USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 915 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: B 88 MET CE :methyl -113:sc= -7.24! (180deg=-8.02!) USER MOD Set 1.2: B 130 CYS SG : rot -150:sc= -2.15 USER MOD Set 2.1: B 22 TYR OH : rot 24:sc= 1.1 USER MOD Set 2.2: B 111 HIS : no HD1:sc= -3.16! K(o=-2.1!,f=-4.7) USER MOD Set 3.1: A 16 GLN : amide:sc= -2.34! C(o=-2.5!,f=-5.4!) USER MOD Set 3.2: A 17 ASN : amide:sc= -0.15 X(o=-2.5,f=-2.2) USER MOD Set 4.1: A 14 MET CE :methyl 138:sc= -3.76! (180deg=-8.03!) USER MOD Set 4.2: B 127 GLN : amide:sc= -0.0351 K(o=-3.8,f=-4.9) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -2.43! C(o=-2.4!,f=-3.1!) USER MOD Single : A 19 TYR OH : rot 30:sc= 0 USER MOD Single : B 16 GLN : amide:sc= -0.67 K(o=-0.67,f=-0.14) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 GLN : amide:sc= -0.514 K(o=-0.51,f=-2.9!) USER MOD Single : B 25 MET CE :methyl 156:sc= -0.258 (180deg=-0.419) USER MOD Single : B 34 MET CE :methyl 158:sc= -2.55 (180deg=-3.68!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 ASN : amide:sc= -3.26! C(o=-3.3!,f=-7.2!) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 43 ASN : amide:sc= -2.27! K(o=-2.3!,f=-1.6) USER MOD Single : B 45 MET CE :methyl -142:sc= -3.52 (180deg=-6.65!) USER MOD Single : B 46 THR OG1 : rot 180:sc= 0 USER MOD Single : B 47 SER OG : rot 180:sc= 0 USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 LYS NZ :NH3+ -150:sc= 1.65 (180deg=1.18) USER MOD Single : B 55 SER OG : rot 180:sc= 0.0403 USER MOD Single : B 57 ASN : amide:sc= -5.8! C(o=-5.8!,f=-13!) USER MOD Single : B 58 MET CE :methyl -149:sc= -0.616 (180deg=-2.56!) USER MOD Single : B 59 ASN : amide:sc= -3.51 K(o=-3.5,f=-7.7!) USER MOD Single : B 64 THR OG1 : rot 180:sc= -0.387 USER MOD Single : B 66 THR OG1 : rot 180:sc=-0.00889 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 ASN : amide:sc= 1.2 K(o=1.2,f=-0.16) USER MOD Single : B 80 CYS SG : rot 139:sc= -9.05! USER MOD Single : B 86 SER OG : rot 119:sc= -0.908 USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 HIS : no HD1:sc= -1.34 K(o=-1.3,f=-7.3!) USER MOD Single : B 96 THR OG1 : rot -80:sc= 0.539 USER MOD Single : B 101 MET CE :methyl -165:sc= -2.05 (180deg=-2.74) USER MOD Single : B 110 CYS SG : rot 180:sc= -2.54! USER MOD Single : B 115 CYS SG : rot 130:sc= -4.84! USER MOD Single : B 118 ASN : amide:sc= -2.3 K(o=-2.3,f=-5.2!) USER MOD Single : B 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 123 SER OG : rot -103:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 148 N LEU A 11 11.094 -14.956 2.380 1.00 0.00 N ATOM 149 CA LEU A 11 9.679 -15.157 2.645 1.00 0.00 C ATOM 150 C LEU A 11 9.479 -15.436 4.136 1.00 0.00 C ATOM 151 O LEU A 11 8.688 -14.764 4.795 1.00 0.00 O ATOM 152 CB LEU A 11 9.114 -16.249 1.733 1.00 0.00 C ATOM 153 CG LEU A 11 9.056 -15.914 0.242 1.00 0.00 C ATOM 154 CD1 LEU A 11 8.810 -17.171 -0.594 1.00 0.00 C ATOM 155 CD2 LEU A 11 8.015 -14.828 -0.037 1.00 0.00 C ATOM 0 HA LEU A 11 9.115 -14.254 2.411 1.00 0.00 H new ATOM 0 HB2 LEU A 11 9.717 -17.148 1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 11 8.106 -16.491 2.070 1.00 0.00 H new ATOM 0 HG LEU A 11 10.026 -15.514 -0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.773 -16.904 -1.650 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.619 -17.883 -0.427 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.863 -17.623 -0.301 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.995 -14.609 -1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.032 -15.176 0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 11 8.276 -13.924 0.514 1.00 0.00 H new ATOM 167 N SER A 12 10.210 -16.428 4.623 1.00 0.00 N ATOM 168 CA SER A 12 10.122 -16.804 6.024 1.00 0.00 C ATOM 169 C SER A 12 10.172 -15.555 6.905 1.00 0.00 C ATOM 170 O SER A 12 9.668 -15.562 8.027 1.00 0.00 O ATOM 171 CB SER A 12 11.246 -17.769 6.407 1.00 0.00 C ATOM 172 OG SER A 12 10.792 -18.798 7.281 1.00 0.00 O ATOM 0 H SER A 12 10.866 -16.983 4.073 1.00 0.00 H new ATOM 0 HA SER A 12 9.172 -17.314 6.182 1.00 0.00 H new ATOM 0 HB2 SER A 12 11.662 -18.217 5.505 1.00 0.00 H new ATOM 0 HB3 SER A 12 12.052 -17.214 6.888 1.00 0.00 H new ATOM 0 HG SER A 12 11.539 -19.394 7.500 1.00 0.00 H new ATOM 178 N LYS A 13 10.784 -14.512 6.364 1.00 0.00 N ATOM 179 CA LYS A 13 10.906 -13.257 7.087 1.00 0.00 C ATOM 180 C LYS A 13 9.552 -12.545 7.095 1.00 0.00 C ATOM 181 O LYS A 13 8.968 -12.327 8.155 1.00 0.00 O ATOM 182 CB LYS A 13 12.042 -12.413 6.506 1.00 0.00 C ATOM 183 CG LYS A 13 12.272 -11.153 7.344 1.00 0.00 C ATOM 184 CD LYS A 13 13.153 -10.151 6.596 1.00 0.00 C ATOM 185 CE LYS A 13 12.487 -8.775 6.533 1.00 0.00 C ATOM 186 NZ LYS A 13 12.917 -7.938 7.676 1.00 0.00 N ATOM 0 H LYS A 13 11.201 -14.510 5.433 1.00 0.00 H new ATOM 0 HA LYS A 13 11.176 -13.440 8.127 1.00 0.00 H new ATOM 0 HB2 LYS A 13 12.958 -13.003 6.471 1.00 0.00 H new ATOM 0 HB3 LYS A 13 11.804 -12.133 5.480 1.00 0.00 H new ATOM 0 HG2 LYS A 13 11.314 -10.692 7.584 1.00 0.00 H new ATOM 0 HG3 LYS A 13 12.743 -11.422 8.290 1.00 0.00 H new ATOM 0 HD2 LYS A 13 14.119 -10.069 7.094 1.00 0.00 H new ATOM 0 HD3 LYS A 13 13.344 -10.513 5.586 1.00 0.00 H new ATOM 0 HE2 LYS A 13 12.746 -8.282 5.596 1.00 0.00 H new ATOM 0 HE3 LYS A 13 11.403 -8.888 6.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 12.456 -7.008 7.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 12.648 -8.403 8.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 13.949 -7.815 7.647 1.00 0.00 H new ATOM 200 N MET A 14 9.093 -12.200 5.901 1.00 0.00 N ATOM 201 CA MET A 14 7.819 -11.517 5.757 1.00 0.00 C ATOM 202 C MET A 14 6.665 -12.403 6.231 1.00 0.00 C ATOM 203 O MET A 14 5.532 -11.940 6.353 1.00 0.00 O ATOM 204 CB MET A 14 7.605 -11.139 4.290 1.00 0.00 C ATOM 205 CG MET A 14 8.476 -9.943 3.899 1.00 0.00 C ATOM 206 SD MET A 14 8.056 -9.395 2.253 1.00 0.00 S ATOM 207 CE MET A 14 8.743 -7.748 2.291 1.00 0.00 C ATOM 0 H MET A 14 9.581 -12.381 5.024 1.00 0.00 H new ATOM 0 HA MET A 14 7.838 -10.618 6.373 1.00 0.00 H new ATOM 0 HB2 MET A 14 7.843 -11.991 3.653 1.00 0.00 H new ATOM 0 HB3 MET A 14 6.555 -10.899 4.122 1.00 0.00 H new ATOM 0 HG2 MET A 14 8.332 -9.130 4.610 1.00 0.00 H new ATOM 0 HG3 MET A 14 9.529 -10.220 3.941 1.00 0.00 H new ATOM 0 HE1 MET A 14 9.247 -7.542 1.347 1.00 0.00 H new ATOM 0 HE2 MET A 14 7.943 -7.023 2.440 1.00 0.00 H new ATOM 0 HE3 MET A 14 9.459 -7.671 3.109 1.00 0.00 H new ATOM 217 N GLN A 15 6.993 -13.661 6.483 1.00 0.00 N ATOM 218 CA GLN A 15 5.998 -14.616 6.940 1.00 0.00 C ATOM 219 C GLN A 15 5.549 -14.276 8.363 1.00 0.00 C ATOM 220 O GLN A 15 4.427 -14.590 8.756 1.00 0.00 O ATOM 221 CB GLN A 15 6.534 -16.047 6.862 1.00 0.00 C ATOM 222 CG GLN A 15 6.407 -16.604 5.443 1.00 0.00 C ATOM 223 CD GLN A 15 5.857 -18.031 5.461 1.00 0.00 C ATOM 224 OE1 GLN A 15 6.587 -19.005 5.546 1.00 0.00 O ATOM 225 NE2 GLN A 15 4.531 -18.100 5.376 1.00 0.00 N ATOM 0 H GLN A 15 7.934 -14.041 6.379 1.00 0.00 H new ATOM 0 HA GLN A 15 5.132 -14.551 6.281 1.00 0.00 H new ATOM 0 HB2 GLN A 15 7.579 -16.065 7.171 1.00 0.00 H new ATOM 0 HB3 GLN A 15 5.985 -16.683 7.557 1.00 0.00 H new ATOM 0 HG2 GLN A 15 5.749 -15.964 4.855 1.00 0.00 H new ATOM 0 HG3 GLN A 15 7.382 -16.592 4.955 1.00 0.00 H new ATOM 0 HE21 GLN A 15 3.979 -17.245 5.307 1.00 0.00 H new ATOM 0 HE22 GLN A 15 4.066 -19.008 5.380 1.00 0.00 H new ATOM 234 N GLN A 16 6.449 -13.638 9.096 1.00 0.00 N ATOM 235 CA GLN A 16 6.160 -13.251 10.467 1.00 0.00 C ATOM 236 C GLN A 16 6.753 -11.873 10.766 1.00 0.00 C ATOM 237 O GLN A 16 6.099 -11.032 11.381 1.00 0.00 O ATOM 238 CB GLN A 16 6.681 -14.298 11.453 1.00 0.00 C ATOM 239 CG GLN A 16 7.940 -14.981 10.914 1.00 0.00 C ATOM 240 CD GLN A 16 9.179 -14.114 11.152 1.00 0.00 C ATOM 241 OE1 GLN A 16 9.247 -13.326 12.081 1.00 0.00 O ATOM 242 NE2 GLN A 16 10.150 -14.302 10.264 1.00 0.00 N ATOM 0 H GLN A 16 7.379 -13.379 8.767 1.00 0.00 H new ATOM 0 HA GLN A 16 5.078 -13.193 10.587 1.00 0.00 H new ATOM 0 HB2 GLN A 16 6.901 -13.824 12.409 1.00 0.00 H new ATOM 0 HB3 GLN A 16 5.909 -15.045 11.638 1.00 0.00 H new ATOM 0 HG2 GLN A 16 8.070 -15.948 11.400 1.00 0.00 H new ATOM 0 HG3 GLN A 16 7.826 -15.173 9.847 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.028 -14.978 9.510 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.017 -13.770 10.336 1.00 0.00 H new ATOM 251 N ASN A 17 7.985 -11.684 10.317 1.00 0.00 N ATOM 252 CA ASN A 17 8.674 -10.422 10.529 1.00 0.00 C ATOM 253 C ASN A 17 8.029 -9.342 9.658 1.00 0.00 C ATOM 254 O ASN A 17 8.091 -8.157 9.984 1.00 0.00 O ATOM 255 CB ASN A 17 10.149 -10.527 10.137 1.00 0.00 C ATOM 256 CG ASN A 17 11.053 -10.379 11.362 1.00 0.00 C ATOM 257 OD1 ASN A 17 11.016 -9.393 12.078 1.00 0.00 O ATOM 258 ND2 ASN A 17 11.866 -11.413 11.561 1.00 0.00 N ATOM 0 H ASN A 17 8.524 -12.384 9.807 1.00 0.00 H new ATOM 0 HA ASN A 17 8.599 -10.170 11.587 1.00 0.00 H new ATOM 0 HB2 ASN A 17 10.334 -11.488 9.658 1.00 0.00 H new ATOM 0 HB3 ASN A 17 10.391 -9.755 9.407 1.00 0.00 H new ATOM 0 HD21 ASN A 17 12.510 -11.411 12.352 1.00 0.00 H new ATOM 0 HD22 ASN A 17 11.846 -12.208 10.922 1.00 0.00 H new ATOM 265 N GLY A 18 7.424 -9.789 8.567 1.00 0.00 N ATOM 266 CA GLY A 18 6.768 -8.875 7.647 1.00 0.00 C ATOM 267 C GLY A 18 7.745 -7.812 7.141 1.00 0.00 C ATOM 268 O GLY A 18 8.957 -8.017 7.163 1.00 0.00 O ATOM 0 H GLY A 18 7.374 -10.772 8.299 1.00 0.00 H new ATOM 0 HA2 GLY A 18 6.362 -9.432 6.803 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.927 -8.393 8.145 1.00 0.00 H new ATOM 272 N TYR A 19 7.180 -6.699 6.697 1.00 0.00 N ATOM 273 CA TYR A 19 7.985 -5.603 6.186 1.00 0.00 C ATOM 274 C TYR A 19 7.260 -4.266 6.351 1.00 0.00 C ATOM 275 O TYR A 19 6.064 -4.167 6.083 1.00 0.00 O ATOM 276 CB TYR A 19 8.181 -5.883 4.695 1.00 0.00 C ATOM 277 CG TYR A 19 8.988 -4.810 3.961 1.00 0.00 C ATOM 278 CD1 TYR A 19 10.367 -4.826 4.015 1.00 0.00 C ATOM 279 CD2 TYR A 19 8.337 -3.826 3.244 1.00 0.00 C ATOM 280 CE1 TYR A 19 11.127 -3.817 3.324 1.00 0.00 C ATOM 281 CE2 TYR A 19 9.097 -2.817 2.554 1.00 0.00 C ATOM 282 CZ TYR A 19 10.454 -2.862 2.628 1.00 0.00 C ATOM 283 OH TYR A 19 11.172 -1.908 1.975 1.00 0.00 O ATOM 0 H TYR A 19 6.174 -6.533 6.681 1.00 0.00 H new ATOM 0 HA TYR A 19 8.929 -5.536 6.726 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.683 -6.843 4.579 1.00 0.00 H new ATOM 0 HB3 TYR A 19 7.204 -5.975 4.222 1.00 0.00 H new ATOM 0 HD1 TYR A 19 10.876 -5.596 4.576 1.00 0.00 H new ATOM 0 HD2 TYR A 19 7.258 -3.813 3.201 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.206 -3.819 3.358 1.00 0.00 H new ATOM 0 HE2 TYR A 19 8.600 -2.041 1.990 1.00 0.00 H new ATOM 0 HH TYR A 19 12.036 -2.280 1.700 1.00 0.00 H new ATOM 293 N GLU A 20 8.015 -3.270 6.791 1.00 0.00 N ATOM 294 CA GLU A 20 7.460 -1.943 6.995 1.00 0.00 C ATOM 295 C GLU A 20 7.983 -0.979 5.929 1.00 0.00 C ATOM 296 O GLU A 20 9.059 -0.404 6.081 1.00 0.00 O ATOM 297 CB GLU A 20 7.773 -1.428 8.401 1.00 0.00 C ATOM 298 CG GLU A 20 6.499 -0.973 9.115 1.00 0.00 C ATOM 299 CD GLU A 20 6.715 0.367 9.823 1.00 0.00 C ATOM 300 OE1 GLU A 20 7.052 1.337 9.110 1.00 0.00 O ATOM 301 OE2 GLU A 20 6.537 0.390 11.060 1.00 0.00 O ATOM 0 H GLU A 20 9.007 -3.356 7.012 1.00 0.00 H new ATOM 0 HA GLU A 20 6.376 -2.006 6.900 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.258 -2.214 8.980 1.00 0.00 H new ATOM 0 HB3 GLU A 20 8.476 -0.597 8.340 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.687 -0.880 8.394 1.00 0.00 H new ATOM 0 HG3 GLU A 20 6.196 -1.727 9.841 1.00 0.00 H new ATOM 691 N VAL B 15 6.905 -3.116 -17.849 1.00 0.00 N ATOM 692 CA VAL B 15 7.063 -3.214 -16.408 1.00 0.00 C ATOM 693 C VAL B 15 7.288 -4.677 -16.022 1.00 0.00 C ATOM 694 O VAL B 15 7.270 -5.559 -16.880 1.00 0.00 O ATOM 695 CB VAL B 15 5.856 -2.589 -15.706 1.00 0.00 C ATOM 696 CG1 VAL B 15 5.884 -1.064 -15.821 1.00 0.00 C ATOM 697 CG2 VAL B 15 4.546 -3.157 -16.257 1.00 0.00 C ATOM 0 HA VAL B 15 7.939 -2.654 -16.081 1.00 0.00 H new ATOM 0 HB VAL B 15 5.914 -2.846 -14.648 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.015 -0.645 -15.314 1.00 0.00 H new ATOM 0 HG12 VAL B 15 6.794 -0.681 -15.359 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.863 -0.778 -16.873 1.00 0.00 H new ATOM 0 HG21 VAL B 15 3.704 -2.696 -15.741 1.00 0.00 H new ATOM 0 HG22 VAL B 15 4.478 -2.945 -17.324 1.00 0.00 H new ATOM 0 HG23 VAL B 15 4.522 -4.235 -16.099 1.00 0.00 H new ATOM 707 N GLN B 16 7.494 -4.891 -14.731 1.00 0.00 N ATOM 708 CA GLN B 16 7.722 -6.232 -14.221 1.00 0.00 C ATOM 709 C GLN B 16 6.460 -7.082 -14.380 1.00 0.00 C ATOM 710 O GLN B 16 6.494 -8.138 -15.010 1.00 0.00 O ATOM 711 CB GLN B 16 8.177 -6.193 -12.761 1.00 0.00 C ATOM 712 CG GLN B 16 9.244 -5.118 -12.547 1.00 0.00 C ATOM 713 CD GLN B 16 10.469 -5.695 -11.835 1.00 0.00 C ATOM 714 OE1 GLN B 16 11.606 -5.374 -12.142 1.00 0.00 O ATOM 715 NE2 GLN B 16 10.176 -6.561 -10.869 1.00 0.00 N ATOM 0 H GLN B 16 7.508 -4.157 -14.022 1.00 0.00 H new ATOM 0 HA GLN B 16 8.521 -6.691 -14.804 1.00 0.00 H new ATOM 0 HB2 GLN B 16 7.322 -5.995 -12.115 1.00 0.00 H new ATOM 0 HB3 GLN B 16 8.574 -7.167 -12.474 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.541 -4.699 -13.508 1.00 0.00 H new ATOM 0 HG3 GLN B 16 8.828 -4.300 -11.958 1.00 0.00 H new ATOM 0 HE21 GLN B 16 9.202 -6.785 -10.663 1.00 0.00 H new ATOM 0 HE22 GLN B 16 10.925 -7.001 -10.334 1.00 0.00 H new ATOM 724 N LYS B 17 5.377 -6.590 -13.798 1.00 0.00 N ATOM 725 CA LYS B 17 4.106 -7.291 -13.867 1.00 0.00 C ATOM 726 C LYS B 17 4.238 -8.646 -13.169 1.00 0.00 C ATOM 727 O LYS B 17 5.322 -9.226 -13.132 1.00 0.00 O ATOM 728 CB LYS B 17 3.627 -7.390 -15.317 1.00 0.00 C ATOM 729 CG LYS B 17 2.901 -6.112 -15.743 1.00 0.00 C ATOM 730 CD LYS B 17 2.846 -5.995 -17.267 1.00 0.00 C ATOM 731 CE LYS B 17 2.108 -4.724 -17.693 1.00 0.00 C ATOM 732 NZ LYS B 17 2.339 -4.447 -19.129 1.00 0.00 N ATOM 0 H LYS B 17 5.353 -5.714 -13.276 1.00 0.00 H new ATOM 0 HA LYS B 17 3.333 -6.733 -13.338 1.00 0.00 H new ATOM 0 HB2 LYS B 17 4.479 -7.565 -15.974 1.00 0.00 H new ATOM 0 HB3 LYS B 17 2.960 -8.245 -15.426 1.00 0.00 H new ATOM 0 HG2 LYS B 17 1.889 -6.112 -15.338 1.00 0.00 H new ATOM 0 HG3 LYS B 17 3.411 -5.244 -15.326 1.00 0.00 H new ATOM 0 HD2 LYS B 17 3.858 -5.985 -17.671 1.00 0.00 H new ATOM 0 HD3 LYS B 17 2.345 -6.868 -17.685 1.00 0.00 H new ATOM 0 HE2 LYS B 17 1.040 -4.836 -17.505 1.00 0.00 H new ATOM 0 HE3 LYS B 17 2.450 -3.880 -17.094 1.00 0.00 H new ATOM 0 HZ1 LYS B 17 1.831 -3.581 -19.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 17 3.357 -4.319 -19.299 1.00 0.00 H new ATOM 0 HZ3 LYS B 17 1.991 -5.246 -19.697 1.00 0.00 H new ATOM 746 N PHE B 18 3.119 -9.112 -12.634 1.00 0.00 N ATOM 747 CA PHE B 18 3.095 -10.388 -11.939 1.00 0.00 C ATOM 748 C PHE B 18 1.681 -10.971 -11.912 1.00 0.00 C ATOM 749 O PHE B 18 0.792 -10.423 -11.263 1.00 0.00 O ATOM 750 CB PHE B 18 3.553 -10.124 -10.503 1.00 0.00 C ATOM 751 CG PHE B 18 5.035 -9.762 -10.379 1.00 0.00 C ATOM 752 CD1 PHE B 18 5.973 -10.745 -10.333 1.00 0.00 C ATOM 753 CD2 PHE B 18 5.413 -8.457 -10.315 1.00 0.00 C ATOM 754 CE1 PHE B 18 7.348 -10.409 -10.218 1.00 0.00 C ATOM 755 CE2 PHE B 18 6.788 -8.121 -10.200 1.00 0.00 C ATOM 756 CZ PHE B 18 7.726 -9.105 -10.153 1.00 0.00 C ATOM 0 H PHE B 18 2.222 -8.628 -12.668 1.00 0.00 H new ATOM 0 HA PHE B 18 3.743 -11.101 -12.448 1.00 0.00 H new ATOM 0 HB2 PHE B 18 2.955 -9.314 -10.085 1.00 0.00 H new ATOM 0 HB3 PHE B 18 3.354 -11.010 -9.900 1.00 0.00 H new ATOM 0 HD1 PHE B 18 5.673 -11.781 -10.384 1.00 0.00 H new ATOM 0 HD2 PHE B 18 4.668 -7.676 -10.352 1.00 0.00 H new ATOM 0 HE1 PHE B 18 8.093 -11.190 -10.182 1.00 0.00 H new ATOM 0 HE2 PHE B 18 7.089 -7.085 -10.150 1.00 0.00 H new ATOM 0 HZ PHE B 18 8.772 -8.850 -10.064 1.00 0.00 H new ATOM 766 N ARG B 19 1.518 -12.076 -12.624 1.00 0.00 N ATOM 767 CA ARG B 19 0.227 -12.740 -12.690 1.00 0.00 C ATOM 768 C ARG B 19 -0.024 -13.541 -11.410 1.00 0.00 C ATOM 769 O ARG B 19 0.748 -14.437 -11.073 1.00 0.00 O ATOM 770 CB ARG B 19 0.152 -13.681 -13.894 1.00 0.00 C ATOM 771 CG ARG B 19 -1.023 -13.315 -14.803 1.00 0.00 C ATOM 772 CD ARG B 19 -0.562 -12.438 -15.969 1.00 0.00 C ATOM 773 NE ARG B 19 -1.462 -12.625 -17.129 1.00 0.00 N ATOM 774 CZ ARG B 19 -1.310 -12.001 -18.306 1.00 0.00 C ATOM 775 NH1 ARG B 19 -0.293 -11.147 -18.485 1.00 0.00 N ATOM 776 NH2 ARG B 19 -2.175 -12.231 -19.303 1.00 0.00 N ATOM 0 H ARG B 19 2.258 -12.528 -13.160 1.00 0.00 H new ATOM 0 HA ARG B 19 -0.537 -11.970 -12.797 1.00 0.00 H new ATOM 0 HB2 ARG B 19 1.083 -13.630 -14.459 1.00 0.00 H new ATOM 0 HB3 ARG B 19 0.044 -14.710 -13.550 1.00 0.00 H new ATOM 0 HG2 ARG B 19 -1.486 -14.223 -15.188 1.00 0.00 H new ATOM 0 HG3 ARG B 19 -1.784 -12.789 -14.226 1.00 0.00 H new ATOM 0 HD2 ARG B 19 -0.557 -11.391 -15.667 1.00 0.00 H new ATOM 0 HD3 ARG B 19 0.460 -12.695 -16.246 1.00 0.00 H new ATOM 0 HE ARG B 19 -2.247 -13.269 -17.027 1.00 0.00 H new ATOM 0 HH11 ARG B 19 0.365 -10.972 -17.726 1.00 0.00 H new ATOM 0 HH12 ARG B 19 -0.177 -10.672 -19.380 1.00 0.00 H new ATOM 0 HH21 ARG B 19 -2.949 -12.881 -19.167 1.00 0.00 H new ATOM 0 HH22 ARG B 19 -2.059 -11.756 -20.198 1.00 0.00 H new ATOM 790 N VAL B 20 -1.106 -13.188 -10.732 1.00 0.00 N ATOM 791 CA VAL B 20 -1.468 -13.862 -9.497 1.00 0.00 C ATOM 792 C VAL B 20 -2.990 -13.846 -9.340 1.00 0.00 C ATOM 793 O VAL B 20 -3.715 -13.612 -10.305 1.00 0.00 O ATOM 794 CB VAL B 20 -0.738 -13.219 -8.316 1.00 0.00 C ATOM 795 CG1 VAL B 20 0.718 -12.913 -8.673 1.00 0.00 C ATOM 796 CG2 VAL B 20 -1.464 -11.957 -7.844 1.00 0.00 C ATOM 0 H VAL B 20 -1.744 -12.444 -11.015 1.00 0.00 H new ATOM 0 HA VAL B 20 -1.155 -14.906 -9.525 1.00 0.00 H new ATOM 0 HB VAL B 20 -0.738 -13.933 -7.493 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.214 -12.457 -7.817 1.00 0.00 H new ATOM 0 HG12 VAL B 20 1.230 -13.838 -8.938 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.749 -12.226 -9.519 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -0.925 -11.520 -7.004 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -1.510 -11.237 -8.661 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -2.476 -12.215 -7.531 1.00 0.00 H new ATOM 806 N GLN B 21 -3.429 -14.098 -8.115 1.00 0.00 N ATOM 807 CA GLN B 21 -4.851 -14.115 -7.819 1.00 0.00 C ATOM 808 C GLN B 21 -5.215 -12.954 -6.891 1.00 0.00 C ATOM 809 O GLN B 21 -4.333 -12.276 -6.365 1.00 0.00 O ATOM 810 CB GLN B 21 -5.268 -15.455 -7.209 1.00 0.00 C ATOM 811 CG GLN B 21 -6.309 -16.156 -8.085 1.00 0.00 C ATOM 812 CD GLN B 21 -6.479 -17.619 -7.670 1.00 0.00 C ATOM 813 OE1 GLN B 21 -5.581 -18.247 -7.133 1.00 0.00 O ATOM 814 NE2 GLN B 21 -7.677 -18.125 -7.948 1.00 0.00 N ATOM 0 H GLN B 21 -2.825 -14.292 -7.317 1.00 0.00 H new ATOM 0 HA GLN B 21 -5.398 -13.992 -8.754 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -4.393 -16.095 -7.095 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -5.676 -15.293 -6.211 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -7.265 -15.638 -8.005 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -6.005 -16.104 -9.130 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -8.384 -17.544 -8.399 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -7.889 -19.094 -7.710 1.00 0.00 H new ATOM 823 N TYR B 22 -6.514 -12.761 -6.719 1.00 0.00 N ATOM 824 CA TYR B 22 -7.005 -11.693 -5.864 1.00 0.00 C ATOM 825 C TYR B 22 -7.963 -12.238 -4.802 1.00 0.00 C ATOM 826 O TYR B 22 -9.129 -12.502 -5.090 1.00 0.00 O ATOM 827 CB TYR B 22 -7.769 -10.736 -6.780 1.00 0.00 C ATOM 828 CG TYR B 22 -8.111 -9.393 -6.132 1.00 0.00 C ATOM 829 CD1 TYR B 22 -7.617 -9.086 -4.880 1.00 0.00 C ATOM 830 CD2 TYR B 22 -8.913 -8.490 -6.798 1.00 0.00 C ATOM 831 CE1 TYR B 22 -7.939 -7.822 -4.269 1.00 0.00 C ATOM 832 CE2 TYR B 22 -9.235 -7.226 -6.188 1.00 0.00 C ATOM 833 CZ TYR B 22 -8.732 -6.954 -4.953 1.00 0.00 C ATOM 834 OH TYR B 22 -9.036 -5.761 -4.377 1.00 0.00 O ATOM 0 H TYR B 22 -7.242 -13.326 -7.157 1.00 0.00 H new ATOM 0 HA TYR B 22 -6.179 -11.205 -5.347 1.00 0.00 H new ATOM 0 HB2 TYR B 22 -7.175 -10.555 -7.675 1.00 0.00 H new ATOM 0 HB3 TYR B 22 -8.692 -11.218 -7.102 1.00 0.00 H new ATOM 0 HD1 TYR B 22 -6.989 -9.793 -4.359 1.00 0.00 H new ATOM 0 HD2 TYR B 22 -9.300 -8.731 -7.777 1.00 0.00 H new ATOM 0 HE1 TYR B 22 -7.559 -7.569 -3.290 1.00 0.00 H new ATOM 0 HE2 TYR B 22 -9.862 -6.510 -6.699 1.00 0.00 H new ATOM 0 HH TYR B 22 -8.346 -5.529 -3.721 1.00 0.00 H new ATOM 844 N LEU B 23 -7.435 -12.389 -3.596 1.00 0.00 N ATOM 845 CA LEU B 23 -8.228 -12.897 -2.490 1.00 0.00 C ATOM 846 C LEU B 23 -9.375 -11.926 -2.202 1.00 0.00 C ATOM 847 O LEU B 23 -10.486 -12.348 -1.887 1.00 0.00 O ATOM 848 CB LEU B 23 -7.339 -13.176 -1.277 1.00 0.00 C ATOM 849 CG LEU B 23 -6.803 -14.604 -1.153 1.00 0.00 C ATOM 850 CD1 LEU B 23 -5.372 -14.700 -1.685 1.00 0.00 C ATOM 851 CD2 LEU B 23 -6.913 -15.108 0.287 1.00 0.00 C ATOM 0 H LEU B 23 -6.467 -12.168 -3.361 1.00 0.00 H new ATOM 0 HA LEU B 23 -8.679 -13.854 -2.752 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -6.491 -12.492 -1.308 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -7.905 -12.942 -0.375 1.00 0.00 H new ATOM 0 HG LEU B 23 -7.421 -15.256 -1.770 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -5.015 -15.725 -1.585 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -5.354 -14.410 -2.736 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -4.726 -14.033 -1.114 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -6.525 -16.125 0.347 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -6.334 -14.459 0.945 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -7.958 -15.099 0.597 1.00 0.00 H new ATOM 863 N GLY B 24 -9.065 -10.643 -2.321 1.00 0.00 N ATOM 864 CA GLY B 24 -10.055 -9.608 -2.078 1.00 0.00 C ATOM 865 C GLY B 24 -9.510 -8.540 -1.127 1.00 0.00 C ATOM 866 O GLY B 24 -8.321 -8.533 -0.813 1.00 0.00 O ATOM 0 H GLY B 24 -8.142 -10.297 -2.583 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -10.343 -9.146 -3.022 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -10.955 -10.053 -1.653 1.00 0.00 H new ATOM 870 N MET B 25 -10.406 -7.664 -0.696 1.00 0.00 N ATOM 871 CA MET B 25 -10.030 -6.594 0.212 1.00 0.00 C ATOM 872 C MET B 25 -10.528 -6.879 1.630 1.00 0.00 C ATOM 873 O MET B 25 -11.692 -7.225 1.826 1.00 0.00 O ATOM 874 CB MET B 25 -10.622 -5.273 -0.282 1.00 0.00 C ATOM 875 CG MET B 25 -9.946 -4.081 0.397 1.00 0.00 C ATOM 876 SD MET B 25 -11.176 -2.895 0.916 1.00 0.00 S ATOM 877 CE MET B 25 -11.915 -3.789 2.273 1.00 0.00 C ATOM 0 H MET B 25 -11.391 -7.674 -0.959 1.00 0.00 H new ATOM 0 HA MET B 25 -8.942 -6.528 0.235 1.00 0.00 H new ATOM 0 HB2 MET B 25 -10.500 -5.197 -1.363 1.00 0.00 H new ATOM 0 HB3 MET B 25 -11.693 -5.252 -0.080 1.00 0.00 H new ATOM 0 HG2 MET B 25 -9.371 -4.421 1.258 1.00 0.00 H new ATOM 0 HG3 MET B 25 -9.243 -3.611 -0.291 1.00 0.00 H new ATOM 0 HE1 MET B 25 -12.378 -3.084 2.964 1.00 0.00 H new ATOM 0 HE2 MET B 25 -12.673 -4.472 1.889 1.00 0.00 H new ATOM 0 HE3 MET B 25 -11.146 -4.358 2.796 1.00 0.00 H new ATOM 887 N LEU B 26 -9.621 -6.722 2.584 1.00 0.00 N ATOM 888 CA LEU B 26 -9.953 -6.958 3.978 1.00 0.00 C ATOM 889 C LEU B 26 -9.789 -5.656 4.764 1.00 0.00 C ATOM 890 O LEU B 26 -8.764 -4.984 4.654 1.00 0.00 O ATOM 891 CB LEU B 26 -9.130 -8.121 4.536 1.00 0.00 C ATOM 892 CG LEU B 26 -9.928 -9.274 5.148 1.00 0.00 C ATOM 893 CD1 LEU B 26 -10.255 -8.997 6.616 1.00 0.00 C ATOM 894 CD2 LEU B 26 -11.184 -9.569 4.326 1.00 0.00 C ATOM 0 H LEU B 26 -8.657 -6.434 2.418 1.00 0.00 H new ATOM 0 HA LEU B 26 -10.996 -7.261 4.075 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -8.511 -8.520 3.733 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -8.454 -7.730 5.296 1.00 0.00 H new ATOM 0 HG LEU B 26 -9.308 -10.170 5.121 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -10.823 -9.832 7.026 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -9.329 -8.876 7.178 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -10.847 -8.085 6.691 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -11.733 -10.393 4.783 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -11.817 -8.682 4.298 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -10.898 -9.843 3.310 1.00 0.00 H new ATOM 906 N PRO B 27 -10.842 -5.329 5.561 1.00 0.00 N ATOM 907 CA PRO B 27 -10.824 -4.119 6.365 1.00 0.00 C ATOM 908 C PRO B 27 -9.910 -4.281 7.581 1.00 0.00 C ATOM 909 O PRO B 27 -10.037 -5.247 8.333 1.00 0.00 O ATOM 910 CB PRO B 27 -12.277 -3.876 6.743 1.00 0.00 C ATOM 911 CG PRO B 27 -12.989 -5.202 6.531 1.00 0.00 C ATOM 912 CD PRO B 27 -12.072 -6.099 5.717 1.00 0.00 C ATOM 0 HA PRO B 27 -10.417 -3.263 5.827 1.00 0.00 H new ATOM 0 HB2 PRO B 27 -12.362 -3.548 7.779 1.00 0.00 H new ATOM 0 HB3 PRO B 27 -12.716 -3.093 6.124 1.00 0.00 H new ATOM 0 HG2 PRO B 27 -13.225 -5.666 7.489 1.00 0.00 H new ATOM 0 HG3 PRO B 27 -13.934 -5.049 6.010 1.00 0.00 H new ATOM 0 HD2 PRO B 27 -11.886 -7.043 6.229 1.00 0.00 H new ATOM 0 HD3 PRO B 27 -12.512 -6.342 4.750 1.00 0.00 H new ATOM 920 N VAL B 28 -9.009 -3.323 7.737 1.00 0.00 N ATOM 921 CA VAL B 28 -8.074 -3.348 8.849 1.00 0.00 C ATOM 922 C VAL B 28 -8.310 -2.124 9.736 1.00 0.00 C ATOM 923 O VAL B 28 -9.308 -1.422 9.579 1.00 0.00 O ATOM 924 CB VAL B 28 -6.639 -3.437 8.324 1.00 0.00 C ATOM 925 CG1 VAL B 28 -6.442 -4.699 7.481 1.00 0.00 C ATOM 926 CG2 VAL B 28 -6.266 -2.184 7.530 1.00 0.00 C ATOM 0 H VAL B 28 -8.906 -2.524 7.112 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.237 -4.232 9.465 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.971 -3.499 9.183 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.414 -4.739 7.120 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.647 -5.579 8.090 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.125 -4.679 6.631 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.242 -2.274 7.169 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -6.942 -2.076 6.682 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.348 -1.308 8.173 1.00 0.00 H new ATOM 936 N ASP B 29 -7.375 -1.905 10.649 1.00 0.00 N ATOM 937 CA ASP B 29 -7.469 -0.779 11.562 1.00 0.00 C ATOM 938 C ASP B 29 -6.130 -0.041 11.594 1.00 0.00 C ATOM 939 O ASP B 29 -6.081 1.174 11.405 1.00 0.00 O ATOM 940 CB ASP B 29 -7.786 -1.246 12.984 1.00 0.00 C ATOM 941 CG ASP B 29 -8.180 -0.134 13.957 1.00 0.00 C ATOM 942 OD1 ASP B 29 -8.757 0.864 13.475 1.00 0.00 O ATOM 943 OD2 ASP B 29 -7.896 -0.308 15.162 1.00 0.00 O ATOM 0 H ASP B 29 -6.548 -2.489 10.776 1.00 0.00 H new ATOM 0 HA ASP B 29 -8.269 -0.127 11.211 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -8.597 -1.973 12.939 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -6.914 -1.765 13.383 1.00 0.00 H new ATOM 948 N ARG B 30 -5.075 -0.805 11.835 1.00 0.00 N ATOM 949 CA ARG B 30 -3.738 -0.239 11.894 1.00 0.00 C ATOM 950 C ARG B 30 -3.059 -0.337 10.527 1.00 0.00 C ATOM 951 O ARG B 30 -3.343 -1.249 9.752 1.00 0.00 O ATOM 952 CB ARG B 30 -2.880 -0.962 12.935 1.00 0.00 C ATOM 953 CG ARG B 30 -3.346 -0.633 14.354 1.00 0.00 C ATOM 954 CD ARG B 30 -2.986 0.806 14.730 1.00 0.00 C ATOM 955 NE ARG B 30 -3.482 1.113 16.090 1.00 0.00 N ATOM 956 CZ ARG B 30 -2.867 0.733 17.218 1.00 0.00 C ATOM 957 NH1 ARG B 30 -1.728 0.029 17.156 1.00 0.00 N ATOM 958 NH2 ARG B 30 -3.390 1.056 18.409 1.00 0.00 N ATOM 0 H ARG B 30 -5.119 -1.812 11.992 1.00 0.00 H new ATOM 0 HA ARG B 30 -3.833 0.808 12.181 1.00 0.00 H new ATOM 0 HB2 ARG B 30 -2.933 -2.038 12.771 1.00 0.00 H new ATOM 0 HB3 ARG B 30 -1.836 -0.673 12.815 1.00 0.00 H new ATOM 0 HG2 ARG B 30 -4.424 -0.773 14.428 1.00 0.00 H new ATOM 0 HG3 ARG B 30 -2.886 -1.323 15.061 1.00 0.00 H new ATOM 0 HD2 ARG B 30 -1.905 0.942 14.689 1.00 0.00 H new ATOM 0 HD3 ARG B 30 -3.422 1.499 14.010 1.00 0.00 H new ATOM 0 HE ARG B 30 -4.347 1.648 16.174 1.00 0.00 H new ATOM 0 HH11 ARG B 30 -1.329 -0.217 16.250 1.00 0.00 H new ATOM 0 HH12 ARG B 30 -1.260 -0.260 18.015 1.00 0.00 H new ATOM 0 HH21 ARG B 30 -4.257 1.591 18.457 1.00 0.00 H new ATOM 0 HH22 ARG B 30 -2.921 0.766 19.267 1.00 0.00 H new ATOM 972 N PRO B 31 -2.151 0.641 10.265 1.00 0.00 N ATOM 973 CA PRO B 31 -1.429 0.674 9.004 1.00 0.00 C ATOM 974 C PRO B 31 -0.337 -0.398 8.969 1.00 0.00 C ATOM 975 O PRO B 31 -0.022 -0.934 7.908 1.00 0.00 O ATOM 976 CB PRO B 31 -0.878 2.087 8.903 1.00 0.00 C ATOM 977 CG PRO B 31 -0.915 2.651 10.314 1.00 0.00 C ATOM 978 CD PRO B 31 -1.788 1.737 11.158 1.00 0.00 C ATOM 0 HA PRO B 31 -2.065 0.447 8.149 1.00 0.00 H new ATOM 0 HB2 PRO B 31 0.139 2.082 8.511 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -1.479 2.693 8.224 1.00 0.00 H new ATOM 0 HG2 PRO B 31 0.091 2.708 10.729 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -1.316 3.665 10.310 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -1.250 1.373 12.033 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -2.672 2.260 11.522 1.00 0.00 H new ATOM 986 N VAL B 32 0.211 -0.677 10.143 1.00 0.00 N ATOM 987 CA VAL B 32 1.261 -1.674 10.260 1.00 0.00 C ATOM 988 C VAL B 32 0.924 -2.630 11.407 1.00 0.00 C ATOM 989 O VAL B 32 0.544 -2.194 12.492 1.00 0.00 O ATOM 990 CB VAL B 32 2.617 -0.988 10.432 1.00 0.00 C ATOM 991 CG1 VAL B 32 2.827 0.088 9.365 1.00 0.00 C ATOM 992 CG2 VAL B 32 2.761 -0.402 11.838 1.00 0.00 C ATOM 0 H VAL B 32 -0.053 -0.230 11.021 1.00 0.00 H new ATOM 0 HA VAL B 32 1.327 -2.269 9.349 1.00 0.00 H new ATOM 0 HB VAL B 32 3.393 -1.743 10.303 1.00 0.00 H new ATOM 0 HG11 VAL B 32 3.799 0.560 9.510 1.00 0.00 H new ATOM 0 HG12 VAL B 32 2.790 -0.368 8.376 1.00 0.00 H new ATOM 0 HG13 VAL B 32 2.042 0.840 9.447 1.00 0.00 H new ATOM 0 HG21 VAL B 32 3.734 0.080 11.933 1.00 0.00 H new ATOM 0 HG22 VAL B 32 1.974 0.333 12.008 1.00 0.00 H new ATOM 0 HG23 VAL B 32 2.678 -1.200 12.575 1.00 0.00 H new ATOM 1002 N GLY B 33 1.077 -3.916 11.127 1.00 0.00 N ATOM 1003 CA GLY B 33 0.795 -4.937 12.121 1.00 0.00 C ATOM 1004 C GLY B 33 0.695 -6.320 11.474 1.00 0.00 C ATOM 1005 O GLY B 33 -0.247 -6.595 10.732 1.00 0.00 O ATOM 0 H GLY B 33 1.393 -4.274 10.226 1.00 0.00 H new ATOM 0 HA2 GLY B 33 1.581 -4.941 12.876 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -0.138 -4.703 12.633 1.00 0.00 H new ATOM 1009 N MET B 34 1.679 -7.153 11.779 1.00 0.00 N ATOM 1010 CA MET B 34 1.713 -8.501 11.236 1.00 0.00 C ATOM 1011 C MET B 34 0.534 -9.329 11.749 1.00 0.00 C ATOM 1012 O MET B 34 0.290 -10.434 11.267 1.00 0.00 O ATOM 1013 CB MET B 34 3.026 -9.178 11.635 1.00 0.00 C ATOM 1014 CG MET B 34 3.297 -10.404 10.760 1.00 0.00 C ATOM 1015 SD MET B 34 4.151 -9.915 9.271 1.00 0.00 S ATOM 1016 CE MET B 34 3.490 -11.115 8.127 1.00 0.00 C ATOM 0 H MET B 34 2.458 -6.921 12.395 1.00 0.00 H new ATOM 0 HA MET B 34 1.642 -8.438 10.150 1.00 0.00 H new ATOM 0 HB2 MET B 34 3.849 -8.469 11.540 1.00 0.00 H new ATOM 0 HB3 MET B 34 2.982 -9.476 12.682 1.00 0.00 H new ATOM 0 HG2 MET B 34 3.896 -11.129 11.311 1.00 0.00 H new ATOM 0 HG3 MET B 34 2.357 -10.894 10.506 1.00 0.00 H new ATOM 0 HE1 MET B 34 3.592 -10.741 7.108 1.00 0.00 H new ATOM 0 HE2 MET B 34 4.037 -12.052 8.226 1.00 0.00 H new ATOM 0 HE3 MET B 34 2.436 -11.285 8.347 1.00 0.00 H new ATOM 1026 N ASP B 35 -0.167 -8.763 12.721 1.00 0.00 N ATOM 1027 CA ASP B 35 -1.315 -9.436 13.306 1.00 0.00 C ATOM 1028 C ASP B 35 -2.579 -9.030 12.546 1.00 0.00 C ATOM 1029 O ASP B 35 -3.500 -9.832 12.393 1.00 0.00 O ATOM 1030 CB ASP B 35 -1.497 -9.040 14.772 1.00 0.00 C ATOM 1031 CG ASP B 35 -0.905 -10.021 15.785 1.00 0.00 C ATOM 1032 OD1 ASP B 35 -0.059 -10.836 15.358 1.00 0.00 O ATOM 1033 OD2 ASP B 35 -1.312 -9.934 16.964 1.00 0.00 O ATOM 0 H ASP B 35 0.038 -7.846 13.118 1.00 0.00 H new ATOM 0 HA ASP B 35 -1.146 -10.511 13.241 1.00 0.00 H new ATOM 0 HB2 ASP B 35 -1.042 -8.062 14.928 1.00 0.00 H new ATOM 0 HB3 ASP B 35 -2.563 -8.932 14.974 1.00 0.00 H new ATOM 1038 N THR B 36 -2.583 -7.787 12.088 1.00 0.00 N ATOM 1039 CA THR B 36 -3.719 -7.266 11.348 1.00 0.00 C ATOM 1040 C THR B 36 -3.693 -7.772 9.904 1.00 0.00 C ATOM 1041 O THR B 36 -4.741 -8.038 9.317 1.00 0.00 O ATOM 1042 CB THR B 36 -3.695 -5.740 11.456 1.00 0.00 C ATOM 1043 OG1 THR B 36 -4.416 -5.465 12.654 1.00 0.00 O ATOM 1044 CG2 THR B 36 -4.520 -5.061 10.361 1.00 0.00 C ATOM 0 H THR B 36 -1.817 -7.125 12.215 1.00 0.00 H new ATOM 0 HA THR B 36 -4.660 -7.622 11.768 1.00 0.00 H new ATOM 0 HB THR B 36 -2.664 -5.390 11.403 1.00 0.00 H new ATOM 0 HG1 THR B 36 -4.448 -4.497 12.802 1.00 0.00 H new ATOM 0 HG21 THR B 36 -4.469 -3.979 10.485 1.00 0.00 H new ATOM 0 HG22 THR B 36 -4.122 -5.334 9.384 1.00 0.00 H new ATOM 0 HG23 THR B 36 -5.558 -5.386 10.434 1.00 0.00 H new ATOM 1052 N LEU B 37 -2.485 -7.892 9.375 1.00 0.00 N ATOM 1053 CA LEU B 37 -2.308 -8.362 8.011 1.00 0.00 C ATOM 1054 C LEU B 37 -2.795 -9.809 7.908 1.00 0.00 C ATOM 1055 O LEU B 37 -3.773 -10.091 7.217 1.00 0.00 O ATOM 1056 CB LEU B 37 -0.859 -8.168 7.561 1.00 0.00 C ATOM 1057 CG LEU B 37 -0.564 -8.489 6.094 1.00 0.00 C ATOM 1058 CD1 LEU B 37 -0.546 -7.215 5.247 1.00 0.00 C ATOM 1059 CD2 LEU B 37 0.735 -9.286 5.958 1.00 0.00 C ATOM 0 H LEU B 37 -1.618 -7.672 9.866 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.913 -7.771 7.323 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.576 -7.132 7.750 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.219 -8.792 8.185 1.00 0.00 H new ATOM 0 HG LEU B 37 -1.369 -9.118 5.713 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.334 -7.471 4.209 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -1.517 -6.723 5.309 1.00 0.00 H new ATOM 0 HD13 LEU B 37 0.226 -6.541 5.619 1.00 0.00 H new ATOM 0 HD21 LEU B 37 0.921 -9.501 4.906 1.00 0.00 H new ATOM 0 HD22 LEU B 37 1.563 -8.704 6.362 1.00 0.00 H new ATOM 0 HD23 LEU B 37 0.647 -10.222 6.510 1.00 0.00 H new ATOM 1071 N ASN B 38 -2.091 -10.688 8.606 1.00 0.00 N ATOM 1072 CA ASN B 38 -2.439 -12.098 8.602 1.00 0.00 C ATOM 1073 C ASN B 38 -3.959 -12.244 8.703 1.00 0.00 C ATOM 1074 O ASN B 38 -4.573 -12.945 7.900 1.00 0.00 O ATOM 1075 CB ASN B 38 -1.814 -12.823 9.796 1.00 0.00 C ATOM 1076 CG ASN B 38 -0.715 -13.784 9.339 1.00 0.00 C ATOM 1077 OD1 ASN B 38 -0.969 -14.869 8.843 1.00 0.00 O ATOM 1078 ND2 ASN B 38 0.519 -13.326 9.534 1.00 0.00 N ATOM 0 H ASN B 38 -1.281 -10.450 9.178 1.00 0.00 H new ATOM 0 HA ASN B 38 -2.063 -12.536 7.677 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.399 -12.094 10.492 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -2.584 -13.375 10.335 1.00 0.00 H new ATOM 0 HD21 ASN B 38 1.322 -13.893 9.263 1.00 0.00 H new ATOM 0 HD22 ASN B 38 0.662 -12.408 9.955 1.00 0.00 H new ATOM 1085 N SER B 39 -4.521 -11.571 9.696 1.00 0.00 N ATOM 1086 CA SER B 39 -5.957 -11.617 9.912 1.00 0.00 C ATOM 1087 C SER B 39 -6.690 -11.579 8.569 1.00 0.00 C ATOM 1088 O SER B 39 -7.608 -12.364 8.337 1.00 0.00 O ATOM 1089 CB SER B 39 -6.418 -10.460 10.800 1.00 0.00 C ATOM 1090 OG SER B 39 -7.681 -10.721 11.405 1.00 0.00 O ATOM 0 H SER B 39 -4.008 -10.991 10.360 1.00 0.00 H new ATOM 0 HA SER B 39 -6.196 -12.550 10.423 1.00 0.00 H new ATOM 0 HB2 SER B 39 -5.674 -10.281 11.577 1.00 0.00 H new ATOM 0 HB3 SER B 39 -6.483 -9.549 10.204 1.00 0.00 H new ATOM 0 HG SER B 39 -7.939 -9.959 11.965 1.00 0.00 H new ATOM 1096 N ALA B 40 -6.257 -10.659 7.720 1.00 0.00 N ATOM 1097 CA ALA B 40 -6.860 -10.509 6.407 1.00 0.00 C ATOM 1098 C ALA B 40 -6.707 -11.817 5.628 1.00 0.00 C ATOM 1099 O ALA B 40 -7.698 -12.472 5.308 1.00 0.00 O ATOM 1100 CB ALA B 40 -6.221 -9.322 5.684 1.00 0.00 C ATOM 0 H ALA B 40 -5.495 -10.010 7.916 1.00 0.00 H new ATOM 0 HA ALA B 40 -7.926 -10.301 6.496 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -6.674 -9.210 4.699 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -6.383 -8.413 6.263 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -5.151 -9.496 5.574 1.00 0.00 H new ATOM 1106 N ILE B 41 -5.459 -12.158 5.345 1.00 0.00 N ATOM 1107 CA ILE B 41 -5.164 -13.376 4.609 1.00 0.00 C ATOM 1108 C ILE B 41 -6.025 -14.517 5.155 1.00 0.00 C ATOM 1109 O ILE B 41 -6.566 -15.312 4.388 1.00 0.00 O ATOM 1110 CB ILE B 41 -3.662 -13.670 4.639 1.00 0.00 C ATOM 1111 CG1 ILE B 41 -2.874 -12.569 3.927 1.00 0.00 C ATOM 1112 CG2 ILE B 41 -3.363 -15.055 4.062 1.00 0.00 C ATOM 1113 CD1 ILE B 41 -1.504 -12.367 4.576 1.00 0.00 C ATOM 0 H ILE B 41 -4.640 -11.612 5.612 1.00 0.00 H new ATOM 0 HA ILE B 41 -5.421 -13.257 3.556 1.00 0.00 H new ATOM 0 HB ILE B 41 -3.336 -13.678 5.679 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -2.748 -12.829 2.876 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -3.436 -11.636 3.959 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.289 -15.239 4.095 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.879 -15.814 4.650 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.707 -15.101 3.029 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -0.965 -11.579 4.050 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.634 -12.083 5.620 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -0.935 -13.295 4.521 1.00 0.00 H new ATOM 1125 N GLU B 42 -6.124 -14.561 6.475 1.00 0.00 N ATOM 1126 CA GLU B 42 -6.910 -15.592 7.132 1.00 0.00 C ATOM 1127 C GLU B 42 -8.398 -15.399 6.830 1.00 0.00 C ATOM 1128 O GLU B 42 -9.093 -16.352 6.480 1.00 0.00 O ATOM 1129 CB GLU B 42 -6.654 -15.599 8.641 1.00 0.00 C ATOM 1130 CG GLU B 42 -5.286 -16.205 8.961 1.00 0.00 C ATOM 1131 CD GLU B 42 -5.343 -17.040 10.242 1.00 0.00 C ATOM 1132 OE1 GLU B 42 -6.302 -17.833 10.360 1.00 0.00 O ATOM 1133 OE2 GLU B 42 -4.426 -16.867 11.074 1.00 0.00 O ATOM 0 H GLU B 42 -5.673 -13.900 7.108 1.00 0.00 H new ATOM 0 HA GLU B 42 -6.602 -16.561 6.739 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -6.704 -14.581 9.027 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -7.435 -16.169 9.144 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -4.957 -16.829 8.130 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -4.549 -15.410 9.073 1.00 0.00 H new ATOM 1140 N ASN B 43 -8.842 -14.159 6.976 1.00 0.00 N ATOM 1141 CA ASN B 43 -10.234 -13.829 6.723 1.00 0.00 C ATOM 1142 C ASN B 43 -10.591 -14.208 5.284 1.00 0.00 C ATOM 1143 O ASN B 43 -11.366 -15.136 5.056 1.00 0.00 O ATOM 1144 CB ASN B 43 -10.484 -12.329 6.892 1.00 0.00 C ATOM 1145 CG ASN B 43 -11.759 -12.073 7.699 1.00 0.00 C ATOM 1146 OD1 ASN B 43 -12.796 -12.677 7.477 1.00 0.00 O ATOM 1147 ND2 ASN B 43 -11.625 -11.147 8.643 1.00 0.00 N ATOM 0 H ASN B 43 -8.263 -13.371 7.266 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.846 -14.380 7.437 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.633 -11.869 7.394 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.569 -11.858 5.913 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.419 -10.904 9.235 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -10.728 -10.680 8.775 1.00 0.00 H new ATOM 1154 N LEU B 44 -10.008 -13.471 4.350 1.00 0.00 N ATOM 1155 CA LEU B 44 -10.254 -13.718 2.940 1.00 0.00 C ATOM 1156 C LEU B 44 -10.168 -15.221 2.667 1.00 0.00 C ATOM 1157 O LEU B 44 -11.077 -15.801 2.074 1.00 0.00 O ATOM 1158 CB LEU B 44 -9.308 -12.881 2.076 1.00 0.00 C ATOM 1159 CG LEU B 44 -9.692 -11.412 1.891 1.00 0.00 C ATOM 1160 CD1 LEU B 44 -8.530 -10.612 1.299 1.00 0.00 C ATOM 1161 CD2 LEU B 44 -10.964 -11.279 1.052 1.00 0.00 C ATOM 0 H LEU B 44 -9.366 -12.702 4.543 1.00 0.00 H new ATOM 0 HA LEU B 44 -11.261 -13.401 2.668 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.312 -12.923 2.517 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -9.240 -13.345 1.092 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.908 -10.990 2.872 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.829 -9.571 1.178 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.672 -10.667 1.969 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.260 -11.027 0.328 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -11.215 -10.225 0.936 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.800 -11.723 0.070 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -11.785 -11.794 1.551 1.00 0.00 H new ATOM 1173 N MET B 45 -9.067 -15.809 3.113 1.00 0.00 N ATOM 1174 CA MET B 45 -8.851 -17.233 2.924 1.00 0.00 C ATOM 1175 C MET B 45 -10.156 -18.013 3.093 1.00 0.00 C ATOM 1176 O MET B 45 -10.496 -18.850 2.257 1.00 0.00 O ATOM 1177 CB MET B 45 -7.823 -17.732 3.941 1.00 0.00 C ATOM 1178 CG MET B 45 -6.416 -17.739 3.340 1.00 0.00 C ATOM 1179 SD MET B 45 -6.174 -19.217 2.369 1.00 0.00 S ATOM 1180 CE MET B 45 -5.116 -18.574 1.083 1.00 0.00 C ATOM 0 H MET B 45 -8.316 -15.325 3.604 1.00 0.00 H new ATOM 0 HA MET B 45 -8.482 -17.394 1.911 1.00 0.00 H new ATOM 0 HB2 MET B 45 -7.842 -17.094 4.825 1.00 0.00 H new ATOM 0 HB3 MET B 45 -8.088 -18.738 4.268 1.00 0.00 H new ATOM 0 HG2 MET B 45 -6.274 -16.857 2.716 1.00 0.00 H new ATOM 0 HG3 MET B 45 -5.672 -17.690 4.135 1.00 0.00 H new ATOM 0 HE1 MET B 45 -5.383 -19.031 0.130 1.00 0.00 H new ATOM 0 HE2 MET B 45 -5.241 -17.493 1.015 1.00 0.00 H new ATOM 0 HE3 MET B 45 -4.077 -18.805 1.318 1.00 0.00 H new ATOM 1190 N THR B 46 -10.853 -17.711 4.179 1.00 0.00 N ATOM 1191 CA THR B 46 -12.114 -18.373 4.467 1.00 0.00 C ATOM 1192 C THR B 46 -13.273 -17.625 3.806 1.00 0.00 C ATOM 1193 O THR B 46 -14.237 -18.242 3.355 1.00 0.00 O ATOM 1194 CB THR B 46 -12.251 -18.486 5.987 1.00 0.00 C ATOM 1195 OG1 THR B 46 -13.580 -18.962 6.181 1.00 0.00 O ATOM 1196 CG2 THR B 46 -12.240 -17.121 6.679 1.00 0.00 C ATOM 0 H THR B 46 -10.568 -17.017 4.870 1.00 0.00 H new ATOM 0 HA THR B 46 -12.138 -19.379 4.048 1.00 0.00 H new ATOM 0 HB THR B 46 -11.440 -19.099 6.380 1.00 0.00 H new ATOM 0 HG1 THR B 46 -13.754 -19.066 7.140 1.00 0.00 H new ATOM 0 HG21 THR B 46 -12.340 -17.258 7.756 1.00 0.00 H new ATOM 0 HG22 THR B 46 -11.301 -16.612 6.464 1.00 0.00 H new ATOM 0 HG23 THR B 46 -13.071 -16.520 6.311 1.00 0.00 H new ATOM 1204 N SER B 47 -13.140 -16.308 3.769 1.00 0.00 N ATOM 1205 CA SER B 47 -14.164 -15.469 3.170 1.00 0.00 C ATOM 1206 C SER B 47 -14.717 -16.137 1.909 1.00 0.00 C ATOM 1207 O SER B 47 -15.865 -16.577 1.888 1.00 0.00 O ATOM 1208 CB SER B 47 -13.614 -14.081 2.837 1.00 0.00 C ATOM 1209 OG SER B 47 -14.654 -13.147 2.559 1.00 0.00 O ATOM 0 H SER B 47 -12.339 -15.801 4.144 1.00 0.00 H new ATOM 0 HA SER B 47 -14.971 -15.347 3.893 1.00 0.00 H new ATOM 0 HB2 SER B 47 -13.015 -13.718 3.672 1.00 0.00 H new ATOM 0 HB3 SER B 47 -12.950 -14.151 1.975 1.00 0.00 H new ATOM 0 HG SER B 47 -14.262 -12.273 2.353 1.00 0.00 H new ATOM 1215 N SER B 48 -13.874 -16.192 0.889 1.00 0.00 N ATOM 1216 CA SER B 48 -14.263 -16.799 -0.372 1.00 0.00 C ATOM 1217 C SER B 48 -13.470 -18.088 -0.600 1.00 0.00 C ATOM 1218 O SER B 48 -12.699 -18.507 0.262 1.00 0.00 O ATOM 1219 CB SER B 48 -14.050 -15.832 -1.538 1.00 0.00 C ATOM 1220 OG SER B 48 -14.722 -14.592 -1.333 1.00 0.00 O ATOM 0 H SER B 48 -12.922 -15.826 0.910 1.00 0.00 H new ATOM 0 HA SER B 48 -15.325 -17.038 -0.323 1.00 0.00 H new ATOM 0 HB2 SER B 48 -12.983 -15.649 -1.667 1.00 0.00 H new ATOM 0 HB3 SER B 48 -14.409 -16.291 -2.459 1.00 0.00 H new ATOM 0 HG SER B 48 -14.560 -14.002 -2.098 1.00 0.00 H new ATOM 1226 N SER B 49 -13.687 -18.680 -1.765 1.00 0.00 N ATOM 1227 CA SER B 49 -13.002 -19.913 -2.117 1.00 0.00 C ATOM 1228 C SER B 49 -11.687 -19.595 -2.831 1.00 0.00 C ATOM 1229 O SER B 49 -11.314 -18.430 -2.963 1.00 0.00 O ATOM 1230 CB SER B 49 -13.883 -20.800 -2.997 1.00 0.00 C ATOM 1231 OG SER B 49 -15.032 -21.273 -2.299 1.00 0.00 O ATOM 0 H SER B 49 -14.327 -18.329 -2.477 1.00 0.00 H new ATOM 0 HA SER B 49 -12.786 -20.459 -1.199 1.00 0.00 H new ATOM 0 HB2 SER B 49 -14.199 -20.239 -3.876 1.00 0.00 H new ATOM 0 HB3 SER B 49 -13.300 -21.649 -3.354 1.00 0.00 H new ATOM 0 HG SER B 49 -15.569 -21.834 -2.896 1.00 0.00 H new ATOM 1237 N LYS B 50 -11.020 -20.651 -3.272 1.00 0.00 N ATOM 1238 CA LYS B 50 -9.754 -20.499 -3.969 1.00 0.00 C ATOM 1239 C LYS B 50 -10.022 -20.229 -5.451 1.00 0.00 C ATOM 1240 O LYS B 50 -9.284 -19.483 -6.093 1.00 0.00 O ATOM 1241 CB LYS B 50 -8.855 -21.712 -3.718 1.00 0.00 C ATOM 1242 CG LYS B 50 -7.922 -21.957 -4.905 1.00 0.00 C ATOM 1243 CD LYS B 50 -6.594 -22.561 -4.443 1.00 0.00 C ATOM 1244 CE LYS B 50 -5.463 -21.534 -4.537 1.00 0.00 C ATOM 1245 NZ LYS B 50 -4.484 -21.935 -5.572 1.00 0.00 N ATOM 0 H LYS B 50 -11.332 -21.616 -3.160 1.00 0.00 H new ATOM 0 HA LYS B 50 -9.207 -19.640 -3.582 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -8.266 -21.552 -2.815 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -9.470 -22.595 -3.546 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -8.402 -22.628 -5.617 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -7.737 -21.018 -5.426 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -6.688 -22.911 -3.415 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -6.353 -23.430 -5.055 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -5.873 -20.553 -4.777 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -4.965 -21.444 -3.572 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -3.540 -21.584 -5.312 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -4.460 -22.972 -5.644 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -4.763 -21.531 -6.489 1.00 0.00 H new ATOM 1259 N GLU B 51 -11.081 -20.849 -5.951 1.00 0.00 N ATOM 1260 CA GLU B 51 -11.456 -20.684 -7.345 1.00 0.00 C ATOM 1261 C GLU B 51 -12.160 -19.342 -7.550 1.00 0.00 C ATOM 1262 O GLU B 51 -12.207 -18.825 -8.665 1.00 0.00 O ATOM 1263 CB GLU B 51 -12.336 -21.843 -7.816 1.00 0.00 C ATOM 1264 CG GLU B 51 -11.512 -22.882 -8.580 1.00 0.00 C ATOM 1265 CD GLU B 51 -12.126 -23.169 -9.952 1.00 0.00 C ATOM 1266 OE1 GLU B 51 -12.236 -22.203 -10.737 1.00 0.00 O ATOM 1267 OE2 GLU B 51 -12.472 -24.348 -10.183 1.00 0.00 O ATOM 0 H GLU B 51 -11.691 -21.466 -5.415 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.549 -20.691 -7.949 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -12.815 -22.313 -6.957 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -13.132 -21.463 -8.456 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -10.491 -22.522 -8.703 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -11.457 -23.805 -8.002 1.00 0.00 H new ATOM 1274 N ASP B 52 -12.691 -18.815 -6.456 1.00 0.00 N ATOM 1275 CA ASP B 52 -13.392 -17.543 -6.502 1.00 0.00 C ATOM 1276 C ASP B 52 -12.387 -16.423 -6.781 1.00 0.00 C ATOM 1277 O ASP B 52 -12.700 -15.465 -7.486 1.00 0.00 O ATOM 1278 CB ASP B 52 -14.076 -17.243 -5.167 1.00 0.00 C ATOM 1279 CG ASP B 52 -15.360 -16.417 -5.271 1.00 0.00 C ATOM 1280 OD1 ASP B 52 -15.272 -15.297 -5.818 1.00 0.00 O ATOM 1281 OD2 ASP B 52 -16.401 -16.925 -4.800 1.00 0.00 O ATOM 0 H ASP B 52 -12.650 -19.246 -5.532 1.00 0.00 H new ATOM 0 HA ASP B 52 -14.145 -17.600 -7.288 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -14.308 -18.187 -4.674 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.372 -16.713 -4.526 1.00 0.00 H new ATOM 1286 N TRP B 53 -11.201 -16.580 -6.213 1.00 0.00 N ATOM 1287 CA TRP B 53 -10.149 -15.594 -6.392 1.00 0.00 C ATOM 1288 C TRP B 53 -9.894 -15.441 -7.893 1.00 0.00 C ATOM 1289 O TRP B 53 -9.384 -16.357 -8.536 1.00 0.00 O ATOM 1290 CB TRP B 53 -8.893 -15.984 -5.609 1.00 0.00 C ATOM 1291 CG TRP B 53 -9.162 -16.368 -4.153 1.00 0.00 C ATOM 1292 CD1 TRP B 53 -10.085 -15.863 -3.323 1.00 0.00 C ATOM 1293 CD2 TRP B 53 -8.459 -17.367 -3.383 1.00 0.00 C ATOM 1294 NE1 TRP B 53 -10.028 -16.460 -2.080 1.00 0.00 N ATOM 1295 CE2 TRP B 53 -9.008 -17.403 -2.118 1.00 0.00 C ATOM 1296 CE3 TRP B 53 -7.394 -18.211 -3.745 1.00 0.00 C ATOM 1297 CZ2 TRP B 53 -8.559 -18.267 -1.112 1.00 0.00 C ATOM 1298 CZ3 TRP B 53 -6.956 -19.068 -2.728 1.00 0.00 C ATOM 1299 CH2 TRP B 53 -7.499 -19.117 -1.449 1.00 0.00 C ATOM 0 H TRP B 53 -10.945 -17.375 -5.628 1.00 0.00 H new ATOM 0 HA TRP B 53 -10.454 -14.628 -5.991 1.00 0.00 H new ATOM 0 HB2 TRP B 53 -8.409 -16.822 -6.112 1.00 0.00 H new ATOM 0 HB3 TRP B 53 -8.191 -15.151 -5.630 1.00 0.00 H new ATOM 0 HD1 TRP B 53 -10.785 -15.086 -3.593 1.00 0.00 H new ATOM 0 HE1 TRP B 53 -10.625 -16.248 -1.280 1.00 0.00 H new ATOM 0 HE3 TRP B 53 -6.949 -18.199 -4.729 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 -9.006 -18.277 -0.129 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 -6.139 -19.738 -2.953 1.00 0.00 H new ATOM 0 HH2 TRP B 53 -7.105 -19.808 -0.719 1.00 0.00 H new ATOM 1310 N PRO B 54 -10.271 -14.246 -8.420 1.00 0.00 N ATOM 1311 CA PRO B 54 -10.088 -13.961 -9.834 1.00 0.00 C ATOM 1312 C PRO B 54 -8.619 -13.677 -10.151 1.00 0.00 C ATOM 1313 O PRO B 54 -7.861 -13.259 -9.276 1.00 0.00 O ATOM 1314 CB PRO B 54 -10.996 -12.775 -10.116 1.00 0.00 C ATOM 1315 CG PRO B 54 -11.297 -12.149 -8.764 1.00 0.00 C ATOM 1316 CD PRO B 54 -10.877 -13.137 -7.689 1.00 0.00 C ATOM 0 HA PRO B 54 -10.349 -14.807 -10.471 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -10.509 -12.059 -10.778 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -11.913 -13.094 -10.611 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -10.757 -11.209 -8.650 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -12.359 -11.920 -8.678 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -10.169 -12.687 -6.993 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -11.733 -13.470 -7.102 1.00 0.00 H new ATOM 1324 N SER B 55 -8.260 -13.916 -11.404 1.00 0.00 N ATOM 1325 CA SER B 55 -6.895 -13.691 -11.847 1.00 0.00 C ATOM 1326 C SER B 55 -6.676 -12.205 -12.136 1.00 0.00 C ATOM 1327 O SER B 55 -7.468 -11.584 -12.843 1.00 0.00 O ATOM 1328 CB SER B 55 -6.574 -14.526 -13.088 1.00 0.00 C ATOM 1329 OG SER B 55 -7.683 -14.605 -13.980 1.00 0.00 O ATOM 0 H SER B 55 -8.891 -14.263 -12.126 1.00 0.00 H new ATOM 0 HA SER B 55 -6.221 -14.002 -11.049 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.721 -14.090 -13.608 1.00 0.00 H new ATOM 0 HB3 SER B 55 -6.282 -15.531 -12.783 1.00 0.00 H new ATOM 0 HG SER B 55 -7.437 -15.145 -14.760 1.00 0.00 H new ATOM 1335 N VAL B 56 -5.598 -11.678 -11.575 1.00 0.00 N ATOM 1336 CA VAL B 56 -5.265 -10.276 -11.764 1.00 0.00 C ATOM 1337 C VAL B 56 -3.808 -10.158 -12.215 1.00 0.00 C ATOM 1338 O VAL B 56 -3.084 -11.152 -12.253 1.00 0.00 O ATOM 1339 CB VAL B 56 -5.560 -9.491 -10.485 1.00 0.00 C ATOM 1340 CG1 VAL B 56 -7.043 -9.577 -10.118 1.00 0.00 C ATOM 1341 CG2 VAL B 56 -4.681 -9.974 -9.330 1.00 0.00 C ATOM 0 H VAL B 56 -4.943 -12.197 -10.989 1.00 0.00 H new ATOM 0 HA VAL B 56 -5.884 -9.839 -12.548 1.00 0.00 H new ATOM 0 HB VAL B 56 -5.321 -8.444 -10.673 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -7.225 -9.010 -9.205 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -7.643 -9.163 -10.928 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -7.319 -10.620 -9.959 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -4.911 -9.399 -8.433 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.873 -11.031 -9.143 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -3.631 -9.837 -9.590 1.00 0.00 H new ATOM 1351 N ASN B 57 -3.421 -8.935 -12.545 1.00 0.00 N ATOM 1352 CA ASN B 57 -2.063 -8.675 -12.992 1.00 0.00 C ATOM 1353 C ASN B 57 -1.460 -7.550 -12.147 1.00 0.00 C ATOM 1354 O ASN B 57 -1.832 -6.388 -12.298 1.00 0.00 O ATOM 1355 CB ASN B 57 -2.040 -8.231 -14.456 1.00 0.00 C ATOM 1356 CG ASN B 57 -2.351 -9.403 -15.389 1.00 0.00 C ATOM 1357 OD1 ASN B 57 -2.463 -10.545 -14.977 1.00 0.00 O ATOM 1358 ND2 ASN B 57 -2.484 -9.057 -16.666 1.00 0.00 N ATOM 0 H ASN B 57 -4.024 -8.113 -12.512 1.00 0.00 H new ATOM 0 HA ASN B 57 -1.491 -9.597 -12.886 1.00 0.00 H new ATOM 0 HB2 ASN B 57 -2.769 -7.435 -14.610 1.00 0.00 H new ATOM 0 HB3 ASN B 57 -1.061 -7.818 -14.699 1.00 0.00 H new ATOM 0 HD21 ASN B 57 -2.692 -9.767 -17.368 1.00 0.00 H new ATOM 0 HD22 ASN B 57 -2.378 -8.081 -16.944 1.00 0.00 H new ATOM 1365 N MET B 58 -0.538 -7.936 -11.278 1.00 0.00 N ATOM 1366 CA MET B 58 0.121 -6.975 -10.409 1.00 0.00 C ATOM 1367 C MET B 58 1.273 -6.279 -11.136 1.00 0.00 C ATOM 1368 O MET B 58 2.309 -6.890 -11.394 1.00 0.00 O ATOM 1369 CB MET B 58 0.658 -7.692 -9.169 1.00 0.00 C ATOM 1370 CG MET B 58 1.573 -6.772 -8.358 1.00 0.00 C ATOM 1371 SD MET B 58 1.920 -7.505 -6.767 1.00 0.00 S ATOM 1372 CE MET B 58 0.257 -7.833 -6.208 1.00 0.00 C ATOM 0 H MET B 58 -0.231 -8.901 -11.157 1.00 0.00 H new ATOM 0 HA MET B 58 -0.608 -6.219 -10.115 1.00 0.00 H new ATOM 0 HB2 MET B 58 -0.174 -8.024 -8.547 1.00 0.00 H new ATOM 0 HB3 MET B 58 1.207 -8.584 -9.470 1.00 0.00 H new ATOM 0 HG2 MET B 58 2.503 -6.601 -8.900 1.00 0.00 H new ATOM 0 HG3 MET B 58 1.099 -5.800 -8.224 1.00 0.00 H new ATOM 0 HE1 MET B 58 0.217 -7.760 -5.121 1.00 0.00 H new ATOM 0 HE2 MET B 58 -0.425 -7.104 -6.646 1.00 0.00 H new ATOM 0 HE3 MET B 58 -0.039 -8.836 -6.515 1.00 0.00 H new ATOM 1382 N ASN B 59 1.054 -5.010 -11.446 1.00 0.00 N ATOM 1383 CA ASN B 59 2.061 -4.224 -12.138 1.00 0.00 C ATOM 1384 C ASN B 59 2.923 -3.488 -11.110 1.00 0.00 C ATOM 1385 O ASN B 59 2.407 -2.723 -10.297 1.00 0.00 O ATOM 1386 CB ASN B 59 1.414 -3.178 -13.049 1.00 0.00 C ATOM 1387 CG ASN B 59 0.738 -3.840 -14.251 1.00 0.00 C ATOM 1388 OD1 ASN B 59 1.097 -3.621 -15.396 1.00 0.00 O ATOM 1389 ND2 ASN B 59 -0.258 -4.660 -13.928 1.00 0.00 N ATOM 0 H ASN B 59 0.194 -4.506 -11.231 1.00 0.00 H new ATOM 0 HA ASN B 59 2.663 -4.904 -12.741 1.00 0.00 H new ATOM 0 HB2 ASN B 59 0.679 -2.604 -12.485 1.00 0.00 H new ATOM 0 HB3 ASN B 59 2.171 -2.474 -13.395 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -0.772 -5.150 -14.660 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -0.507 -4.798 -12.949 1.00 0.00 H new ATOM 1396 N VAL B 60 4.221 -3.745 -11.181 1.00 0.00 N ATOM 1397 CA VAL B 60 5.159 -3.117 -10.266 1.00 0.00 C ATOM 1398 C VAL B 60 6.207 -2.343 -11.069 1.00 0.00 C ATOM 1399 O VAL B 60 7.058 -2.942 -11.725 1.00 0.00 O ATOM 1400 CB VAL B 60 5.772 -4.169 -9.340 1.00 0.00 C ATOM 1401 CG1 VAL B 60 6.624 -3.513 -8.252 1.00 0.00 C ATOM 1402 CG2 VAL B 60 4.688 -5.058 -8.726 1.00 0.00 C ATOM 0 H VAL B 60 4.645 -4.379 -11.858 1.00 0.00 H new ATOM 0 HA VAL B 60 4.645 -2.400 -9.625 1.00 0.00 H new ATOM 0 HB VAL B 60 6.425 -4.803 -9.940 1.00 0.00 H new ATOM 0 HG11 VAL B 60 7.048 -4.283 -7.608 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.430 -2.943 -8.715 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.002 -2.844 -7.657 1.00 0.00 H new ATOM 0 HG21 VAL B 60 5.151 -5.797 -8.072 1.00 0.00 H new ATOM 0 HG22 VAL B 60 3.998 -4.444 -8.148 1.00 0.00 H new ATOM 0 HG23 VAL B 60 4.142 -5.567 -9.520 1.00 0.00 H new ATOM 1412 N ALA B 61 6.110 -1.024 -10.991 1.00 0.00 N ATOM 1413 CA ALA B 61 7.039 -0.163 -11.702 1.00 0.00 C ATOM 1414 C ALA B 61 6.982 1.245 -11.106 1.00 0.00 C ATOM 1415 O ALA B 61 6.070 1.563 -10.343 1.00 0.00 O ATOM 1416 CB ALA B 61 6.708 -0.177 -13.196 1.00 0.00 C ATOM 0 H ALA B 61 5.402 -0.531 -10.446 1.00 0.00 H new ATOM 0 HA ALA B 61 8.060 -0.527 -11.591 1.00 0.00 H new ATOM 0 HB1 ALA B 61 7.405 0.469 -13.729 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.792 -1.195 -13.578 1.00 0.00 H new ATOM 0 HB3 ALA B 61 5.691 0.184 -13.347 1.00 0.00 H new ATOM 1422 N ASP B 62 7.967 2.051 -11.475 1.00 0.00 N ATOM 1423 CA ASP B 62 8.039 3.417 -10.986 1.00 0.00 C ATOM 1424 C ASP B 62 7.664 3.444 -9.503 1.00 0.00 C ATOM 1425 O ASP B 62 7.146 4.444 -9.008 1.00 0.00 O ATOM 1426 CB ASP B 62 7.063 4.324 -11.738 1.00 0.00 C ATOM 1427 CG ASP B 62 7.619 5.696 -12.121 1.00 0.00 C ATOM 1428 OD1 ASP B 62 8.853 5.777 -12.306 1.00 0.00 O ATOM 1429 OD2 ASP B 62 6.799 6.634 -12.221 1.00 0.00 O ATOM 0 H ASP B 62 8.722 1.784 -12.107 1.00 0.00 H new ATOM 0 HA ASP B 62 9.056 3.777 -11.140 1.00 0.00 H new ATOM 0 HB2 ASP B 62 6.741 3.813 -12.645 1.00 0.00 H new ATOM 0 HB3 ASP B 62 6.176 4.468 -11.122 1.00 0.00 H new ATOM 1434 N ALA B 63 7.939 2.333 -8.836 1.00 0.00 N ATOM 1435 CA ALA B 63 7.637 2.217 -7.419 1.00 0.00 C ATOM 1436 C ALA B 63 6.125 2.336 -7.213 1.00 0.00 C ATOM 1437 O ALA B 63 5.669 3.104 -6.367 1.00 0.00 O ATOM 1438 CB ALA B 63 8.417 3.279 -6.642 1.00 0.00 C ATOM 0 H ALA B 63 8.368 1.505 -9.250 1.00 0.00 H new ATOM 0 HA ALA B 63 7.946 1.243 -7.039 1.00 0.00 H new ATOM 0 HB1 ALA B 63 8.190 3.192 -5.579 1.00 0.00 H new ATOM 0 HB2 ALA B 63 9.486 3.133 -6.798 1.00 0.00 H new ATOM 0 HB3 ALA B 63 8.131 4.270 -6.994 1.00 0.00 H new ATOM 1444 N THR B 64 5.390 1.565 -8.001 1.00 0.00 N ATOM 1445 CA THR B 64 3.940 1.575 -7.916 1.00 0.00 C ATOM 1446 C THR B 64 3.381 0.176 -8.182 1.00 0.00 C ATOM 1447 O THR B 64 3.736 -0.461 -9.172 1.00 0.00 O ATOM 1448 CB THR B 64 3.416 2.634 -8.889 1.00 0.00 C ATOM 1449 OG1 THR B 64 3.991 3.850 -8.421 1.00 0.00 O ATOM 1450 CG2 THR B 64 1.909 2.858 -8.754 1.00 0.00 C ATOM 0 H THR B 64 5.772 0.929 -8.701 1.00 0.00 H new ATOM 0 HA THR B 64 3.604 1.840 -6.913 1.00 0.00 H new ATOM 0 HB THR B 64 3.648 2.335 -9.911 1.00 0.00 H new ATOM 0 HG1 THR B 64 3.705 4.590 -8.996 1.00 0.00 H new ATOM 0 HG21 THR B 64 1.589 3.618 -9.466 1.00 0.00 H new ATOM 0 HG22 THR B 64 1.383 1.925 -8.958 1.00 0.00 H new ATOM 0 HG23 THR B 64 1.680 3.190 -7.741 1.00 0.00 H new ATOM 1458 N VAL B 65 2.514 -0.261 -7.280 1.00 0.00 N ATOM 1459 CA VAL B 65 1.903 -1.573 -7.404 1.00 0.00 C ATOM 1460 C VAL B 65 0.440 -1.411 -7.823 1.00 0.00 C ATOM 1461 O VAL B 65 -0.404 -1.033 -7.012 1.00 0.00 O ATOM 1462 CB VAL B 65 2.067 -2.354 -6.098 1.00 0.00 C ATOM 1463 CG1 VAL B 65 1.212 -3.622 -6.106 1.00 0.00 C ATOM 1464 CG2 VAL B 65 3.538 -2.685 -5.840 1.00 0.00 C ATOM 0 H VAL B 65 2.220 0.271 -6.460 1.00 0.00 H new ATOM 0 HA VAL B 65 2.402 -2.154 -8.179 1.00 0.00 H new ATOM 0 HB VAL B 65 1.718 -1.721 -5.282 1.00 0.00 H new ATOM 0 HG11 VAL B 65 1.347 -4.158 -5.167 1.00 0.00 H new ATOM 0 HG12 VAL B 65 0.162 -3.352 -6.222 1.00 0.00 H new ATOM 0 HG13 VAL B 65 1.516 -4.261 -6.935 1.00 0.00 H new ATOM 0 HG21 VAL B 65 3.628 -3.240 -4.906 1.00 0.00 H new ATOM 0 HG22 VAL B 65 3.924 -3.290 -6.660 1.00 0.00 H new ATOM 0 HG23 VAL B 65 4.112 -1.761 -5.769 1.00 0.00 H new ATOM 1474 N THR B 66 0.185 -1.706 -9.089 1.00 0.00 N ATOM 1475 CA THR B 66 -1.161 -1.598 -9.626 1.00 0.00 C ATOM 1476 C THR B 66 -1.669 -2.970 -10.074 1.00 0.00 C ATOM 1477 O THR B 66 -0.964 -3.701 -10.768 1.00 0.00 O ATOM 1478 CB THR B 66 -1.140 -0.562 -10.751 1.00 0.00 C ATOM 1479 OG1 THR B 66 -0.680 0.629 -10.118 1.00 0.00 O ATOM 1480 CG2 THR B 66 -2.543 -0.204 -11.245 1.00 0.00 C ATOM 0 H THR B 66 0.888 -2.020 -9.759 1.00 0.00 H new ATOM 0 HA THR B 66 -1.863 -1.259 -8.865 1.00 0.00 H new ATOM 0 HB THR B 66 -0.549 -0.943 -11.584 1.00 0.00 H new ATOM 0 HG1 THR B 66 -0.635 1.353 -10.777 1.00 0.00 H new ATOM 0 HG21 THR B 66 -2.470 0.535 -12.043 1.00 0.00 H new ATOM 0 HG22 THR B 66 -3.035 -1.100 -11.624 1.00 0.00 H new ATOM 0 HG23 THR B 66 -3.125 0.208 -10.421 1.00 0.00 H new ATOM 1488 N VAL B 67 -2.888 -3.279 -9.658 1.00 0.00 N ATOM 1489 CA VAL B 67 -3.498 -4.551 -10.007 1.00 0.00 C ATOM 1490 C VAL B 67 -4.483 -4.340 -11.159 1.00 0.00 C ATOM 1491 O VAL B 67 -5.602 -3.875 -10.946 1.00 0.00 O ATOM 1492 CB VAL B 67 -4.149 -5.176 -8.771 1.00 0.00 C ATOM 1493 CG1 VAL B 67 -4.859 -6.483 -9.128 1.00 0.00 C ATOM 1494 CG2 VAL B 67 -3.119 -5.397 -7.662 1.00 0.00 C ATOM 0 H VAL B 67 -3.470 -2.671 -9.082 1.00 0.00 H new ATOM 0 HA VAL B 67 -2.741 -5.256 -10.351 1.00 0.00 H new ATOM 0 HB VAL B 67 -4.899 -4.478 -8.398 1.00 0.00 H new ATOM 0 HG11 VAL B 67 -5.313 -6.907 -8.232 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -5.634 -6.286 -9.869 1.00 0.00 H new ATOM 0 HG13 VAL B 67 -4.137 -7.189 -9.537 1.00 0.00 H new ATOM 0 HG21 VAL B 67 -3.607 -5.842 -6.795 1.00 0.00 H new ATOM 0 HG22 VAL B 67 -2.336 -6.066 -8.020 1.00 0.00 H new ATOM 0 HG23 VAL B 67 -2.678 -4.441 -7.379 1.00 0.00 H new ATOM 1504 N ILE B 68 -4.031 -4.691 -12.353 1.00 0.00 N ATOM 1505 CA ILE B 68 -4.858 -4.546 -13.539 1.00 0.00 C ATOM 1506 C ILE B 68 -5.578 -5.867 -13.818 1.00 0.00 C ATOM 1507 O ILE B 68 -5.116 -6.929 -13.403 1.00 0.00 O ATOM 1508 CB ILE B 68 -4.023 -4.040 -14.717 1.00 0.00 C ATOM 1509 CG1 ILE B 68 -3.111 -2.889 -14.287 1.00 0.00 C ATOM 1510 CG2 ILE B 68 -4.916 -3.654 -15.897 1.00 0.00 C ATOM 1511 CD1 ILE B 68 -2.222 -2.432 -15.446 1.00 0.00 C ATOM 0 H ILE B 68 -3.102 -5.076 -12.525 1.00 0.00 H new ATOM 0 HA ILE B 68 -5.627 -3.791 -13.377 1.00 0.00 H new ATOM 0 HB ILE B 68 -3.379 -4.853 -15.054 1.00 0.00 H new ATOM 0 HG12 ILE B 68 -3.716 -2.053 -13.936 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -2.489 -3.206 -13.450 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -4.297 -3.298 -16.720 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -5.486 -4.524 -16.222 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -5.602 -2.864 -15.591 1.00 0.00 H new ATOM 0 HD11 ILE B 68 -1.584 -1.613 -15.114 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.601 -3.264 -15.779 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -2.847 -2.093 -16.272 1.00 0.00 H new ATOM 1523 N SER B 69 -6.696 -5.758 -14.520 1.00 0.00 N ATOM 1524 CA SER B 69 -7.484 -6.931 -14.859 1.00 0.00 C ATOM 1525 C SER B 69 -6.707 -7.819 -15.832 1.00 0.00 C ATOM 1526 O SER B 69 -6.379 -7.395 -16.940 1.00 0.00 O ATOM 1527 CB SER B 69 -8.832 -6.533 -15.465 1.00 0.00 C ATOM 1528 OG SER B 69 -9.867 -7.446 -15.110 1.00 0.00 O ATOM 0 H SER B 69 -7.075 -4.876 -14.863 1.00 0.00 H new ATOM 0 HA SER B 69 -7.678 -7.489 -13.943 1.00 0.00 H new ATOM 0 HB2 SER B 69 -9.100 -5.532 -15.127 1.00 0.00 H new ATOM 0 HB3 SER B 69 -8.743 -6.490 -16.551 1.00 0.00 H new ATOM 0 HG SER B 69 -10.711 -7.157 -15.514 1.00 0.00 H new ATOM 1534 N GLU B 70 -6.434 -9.036 -15.384 1.00 0.00 N ATOM 1535 CA GLU B 70 -5.702 -9.988 -16.201 1.00 0.00 C ATOM 1536 C GLU B 70 -6.137 -9.878 -17.664 1.00 0.00 C ATOM 1537 O GLU B 70 -5.299 -9.812 -18.561 1.00 0.00 O ATOM 1538 CB GLU B 70 -5.887 -11.415 -15.680 1.00 0.00 C ATOM 1539 CG GLU B 70 -4.578 -12.203 -15.764 1.00 0.00 C ATOM 1540 CD GLU B 70 -4.848 -13.685 -16.034 1.00 0.00 C ATOM 1541 OE1 GLU B 70 -5.685 -13.957 -16.922 1.00 0.00 O ATOM 1542 OE2 GLU B 70 -4.210 -14.512 -15.347 1.00 0.00 O ATOM 0 H GLU B 70 -6.707 -9.384 -14.465 1.00 0.00 H new ATOM 0 HA GLU B 70 -4.640 -9.748 -16.139 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -6.233 -11.387 -14.647 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -6.658 -11.921 -16.261 1.00 0.00 H new ATOM 0 HG2 GLU B 70 -3.953 -11.793 -16.557 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -4.023 -12.094 -14.832 1.00 0.00 H new ATOM 1549 N LYS B 71 -7.448 -9.861 -17.858 1.00 0.00 N ATOM 1550 CA LYS B 71 -8.005 -9.759 -19.196 1.00 0.00 C ATOM 1551 C LYS B 71 -7.573 -8.433 -19.825 1.00 0.00 C ATOM 1552 O LYS B 71 -6.537 -8.363 -20.485 1.00 0.00 O ATOM 1553 CB LYS B 71 -9.521 -9.959 -19.162 1.00 0.00 C ATOM 1554 CG LYS B 71 -9.876 -11.440 -19.020 1.00 0.00 C ATOM 1555 CD LYS B 71 -9.795 -12.155 -20.370 1.00 0.00 C ATOM 1556 CE LYS B 71 -9.336 -13.604 -20.196 1.00 0.00 C ATOM 1557 NZ LYS B 71 -10.463 -14.455 -19.751 1.00 0.00 N ATOM 0 H LYS B 71 -8.140 -9.916 -17.111 1.00 0.00 H new ATOM 0 HA LYS B 71 -7.616 -10.555 -19.832 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -9.947 -9.398 -18.330 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -9.964 -9.561 -20.075 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -9.196 -11.914 -18.312 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -10.882 -11.539 -18.612 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -10.771 -12.135 -20.856 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -9.102 -11.626 -21.025 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -8.938 -13.981 -21.138 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -8.527 -13.650 -19.467 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -10.134 -15.435 -19.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -10.825 -14.104 -18.841 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -11.222 -14.424 -20.461 1.00 0.00 H new ATOM 1571 N ASN B 72 -8.388 -7.414 -19.597 1.00 0.00 N ATOM 1572 CA ASN B 72 -8.103 -6.093 -20.132 1.00 0.00 C ATOM 1573 C ASN B 72 -6.922 -5.484 -19.374 1.00 0.00 C ATOM 1574 O ASN B 72 -6.950 -5.387 -18.148 1.00 0.00 O ATOM 1575 CB ASN B 72 -9.304 -5.160 -19.965 1.00 0.00 C ATOM 1576 CG ASN B 72 -10.585 -5.816 -20.485 1.00 0.00 C ATOM 1577 OD1 ASN B 72 -10.606 -6.463 -21.519 1.00 0.00 O ATOM 1578 ND2 ASN B 72 -11.648 -5.614 -19.712 1.00 0.00 N ATOM 0 H ASN B 72 -9.246 -7.476 -19.049 1.00 0.00 H new ATOM 0 HA ASN B 72 -7.875 -6.201 -21.192 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -9.425 -4.902 -18.913 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -9.124 -4.229 -20.503 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -12.551 -6.011 -19.972 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -11.561 -5.062 -18.859 1.00 0.00 H new ATOM 1585 N GLU B 73 -5.912 -5.089 -20.135 1.00 0.00 N ATOM 1586 CA GLU B 73 -4.723 -4.492 -19.551 1.00 0.00 C ATOM 1587 C GLU B 73 -4.960 -3.008 -19.266 1.00 0.00 C ATOM 1588 O GLU B 73 -4.125 -2.350 -18.647 1.00 0.00 O ATOM 1589 CB GLU B 73 -3.507 -4.689 -20.459 1.00 0.00 C ATOM 1590 CG GLU B 73 -2.205 -4.587 -19.661 1.00 0.00 C ATOM 1591 CD GLU B 73 -1.456 -3.296 -19.998 1.00 0.00 C ATOM 1592 OE1 GLU B 73 -0.806 -3.279 -21.066 1.00 0.00 O ATOM 1593 OE2 GLU B 73 -1.551 -2.355 -19.181 1.00 0.00 O ATOM 0 H GLU B 73 -5.893 -5.171 -21.152 1.00 0.00 H new ATOM 0 HA GLU B 73 -4.514 -4.995 -18.607 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -3.565 -5.663 -20.944 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.513 -3.938 -21.249 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -2.425 -4.616 -18.594 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -1.572 -5.447 -19.880 1.00 0.00 H new ATOM 1600 N GLU B 74 -6.102 -2.523 -19.732 1.00 0.00 N ATOM 1601 CA GLU B 74 -6.459 -1.129 -19.535 1.00 0.00 C ATOM 1602 C GLU B 74 -7.622 -1.013 -18.548 1.00 0.00 C ATOM 1603 O GLU B 74 -8.416 -0.076 -18.625 1.00 0.00 O ATOM 1604 CB GLU B 74 -6.801 -0.457 -20.867 1.00 0.00 C ATOM 1605 CG GLU B 74 -5.553 -0.296 -21.736 1.00 0.00 C ATOM 1606 CD GLU B 74 -5.124 1.171 -21.813 1.00 0.00 C ATOM 1607 OE1 GLU B 74 -5.161 1.829 -20.751 1.00 0.00 O ATOM 1608 OE2 GLU B 74 -4.769 1.601 -22.932 1.00 0.00 O ATOM 0 H GLU B 74 -6.792 -3.071 -20.246 1.00 0.00 H new ATOM 0 HA GLU B 74 -5.598 -0.610 -19.114 1.00 0.00 H new ATOM 0 HB2 GLU B 74 -7.544 -1.052 -21.398 1.00 0.00 H new ATOM 0 HB3 GLU B 74 -7.248 0.520 -20.681 1.00 0.00 H new ATOM 0 HG2 GLU B 74 -4.740 -0.895 -21.326 1.00 0.00 H new ATOM 0 HG3 GLU B 74 -5.753 -0.673 -22.739 1.00 0.00 H new ATOM 1615 N GLU B 75 -7.686 -1.978 -17.643 1.00 0.00 N ATOM 1616 CA GLU B 75 -8.739 -1.996 -16.641 1.00 0.00 C ATOM 1617 C GLU B 75 -8.140 -2.177 -15.245 1.00 0.00 C ATOM 1618 O GLU B 75 -8.141 -3.282 -14.704 1.00 0.00 O ATOM 1619 CB GLU B 75 -9.765 -3.090 -16.944 1.00 0.00 C ATOM 1620 CG GLU B 75 -10.954 -3.007 -15.984 1.00 0.00 C ATOM 1621 CD GLU B 75 -12.117 -3.869 -16.477 1.00 0.00 C ATOM 1622 OE1 GLU B 75 -12.308 -3.913 -17.712 1.00 0.00 O ATOM 1623 OE2 GLU B 75 -12.789 -4.466 -15.608 1.00 0.00 O ATOM 0 H GLU B 75 -7.026 -2.753 -17.582 1.00 0.00 H new ATOM 0 HA GLU B 75 -9.259 -1.038 -16.670 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -10.115 -2.991 -17.972 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -9.293 -4.069 -16.861 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -10.648 -3.336 -14.991 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -11.279 -1.971 -15.890 1.00 0.00 H new ATOM 1630 N VAL B 76 -7.643 -1.076 -14.701 1.00 0.00 N ATOM 1631 CA VAL B 76 -7.042 -1.099 -13.379 1.00 0.00 C ATOM 1632 C VAL B 76 -8.065 -1.623 -12.368 1.00 0.00 C ATOM 1633 O VAL B 76 -9.270 -1.493 -12.576 1.00 0.00 O ATOM 1634 CB VAL B 76 -6.506 0.289 -13.023 1.00 0.00 C ATOM 1635 CG1 VAL B 76 -7.631 1.325 -13.014 1.00 0.00 C ATOM 1636 CG2 VAL B 76 -5.772 0.265 -11.680 1.00 0.00 C ATOM 0 H VAL B 76 -7.644 -0.161 -15.153 1.00 0.00 H new ATOM 0 HA VAL B 76 -6.188 -1.777 -13.359 1.00 0.00 H new ATOM 0 HB VAL B 76 -5.790 0.579 -13.792 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -7.223 2.303 -12.758 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -8.091 1.371 -14.001 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -8.382 1.041 -12.276 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -5.401 1.264 -11.450 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -6.458 -0.056 -10.896 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -4.934 -0.430 -11.736 1.00 0.00 H new ATOM 1646 N LEU B 77 -7.546 -2.203 -11.296 1.00 0.00 N ATOM 1647 CA LEU B 77 -8.399 -2.747 -10.253 1.00 0.00 C ATOM 1648 C LEU B 77 -8.007 -2.132 -8.908 1.00 0.00 C ATOM 1649 O LEU B 77 -8.853 -1.585 -8.202 1.00 0.00 O ATOM 1650 CB LEU B 77 -8.353 -4.276 -10.266 1.00 0.00 C ATOM 1651 CG LEU B 77 -8.457 -4.939 -11.641 1.00 0.00 C ATOM 1652 CD1 LEU B 77 -8.282 -6.455 -11.534 1.00 0.00 C ATOM 1653 CD2 LEU B 77 -9.768 -4.560 -12.334 1.00 0.00 C ATOM 0 H LEU B 77 -6.546 -2.308 -11.127 1.00 0.00 H new ATOM 0 HA LEU B 77 -9.440 -2.481 -10.435 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -7.421 -4.596 -9.800 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -9.165 -4.649 -9.642 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.644 -4.565 -12.263 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -8.360 -6.901 -12.525 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.303 -6.679 -11.112 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -9.058 -6.866 -10.889 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.817 -5.044 -13.309 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.610 -4.887 -11.724 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -9.812 -3.479 -12.463 1.00 0.00 H new ATOM 1665 N VAL B 78 -6.725 -2.241 -8.594 1.00 0.00 N ATOM 1666 CA VAL B 78 -6.211 -1.703 -7.346 1.00 0.00 C ATOM 1667 C VAL B 78 -4.895 -0.970 -7.616 1.00 0.00 C ATOM 1668 O VAL B 78 -4.043 -1.466 -8.351 1.00 0.00 O ATOM 1669 CB VAL B 78 -6.071 -2.821 -6.311 1.00 0.00 C ATOM 1670 CG1 VAL B 78 -4.853 -2.590 -5.416 1.00 0.00 C ATOM 1671 CG2 VAL B 78 -7.347 -2.958 -5.477 1.00 0.00 C ATOM 0 H VAL B 78 -6.026 -2.694 -9.183 1.00 0.00 H new ATOM 0 HA VAL B 78 -6.908 -0.977 -6.927 1.00 0.00 H new ATOM 0 HB VAL B 78 -5.919 -3.758 -6.847 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -4.777 -3.399 -4.689 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -3.951 -2.566 -6.028 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -4.962 -1.640 -4.892 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -7.221 -3.759 -4.749 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -7.543 -2.021 -4.955 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -8.186 -3.191 -6.132 1.00 0.00 H new ATOM 1681 N GLU B 79 -4.770 0.200 -7.005 1.00 0.00 N ATOM 1682 CA GLU B 79 -3.573 1.006 -7.170 1.00 0.00 C ATOM 1683 C GLU B 79 -2.871 1.195 -5.824 1.00 0.00 C ATOM 1684 O GLU B 79 -3.203 2.108 -5.070 1.00 0.00 O ATOM 1685 CB GLU B 79 -3.904 2.355 -7.810 1.00 0.00 C ATOM 1686 CG GLU B 79 -2.757 2.836 -8.701 1.00 0.00 C ATOM 1687 CD GLU B 79 -3.026 4.246 -9.229 1.00 0.00 C ATOM 1688 OE1 GLU B 79 -3.682 5.013 -8.491 1.00 0.00 O ATOM 1689 OE2 GLU B 79 -2.570 4.526 -10.359 1.00 0.00 O ATOM 0 H GLU B 79 -5.478 0.608 -6.395 1.00 0.00 H new ATOM 0 HA GLU B 79 -2.894 0.480 -7.841 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -4.816 2.267 -8.401 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -4.098 3.093 -7.032 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -1.825 2.827 -8.136 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -2.629 2.149 -9.538 1.00 0.00 H new ATOM 1696 N CYS B 80 -1.914 0.317 -5.563 1.00 0.00 N ATOM 1697 CA CYS B 80 -1.162 0.376 -4.321 1.00 0.00 C ATOM 1698 C CYS B 80 0.145 1.126 -4.585 1.00 0.00 C ATOM 1699 O CYS B 80 1.141 0.524 -4.983 1.00 0.00 O ATOM 1700 CB CYS B 80 -0.912 -1.019 -3.744 1.00 0.00 C ATOM 1701 SG CYS B 80 -0.361 -0.888 -2.004 1.00 0.00 S ATOM 0 H CYS B 80 -1.642 -0.440 -6.191 1.00 0.00 H new ATOM 0 HA CYS B 80 -1.741 0.911 -3.568 1.00 0.00 H new ATOM 0 HB2 CYS B 80 -1.824 -1.614 -3.801 1.00 0.00 H new ATOM 0 HB3 CYS B 80 -0.156 -1.536 -4.335 1.00 0.00 H new ATOM 0 HG CYS B 80 -0.931 -1.818 -1.297 1.00 0.00 H new ATOM 1707 N ARG B 81 0.098 2.430 -4.353 1.00 0.00 N ATOM 1708 CA ARG B 81 1.266 3.269 -4.561 1.00 0.00 C ATOM 1709 C ARG B 81 2.315 2.996 -3.481 1.00 0.00 C ATOM 1710 O ARG B 81 2.073 3.242 -2.300 1.00 0.00 O ATOM 1711 CB ARG B 81 0.891 4.752 -4.535 1.00 0.00 C ATOM 1712 CG ARG B 81 -0.218 5.055 -5.544 1.00 0.00 C ATOM 1713 CD ARG B 81 0.345 5.749 -6.786 1.00 0.00 C ATOM 1714 NE ARG B 81 -0.754 6.097 -7.714 1.00 0.00 N ATOM 1715 CZ ARG B 81 -1.474 7.225 -7.637 1.00 0.00 C ATOM 1716 NH1 ARG B 81 -1.215 8.121 -6.675 1.00 0.00 N ATOM 1717 NH2 ARG B 81 -2.452 7.457 -8.523 1.00 0.00 N ATOM 0 H ARG B 81 -0.730 2.926 -4.023 1.00 0.00 H new ATOM 0 HA ARG B 81 1.677 3.027 -5.541 1.00 0.00 H new ATOM 0 HB2 ARG B 81 0.562 5.030 -3.534 1.00 0.00 H new ATOM 0 HB3 ARG B 81 1.769 5.357 -4.762 1.00 0.00 H new ATOM 0 HG2 ARG B 81 -0.714 4.129 -5.834 1.00 0.00 H new ATOM 0 HG3 ARG B 81 -0.974 5.689 -5.080 1.00 0.00 H new ATOM 0 HD2 ARG B 81 0.886 6.650 -6.496 1.00 0.00 H new ATOM 0 HD3 ARG B 81 1.060 5.095 -7.285 1.00 0.00 H new ATOM 0 HE ARG B 81 -0.978 5.437 -8.459 1.00 0.00 H new ATOM 0 HH11 ARG B 81 -0.470 7.945 -6.001 1.00 0.00 H new ATOM 0 HH12 ARG B 81 -1.763 8.979 -6.617 1.00 0.00 H new ATOM 0 HH21 ARG B 81 -2.648 6.775 -9.256 1.00 0.00 H new ATOM 0 HH22 ARG B 81 -3.000 8.315 -8.465 1.00 0.00 H new ATOM 1731 N VAL B 82 3.457 2.492 -3.924 1.00 0.00 N ATOM 1732 CA VAL B 82 4.543 2.183 -3.010 1.00 0.00 C ATOM 1733 C VAL B 82 4.758 3.365 -2.062 1.00 0.00 C ATOM 1734 O VAL B 82 5.271 3.193 -0.957 1.00 0.00 O ATOM 1735 CB VAL B 82 5.801 1.813 -3.799 1.00 0.00 C ATOM 1736 CG1 VAL B 82 6.792 2.979 -3.829 1.00 0.00 C ATOM 1737 CG2 VAL B 82 6.455 0.553 -3.228 1.00 0.00 C ATOM 0 H VAL B 82 3.654 2.290 -4.904 1.00 0.00 H new ATOM 0 HA VAL B 82 4.292 1.317 -2.398 1.00 0.00 H new ATOM 0 HB VAL B 82 5.502 1.600 -4.825 1.00 0.00 H new ATOM 0 HG11 VAL B 82 7.677 2.690 -4.396 1.00 0.00 H new ATOM 0 HG12 VAL B 82 6.324 3.842 -4.302 1.00 0.00 H new ATOM 0 HG13 VAL B 82 7.082 3.237 -2.810 1.00 0.00 H new ATOM 0 HG21 VAL B 82 7.347 0.312 -3.807 1.00 0.00 H new ATOM 0 HG22 VAL B 82 6.733 0.727 -2.188 1.00 0.00 H new ATOM 0 HG23 VAL B 82 5.752 -0.278 -3.282 1.00 0.00 H new ATOM 1747 N ARG B 83 4.355 4.537 -2.529 1.00 0.00 N ATOM 1748 CA ARG B 83 4.497 5.747 -1.736 1.00 0.00 C ATOM 1749 C ARG B 83 3.485 5.751 -0.589 1.00 0.00 C ATOM 1750 O ARG B 83 3.823 6.105 0.540 1.00 0.00 O ATOM 1751 CB ARG B 83 4.288 6.996 -2.595 1.00 0.00 C ATOM 1752 CG ARG B 83 5.421 7.159 -3.611 1.00 0.00 C ATOM 1753 CD ARG B 83 6.407 8.239 -3.163 1.00 0.00 C ATOM 1754 NE ARG B 83 7.447 8.435 -4.197 1.00 0.00 N ATOM 1755 CZ ARG B 83 8.474 9.288 -4.078 1.00 0.00 C ATOM 1756 NH1 ARG B 83 8.605 10.028 -2.969 1.00 0.00 N ATOM 1757 NH2 ARG B 83 9.371 9.400 -5.067 1.00 0.00 N ATOM 0 H ARG B 83 3.930 4.675 -3.446 1.00 0.00 H new ATOM 0 HA ARG B 83 5.509 5.762 -1.333 1.00 0.00 H new ATOM 0 HB2 ARG B 83 3.334 6.927 -3.117 1.00 0.00 H new ATOM 0 HB3 ARG B 83 4.239 7.877 -1.956 1.00 0.00 H new ATOM 0 HG2 ARG B 83 5.945 6.211 -3.732 1.00 0.00 H new ATOM 0 HG3 ARG B 83 5.007 7.421 -4.585 1.00 0.00 H new ATOM 0 HD2 ARG B 83 5.878 9.175 -2.986 1.00 0.00 H new ATOM 0 HD3 ARG B 83 6.870 7.951 -2.219 1.00 0.00 H new ATOM 0 HE ARG B 83 7.378 7.887 -5.054 1.00 0.00 H new ATOM 0 HH11 ARG B 83 7.923 9.942 -2.215 1.00 0.00 H new ATOM 0 HH12 ARG B 83 9.387 10.677 -2.878 1.00 0.00 H new ATOM 0 HH21 ARG B 83 9.273 8.836 -5.911 1.00 0.00 H new ATOM 0 HH22 ARG B 83 10.152 10.049 -4.976 1.00 0.00 H new ATOM 1771 N PHE B 84 2.265 5.354 -0.916 1.00 0.00 N ATOM 1772 CA PHE B 84 1.202 5.307 0.073 1.00 0.00 C ATOM 1773 C PHE B 84 1.300 4.039 0.924 1.00 0.00 C ATOM 1774 O PHE B 84 0.973 4.056 2.110 1.00 0.00 O ATOM 1775 CB PHE B 84 -0.122 5.291 -0.693 1.00 0.00 C ATOM 1776 CG PHE B 84 -0.489 6.633 -1.330 1.00 0.00 C ATOM 1777 CD1 PHE B 84 -0.249 7.792 -0.659 1.00 0.00 C ATOM 1778 CD2 PHE B 84 -1.055 6.668 -2.566 1.00 0.00 C ATOM 1779 CE1 PHE B 84 -0.589 9.038 -1.250 1.00 0.00 C ATOM 1780 CE2 PHE B 84 -1.395 7.913 -3.157 1.00 0.00 C ATOM 1781 CZ PHE B 84 -1.155 9.072 -2.486 1.00 0.00 C ATOM 0 H PHE B 84 1.988 5.061 -1.853 1.00 0.00 H new ATOM 0 HA PHE B 84 1.276 6.166 0.739 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.069 4.532 -1.474 1.00 0.00 H new ATOM 0 HB3 PHE B 84 -0.920 4.993 -0.013 1.00 0.00 H new ATOM 0 HD1 PHE B 84 0.200 7.765 0.323 1.00 0.00 H new ATOM 0 HD2 PHE B 84 -1.246 5.748 -3.098 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -0.398 9.958 -0.718 1.00 0.00 H new ATOM 0 HE2 PHE B 84 -1.844 7.940 -4.139 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.414 10.019 -2.935 1.00 0.00 H new ATOM 1791 N LEU B 85 1.752 2.970 0.285 1.00 0.00 N ATOM 1792 CA LEU B 85 1.897 1.696 0.969 1.00 0.00 C ATOM 1793 C LEU B 85 2.464 1.935 2.369 1.00 0.00 C ATOM 1794 O LEU B 85 3.165 2.919 2.600 1.00 0.00 O ATOM 1795 CB LEU B 85 2.729 0.727 0.126 1.00 0.00 C ATOM 1796 CG LEU B 85 2.279 -0.735 0.144 1.00 0.00 C ATOM 1797 CD1 LEU B 85 2.484 -1.389 -1.224 1.00 0.00 C ATOM 1798 CD2 LEU B 85 2.980 -1.510 1.261 1.00 0.00 C ATOM 0 H LEU B 85 2.022 2.960 -0.698 1.00 0.00 H new ATOM 0 HA LEU B 85 0.925 1.219 1.096 1.00 0.00 H new ATOM 0 HB2 LEU B 85 2.721 1.076 -0.907 1.00 0.00 H new ATOM 0 HB3 LEU B 85 3.762 0.773 0.470 1.00 0.00 H new ATOM 0 HG LEU B 85 1.210 -0.761 0.356 1.00 0.00 H new ATOM 0 HD11 LEU B 85 2.156 -2.428 -1.184 1.00 0.00 H new ATOM 0 HD12 LEU B 85 1.902 -0.854 -1.974 1.00 0.00 H new ATOM 0 HD13 LEU B 85 3.540 -1.352 -1.490 1.00 0.00 H new ATOM 0 HD21 LEU B 85 2.642 -2.546 1.252 1.00 0.00 H new ATOM 0 HD22 LEU B 85 4.058 -1.478 1.105 1.00 0.00 H new ATOM 0 HD23 LEU B 85 2.739 -1.058 2.223 1.00 0.00 H new ATOM 1810 N SER B 86 2.140 1.018 3.269 1.00 0.00 N ATOM 1811 CA SER B 86 2.608 1.117 4.641 1.00 0.00 C ATOM 1812 C SER B 86 3.300 -0.184 5.053 1.00 0.00 C ATOM 1813 O SER B 86 4.474 -0.178 5.421 1.00 0.00 O ATOM 1814 CB SER B 86 1.454 1.430 5.596 1.00 0.00 C ATOM 1815 OG SER B 86 0.520 0.357 5.673 1.00 0.00 O ATOM 0 H SER B 86 1.559 0.203 3.075 1.00 0.00 H new ATOM 0 HA SER B 86 3.324 1.937 4.699 1.00 0.00 H new ATOM 0 HB2 SER B 86 1.851 1.637 6.590 1.00 0.00 H new ATOM 0 HB3 SER B 86 0.942 2.333 5.263 1.00 0.00 H new ATOM 0 HG SER B 86 0.478 0.026 6.594 1.00 0.00 H new ATOM 1821 N PHE B 87 2.543 -1.269 4.977 1.00 0.00 N ATOM 1822 CA PHE B 87 3.069 -2.575 5.338 1.00 0.00 C ATOM 1823 C PHE B 87 2.750 -3.611 4.258 1.00 0.00 C ATOM 1824 O PHE B 87 1.863 -3.400 3.432 1.00 0.00 O ATOM 1825 CB PHE B 87 2.385 -2.988 6.642 1.00 0.00 C ATOM 1826 CG PHE B 87 3.066 -4.155 7.360 1.00 0.00 C ATOM 1827 CD1 PHE B 87 4.296 -3.986 7.916 1.00 0.00 C ATOM 1828 CD2 PHE B 87 2.442 -5.360 7.442 1.00 0.00 C ATOM 1829 CE1 PHE B 87 4.929 -5.069 8.582 1.00 0.00 C ATOM 1830 CE2 PHE B 87 3.074 -6.443 8.109 1.00 0.00 C ATOM 1831 CZ PHE B 87 4.304 -6.275 8.664 1.00 0.00 C ATOM 0 H PHE B 87 1.570 -1.271 4.671 1.00 0.00 H new ATOM 0 HA PHE B 87 4.152 -2.523 5.446 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.356 -2.129 7.313 1.00 0.00 H new ATOM 0 HB3 PHE B 87 1.351 -3.260 6.428 1.00 0.00 H new ATOM 0 HD1 PHE B 87 4.791 -3.028 7.851 1.00 0.00 H new ATOM 0 HD2 PHE B 87 1.466 -5.494 7.000 1.00 0.00 H new ATOM 0 HE1 PHE B 87 5.906 -4.935 9.023 1.00 0.00 H new ATOM 0 HE2 PHE B 87 2.578 -7.400 8.175 1.00 0.00 H new ATOM 0 HZ PHE B 87 4.785 -7.099 9.170 1.00 0.00 H new ATOM 1841 N MET B 88 3.490 -4.709 4.300 1.00 0.00 N ATOM 1842 CA MET B 88 3.297 -5.779 3.336 1.00 0.00 C ATOM 1843 C MET B 88 4.080 -7.030 3.740 1.00 0.00 C ATOM 1844 O MET B 88 5.227 -6.934 4.175 1.00 0.00 O ATOM 1845 CB MET B 88 3.759 -5.311 1.955 1.00 0.00 C ATOM 1846 CG MET B 88 5.224 -4.871 1.987 1.00 0.00 C ATOM 1847 SD MET B 88 6.107 -5.589 0.612 1.00 0.00 S ATOM 1848 CE MET B 88 7.067 -4.178 0.089 1.00 0.00 C ATOM 0 H MET B 88 4.224 -4.881 4.987 1.00 0.00 H new ATOM 0 HA MET B 88 2.237 -6.031 3.308 1.00 0.00 H new ATOM 0 HB2 MET B 88 3.634 -6.118 1.233 1.00 0.00 H new ATOM 0 HB3 MET B 88 3.134 -4.483 1.620 1.00 0.00 H new ATOM 0 HG2 MET B 88 5.287 -3.784 1.942 1.00 0.00 H new ATOM 0 HG3 MET B 88 5.684 -5.179 2.926 1.00 0.00 H new ATOM 0 HE1 MET B 88 6.728 -3.852 -0.894 1.00 0.00 H new ATOM 0 HE2 MET B 88 6.940 -3.366 0.805 1.00 0.00 H new ATOM 0 HE3 MET B 88 8.120 -4.454 0.037 1.00 0.00 H new ATOM 1858 N GLY B 89 3.430 -8.173 3.583 1.00 0.00 N ATOM 1859 CA GLY B 89 4.052 -9.441 3.926 1.00 0.00 C ATOM 1860 C GLY B 89 3.154 -10.616 3.532 1.00 0.00 C ATOM 1861 O GLY B 89 2.387 -10.522 2.575 1.00 0.00 O ATOM 0 H GLY B 89 2.479 -8.248 3.223 1.00 0.00 H new ATOM 0 HA2 GLY B 89 5.013 -9.527 3.420 1.00 0.00 H new ATOM 0 HA3 GLY B 89 4.252 -9.474 4.997 1.00 0.00 H new ATOM 1865 N VAL B 90 3.280 -11.695 4.290 1.00 0.00 N ATOM 1866 CA VAL B 90 2.490 -12.887 4.032 1.00 0.00 C ATOM 1867 C VAL B 90 1.882 -13.385 5.345 1.00 0.00 C ATOM 1868 O VAL B 90 2.269 -12.935 6.423 1.00 0.00 O ATOM 1869 CB VAL B 90 3.349 -13.943 3.333 1.00 0.00 C ATOM 1870 CG1 VAL B 90 4.773 -13.431 3.109 1.00 0.00 C ATOM 1871 CG2 VAL B 90 3.356 -15.254 4.122 1.00 0.00 C ATOM 0 H VAL B 90 3.917 -11.769 5.083 1.00 0.00 H new ATOM 0 HA VAL B 90 1.665 -12.659 3.357 1.00 0.00 H new ATOM 0 HB VAL B 90 2.907 -14.142 2.357 1.00 0.00 H new ATOM 0 HG11 VAL B 90 5.362 -14.201 2.611 1.00 0.00 H new ATOM 0 HG12 VAL B 90 4.744 -12.536 2.487 1.00 0.00 H new ATOM 0 HG13 VAL B 90 5.228 -13.190 4.070 1.00 0.00 H new ATOM 0 HG21 VAL B 90 3.974 -15.987 3.604 1.00 0.00 H new ATOM 0 HG22 VAL B 90 3.762 -15.077 5.118 1.00 0.00 H new ATOM 0 HG23 VAL B 90 2.337 -15.633 4.207 1.00 0.00 H new ATOM 1881 N GLY B 91 0.939 -14.306 5.212 1.00 0.00 N ATOM 1882 CA GLY B 91 0.273 -14.869 6.374 1.00 0.00 C ATOM 1883 C GLY B 91 0.948 -16.169 6.815 1.00 0.00 C ATOM 1884 O GLY B 91 2.026 -16.144 7.406 1.00 0.00 O ATOM 0 H GLY B 91 0.620 -14.677 4.317 1.00 0.00 H new ATOM 0 HA2 GLY B 91 0.291 -14.149 7.193 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -0.775 -15.060 6.141 1.00 0.00 H new ATOM 1888 N LYS B 92 0.284 -17.275 6.512 1.00 0.00 N ATOM 1889 CA LYS B 92 0.806 -18.583 6.871 1.00 0.00 C ATOM 1890 C LYS B 92 1.510 -19.196 5.659 1.00 0.00 C ATOM 1891 O LYS B 92 2.568 -19.809 5.795 1.00 0.00 O ATOM 1892 CB LYS B 92 -0.304 -19.464 7.447 1.00 0.00 C ATOM 1893 CG LYS B 92 -1.079 -18.724 8.540 1.00 0.00 C ATOM 1894 CD LYS B 92 -0.414 -18.910 9.905 1.00 0.00 C ATOM 1895 CE LYS B 92 0.060 -17.570 10.471 1.00 0.00 C ATOM 1896 NZ LYS B 92 1.074 -17.783 11.528 1.00 0.00 N ATOM 0 H LYS B 92 -0.610 -17.292 6.022 1.00 0.00 H new ATOM 0 HA LYS B 92 1.551 -18.492 7.661 1.00 0.00 H new ATOM 0 HB2 LYS B 92 -0.986 -19.763 6.651 1.00 0.00 H new ATOM 0 HB3 LYS B 92 0.127 -20.377 7.857 1.00 0.00 H new ATOM 0 HG2 LYS B 92 -1.131 -17.662 8.299 1.00 0.00 H new ATOM 0 HG3 LYS B 92 -2.104 -19.093 8.577 1.00 0.00 H new ATOM 0 HD2 LYS B 92 -1.118 -19.372 10.597 1.00 0.00 H new ATOM 0 HD3 LYS B 92 0.433 -19.589 9.811 1.00 0.00 H new ATOM 0 HE2 LYS B 92 0.482 -16.960 9.672 1.00 0.00 H new ATOM 0 HE3 LYS B 92 -0.788 -17.020 10.878 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 1.385 -16.863 11.901 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 0.660 -18.347 12.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 1.891 -18.289 11.129 1.00 0.00 H new ATOM 1910 N ASP B 93 0.894 -19.010 4.500 1.00 0.00 N ATOM 1911 CA ASP B 93 1.449 -19.537 3.265 1.00 0.00 C ATOM 1912 C ASP B 93 2.242 -18.437 2.556 1.00 0.00 C ATOM 1913 O ASP B 93 1.860 -17.268 2.597 1.00 0.00 O ATOM 1914 CB ASP B 93 0.341 -20.005 2.319 1.00 0.00 C ATOM 1915 CG ASP B 93 0.236 -21.521 2.146 1.00 0.00 C ATOM 1916 OD1 ASP B 93 0.521 -22.227 3.137 1.00 0.00 O ATOM 1917 OD2 ASP B 93 -0.126 -21.941 1.025 1.00 0.00 O ATOM 0 H ASP B 93 0.016 -18.502 4.391 1.00 0.00 H new ATOM 0 HA ASP B 93 2.089 -20.382 3.517 1.00 0.00 H new ATOM 0 HB2 ASP B 93 -0.614 -19.630 2.688 1.00 0.00 H new ATOM 0 HB3 ASP B 93 0.505 -19.553 1.341 1.00 0.00 H new ATOM 1922 N VAL B 94 3.330 -18.850 1.924 1.00 0.00 N ATOM 1923 CA VAL B 94 4.180 -17.914 1.208 1.00 0.00 C ATOM 1924 C VAL B 94 3.544 -17.586 -0.145 1.00 0.00 C ATOM 1925 O VAL B 94 3.808 -16.531 -0.719 1.00 0.00 O ATOM 1926 CB VAL B 94 5.595 -18.483 1.081 1.00 0.00 C ATOM 1927 CG1 VAL B 94 6.027 -19.170 2.377 1.00 0.00 C ATOM 1928 CG2 VAL B 94 5.695 -19.441 -0.108 1.00 0.00 C ATOM 0 H VAL B 94 3.643 -19.820 1.893 1.00 0.00 H new ATOM 0 HA VAL B 94 4.269 -16.979 1.761 1.00 0.00 H new ATOM 0 HB VAL B 94 6.276 -17.652 0.900 1.00 0.00 H new ATOM 0 HG11 VAL B 94 7.036 -19.566 2.260 1.00 0.00 H new ATOM 0 HG12 VAL B 94 6.013 -18.448 3.194 1.00 0.00 H new ATOM 0 HG13 VAL B 94 5.341 -19.987 2.602 1.00 0.00 H new ATOM 0 HG21 VAL B 94 6.710 -19.831 -0.176 1.00 0.00 H new ATOM 0 HG22 VAL B 94 4.997 -20.267 0.030 1.00 0.00 H new ATOM 0 HG23 VAL B 94 5.449 -18.908 -1.026 1.00 0.00 H new ATOM 1938 N HIS B 95 2.718 -18.510 -0.613 1.00 0.00 N ATOM 1939 CA HIS B 95 2.042 -18.332 -1.887 1.00 0.00 C ATOM 1940 C HIS B 95 1.116 -17.116 -1.812 1.00 0.00 C ATOM 1941 O HIS B 95 0.656 -16.617 -2.838 1.00 0.00 O ATOM 1942 CB HIS B 95 1.309 -19.611 -2.296 1.00 0.00 C ATOM 1943 CG HIS B 95 1.975 -20.880 -1.821 1.00 0.00 C ATOM 1944 ND1 HIS B 95 1.909 -21.315 -0.509 1.00 0.00 N ATOM 1945 CD2 HIS B 95 2.721 -21.802 -2.495 1.00 0.00 C ATOM 1946 CE1 HIS B 95 2.588 -22.449 -0.409 1.00 0.00 C ATOM 1947 NE2 HIS B 95 3.091 -22.748 -1.641 1.00 0.00 N ATOM 0 H HIS B 95 2.502 -19.384 -0.133 1.00 0.00 H new ATOM 0 HA HIS B 95 2.777 -18.137 -2.668 1.00 0.00 H new ATOM 0 HB2 HIS B 95 0.293 -19.577 -1.902 1.00 0.00 H new ATOM 0 HB3 HIS B 95 1.229 -19.640 -3.383 1.00 0.00 H new ATOM 0 HD2 HIS B 95 2.969 -21.768 -3.546 1.00 0.00 H new ATOM 0 HE1 HIS B 95 2.720 -23.033 0.490 1.00 0.00 H new ATOM 0 HE2 HIS B 95 3.658 -23.565 -1.869 1.00 0.00 H new ATOM 1955 N THR B 96 0.870 -16.675 -0.587 1.00 0.00 N ATOM 1956 CA THR B 96 0.007 -15.527 -0.364 1.00 0.00 C ATOM 1957 C THR B 96 0.844 -14.268 -0.134 1.00 0.00 C ATOM 1958 O THR B 96 1.978 -14.349 0.336 1.00 0.00 O ATOM 1959 CB THR B 96 -0.927 -15.858 0.802 1.00 0.00 C ATOM 1960 OG1 THR B 96 -0.052 -16.011 1.915 1.00 0.00 O ATOM 1961 CG2 THR B 96 -1.586 -17.230 0.653 1.00 0.00 C ATOM 0 H THR B 96 1.253 -17.092 0.261 1.00 0.00 H new ATOM 0 HA THR B 96 -0.606 -15.316 -1.240 1.00 0.00 H new ATOM 0 HB THR B 96 -1.699 -15.092 0.878 1.00 0.00 H new ATOM 0 HG1 THR B 96 0.357 -16.901 1.890 1.00 0.00 H new ATOM 0 HG21 THR B 96 -2.238 -17.415 1.507 1.00 0.00 H new ATOM 0 HG22 THR B 96 -2.174 -17.254 -0.265 1.00 0.00 H new ATOM 0 HG23 THR B 96 -0.816 -18.001 0.611 1.00 0.00 H new ATOM 1969 N PHE B 97 0.253 -13.132 -0.476 1.00 0.00 N ATOM 1970 CA PHE B 97 0.930 -11.857 -0.312 1.00 0.00 C ATOM 1971 C PHE B 97 -0.077 -10.711 -0.208 1.00 0.00 C ATOM 1972 O PHE B 97 -0.781 -10.408 -1.170 1.00 0.00 O ATOM 1973 CB PHE B 97 1.796 -11.648 -1.556 1.00 0.00 C ATOM 1974 CG PHE B 97 2.441 -10.263 -1.640 1.00 0.00 C ATOM 1975 CD1 PHE B 97 3.243 -9.825 -0.633 1.00 0.00 C ATOM 1976 CD2 PHE B 97 2.211 -9.469 -2.720 1.00 0.00 C ATOM 1977 CE1 PHE B 97 3.842 -8.539 -0.710 1.00 0.00 C ATOM 1978 CE2 PHE B 97 2.809 -8.184 -2.798 1.00 0.00 C ATOM 1979 CZ PHE B 97 3.612 -7.746 -1.791 1.00 0.00 C ATOM 0 H PHE B 97 -0.687 -13.068 -0.866 1.00 0.00 H new ATOM 0 HA PHE B 97 1.525 -11.866 0.601 1.00 0.00 H new ATOM 0 HB2 PHE B 97 2.581 -12.404 -1.571 1.00 0.00 H new ATOM 0 HB3 PHE B 97 1.183 -11.807 -2.443 1.00 0.00 H new ATOM 0 HD1 PHE B 97 3.425 -10.455 0.225 1.00 0.00 H new ATOM 0 HD2 PHE B 97 1.573 -9.816 -3.519 1.00 0.00 H new ATOM 0 HE1 PHE B 97 4.480 -8.191 0.089 1.00 0.00 H new ATOM 0 HE2 PHE B 97 2.627 -7.554 -3.656 1.00 0.00 H new ATOM 0 HZ PHE B 97 4.067 -6.768 -1.850 1.00 0.00 H new ATOM 1989 N ALA B 98 -0.115 -10.104 0.969 1.00 0.00 N ATOM 1990 CA ALA B 98 -1.025 -8.997 1.213 1.00 0.00 C ATOM 1991 C ALA B 98 -0.216 -7.732 1.506 1.00 0.00 C ATOM 1992 O ALA B 98 0.981 -7.806 1.780 1.00 0.00 O ATOM 1993 CB ALA B 98 -1.975 -9.359 2.356 1.00 0.00 C ATOM 0 H ALA B 98 0.470 -10.358 1.765 1.00 0.00 H new ATOM 0 HA ALA B 98 -1.635 -8.801 0.331 1.00 0.00 H new ATOM 0 HB1 ALA B 98 -2.657 -8.529 2.539 1.00 0.00 H new ATOM 0 HB2 ALA B 98 -2.547 -10.246 2.086 1.00 0.00 H new ATOM 0 HB3 ALA B 98 -1.398 -9.560 3.259 1.00 0.00 H new ATOM 1999 N PHE B 99 -0.901 -6.601 1.437 1.00 0.00 N ATOM 2000 CA PHE B 99 -0.261 -5.321 1.691 1.00 0.00 C ATOM 2001 C PHE B 99 -1.290 -4.265 2.100 1.00 0.00 C ATOM 2002 O PHE B 99 -2.410 -4.255 1.592 1.00 0.00 O ATOM 2003 CB PHE B 99 0.405 -4.887 0.384 1.00 0.00 C ATOM 2004 CG PHE B 99 -0.581 -4.546 -0.734 1.00 0.00 C ATOM 2005 CD1 PHE B 99 -1.351 -3.428 -0.645 1.00 0.00 C ATOM 2006 CD2 PHE B 99 -0.689 -5.361 -1.818 1.00 0.00 C ATOM 2007 CE1 PHE B 99 -2.267 -3.112 -1.683 1.00 0.00 C ATOM 2008 CE2 PHE B 99 -1.605 -5.044 -2.856 1.00 0.00 C ATOM 2009 CZ PHE B 99 -2.374 -3.927 -2.767 1.00 0.00 C ATOM 0 H PHE B 99 -1.893 -6.544 1.209 1.00 0.00 H new ATOM 0 HA PHE B 99 0.460 -5.420 2.502 1.00 0.00 H new ATOM 0 HB2 PHE B 99 1.032 -4.017 0.579 1.00 0.00 H new ATOM 0 HB3 PHE B 99 1.064 -5.685 0.042 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.266 -2.781 0.215 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.078 -6.249 -1.889 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.879 -2.225 -1.612 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -1.691 -5.691 -3.717 1.00 0.00 H new ATOM 0 HZ PHE B 99 -3.070 -3.686 -3.557 1.00 0.00 H new ATOM 2019 N ILE B 100 -0.873 -3.403 3.016 1.00 0.00 N ATOM 2020 CA ILE B 100 -1.744 -2.345 3.499 1.00 0.00 C ATOM 2021 C ILE B 100 -1.481 -1.068 2.700 1.00 0.00 C ATOM 2022 O ILE B 100 -0.340 -0.620 2.598 1.00 0.00 O ATOM 2023 CB ILE B 100 -1.585 -2.169 5.011 1.00 0.00 C ATOM 2024 CG1 ILE B 100 -2.291 -3.293 5.771 1.00 0.00 C ATOM 2025 CG2 ILE B 100 -2.066 -0.786 5.455 1.00 0.00 C ATOM 2026 CD1 ILE B 100 -1.492 -3.704 7.010 1.00 0.00 C ATOM 0 H ILE B 100 0.056 -3.416 3.436 1.00 0.00 H new ATOM 0 HA ILE B 100 -2.789 -2.610 3.340 1.00 0.00 H new ATOM 0 HB ILE B 100 -0.524 -2.234 5.253 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -3.287 -2.966 6.069 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -2.421 -4.154 5.116 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -1.942 -0.687 6.533 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -1.480 -0.018 4.950 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -3.119 -0.667 5.198 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -2.016 -4.505 7.532 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -0.505 -4.054 6.707 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -1.385 -2.847 7.675 1.00 0.00 H new ATOM 2038 N MET B 101 -2.555 -0.517 2.154 1.00 0.00 N ATOM 2039 CA MET B 101 -2.454 0.700 1.367 1.00 0.00 C ATOM 2040 C MET B 101 -3.331 1.807 1.954 1.00 0.00 C ATOM 2041 O MET B 101 -4.431 1.542 2.438 1.00 0.00 O ATOM 2042 CB MET B 101 -2.887 0.415 -0.073 1.00 0.00 C ATOM 2043 CG MET B 101 -4.404 0.236 -0.164 1.00 0.00 C ATOM 2044 SD MET B 101 -4.879 -0.097 -1.852 1.00 0.00 S ATOM 2045 CE MET B 101 -4.492 1.478 -2.599 1.00 0.00 C ATOM 0 H MET B 101 -3.500 -0.891 2.241 1.00 0.00 H new ATOM 0 HA MET B 101 -1.417 1.036 1.384 1.00 0.00 H new ATOM 0 HB2 MET B 101 -2.575 1.235 -0.720 1.00 0.00 H new ATOM 0 HB3 MET B 101 -2.389 -0.484 -0.435 1.00 0.00 H new ATOM 0 HG2 MET B 101 -4.721 -0.584 0.480 1.00 0.00 H new ATOM 0 HG3 MET B 101 -4.907 1.135 0.193 1.00 0.00 H new ATOM 0 HE1 MET B 101 -4.966 1.542 -3.579 1.00 0.00 H new ATOM 0 HE2 MET B 101 -4.862 2.283 -1.964 1.00 0.00 H new ATOM 0 HE3 MET B 101 -3.412 1.572 -2.711 1.00 0.00 H new ATOM 2055 N ASP B 102 -2.813 3.025 1.893 1.00 0.00 N ATOM 2056 CA ASP B 102 -3.535 4.173 2.412 1.00 0.00 C ATOM 2057 C ASP B 102 -4.321 4.833 1.277 1.00 0.00 C ATOM 2058 O ASP B 102 -3.732 5.362 0.335 1.00 0.00 O ATOM 2059 CB ASP B 102 -2.574 5.215 2.988 1.00 0.00 C ATOM 2060 CG ASP B 102 -3.243 6.463 3.567 1.00 0.00 C ATOM 2061 OD1 ASP B 102 -4.001 7.104 2.808 1.00 0.00 O ATOM 2062 OD2 ASP B 102 -2.981 6.747 4.756 1.00 0.00 O ATOM 0 H ASP B 102 -1.901 3.241 1.491 1.00 0.00 H new ATOM 0 HA ASP B 102 -4.202 3.822 3.200 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -1.979 4.744 3.770 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -1.883 5.523 2.203 1.00 0.00 H new ATOM 2143 N PHE B 108 -7.482 2.118 6.362 1.00 0.00 N ATOM 2144 CA PHE B 108 -6.540 1.426 5.500 1.00 0.00 C ATOM 2145 C PHE B 108 -7.183 0.191 4.865 1.00 0.00 C ATOM 2146 O PHE B 108 -8.142 -0.360 5.404 1.00 0.00 O ATOM 2147 CB PHE B 108 -5.371 0.981 6.380 1.00 0.00 C ATOM 2148 CG PHE B 108 -4.850 2.071 7.320 1.00 0.00 C ATOM 2149 CD1 PHE B 108 -3.951 2.985 6.868 1.00 0.00 C ATOM 2150 CD2 PHE B 108 -5.286 2.124 8.607 1.00 0.00 C ATOM 2151 CE1 PHE B 108 -3.467 3.997 7.739 1.00 0.00 C ATOM 2152 CE2 PHE B 108 -4.802 3.135 9.479 1.00 0.00 C ATOM 2153 CZ PHE B 108 -3.903 4.050 9.027 1.00 0.00 C ATOM 0 HA PHE B 108 -6.216 2.088 4.697 1.00 0.00 H new ATOM 0 HB2 PHE B 108 -5.683 0.122 6.974 1.00 0.00 H new ATOM 0 HB3 PHE B 108 -4.554 0.647 5.740 1.00 0.00 H new ATOM 0 HD1 PHE B 108 -3.605 2.942 5.846 1.00 0.00 H new ATOM 0 HD2 PHE B 108 -6.000 1.398 8.966 1.00 0.00 H new ATOM 0 HE1 PHE B 108 -2.754 4.724 7.379 1.00 0.00 H new ATOM 0 HE2 PHE B 108 -5.148 3.177 10.501 1.00 0.00 H new ATOM 0 HZ PHE B 108 -3.535 4.819 9.690 1.00 0.00 H new ATOM 2163 N GLU B 109 -6.630 -0.207 3.728 1.00 0.00 N ATOM 2164 CA GLU B 109 -7.138 -1.366 3.014 1.00 0.00 C ATOM 2165 C GLU B 109 -6.015 -2.377 2.777 1.00 0.00 C ATOM 2166 O GLU B 109 -4.897 -1.999 2.429 1.00 0.00 O ATOM 2167 CB GLU B 109 -7.793 -0.953 1.694 1.00 0.00 C ATOM 2168 CG GLU B 109 -9.202 -0.407 1.928 1.00 0.00 C ATOM 2169 CD GLU B 109 -9.853 0.016 0.609 1.00 0.00 C ATOM 2170 OE1 GLU B 109 -9.369 -0.461 -0.440 1.00 0.00 O ATOM 2171 OE2 GLU B 109 -10.819 0.805 0.681 1.00 0.00 O ATOM 0 H GLU B 109 -5.835 0.253 3.284 1.00 0.00 H new ATOM 0 HA GLU B 109 -7.903 -1.841 3.628 1.00 0.00 H new ATOM 0 HB2 GLU B 109 -7.183 -0.195 1.203 1.00 0.00 H new ATOM 0 HB3 GLU B 109 -7.838 -1.810 1.023 1.00 0.00 H new ATOM 0 HG2 GLU B 109 -9.815 -1.167 2.412 1.00 0.00 H new ATOM 0 HG3 GLU B 109 -9.157 0.446 2.605 1.00 0.00 H new ATOM 2178 N CYS B 110 -6.350 -3.643 2.975 1.00 0.00 N ATOM 2179 CA CYS B 110 -5.384 -4.712 2.787 1.00 0.00 C ATOM 2180 C CYS B 110 -5.836 -5.565 1.600 1.00 0.00 C ATOM 2181 O CYS B 110 -6.962 -6.061 1.581 1.00 0.00 O ATOM 2182 CB CYS B 110 -5.210 -5.547 4.057 1.00 0.00 C ATOM 2183 SG CYS B 110 -4.055 -6.932 3.742 1.00 0.00 S ATOM 0 H CYS B 110 -7.278 -3.953 3.264 1.00 0.00 H new ATOM 0 HA CYS B 110 -4.403 -4.286 2.574 1.00 0.00 H new ATOM 0 HB2 CYS B 110 -4.829 -4.921 4.864 1.00 0.00 H new ATOM 0 HB3 CYS B 110 -6.175 -5.934 4.383 1.00 0.00 H new ATOM 0 HG CYS B 110 -3.912 -7.633 4.827 1.00 0.00 H new ATOM 2189 N HIS B 111 -4.935 -5.710 0.639 1.00 0.00 N ATOM 2190 CA HIS B 111 -5.228 -6.495 -0.548 1.00 0.00 C ATOM 2191 C HIS B 111 -4.342 -7.742 -0.570 1.00 0.00 C ATOM 2192 O HIS B 111 -3.128 -7.643 -0.747 1.00 0.00 O ATOM 2193 CB HIS B 111 -5.084 -5.644 -1.811 1.00 0.00 C ATOM 2194 CG HIS B 111 -6.029 -4.467 -1.869 1.00 0.00 C ATOM 2195 ND1 HIS B 111 -7.340 -4.580 -2.298 1.00 0.00 N ATOM 2196 CD2 HIS B 111 -5.840 -3.155 -1.549 1.00 0.00 C ATOM 2197 CE1 HIS B 111 -7.905 -3.383 -2.234 1.00 0.00 C ATOM 2198 NE2 HIS B 111 -6.973 -2.501 -1.771 1.00 0.00 N ATOM 0 H HIS B 111 -4.002 -5.297 0.658 1.00 0.00 H new ATOM 0 HA HIS B 111 -6.265 -6.829 -0.521 1.00 0.00 H new ATOM 0 HB2 HIS B 111 -4.059 -5.278 -1.875 1.00 0.00 H new ATOM 0 HB3 HIS B 111 -5.252 -6.275 -2.683 1.00 0.00 H new ATOM 0 HD2 HIS B 111 -4.923 -2.721 -1.178 1.00 0.00 H new ATOM 0 HE1 HIS B 111 -8.924 -3.147 -2.501 1.00 0.00 H new ATOM 0 HE2 HIS B 111 -7.122 -1.503 -1.620 1.00 0.00 H new ATOM 2206 N VAL B 112 -4.982 -8.888 -0.387 1.00 0.00 N ATOM 2207 CA VAL B 112 -4.268 -10.153 -0.384 1.00 0.00 C ATOM 2208 C VAL B 112 -4.244 -10.724 -1.803 1.00 0.00 C ATOM 2209 O VAL B 112 -5.029 -10.311 -2.655 1.00 0.00 O ATOM 2210 CB VAL B 112 -4.897 -11.106 0.634 1.00 0.00 C ATOM 2211 CG1 VAL B 112 -4.070 -12.386 0.770 1.00 0.00 C ATOM 2212 CG2 VAL B 112 -5.074 -10.421 1.991 1.00 0.00 C ATOM 0 H VAL B 112 -5.988 -8.966 -0.240 1.00 0.00 H new ATOM 0 HA VAL B 112 -3.233 -10.007 -0.076 1.00 0.00 H new ATOM 0 HB VAL B 112 -5.885 -11.383 0.267 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -4.539 -13.046 1.500 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -4.018 -12.890 -0.195 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -3.063 -12.135 1.102 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -5.523 -11.121 2.696 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -4.102 -10.101 2.367 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -5.723 -9.553 1.878 1.00 0.00 H new ATOM 2222 N PHE B 113 -3.335 -11.665 -2.012 1.00 0.00 N ATOM 2223 CA PHE B 113 -3.198 -12.297 -3.313 1.00 0.00 C ATOM 2224 C PHE B 113 -2.637 -13.714 -3.178 1.00 0.00 C ATOM 2225 O PHE B 113 -2.139 -14.090 -2.118 1.00 0.00 O ATOM 2226 CB PHE B 113 -2.216 -11.447 -4.123 1.00 0.00 C ATOM 2227 CG PHE B 113 -2.710 -10.028 -4.408 1.00 0.00 C ATOM 2228 CD1 PHE B 113 -2.716 -9.098 -3.416 1.00 0.00 C ATOM 2229 CD2 PHE B 113 -3.143 -9.696 -5.654 1.00 0.00 C ATOM 2230 CE1 PHE B 113 -3.174 -7.780 -3.680 1.00 0.00 C ATOM 2231 CE2 PHE B 113 -3.601 -8.378 -5.918 1.00 0.00 C ATOM 2232 CZ PHE B 113 -3.607 -7.448 -4.926 1.00 0.00 C ATOM 0 H PHE B 113 -2.686 -12.005 -1.302 1.00 0.00 H new ATOM 0 HA PHE B 113 -4.172 -12.365 -3.797 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -1.270 -11.390 -3.584 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -2.014 -11.947 -5.070 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -2.372 -9.362 -2.427 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -3.138 -10.434 -6.442 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -3.179 -7.042 -2.892 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -3.945 -8.114 -6.907 1.00 0.00 H new ATOM 0 HZ PHE B 113 -3.956 -6.446 -5.127 1.00 0.00 H new ATOM 2242 N TRP B 114 -2.736 -14.462 -4.268 1.00 0.00 N ATOM 2243 CA TRP B 114 -2.245 -15.829 -4.284 1.00 0.00 C ATOM 2244 C TRP B 114 -1.264 -15.965 -5.450 1.00 0.00 C ATOM 2245 O TRP B 114 -1.672 -16.210 -6.584 1.00 0.00 O ATOM 2246 CB TRP B 114 -3.402 -16.827 -4.358 1.00 0.00 C ATOM 2247 CG TRP B 114 -2.962 -18.292 -4.363 1.00 0.00 C ATOM 2248 CD1 TRP B 114 -2.488 -19.007 -5.393 1.00 0.00 C ATOM 2249 CD2 TRP B 114 -2.973 -19.197 -3.239 1.00 0.00 C ATOM 2250 NE1 TRP B 114 -2.195 -20.302 -5.016 1.00 0.00 N ATOM 2251 CE2 TRP B 114 -2.499 -20.421 -3.665 1.00 0.00 C ATOM 2252 CE3 TRP B 114 -3.371 -18.989 -1.907 1.00 0.00 C ATOM 2253 CZ2 TRP B 114 -2.378 -21.532 -2.821 1.00 0.00 C ATOM 2254 CZ3 TRP B 114 -3.244 -20.109 -1.077 1.00 0.00 C ATOM 2255 CH2 TRP B 114 -2.768 -21.348 -1.490 1.00 0.00 C ATOM 0 H TRP B 114 -3.149 -14.147 -5.146 1.00 0.00 H new ATOM 0 HA TRP B 114 -1.720 -16.061 -3.357 1.00 0.00 H new ATOM 0 HB2 TRP B 114 -4.066 -16.661 -3.510 1.00 0.00 H new ATOM 0 HB3 TRP B 114 -3.981 -16.629 -5.260 1.00 0.00 H new ATOM 0 HD1 TRP B 114 -2.352 -18.619 -6.392 1.00 0.00 H new ATOM 0 HE1 TRP B 114 -1.824 -21.037 -5.618 1.00 0.00 H new ATOM 0 HE3 TRP B 114 -3.745 -18.040 -1.552 1.00 0.00 H new ATOM 0 HZ2 TRP B 114 -2.004 -22.480 -3.178 1.00 0.00 H new ATOM 0 HZ3 TRP B 114 -3.536 -20.003 -0.043 1.00 0.00 H new ATOM 0 HH2 TRP B 114 -2.700 -22.165 -0.787 1.00 0.00 H new ATOM 2266 N CYS B 115 0.011 -15.798 -5.131 1.00 0.00 N ATOM 2267 CA CYS B 115 1.054 -15.899 -6.138 1.00 0.00 C ATOM 2268 C CYS B 115 1.502 -17.360 -6.221 1.00 0.00 C ATOM 2269 O CYS B 115 1.242 -18.145 -5.311 1.00 0.00 O ATOM 2270 CB CYS B 115 2.224 -14.960 -5.838 1.00 0.00 C ATOM 2271 SG CYS B 115 1.594 -13.302 -5.385 1.00 0.00 S ATOM 0 H CYS B 115 0.346 -15.593 -4.189 1.00 0.00 H new ATOM 0 HA CYS B 115 0.660 -15.585 -7.105 1.00 0.00 H new ATOM 0 HB2 CYS B 115 2.826 -15.364 -5.024 1.00 0.00 H new ATOM 0 HB3 CYS B 115 2.874 -14.886 -6.710 1.00 0.00 H new ATOM 0 HG CYS B 115 2.157 -12.911 -4.280 1.00 0.00 H new ATOM 2277 N GLU B 116 2.167 -17.680 -7.322 1.00 0.00 N ATOM 2278 CA GLU B 116 2.654 -19.032 -7.535 1.00 0.00 C ATOM 2279 C GLU B 116 4.052 -19.001 -8.156 1.00 0.00 C ATOM 2280 O GLU B 116 4.299 -18.253 -9.101 1.00 0.00 O ATOM 2281 CB GLU B 116 1.684 -19.832 -8.407 1.00 0.00 C ATOM 2282 CG GLU B 116 0.539 -20.406 -7.570 1.00 0.00 C ATOM 2283 CD GLU B 116 0.240 -21.852 -7.970 1.00 0.00 C ATOM 2284 OE1 GLU B 116 1.201 -22.539 -8.378 1.00 0.00 O ATOM 2285 OE2 GLU B 116 -0.944 -22.238 -7.858 1.00 0.00 O ATOM 0 H GLU B 116 2.380 -17.026 -8.075 1.00 0.00 H new ATOM 0 HA GLU B 116 2.719 -19.531 -6.568 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.280 -19.191 -9.190 1.00 0.00 H new ATOM 0 HB3 GLU B 116 2.219 -20.642 -8.902 1.00 0.00 H new ATOM 0 HG2 GLU B 116 0.800 -20.364 -6.513 1.00 0.00 H new ATOM 0 HG3 GLU B 116 -0.355 -19.796 -7.702 1.00 0.00 H new ATOM 2292 N PRO B 117 4.953 -19.845 -7.585 1.00 0.00 N ATOM 2293 CA PRO B 117 4.578 -20.697 -6.469 1.00 0.00 C ATOM 2294 C PRO B 117 4.464 -19.888 -5.176 1.00 0.00 C ATOM 2295 O PRO B 117 3.415 -19.884 -4.533 1.00 0.00 O ATOM 2296 CB PRO B 117 5.659 -21.764 -6.409 1.00 0.00 C ATOM 2297 CG PRO B 117 6.839 -21.207 -7.189 1.00 0.00 C ATOM 2298 CD PRO B 117 6.348 -20.009 -7.985 1.00 0.00 C ATOM 0 HA PRO B 117 3.595 -21.151 -6.597 1.00 0.00 H new ATOM 0 HB2 PRO B 117 5.939 -21.979 -5.378 1.00 0.00 H new ATOM 0 HB3 PRO B 117 5.309 -22.699 -6.845 1.00 0.00 H new ATOM 0 HG2 PRO B 117 7.640 -20.912 -6.511 1.00 0.00 H new ATOM 0 HG3 PRO B 117 7.249 -21.966 -7.855 1.00 0.00 H new ATOM 0 HD2 PRO B 117 6.932 -19.117 -7.759 1.00 0.00 H new ATOM 0 HD3 PRO B 117 6.435 -20.184 -9.057 1.00 0.00 H new ATOM 2306 N ASN B 118 5.557 -19.222 -4.833 1.00 0.00 N ATOM 2307 CA ASN B 118 5.593 -18.411 -3.628 1.00 0.00 C ATOM 2308 C ASN B 118 5.513 -16.932 -4.011 1.00 0.00 C ATOM 2309 O ASN B 118 5.471 -16.595 -5.193 1.00 0.00 O ATOM 2310 CB ASN B 118 6.894 -18.631 -2.855 1.00 0.00 C ATOM 2311 CG ASN B 118 8.111 -18.384 -3.749 1.00 0.00 C ATOM 2312 OD1 ASN B 118 8.001 -17.974 -4.893 1.00 0.00 O ATOM 2313 ND2 ASN B 118 9.275 -18.657 -3.166 1.00 0.00 N ATOM 0 H ASN B 118 6.425 -19.228 -5.369 1.00 0.00 H new ATOM 0 HA ASN B 118 4.749 -18.700 -3.002 1.00 0.00 H new ATOM 0 HB2 ASN B 118 6.928 -17.962 -1.995 1.00 0.00 H new ATOM 0 HB3 ASN B 118 6.923 -19.649 -2.468 1.00 0.00 H new ATOM 0 HD21 ASN B 118 10.146 -18.526 -3.680 1.00 0.00 H new ATOM 0 HD22 ASN B 118 9.296 -18.997 -2.205 1.00 0.00 H new ATOM 2320 N ALA B 119 5.496 -16.089 -2.989 1.00 0.00 N ATOM 2321 CA ALA B 119 5.422 -14.654 -3.204 1.00 0.00 C ATOM 2322 C ALA B 119 6.803 -14.037 -2.973 1.00 0.00 C ATOM 2323 O ALA B 119 6.917 -12.964 -2.382 1.00 0.00 O ATOM 2324 CB ALA B 119 4.355 -14.054 -2.287 1.00 0.00 C ATOM 0 H ALA B 119 5.532 -16.372 -2.010 1.00 0.00 H new ATOM 0 HA ALA B 119 5.130 -14.434 -4.231 1.00 0.00 H new ATOM 0 HB1 ALA B 119 4.300 -12.977 -2.449 1.00 0.00 H new ATOM 0 HB2 ALA B 119 3.388 -14.504 -2.511 1.00 0.00 H new ATOM 0 HB3 ALA B 119 4.616 -14.252 -1.247 1.00 0.00 H new ATOM 2330 N ALA B 120 7.819 -14.741 -3.451 1.00 0.00 N ATOM 2331 CA ALA B 120 9.187 -14.276 -3.304 1.00 0.00 C ATOM 2332 C ALA B 120 9.456 -13.166 -4.321 1.00 0.00 C ATOM 2333 O ALA B 120 9.983 -12.112 -3.970 1.00 0.00 O ATOM 2334 CB ALA B 120 10.148 -15.457 -3.461 1.00 0.00 C ATOM 0 H ALA B 120 7.721 -15.630 -3.941 1.00 0.00 H new ATOM 0 HA ALA B 120 9.345 -13.857 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA B 120 11.175 -15.108 -3.351 1.00 0.00 H new ATOM 0 HB2 ALA B 120 9.935 -16.204 -2.696 1.00 0.00 H new ATOM 0 HB3 ALA B 120 10.020 -15.901 -4.448 1.00 0.00 H new ATOM 2340 N ASN B 121 9.082 -13.441 -5.562 1.00 0.00 N ATOM 2341 CA ASN B 121 9.276 -12.478 -6.633 1.00 0.00 C ATOM 2342 C ASN B 121 8.322 -11.299 -6.432 1.00 0.00 C ATOM 2343 O ASN B 121 8.731 -10.143 -6.525 1.00 0.00 O ATOM 2344 CB ASN B 121 8.974 -13.103 -7.997 1.00 0.00 C ATOM 2345 CG ASN B 121 9.912 -14.278 -8.281 1.00 0.00 C ATOM 2346 OD1 ASN B 121 9.573 -15.435 -8.096 1.00 0.00 O ATOM 2347 ND2 ASN B 121 11.107 -13.917 -8.739 1.00 0.00 N ATOM 0 H ASN B 121 8.646 -14.317 -5.850 1.00 0.00 H new ATOM 0 HA ASN B 121 10.315 -12.151 -6.608 1.00 0.00 H new ATOM 0 HB2 ASN B 121 7.939 -13.444 -8.024 1.00 0.00 H new ATOM 0 HB3 ASN B 121 9.081 -12.350 -8.778 1.00 0.00 H new ATOM 0 HD21 ASN B 121 11.805 -14.628 -8.958 1.00 0.00 H new ATOM 0 HD22 ASN B 121 11.326 -12.929 -8.871 1.00 0.00 H new ATOM 2354 N VAL B 122 7.069 -11.632 -6.161 1.00 0.00 N ATOM 2355 CA VAL B 122 6.053 -10.615 -5.947 1.00 0.00 C ATOM 2356 C VAL B 122 6.502 -9.682 -4.820 1.00 0.00 C ATOM 2357 O VAL B 122 6.813 -8.517 -5.061 1.00 0.00 O ATOM 2358 CB VAL B 122 4.701 -11.276 -5.672 1.00 0.00 C ATOM 2359 CG1 VAL B 122 3.858 -10.424 -4.721 1.00 0.00 C ATOM 2360 CG2 VAL B 122 3.949 -11.548 -6.977 1.00 0.00 C ATOM 0 H VAL B 122 6.734 -12.592 -6.085 1.00 0.00 H new ATOM 0 HA VAL B 122 5.926 -10.007 -6.843 1.00 0.00 H new ATOM 0 HB VAL B 122 4.888 -12.234 -5.187 1.00 0.00 H new ATOM 0 HG11 VAL B 122 2.902 -10.916 -4.542 1.00 0.00 H new ATOM 0 HG12 VAL B 122 4.387 -10.303 -3.775 1.00 0.00 H new ATOM 0 HG13 VAL B 122 3.684 -9.445 -5.167 1.00 0.00 H new ATOM 0 HG21 VAL B 122 2.991 -12.018 -6.754 1.00 0.00 H new ATOM 0 HG22 VAL B 122 3.778 -10.608 -7.501 1.00 0.00 H new ATOM 0 HG23 VAL B 122 4.541 -12.212 -7.607 1.00 0.00 H new ATOM 2370 N SER B 123 6.523 -10.230 -3.614 1.00 0.00 N ATOM 2371 CA SER B 123 6.929 -9.462 -2.450 1.00 0.00 C ATOM 2372 C SER B 123 8.247 -8.739 -2.734 1.00 0.00 C ATOM 2373 O SER B 123 8.460 -7.622 -2.264 1.00 0.00 O ATOM 2374 CB SER B 123 7.070 -10.360 -1.219 1.00 0.00 C ATOM 2375 OG SER B 123 8.276 -11.118 -1.247 1.00 0.00 O ATOM 0 H SER B 123 6.265 -11.197 -3.418 1.00 0.00 H new ATOM 0 HA SER B 123 6.155 -8.724 -2.240 1.00 0.00 H new ATOM 0 HB2 SER B 123 7.048 -9.747 -0.318 1.00 0.00 H new ATOM 0 HB3 SER B 123 6.217 -11.037 -1.164 1.00 0.00 H new ATOM 0 HG SER B 123 8.075 -12.044 -1.499 1.00 0.00 H new ATOM 2381 N GLU B 124 9.098 -9.405 -3.500 1.00 0.00 N ATOM 2382 CA GLU B 124 10.389 -8.840 -3.852 1.00 0.00 C ATOM 2383 C GLU B 124 10.205 -7.607 -4.738 1.00 0.00 C ATOM 2384 O GLU B 124 10.665 -6.518 -4.397 1.00 0.00 O ATOM 2385 CB GLU B 124 11.275 -9.882 -4.539 1.00 0.00 C ATOM 2386 CG GLU B 124 12.439 -9.214 -5.272 1.00 0.00 C ATOM 2387 CD GLU B 124 13.456 -10.253 -5.749 1.00 0.00 C ATOM 2388 OE1 GLU B 124 13.190 -10.864 -6.806 1.00 0.00 O ATOM 2389 OE2 GLU B 124 14.476 -10.413 -5.044 1.00 0.00 O ATOM 0 H GLU B 124 8.918 -10.331 -3.887 1.00 0.00 H new ATOM 0 HA GLU B 124 10.891 -8.532 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU B 124 11.661 -10.582 -3.798 1.00 0.00 H new ATOM 0 HB3 GLU B 124 10.680 -10.461 -5.245 1.00 0.00 H new ATOM 0 HG2 GLU B 124 12.061 -8.652 -6.126 1.00 0.00 H new ATOM 0 HG3 GLU B 124 12.928 -8.499 -4.610 1.00 0.00 H new ATOM 2396 N ALA B 125 9.532 -7.818 -5.860 1.00 0.00 N ATOM 2397 CA ALA B 125 9.281 -6.737 -6.798 1.00 0.00 C ATOM 2398 C ALA B 125 8.659 -5.555 -6.052 1.00 0.00 C ATOM 2399 O ALA B 125 8.737 -4.416 -6.511 1.00 0.00 O ATOM 2400 CB ALA B 125 8.391 -7.243 -7.934 1.00 0.00 C ATOM 0 H ALA B 125 9.153 -8.722 -6.141 1.00 0.00 H new ATOM 0 HA ALA B 125 10.214 -6.392 -7.244 1.00 0.00 H new ATOM 0 HB1 ALA B 125 8.203 -6.432 -8.638 1.00 0.00 H new ATOM 0 HB2 ALA B 125 8.891 -8.063 -8.450 1.00 0.00 H new ATOM 0 HB3 ALA B 125 7.444 -7.596 -7.525 1.00 0.00 H new ATOM 2406 N VAL B 126 8.056 -5.865 -4.914 1.00 0.00 N ATOM 2407 CA VAL B 126 7.421 -4.842 -4.100 1.00 0.00 C ATOM 2408 C VAL B 126 8.412 -4.350 -3.043 1.00 0.00 C ATOM 2409 O VAL B 126 8.333 -3.206 -2.598 1.00 0.00 O ATOM 2410 CB VAL B 126 6.124 -5.384 -3.497 1.00 0.00 C ATOM 2411 CG1 VAL B 126 5.265 -4.250 -2.935 1.00 0.00 C ATOM 2412 CG2 VAL B 126 5.343 -6.206 -4.524 1.00 0.00 C ATOM 0 H VAL B 126 7.994 -6.810 -4.536 1.00 0.00 H new ATOM 0 HA VAL B 126 7.145 -3.983 -4.712 1.00 0.00 H new ATOM 0 HB VAL B 126 6.389 -6.044 -2.671 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.349 -4.663 -2.512 1.00 0.00 H new ATOM 0 HG12 VAL B 126 5.819 -3.725 -2.157 1.00 0.00 H new ATOM 0 HG13 VAL B 126 5.014 -3.553 -3.735 1.00 0.00 H new ATOM 0 HG21 VAL B 126 4.425 -6.579 -4.069 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.095 -5.578 -5.380 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.952 -7.047 -4.856 1.00 0.00 H new ATOM 2422 N GLN B 127 9.322 -5.239 -2.671 1.00 0.00 N ATOM 2423 CA GLN B 127 10.327 -4.909 -1.675 1.00 0.00 C ATOM 2424 C GLN B 127 11.369 -3.959 -2.267 1.00 0.00 C ATOM 2425 O GLN B 127 11.875 -3.077 -1.574 1.00 0.00 O ATOM 2426 CB GLN B 127 10.988 -6.174 -1.123 1.00 0.00 C ATOM 2427 CG GLN B 127 11.571 -5.925 0.269 1.00 0.00 C ATOM 2428 CD GLN B 127 12.691 -6.920 0.580 1.00 0.00 C ATOM 2429 OE1 GLN B 127 13.557 -7.194 -0.234 1.00 0.00 O ATOM 2430 NE2 GLN B 127 12.625 -7.444 1.801 1.00 0.00 N ATOM 0 H GLN B 127 9.384 -6.187 -3.042 1.00 0.00 H new ATOM 0 HA GLN B 127 9.835 -4.404 -0.844 1.00 0.00 H new ATOM 0 HB2 GLN B 127 10.256 -6.980 -1.076 1.00 0.00 H new ATOM 0 HB3 GLN B 127 11.778 -6.500 -1.799 1.00 0.00 H new ATOM 0 HG2 GLN B 127 11.957 -4.907 0.329 1.00 0.00 H new ATOM 0 HG3 GLN B 127 10.784 -6.012 1.018 1.00 0.00 H new ATOM 0 HE21 GLN B 127 11.873 -7.171 2.433 1.00 0.00 H new ATOM 0 HE22 GLN B 127 13.327 -8.119 2.105 1.00 0.00 H new ATOM 2439 N ALA B 128 11.660 -4.171 -3.542 1.00 0.00 N ATOM 2440 CA ALA B 128 12.634 -3.344 -4.235 1.00 0.00 C ATOM 2441 C ALA B 128 11.956 -2.058 -4.712 1.00 0.00 C ATOM 2442 O ALA B 128 12.624 -1.054 -4.957 1.00 0.00 O ATOM 2443 CB ALA B 128 13.252 -4.139 -5.387 1.00 0.00 C ATOM 0 H ALA B 128 11.239 -4.903 -4.113 1.00 0.00 H new ATOM 0 HA ALA B 128 13.444 -3.061 -3.563 1.00 0.00 H new ATOM 0 HB1 ALA B 128 13.982 -3.519 -5.907 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.745 -5.027 -4.993 1.00 0.00 H new ATOM 0 HB3 ALA B 128 12.469 -4.438 -6.084 1.00 0.00 H new ATOM 2449 N ALA B 129 10.639 -2.129 -4.829 1.00 0.00 N ATOM 2450 CA ALA B 129 9.864 -0.983 -5.273 1.00 0.00 C ATOM 2451 C ALA B 129 9.775 0.038 -4.137 1.00 0.00 C ATOM 2452 O ALA B 129 9.982 1.231 -4.352 1.00 0.00 O ATOM 2453 CB ALA B 129 8.486 -1.450 -5.746 1.00 0.00 C ATOM 0 H ALA B 129 10.088 -2.963 -4.624 1.00 0.00 H new ATOM 0 HA ALA B 129 10.350 -0.495 -6.118 1.00 0.00 H new ATOM 0 HB1 ALA B 129 7.905 -0.590 -6.079 1.00 0.00 H new ATOM 0 HB2 ALA B 129 8.603 -2.151 -6.573 1.00 0.00 H new ATOM 0 HB3 ALA B 129 7.967 -1.942 -4.924 1.00 0.00 H new ATOM 2459 N CYS B 130 9.466 -0.469 -2.952 1.00 0.00 N ATOM 2460 CA CYS B 130 9.348 0.384 -1.781 1.00 0.00 C ATOM 2461 C CYS B 130 10.574 1.297 -1.726 1.00 0.00 C ATOM 2462 O CYS B 130 10.443 2.509 -1.556 1.00 0.00 O ATOM 2463 CB CYS B 130 9.188 -0.435 -0.499 1.00 0.00 C ATOM 2464 SG CYS B 130 7.435 -0.913 -0.276 1.00 0.00 S ATOM 0 H CYS B 130 9.294 -1.459 -2.778 1.00 0.00 H new ATOM 0 HA CYS B 130 8.447 0.992 -1.860 1.00 0.00 H new ATOM 0 HB2 CYS B 130 9.813 -1.327 -0.547 1.00 0.00 H new ATOM 0 HB3 CYS B 130 9.527 0.146 0.358 1.00 0.00 H new ATOM 0 HG CYS B 130 7.172 -1.017 0.993 1.00 0.00 H new