.174 -4.644 1.00 0.00 N ATOM 2527 CA GLU A 171 13.670 -9.598 -5.144 1.00 0.00 C ATOM 2528 C GLU A 171 13.799 -9.312 -6.638 1.00 0.00 C ATOM 2529 O GLU A 171 12.898 -9.592 -7.429 1.00 0.00 O ATOM 2530 CB GLU A 171 13.882 -11.090 -4.879 1.00 0.00 C ATOM 2531 CG GLU A 171 14.104 -11.422 -3.413 1.00 0.00 C ATOM 2532 CD GLU A 171 15.569 -11.392 -3.023 1.00 0.00 C ATOM 2533 OE1 GLU A 171 16.424 -11.572 -3.915 1.00 0.00 O ATOM 2534 OE2 GLU A 171 15.860 -11.189 -1.826 1.00 0.00 O ATOM 0 H GLU A 171 11.589 -9.371 -5.273 1.00 0.00 H new ATOM 0 HA GLU A 171 14.436 -9.030 -4.616 1.00 0.00 H new ATOM 0 HB2 GLU A 171 13.014 -11.642 -5.240 1.00 0.00 H new ATOM 0 HB3 GLU A 171 14.741 -11.434 -5.455 1.00 0.00 H new ATOM 0 HG2 GLU A 171 13.553 -10.712 -2.796 1.00 0.00 H new ATOM 0 HG3 GLU A 171 13.696 -12.411 -3.202 1.00 0.00 H new ATOM 2541 N PRO A 172 14.945 -8.741 -7.034 1.00 0.00 N ATOM 2542 CA PRO A 172 16.025 -8.402 -6.102 1.00 0.00 C ATOM 2543 C PRO A 172 15.653 -7.246 -5.179 1.00 0.00 C ATOM 2544 O PRO A 172 15.838 -7.324 -3.966 1.00 0.00 O ATOM 2545 CB PRO A 172 17.178 -8.000 -7.025 1.00 0.00 C ATOM 2546 CG PRO A 172 16.517 -7.543 -8.279 1.00 0.00 C ATOM 2547 CD PRO A 172 15.277 -8.380 -8.423 1.00 0.00 C ATOM 0 HA PRO A 172 16.264 -9.231 -5.436 1.00 0.00 H new ATOM 0 HB2 PRO A 172 17.781 -7.206 -6.583 1.00 0.00 H new ATOM 0 HB3 PRO A 172 17.846 -8.840 -7.213 1.00 0.00 H new ATOM 0 HG2 PRO A 172 16.268 -6.483 -8.225 1.00 0.00 H new ATOM 0 HG3 PRO A 172 17.177 -7.672 -9.137 1.00 0.00 H new ATOM 0 HD2 PRO A 172 14.469 -7.823 -8.897 1.00 0.00 H new ATOM 0 HD3 PRO A 172 15.457 -9.263 -9.036 1.00 0.00 H new ATOM 2555 N ASN A 173 15.128 -6.174 -5.764 1.00 0.00 N ATOM 2556 CA ASN A 173 14.730 -5.002 -4.994 1.00 0.00 C ATOM 2557 C ASN A 173 13.232 -4.745 -5.128 1.00 0.00 C ATOM 2558 O ASN A 173 12.535 -5.447 -5.860 1.00 0.00 O ATOM 2559 CB ASN A 173 15.513 -3.772 -5.457 1.00 0.00 C ATOM 2560 CG ASN A 173 15.305 -3.475 -6.930 1.00 0.00 C ATOM 2561 OD1 ASN A 173 14.655 -4.240 -7.643 1.00 0.00 O ATOM 2562 ND2 ASN A 173 15.858 -2.360 -7.392 1.00 0.00 N ATOM 0 H ASN A 173 14.969 -6.093 -6.768 1.00 0.00 H new ATOM 0 HA ASN A 173 14.955 -5.194 -3.945 1.00 0.00 H new ATOM 0 HB2 ASN A 173 15.207 -2.907 -4.868 1.00 0.00 H new ATOM 0 HB3 ASN A 173 16.575 -3.928 -5.267 1.00 0.00 H new ATOM 0 HD21 ASN A 173 15.752 -2.108 -8.375 1.00 0.00 H new ATOM 0 HD22 ASN A 173 16.388 -1.756 -6.764 1.00 0.00 H new ATOM 2569 N ALA A 174 12.745 -3.734 -4.416 1.00 0.00 N ATOM 2570 CA ALA A 174 11.331 -3.383 -4.457 1.00 0.00 C ATOM 2571 C ALA A 174 11.100 -2.131 -5.296 1.00 0.00 C ATOM 2572 O ALA A 174 10.271 -1.288 -4.956 1.00 0.00 O ATOM 2573 CB ALA A 174 10.795 -3.182 -3.047 1.00 0.00 C ATOM 0 H ALA A 174 13.309 -3.144 -3.804 1.00 0.00 H new ATOM 0 HA ALA A 174 10.792 -4.207 -4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 174 9.738 -2.920 -3.093 1.00 0.00 H new ATOM 0 HB2 ALA A 174 10.916 -4.103 -2.477 1.00 0.00 H new ATOM 0 HB3 ALA A 174 11.347 -2.378 -2.559 1.00 0.00 H new ATOM 2579 N ALA A 175 11.840 -2.016 -6.394 1.00 0.00 N ATOM 2580 CA ALA A 175 11.715 -0.867 -7.283 1.00 0.00 C ATOM 2581 C ALA A 175 10.557 -1.051 -8.258 1.00 0.00 C ATOM 2582 O ALA A 175 9.609 -0.268 -8.264 1.00 0.00 O ATOM 2583 CB ALA A 175 13.015 -0.642 -8.040 1.00 0.00 C ATOM 0 H ALA A 175 12.532 -2.704 -6.689 1.00 0.00 H new ATOM 0 HA ALA A 175 11.506 0.012 -6.674 1.00 0.00 H new ATOM 0 HB1 ALA A 175 12.907 0.219 -8.700 1.00 0.00 H new ATOM 0 HB2 ALA A 175 13.822 -0.457 -7.331 1.00 0.00 H new ATOM 0 HB3 ALA A 175 13.249 -1.526 -8.633 1.00 0.00 H new ATOM 2589 N ASN A 176 10.643 -2.090 -9.082 1.00 0.00 N ATOM 2590 CA ASN A 176 9.602 -2.376 -10.063 1.00 0.00 C ATOM 2591 C ASN A 176 8.236 -2.477 -9.393 1.00 0.00 C ATOM 2592 O ASN A 176 7.234 -2.001 -9.926 1.00 0.00 O ATOM 2593 CB ASN A 176 9.916 -3.676 -10.806 1.00 0.00 C ATOM 2594 CG ASN A 176 11.324 -3.696 -11.369 1.00 0.00 C ATOM 2595 OD1 ASN A 176 12.089 -4.629 -11.125 1.00 0.00 O ATOM 2596 ND2 ASN A 176 11.672 -2.663 -12.127 1.00 0.00 N ATOM 0 H ASN A 176 11.422 -2.748 -9.090 1.00 0.00 H new ATOM 0 HA ASN A 176 9.576 -1.554 -10.778 1.00 0.00 H new ATOM 0 HB2 ASN A 176 9.787 -4.519 -10.127 1.00 0.00 H new ATOM 0 HB3 ASN A 176 9.201 -3.809 -11.618 1.00 0.00 H new ATOM 0 HD21 ASN A 176 12.606 -2.621 -12.534 1.00 0.00 H new ATOM 0 HD22 ASN A 176 11.005 -1.912 -12.303 1.00 0.00 H new ATOM 2603 N VAL A 177 8.203 -3.099 -8.219 1.00 0.00 N ATOM 2604 CA VAL A 177 6.960 -3.261 -7.474 1.00 0.00 C ATOM 2605 C VAL A 177 6.452 -1.921 -6.954 1.00 0.00 C ATOM 2606 O VAL A 177 5.290 -1.566 -7.155 1.00 0.00 O ATOM 2607 CB VAL A 177 7.139 -4.225 -6.286 1.00 0.00 C ATOM 2608 CG1 VAL A 177 5.887 -4.248 -5.423 1.00 0.00 C ATOM 2609 CG2 VAL A 177 7.482 -5.622 -6.780 1.00 0.00 C ATOM 0 H VAL A 177 9.023 -3.499 -7.763 1.00 0.00 H new ATOM 0 HA VAL A 177 6.229 -3.680 -8.166 1.00 0.00 H new ATOM 0 HB VAL A 177 7.967 -3.868 -5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 177 6.033 -4.935 -4.589 1.00 0.00 H new ATOM 0 HG12 VAL A 177 5.691 -3.247 -5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 177 5.038 -4.579 -6.022 1.00 0.00 H new ATOM 0 HG21 VAL A 177 7.605 -6.290 -5.927 1.00 0.00 H new ATOM 0 HG22 VAL A 177 6.678 -5.991 -7.416 1.00 0.00 H new ATOM 0 HG23 VAL A 177 8.410 -5.588 -7.351 1.00 0.00 H new ATOM 2619 N SER A 178 7.330 -1.180 -6.286 1.00 0.00 N ATOM 2620 CA SER A 178 6.970 0.121 -5.735 1.00 0.00 C ATOM 2621 C SER A 178 6.486 1.062 -6.834 1.00 0.00 C ATOM 2622 O SER A 178 5.388 1.612 -6.756 1.00 0.00 O ATOM 2623 CB SER A 178 8.166 0.740 -5.008 1.00 0.00 C ATOM 2624 OG SER A 178 8.379 0.115 -3.754 1.00 0.00 O ATOM 0 H SER A 178 8.296 -1.458 -6.113 1.00 0.00 H new ATOM 0 HA SER A 178 6.158 -0.026 -5.023 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.060 0.642 -5.623 1.00 0.00 H new ATOM 0 HB3 SER A 178 7.995 1.807 -4.862 1.00 0.00 H new ATOM 0 HG SER A 178 9.087 -0.557 -3.840 1.00 0.00 H new ATOM 2630 N GLU A 179 7.315 1.242 -7.858 1.00 0.00 N ATOM 2631 CA GLU A 179 6.972 2.117 -8.972 1.00 0.00 C ATOM 2632 C GLU A 179 5.676 1.666 -9.640 1.00 0.00 C ATOM 2633 O GLU A 179 4.859 2.488 -10.052 1.00 0.00 O ATOM 2634 CB GLU A 179 8.107 2.140 -9.999 1.00 0.00 C ATOM 2635 CG GLU A 179 8.192 0.877 -10.840 1.00 0.00 C ATOM 2636 CD GLU A 179 9.418 0.852 -11.732 1.00 0.00 C ATOM 2637 OE1 GLU A 179 10.399 1.556 -11.411 1.00 0.00 O ATOM 2638 OE2 GLU A 179 9.397 0.130 -12.750 1.00 0.00 O ATOM 0 H GLU A 179 8.228 0.794 -7.939 1.00 0.00 H new ATOM 0 HA GLU A 179 6.826 3.123 -8.579 1.00 0.00 H new ATOM 0 HB2 GLU A 179 7.972 2.997 -10.659 1.00 0.00 H new ATOM 0 HB3 GLU A 179 9.054 2.284 -9.479 1.00 0.00 H new ATOM 0 HG2 GLU A 179 8.208 0.008 -10.183 1.00 0.00 H new ATOM 0 HG3 GLU A 179 7.297 0.794 -11.456 1.00 0.00 H new ATOM 2645 N ALA A 180 5.497 0.353 -9.743 1.00 0.00 N ATOM 2646 CA ALA A 180 4.301 -0.209 -10.359 1.00 0.00 C ATOM 2647 C ALA A 180 3.043 0.241 -9.624 1.00 0.00 C ATOM 2648 O ALA A 180 2.168 0.883 -10.206 1.00 0.00 O ATOM 2649 CB ALA A 180 4.384 -1.728 -10.385 1.00 0.00 C ATOM 0 H ALA A 180 6.165 -0.341 -9.408 1.00 0.00 H new ATOM 0 HA ALA A 180 4.243 0.158 -11.384 1.00 0.00 H new ATOM 0 HB1 ALA A 180 3.484 -2.134 -10.848 1.00 0.00 H new ATOM 0 HB2 ALA A 180 5.258 -2.035 -10.960 1.00 0.00 H new ATOM 0 HB3 ALA A 180 4.470 -2.105 -9.366 1.00 0.00 H new ATOM 2655 N VAL A 181 2.957 -0.100 -8.342 1.00 0.00 N ATOM 2656 CA VAL A 181 1.805 0.270 -7.528 1.00 0.00 C ATOM 2657 C VAL A 181 1.655 1.784 -7.444 1.00 0.00 C ATOM 2658 O VAL A 181 0.545 2.312 -7.512 1.00 0.00 O ATOM 2659 CB VAL A 181 1.919 -0.304 -6.103 1.00 0.00 C ATOM 2660 CG1 VAL A 181 3.123 0.285 -5.384 1.00 0.00 C ATOM 2661 CG2 VAL A 181 0.640 -0.042 -5.321 1.00 0.00 C ATOM 0 H VAL A 181 3.671 -0.632 -7.845 1.00 0.00 H new ATOM 0 HA VAL A 181 0.925 -0.152 -8.013 1.00 0.00 H new ATOM 0 HB VAL A 181 2.061 -1.382 -6.174 1.00 0.00 H new ATOM 0 HG11 VAL A 181 3.187 -0.132 -4.379 1.00 0.00 H new ATOM 0 HG12 VAL A 181 4.031 0.042 -5.936 1.00 0.00 H new ATOM 0 HG13 VAL A 181 3.015 1.368 -5.321 1.00 0.00 H new ATOM 0 HG21 VAL A 181 0.737 -0.454 -4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 181 0.466 1.032 -5.258 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -0.200 -0.516 -5.828 1.00 0.00 H new ATOM 2671 N GLN A 182 2.779 2.478 -7.297 1.00 0.00 N ATOM 2672 CA GLN A 182 2.771 3.933 -7.203 1.00 0.00 C ATOM 2673 C GLN A 182 2.136 4.555 -8.443 1.00 0.00 C ATOM 2674 O GLN A 182 1.244 5.396 -8.340 1.00 0.00 O ATOM 2675 CB GLN A 182 4.196 4.461 -7.026 1.00 0.00 C ATOM 2676 CG GLN A 182 4.255 5.888 -6.505 1.00 0.00 C ATOM 2677 CD GLN A 182 5.484 6.634 -6.986 1.00 0.00 C ATOM 2678 OE1 GLN A 182 5.878 6.522 -8.148 1.00 0.00 O ATOM 2679 NE2 GLN A 182 6.097 7.403 -6.094 1.00 0.00 N ATOM 0 H GLN A 182 3.706 2.056 -7.240 1.00 0.00 H new ATOM 0 HA GLN A 182 2.176 4.213 -6.333 1.00 0.00 H new ATOM 0 HB2 GLN A 182 4.733 3.809 -6.337 1.00 0.00 H new ATOM 0 HB3 GLN A 182 4.715 4.411 -7.983 1.00 0.00 H new ATOM 0 HG2 GLN A 182 3.361 6.424 -6.824 1.00 0.00 H new ATOM 0 HG3 GLN A 182 4.247 5.874 -5.415 1.00 0.00 H new ATOM 0 HE21 GLN A 182 5.736 7.467 -5.142 1.00 0.00 H new ATOM 0 HE22 GLN A 182 6.928 7.930 -6.361 1.00 0.00 H new ATOM 2688 N ALA A 183 2.603 4.136 -9.615 1.00 0.00 N ATOM 2689 CA ALA A 183 2.080 4.650 -10.874 1.00 0.00 C ATOM 2690 C ALA A 183 0.556 4.616 -10.890 1.00 0.00 C ATOM 2691 O ALA A 183 -0.088 5.479 -11.485 1.00 0.00 O ATOM 2692 CB ALA A 183 2.640 3.853 -12.043 1.00 0.00 C ATOM 0 H ALA A 183 3.343 3.442 -9.718 1.00 0.00 H new ATOM 0 HA ALA A 183 2.395 5.689 -10.973 1.00 0.00 H new ATOM 0 HB1 ALA A 183 2.241 4.248 -12.977 1.00 0.00 H new ATOM 0 HB2 ALA A 183 3.727 3.933 -12.050 1.00 0.00 H new ATOM 0 HB3 ALA A 183 2.354 2.806 -11.940 1.00 0.00 H new ATOM 2698 N ALA A 184 -0.016 3.611 -10.233 1.00 0.00 N ATOM 2699 CA ALA A 184 -1.465 3.465 -10.171 1.00 0.00 C ATOM 2700 C ALA A 184 -2.109 4.666 -9.487 1.00 0.00 C ATOM 2701 O ALA A 184 -3.142 5.167 -9.933 1.00 0.00 O ATOM 2702 CB ALA A 184 -1.835 2.181 -9.445 1.00 0.00 C ATOM 0 H ALA A 184 0.503 2.886 -9.737 1.00 0.00 H new ATOM 0 HA ALA A 184 -1.844 3.415 -11.192 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -2.920 2.085 -9.406 1.00 0.00 H new ATOM 0 HB2 ALA A 184 -1.414 1.328 -9.977 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -1.437 2.209 -8.431 1.00 0.00 H new ATOM 2708 N CYS A 185 -1.493 5.123 -8.402 1.00 0.00 N ATOM 2709 CA CYS A 185 -2.008 6.265 -7.654 1.00 0.00 C ATOM 2710 C CYS A 185 -2.356 7.416 -8.593 1.00 0.00 C ATOM 2711 O CYS A 185 -3.205 8.250 -8.279 1.00 0.00 O ATOM 2712 CB CYS A 185 -0.982 6.728 -6.619 1.00 0.00 C ATOM 2713 SG CYS A 185 -0.659 5.523 -5.310 1.00 0.00 S ATOM 0 H CYS A 185 -0.637 4.721 -8.021 1.00 0.00 H new ATOM 0 HA CYS A 185 -2.916 5.952 -7.139 1.00 0.00 H new ATOM 0 HB2 CYS A 185 -0.045 6.955 -7.128 1.00 0.00 H new ATOM 0 HB3 CYS A 185 -1.332 7.656 -6.166 1.00 0.00 H new ATOM 0 HG CYS A 185 -1.238 5.909 -4.212 1.00 0.00 H new