USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 953 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0.0593 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0.00346 USER MOD Single : A 30 TYR OH : rot 180:sc= -0.0363 USER MOD Single : A 33 MET CE :methyl -173:sc= -0.253 (180deg=-0.35) USER MOD Single : A 34 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00221) USER MOD Single : A 35 TYR OH : rot 144:sc= 0.726 USER MOD Single : A 39 GLN :FLIP amide:sc= -0.252 F(o=-0.81,f=-0.25) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.0601 X(o=-0.06,f=-0.01) USER MOD Single : A 47 SER OG : rot 170:sc= 1.01 USER MOD Single : A 49 LYS NZ :NH3+ 148:sc= -0.366 (180deg=-1.56!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 GLN :FLIP amide:sc= 0.0995 F(o=-0.71,f=0.099) USER MOD Single : A 59 GLN : amide:sc= -0.105 X(o=-0.11,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.215 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl -134:sc= -0.321 (180deg=-2.3!) USER MOD Single : A 79 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.83) USER MOD Single : A 80 SER OG : rot 180:sc= -0.122 USER MOD Single : A 88 GLN : amide:sc= -0.322 X(o=-0.32,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 157:sc= -0.369 (180deg=-1.51) USER MOD Single : A 97 THR OG1 : rot 67:sc= 1.22 USER MOD Single : A 101 GLN : amide:sc= -0.241 K(o=-0.24,f=-3.2!) USER MOD Single : A 106 ASN : amide:sc= 0.674 K(o=0.67,f=-4.8!) USER MOD Single : A 108 GLN : amide:sc= -0.16 K(o=-0.16,f=-1.7!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 CYS SG : rot 180:sc= -0.523 USER MOD ----------------------------------------------------------------- ATOM 81 N ILE A 6 6.110 -2.206 -12.843 1.00 1.45 N ATOM 82 CA ILE A 6 7.532 -2.526 -12.824 1.00 50.32 C ATOM 83 C ILE A 6 8.190 -2.032 -11.540 1.00 41.14 C ATOM 84 O ILE A 6 9.187 -2.593 -11.086 1.00 74.21 O ATOM 85 CB ILE A 6 8.263 -1.911 -14.032 1.00 41.41 C ATOM 86 CG1 ILE A 6 7.871 -0.441 -14.199 1.00 74.24 C ATOM 87 CG2 ILE A 6 7.949 -2.696 -15.297 1.00 45.40 C ATOM 88 CD1 ILE A 6 8.685 0.286 -15.246 1.00 50.40 C ATOM 0 HA ILE A 6 7.612 -3.612 -12.875 1.00 50.32 H new ATOM 0 HB ILE A 6 9.337 -1.963 -13.853 1.00 41.41 H new ATOM 0 HG12 ILE A 6 6.816 -0.383 -14.466 1.00 74.24 H new ATOM 0 HG13 ILE A 6 7.986 0.068 -13.242 1.00 74.24 H new ATOM 0 HG21 ILE A 6 8.473 -2.249 -16.142 1.00 45.40 H new ATOM 0 HG22 ILE A 6 8.274 -3.729 -15.174 1.00 45.40 H new ATOM 0 HG23 ILE A 6 6.875 -2.673 -15.482 1.00 45.40 H new ATOM 0 HD11 ILE A 6 8.353 1.322 -15.310 1.00 50.40 H new ATOM 0 HD12 ILE A 6 9.739 0.259 -14.970 1.00 50.40 H new ATOM 0 HD13 ILE A 6 8.550 -0.199 -16.213 1.00 50.40 H new ATOM 100 N ALA A 7 7.625 -0.979 -10.959 1.00 53.12 N ATOM 101 CA ALA A 7 8.154 -0.412 -9.725 1.00 50.42 C ATOM 102 C ALA A 7 8.261 -1.472 -8.635 1.00 35.32 C ATOM 103 O ALA A 7 9.226 -1.499 -7.873 1.00 43.32 O ATOM 104 CB ALA A 7 7.280 0.743 -9.258 1.00 21.23 C ATOM 0 H ALA A 7 6.801 -0.501 -11.323 1.00 53.12 H new ATOM 0 HA ALA A 7 9.157 -0.036 -9.928 1.00 50.42 H new ATOM 0 HB1 ALA A 7 7.687 1.157 -8.335 1.00 21.23 H new ATOM 0 HB2 ALA A 7 7.260 1.517 -10.025 1.00 21.23 H new ATOM 0 HB3 ALA A 7 6.267 0.383 -9.079 1.00 21.23 H new ATOM 110 N GLY A 8 7.260 -2.346 -8.565 1.00 44.32 N ATOM 111 CA GLY A 8 7.261 -3.396 -7.564 1.00 21.03 C ATOM 112 C GLY A 8 8.199 -4.533 -7.917 1.00 72.30 C ATOM 113 O GLY A 8 8.773 -5.170 -7.033 1.00 44.14 O ATOM 0 H GLY A 8 6.449 -2.345 -9.184 1.00 44.32 H new ATOM 0 HA2 GLY A 8 7.551 -2.975 -6.601 1.00 21.03 H new ATOM 0 HA3 GLY A 8 6.249 -3.786 -7.450 1.00 21.03 H new ATOM 117 N ILE A 9 8.353 -4.791 -9.211 1.00 50.55 N ATOM 118 CA ILE A 9 9.227 -5.859 -9.679 1.00 20.34 C ATOM 119 C ILE A 9 10.694 -5.457 -9.570 1.00 52.13 C ATOM 120 O ILE A 9 11.565 -6.298 -9.347 1.00 22.40 O ATOM 121 CB ILE A 9 8.918 -6.242 -11.138 1.00 72.10 C ATOM 122 CG1 ILE A 9 7.533 -6.884 -11.237 1.00 74.42 C ATOM 123 CG2 ILE A 9 9.984 -7.184 -11.676 1.00 23.32 C ATOM 124 CD1 ILE A 9 6.403 -5.880 -11.283 1.00 14.13 C ATOM 0 H ILE A 9 7.883 -4.274 -9.955 1.00 50.55 H new ATOM 0 HA ILE A 9 9.041 -6.721 -9.039 1.00 20.34 H new ATOM 0 HB ILE A 9 8.922 -5.336 -11.744 1.00 72.10 H new ATOM 0 HG12 ILE A 9 7.493 -7.505 -12.132 1.00 74.42 H new ATOM 0 HG13 ILE A 9 7.386 -7.545 -10.383 1.00 74.42 H new ATOM 0 HG21 ILE A 9 9.751 -7.445 -12.708 1.00 23.32 H new ATOM 0 HG22 ILE A 9 10.957 -6.693 -11.636 1.00 23.32 H new ATOM 0 HG23 ILE A 9 10.009 -8.089 -11.069 1.00 23.32 H new ATOM 0 HD11 ILE A 9 5.451 -6.406 -11.353 1.00 14.13 H new ATOM 0 HD12 ILE A 9 6.417 -5.275 -10.377 1.00 14.13 H new ATOM 0 HD13 ILE A 9 6.525 -5.234 -12.153 1.00 14.13 H new ATOM 136 N LEU A 10 10.960 -4.165 -9.728 1.00 62.00 N ATOM 137 CA LEU A 10 12.322 -3.649 -9.646 1.00 63.11 C ATOM 138 C LEU A 10 12.714 -3.374 -8.198 1.00 1.12 C ATOM 139 O LEU A 10 13.887 -3.464 -7.832 1.00 35.41 O ATOM 140 CB LEU A 10 12.455 -2.370 -10.474 1.00 52.21 C ATOM 141 CG LEU A 10 12.140 -1.063 -9.745 1.00 54.05 C ATOM 142 CD1 LEU A 10 13.381 -0.527 -9.050 1.00 42.30 C ATOM 143 CD2 LEU A 10 11.583 -0.032 -10.716 1.00 53.03 C ATOM 0 H LEU A 10 10.251 -3.456 -9.914 1.00 62.00 H new ATOM 0 HA LEU A 10 12.995 -4.406 -10.048 1.00 63.11 H new ATOM 0 HB2 LEU A 10 13.474 -2.313 -10.857 1.00 52.21 H new ATOM 0 HB3 LEU A 10 11.794 -2.450 -11.337 1.00 52.21 H new ATOM 0 HG LEU A 10 11.383 -1.265 -8.987 1.00 54.05 H new ATOM 0 HD11 LEU A 10 13.137 0.403 -8.537 1.00 42.30 H new ATOM 0 HD12 LEU A 10 13.737 -1.259 -8.325 1.00 42.30 H new ATOM 0 HD13 LEU A 10 14.160 -0.340 -9.789 1.00 42.30 H new ATOM 0 HD21 LEU A 10 11.364 0.892 -10.180 1.00 53.03 H new ATOM 0 HD22 LEU A 10 12.317 0.166 -11.497 1.00 53.03 H new ATOM 0 HD23 LEU A 10 10.668 -0.415 -11.168 1.00 53.03 H new ATOM 155 N THR A 11 11.724 -3.039 -7.376 1.00 24.13 N ATOM 156 CA THR A 11 11.965 -2.752 -5.967 1.00 51.13 C ATOM 157 C THR A 11 12.028 -4.035 -5.147 1.00 74.43 C ATOM 158 O THR A 11 12.639 -4.072 -4.079 1.00 50.25 O ATOM 159 CB THR A 11 10.870 -1.837 -5.386 1.00 22.55 C ATOM 160 OG1 THR A 11 11.338 -1.217 -4.183 1.00 22.23 O ATOM 161 CG2 THR A 11 9.603 -2.628 -5.095 1.00 2.41 C ATOM 0 H THR A 11 10.748 -2.960 -7.662 1.00 24.13 H new ATOM 0 HA THR A 11 12.926 -2.240 -5.908 1.00 51.13 H new ATOM 0 HB THR A 11 10.639 -1.069 -6.124 1.00 22.55 H new ATOM 0 HG1 THR A 11 10.637 -0.636 -3.820 1.00 22.23 H new ATOM 0 HG21 THR A 11 8.844 -1.961 -4.686 1.00 2.41 H new ATOM 0 HG22 THR A 11 9.233 -3.076 -6.018 1.00 2.41 H new ATOM 0 HG23 THR A 11 9.823 -3.414 -4.373 1.00 2.41 H new ATOM 169 N SER A 12 11.392 -5.087 -5.654 1.00 22.34 N ATOM 170 CA SER A 12 11.373 -6.373 -4.966 1.00 5.02 C ATOM 171 C SER A 12 12.655 -7.154 -5.239 1.00 62.12 C ATOM 172 O SER A 12 13.451 -7.403 -4.333 1.00 33.23 O ATOM 173 CB SER A 12 10.159 -7.193 -5.406 1.00 23.11 C ATOM 174 OG SER A 12 10.088 -8.419 -4.699 1.00 4.04 O ATOM 0 H SER A 12 10.883 -5.074 -6.538 1.00 22.34 H new ATOM 0 HA SER A 12 11.305 -6.183 -3.895 1.00 5.02 H new ATOM 0 HB2 SER A 12 9.248 -6.619 -5.237 1.00 23.11 H new ATOM 0 HB3 SER A 12 10.218 -7.390 -6.476 1.00 23.11 H new ATOM 0 HG SER A 12 9.303 -8.924 -4.997 1.00 4.04 H new ATOM 180 N THR A 13 12.849 -7.539 -6.497 1.00 4.11 N ATOM 181 CA THR A 13 14.033 -8.293 -6.892 1.00 13.45 C ATOM 182 C THR A 13 14.725 -7.644 -8.085 1.00 20.12 C ATOM 183 O THR A 13 14.070 -7.095 -8.971 1.00 63.33 O ATOM 184 CB THR A 13 13.678 -9.749 -7.247 1.00 45.10 C ATOM 185 OG1 THR A 13 13.042 -10.384 -6.133 1.00 33.21 O ATOM 186 CG2 THR A 13 14.925 -10.529 -7.638 1.00 14.01 C ATOM 0 H THR A 13 12.201 -7.341 -7.260 1.00 4.11 H new ATOM 0 HA THR A 13 14.710 -8.290 -6.038 1.00 13.45 H new ATOM 0 HB THR A 13 12.994 -9.737 -8.096 1.00 45.10 H new ATOM 0 HG1 THR A 13 12.818 -11.309 -6.368 1.00 33.21 H new ATOM 0 HG21 THR A 13 14.650 -11.555 -7.885 1.00 14.01 H new ATOM 0 HG22 THR A 13 15.391 -10.060 -8.505 1.00 14.01 H new ATOM 0 HG23 THR A 13 15.628 -10.532 -6.805 1.00 14.01 H new ATOM 194 N ARG A 14 16.052 -7.712 -8.102 1.00 2.45 N ATOM 195 CA ARG A 14 16.833 -7.130 -9.187 1.00 21.13 C ATOM 196 C ARG A 14 17.594 -8.211 -9.949 1.00 32.21 C ATOM 197 O ARG A 14 18.621 -8.708 -9.485 1.00 35.41 O ATOM 198 CB ARG A 14 17.814 -6.092 -8.638 1.00 52.03 C ATOM 199 CG ARG A 14 17.159 -5.043 -7.755 1.00 1.15 C ATOM 200 CD ARG A 14 18.193 -4.134 -7.109 1.00 44.23 C ATOM 201 NE ARG A 14 19.200 -4.889 -6.369 1.00 64.41 N ATOM 202 CZ ARG A 14 19.003 -5.378 -5.150 1.00 3.14 C ATOM 203 NH1 ARG A 14 17.843 -5.191 -4.537 1.00 35.32 N ATOM 204 NH2 ARG A 14 19.968 -6.055 -4.541 1.00 24.11 N ATOM 0 H ARG A 14 16.609 -8.164 -7.377 1.00 2.45 H new ATOM 0 HA ARG A 14 16.144 -6.641 -9.875 1.00 21.13 H new ATOM 0 HB2 ARG A 14 18.589 -6.603 -8.067 1.00 52.03 H new ATOM 0 HB3 ARG A 14 18.309 -5.595 -9.472 1.00 52.03 H new ATOM 0 HG2 ARG A 14 16.468 -4.445 -8.350 1.00 1.15 H new ATOM 0 HG3 ARG A 14 16.570 -5.534 -6.980 1.00 1.15 H new ATOM 0 HD2 ARG A 14 18.681 -3.536 -7.879 1.00 44.23 H new ATOM 0 HD3 ARG A 14 17.693 -3.439 -6.435 1.00 44.23 H new ATOM 0 HE ARG A 14 20.104 -5.050 -6.813 1.00 64.41 H new ATOM 0 HH11 ARG A 14 17.099 -4.670 -5.001 1.00 35.32 H new ATOM 0 HH12 ARG A 14 17.694 -5.568 -3.601 1.00 35.32 H new ATOM 0 HH21 ARG A 14 20.863 -6.200 -5.009 1.00 24.11 H new ATOM 0 HH22 ARG A 14 19.815 -6.430 -3.605 1.00 24.11 H new ATOM 218 N THR A 15 17.083 -8.572 -11.122 1.00 53.21 N ATOM 219 CA THR A 15 17.712 -9.595 -11.948 1.00 51.50 C ATOM 220 C THR A 15 17.654 -9.221 -13.425 1.00 32.22 C ATOM 221 O THR A 15 16.671 -8.643 -13.890 1.00 62.22 O ATOM 222 CB THR A 15 17.041 -10.967 -11.750 1.00 64.14 C ATOM 223 OG1 THR A 15 17.200 -11.399 -10.395 1.00 24.44 O ATOM 224 CG2 THR A 15 17.639 -12.002 -12.691 1.00 64.04 C ATOM 0 H THR A 15 16.235 -8.171 -11.521 1.00 53.21 H new ATOM 0 HA THR A 15 18.754 -9.660 -11.633 1.00 51.50 H new ATOM 0 HB THR A 15 15.980 -10.864 -11.976 1.00 64.14 H new ATOM 0 HG1 THR A 15 16.769 -12.271 -10.277 1.00 24.44 H new ATOM 0 HG21 THR A 15 17.150 -12.963 -12.533 1.00 64.04 H new ATOM 0 HG22 THR A 15 17.490 -11.684 -13.723 1.00 64.04 H new ATOM 0 HG23 THR A 15 18.706 -12.101 -12.492 1.00 64.04 H new ATOM 232 N ILE A 16 18.711 -9.555 -14.157 1.00 22.52 N ATOM 233 CA ILE A 16 18.779 -9.256 -15.582 1.00 35.42 C ATOM 234 C ILE A 16 19.249 -10.470 -16.377 1.00 14.04 C ATOM 235 O ILE A 16 20.345 -10.984 -16.154 1.00 54.44 O ATOM 236 CB ILE A 16 19.724 -8.074 -15.865 1.00 11.12 C ATOM 237 CG1 ILE A 16 19.258 -6.828 -15.109 1.00 55.23 C ATOM 238 CG2 ILE A 16 19.795 -7.798 -17.359 1.00 73.43 C ATOM 239 CD1 ILE A 16 19.954 -6.630 -13.781 1.00 64.23 C ATOM 0 H ILE A 16 19.532 -10.033 -13.787 1.00 22.52 H new ATOM 0 HA ILE A 16 17.770 -8.987 -15.896 1.00 35.42 H new ATOM 0 HB ILE A 16 20.723 -8.335 -15.516 1.00 11.12 H new ATOM 0 HG12 ILE A 16 19.427 -5.950 -15.733 1.00 55.23 H new ATOM 0 HG13 ILE A 16 18.183 -6.897 -14.940 1.00 55.23 H new ATOM 0 HG21 ILE A 16 20.467 -6.960 -17.543 1.00 73.43 H new ATOM 0 HG22 ILE A 16 20.169 -8.682 -17.875 1.00 73.43 H new ATOM 0 HG23 ILE A 16 18.800 -7.554 -17.732 1.00 73.43 H new ATOM 0 HD11 ILE A 16 19.573 -5.728 -13.302 1.00 64.23 H new ATOM 0 HD12 ILE A 16 19.764 -7.490 -13.139 1.00 64.23 H new ATOM 0 HD13 ILE A 16 21.027 -6.529 -13.944 1.00 64.23 H new ATOM 251 N ALA A 17 18.412 -10.922 -17.305 1.00 64.32 N ATOM 252 CA ALA A 17 18.744 -12.073 -18.136 1.00 72.03 C ATOM 253 C ALA A 17 18.910 -11.666 -19.597 1.00 35.15 C ATOM 254 O ALA A 17 17.993 -11.111 -20.205 1.00 25.11 O ATOM 255 CB ALA A 17 17.673 -13.146 -18.004 1.00 11.34 C ATOM 0 H ALA A 17 17.500 -10.509 -17.500 1.00 64.32 H new ATOM 0 HA ALA A 17 19.694 -12.479 -17.788 1.00 72.03 H new ATOM 0 HB1 ALA A 17 17.934 -13.999 -18.630 1.00 11.34 H new ATOM 0 HB2 ALA A 17 17.605 -13.466 -16.964 1.00 11.34 H new ATOM 0 HB3 ALA A 17 16.712 -12.742 -18.323 1.00 11.34 H new ATOM 261 N LEU A 18 20.083 -11.944 -20.154 1.00 31.43 N ATOM 262 CA LEU A 18 20.369 -11.607 -21.544 1.00 1.53 C ATOM 263 C LEU A 18 19.985 -12.753 -22.473 1.00 74.21 C ATOM 264 O LEU A 18 20.398 -13.895 -22.272 1.00 22.14 O ATOM 265 CB LEU A 18 21.852 -11.273 -21.713 1.00 64.20 C ATOM 266 CG LEU A 18 22.190 -10.239 -22.788 1.00 35.03 C ATOM 267 CD1 LEU A 18 21.684 -10.697 -24.147 1.00 34.23 C ATOM 268 CD2 LEU A 18 21.600 -8.883 -22.427 1.00 24.24 C ATOM 0 H LEU A 18 20.852 -12.402 -19.665 1.00 31.43 H new ATOM 0 HA LEU A 18 19.773 -10.734 -21.810 1.00 1.53 H new ATOM 0 HB2 LEU A 18 22.234 -10.912 -20.758 1.00 64.20 H new ATOM 0 HB3 LEU A 18 22.387 -12.194 -21.943 1.00 64.20 H new ATOM 0 HG LEU A 18 23.274 -10.139 -22.841 1.00 35.03 H new ATOM 0 HD11 LEU A 18 21.934 -9.949 -24.899 1.00 34.23 H new ATOM 0 HD12 LEU A 18 22.153 -11.645 -24.409 1.00 34.23 H new ATOM 0 HD13 LEU A 18 20.602 -10.826 -24.108 1.00 34.23 H new ATOM 0 HD21 LEU A 18 21.850 -8.159 -23.203 1.00 24.24 H new ATOM 0 HD22 LEU A 18 20.516 -8.968 -22.346 1.00 24.24 H new ATOM 0 HD23 LEU A 18 22.010 -8.550 -21.474 1.00 24.24 H new ATOM 280 N VAL A 19 19.192 -12.441 -23.493 1.00 51.24 N ATOM 281 CA VAL A 19 18.754 -13.444 -24.456 1.00 61.15 C ATOM 282 C VAL A 19 19.616 -13.412 -25.714 1.00 31.14 C ATOM 283 O VAL A 19 19.624 -12.425 -26.448 1.00 64.32 O ATOM 284 CB VAL A 19 17.280 -13.237 -24.852 1.00 41.54 C ATOM 285 CG1 VAL A 19 16.847 -14.284 -25.866 1.00 72.24 C ATOM 286 CG2 VAL A 19 16.388 -13.273 -23.621 1.00 32.41 C ATOM 0 H VAL A 19 18.840 -11.501 -23.674 1.00 51.24 H new ATOM 0 HA VAL A 19 18.859 -14.415 -23.971 1.00 61.15 H new ATOM 0 HB VAL A 19 17.181 -12.255 -25.315 1.00 41.54 H new ATOM 0 HG11 VAL A 19 15.803 -14.121 -26.134 1.00 72.24 H new ATOM 0 HG12 VAL A 19 17.467 -14.204 -26.759 1.00 72.24 H new ATOM 0 HG13 VAL A 19 16.960 -15.278 -25.433 1.00 72.24 H new ATOM 0 HG21 VAL A 19 15.350 -13.125 -23.919 1.00 32.41 H new ATOM 0 HG22 VAL A 19 16.489 -14.239 -23.126 1.00 32.41 H new ATOM 0 HG23 VAL A 19 16.684 -12.481 -22.934 1.00 32.41 H new ATOM 296 N GLY A 20 20.341 -14.500 -25.956 1.00 32.24 N ATOM 297 CA GLY A 20 21.196 -14.577 -27.125 1.00 44.43 C ATOM 298 C GLY A 20 22.579 -14.009 -26.871 1.00 33.04 C ATOM 299 O GLY A 20 22.999 -13.061 -27.533 1.00 3.12 O ATOM 0 H GLY A 20 20.351 -15.330 -25.363 1.00 32.24 H new ATOM 0 HA2 GLY A 20 21.286 -15.617 -27.438 1.00 44.43 H new ATOM 0 HA3 GLY A 20 20.730 -14.036 -27.948 1.00 44.43 H new ATOM 303 N ALA A 21 23.286 -14.589 -25.907 1.00 25.21 N ATOM 304 CA ALA A 21 24.629 -14.136 -25.567 1.00 2.54 C ATOM 305 C ALA A 21 25.687 -14.949 -26.305 1.00 1.05 C ATOM 306 O ALA A 21 26.099 -16.013 -25.843 1.00 72.43 O ATOM 307 CB ALA A 21 24.850 -14.220 -24.063 1.00 55.34 C ATOM 0 H ALA A 21 22.951 -15.373 -25.348 1.00 25.21 H new ATOM 0 HA ALA A 21 24.724 -13.096 -25.880 1.00 2.54 H new ATOM 0 HB1 ALA A 21 25.857 -13.879 -23.824 1.00 55.34 H new ATOM 0 HB2 ALA A 21 24.122 -13.589 -23.553 1.00 55.34 H new ATOM 0 HB3 ALA A 21 24.729 -15.252 -23.735 1.00 55.34 H new ATOM 313 N SER A 22 26.123 -14.441 -27.453 1.00 73.31 N ATOM 314 CA SER A 22 27.130 -15.124 -28.257 1.00 53.44 C ATOM 315 C SER A 22 28.497 -14.469 -28.086 1.00 10.22 C ATOM 316 O SER A 22 28.687 -13.624 -27.211 1.00 5.12 O ATOM 317 CB SER A 22 26.728 -15.112 -29.733 1.00 53.15 C ATOM 318 OG SER A 22 27.275 -16.224 -30.420 1.00 32.42 O ATOM 0 H SER A 22 25.795 -13.559 -27.847 1.00 73.31 H new ATOM 0 HA SER A 22 27.195 -16.156 -27.913 1.00 53.44 H new ATOM 0 HB2 SER A 22 25.641 -15.127 -29.817 1.00 53.15 H new ATOM 0 HB3 SER A 22 27.071 -14.188 -30.199 1.00 53.15 H new ATOM 0 HG SER A 22 27.002 -16.194 -31.361 1.00 32.42 H new ATOM 324 N ASP A 23 29.445 -14.865 -28.927 1.00 64.32 N ATOM 325 CA ASP A 23 30.796 -14.317 -28.871 1.00 34.33 C ATOM 326 C ASP A 23 30.953 -13.158 -29.850 1.00 20.12 C ATOM 327 O ASP A 23 31.953 -13.064 -30.562 1.00 51.00 O ATOM 328 CB ASP A 23 31.824 -15.406 -29.180 1.00 42.04 C ATOM 329 CG ASP A 23 31.450 -16.226 -30.399 1.00 41.04 C ATOM 330 OD1 ASP A 23 31.012 -15.629 -31.405 1.00 52.30 O ATOM 331 OD2 ASP A 23 31.597 -17.465 -30.348 1.00 55.13 O ATOM 0 H ASP A 23 29.304 -15.564 -29.656 1.00 64.32 H new ATOM 0 HA ASP A 23 30.968 -13.942 -27.862 1.00 34.33 H new ATOM 0 HB2 ASP A 23 32.799 -14.946 -29.340 1.00 42.04 H new ATOM 0 HB3 ASP A 23 31.921 -16.066 -28.318 1.00 42.04 H new ATOM 336 N LYS A 24 29.959 -12.277 -29.881 1.00 35.51 N ATOM 337 CA LYS A 24 29.985 -11.124 -30.772 1.00 2.30 C ATOM 338 C LYS A 24 30.171 -9.831 -29.983 1.00 71.33 C ATOM 339 O LYS A 24 29.212 -9.128 -29.662 1.00 64.54 O ATOM 340 CB LYS A 24 28.693 -11.054 -31.589 1.00 32.05 C ATOM 341 CG LYS A 24 28.660 -12.022 -32.759 1.00 12.32 C ATOM 342 CD LYS A 24 29.595 -11.582 -33.873 1.00 12.42 C ATOM 343 CE LYS A 24 29.341 -12.361 -35.154 1.00 51.00 C ATOM 344 NZ LYS A 24 30.142 -11.832 -36.293 1.00 33.22 N ATOM 0 H LYS A 24 29.124 -12.340 -29.298 1.00 35.51 H new ATOM 0 HA LYS A 24 30.830 -11.240 -31.451 1.00 2.30 H new ATOM 0 HB2 LYS A 24 27.847 -11.260 -30.934 1.00 32.05 H new ATOM 0 HB3 LYS A 24 28.565 -10.039 -31.965 1.00 32.05 H new ATOM 0 HG2 LYS A 24 28.943 -13.017 -32.417 1.00 12.32 H new ATOM 0 HG3 LYS A 24 27.643 -12.095 -33.144 1.00 12.32 H new ATOM 0 HD2 LYS A 24 29.462 -10.517 -34.061 1.00 12.42 H new ATOM 0 HD3 LYS A 24 30.629 -11.724 -33.559 1.00 12.42 H new ATOM 0 HE2 LYS A 24 29.585 -13.411 -34.995 1.00 51.00 H new ATOM 0 HE3 LYS A 24 28.281 -12.315 -35.403 1.00 51.00 H new ATOM 0 HZ1 LYS A 24 29.941 -12.390 -37.148 1.00 33.22 H new ATOM 0 HZ2 LYS A 24 29.891 -10.837 -36.462 1.00 33.22 H new ATOM 0 HZ3 LYS A 24 31.155 -11.900 -36.066 1.00 33.22 H new ATOM 358 N PRO A 25 31.433 -9.508 -29.664 1.00 31.11 N ATOM 359 CA PRO A 25 31.774 -8.297 -28.911 1.00 34.42 C ATOM 360 C PRO A 25 31.550 -7.027 -29.724 1.00 3.11 C ATOM 361 O PRO A 25 31.676 -5.917 -29.206 1.00 62.10 O ATOM 362 CB PRO A 25 33.262 -8.479 -28.601 1.00 74.40 C ATOM 363 CG PRO A 25 33.765 -9.379 -29.676 1.00 60.51 C ATOM 364 CD PRO A 25 32.624 -10.299 -30.014 1.00 25.41 C ATOM 0 HA PRO A 25 31.152 -8.180 -28.024 1.00 34.42 H new ATOM 0 HB2 PRO A 25 33.787 -7.524 -28.606 1.00 74.40 H new ATOM 0 HB3 PRO A 25 33.410 -8.919 -27.615 1.00 74.40 H new ATOM 0 HG2 PRO A 25 34.077 -8.807 -30.550 1.00 60.51 H new ATOM 0 HG3 PRO A 25 34.634 -9.943 -29.338 1.00 60.51 H new ATOM 0 HD2 PRO A 25 32.628 -10.574 -31.069 1.00 25.41 H new ATOM 0 HD3 PRO A 25 32.673 -11.226 -29.443 1.00 25.41 H new ATOM 372 N ASP A 26 31.218 -7.197 -30.999 1.00 10.23 N ATOM 373 CA ASP A 26 30.975 -6.063 -31.883 1.00 64.03 C ATOM 374 C ASP A 26 29.479 -5.822 -32.060 1.00 64.33 C ATOM 375 O ASP A 26 29.049 -5.228 -33.049 1.00 61.41 O ATOM 376 CB ASP A 26 31.631 -6.301 -33.244 1.00 72.45 C ATOM 377 CG ASP A 26 32.025 -5.009 -33.932 1.00 11.24 C ATOM 378 OD1 ASP A 26 32.263 -4.009 -33.223 1.00 32.15 O ATOM 379 OD2 ASP A 26 32.094 -4.997 -35.179 1.00 5.33 O ATOM 0 H ASP A 26 31.111 -8.109 -31.443 1.00 10.23 H new ATOM 0 HA ASP A 26 31.415 -5.177 -31.426 1.00 64.03 H new ATOM 0 HB2 ASP A 26 32.516 -6.924 -33.113 1.00 72.45 H new ATOM 0 HB3 ASP A 26 30.943 -6.854 -33.883 1.00 72.45 H new ATOM 384 N ARG A 27 28.692 -6.288 -31.096 1.00 61.33 N ATOM 385 CA ARG A 27 27.244 -6.126 -31.147 1.00 2.30 C ATOM 386 C ARG A 27 26.726 -5.465 -29.873 1.00 4.22 C ATOM 387 O ARG A 27 27.394 -5.446 -28.839 1.00 2.43 O ATOM 388 CB ARG A 27 26.564 -7.482 -31.344 1.00 11.34 C ATOM 389 CG ARG A 27 26.379 -7.864 -32.803 1.00 35.21 C ATOM 390 CD ARG A 27 25.190 -8.794 -32.988 1.00 54.04 C ATOM 391 NE ARG A 27 23.926 -8.063 -33.042 1.00 23.14 N ATOM 392 CZ ARG A 27 23.529 -7.359 -34.095 1.00 53.42 C ATOM 393 NH1 ARG A 27 24.291 -7.291 -35.178 1.00 5.45 N ATOM 394 NH2 ARG A 27 22.365 -6.721 -34.068 1.00 4.22 N ATOM 0 H ARG A 27 29.033 -6.781 -30.270 1.00 61.33 H new ATOM 0 HA ARG A 27 27.005 -5.482 -31.993 1.00 2.30 H new ATOM 0 HB2 ARG A 27 27.156 -8.251 -30.848 1.00 11.34 H new ATOM 0 HB3 ARG A 27 25.590 -7.465 -30.855 1.00 11.34 H new ATOM 0 HG2 ARG A 27 26.235 -6.964 -33.401 1.00 35.21 H new ATOM 0 HG3 ARG A 27 27.283 -8.349 -33.171 1.00 35.21 H new ATOM 0 HD2 ARG A 27 25.317 -9.366 -33.907 1.00 54.04 H new ATOM 0 HD3 ARG A 27 25.159 -9.511 -32.167 1.00 54.04 H new ATOM 0 HE ARG A 27 23.315 -8.095 -32.226 1.00 23.14 H new ATOM 0 HH11 ARG A 27 25.185 -7.781 -35.204 1.00 5.45 H new ATOM 0 HH12 ARG A 27 23.983 -6.749 -35.985 1.00 5.45 H new ATOM 0 HH21 ARG A 27 21.775 -6.772 -33.238 1.00 4.22 H new ATOM 0 HH22 ARG A 27 22.061 -6.180 -34.878 1.00 4.22 H new ATOM 408 N PRO A 28 25.508 -4.909 -29.947 1.00 71.13 N ATOM 409 CA PRO A 28 24.874 -4.237 -28.809 1.00 75.04 C ATOM 410 C PRO A 28 24.468 -5.214 -27.711 1.00 62.43 C ATOM 411 O PRO A 28 24.177 -4.812 -26.585 1.00 41.41 O ATOM 412 CB PRO A 28 23.635 -3.585 -29.428 1.00 51.54 C ATOM 413 CG PRO A 28 23.329 -4.414 -30.627 1.00 50.04 C ATOM 414 CD PRO A 28 24.655 -4.895 -31.148 1.00 4.42 C ATOM 0 HA PRO A 28 25.549 -3.531 -28.326 1.00 75.04 H new ATOM 0 HB2 PRO A 28 22.800 -3.578 -28.728 1.00 51.54 H new ATOM 0 HB3 PRO A 28 23.829 -2.548 -29.703 1.00 51.54 H new ATOM 0 HG2 PRO A 28 22.684 -5.254 -30.367 1.00 50.04 H new ATOM 0 HG3 PRO A 28 22.802 -3.830 -31.381 1.00 50.04 H new ATOM 0 HD2 PRO A 28 24.575 -5.885 -31.596 1.00 4.42 H new ATOM 0 HD3 PRO A 28 25.051 -4.229 -31.915 1.00 4.42 H new ATOM 422 N SER A 29 24.452 -6.500 -28.047 1.00 32.54 N ATOM 423 CA SER A 29 24.079 -7.535 -27.089 1.00 72.33 C ATOM 424 C SER A 29 25.224 -7.818 -26.121 1.00 73.13 C ATOM 425 O SER A 29 25.002 -8.239 -24.986 1.00 13.13 O ATOM 426 CB SER A 29 23.686 -8.820 -27.822 1.00 2.22 C ATOM 427 OG SER A 29 24.683 -9.200 -28.754 1.00 61.14 O ATOM 0 H SER A 29 24.693 -6.850 -28.974 1.00 32.54 H new ATOM 0 HA SER A 29 23.224 -7.175 -26.517 1.00 72.33 H new ATOM 0 HB2 SER A 29 23.534 -9.622 -27.100 1.00 2.22 H new ATOM 0 HB3 SER A 29 22.738 -8.672 -28.339 1.00 2.22 H new ATOM 0 HG SER A 29 24.409 -10.024 -29.208 1.00 61.14 H new ATOM 433 N TYR A 30 26.448 -7.584 -26.579 1.00 43.22 N ATOM 434 CA TYR A 30 27.629 -7.815 -25.756 1.00 23.20 C ATOM 435 C TYR A 30 27.963 -6.581 -24.923 1.00 63.24 C ATOM 436 O TYR A 30 28.233 -6.681 -23.726 1.00 55.32 O ATOM 437 CB TYR A 30 28.824 -8.190 -26.635 1.00 11.22 C ATOM 438 CG TYR A 30 29.861 -9.029 -25.922 1.00 55.31 C ATOM 439 CD1 TYR A 30 30.556 -8.528 -24.829 1.00 4.11 C ATOM 440 CD2 TYR A 30 30.143 -10.323 -26.342 1.00 2.14 C ATOM 441 CE1 TYR A 30 31.505 -9.291 -24.175 1.00 52.44 C ATOM 442 CE2 TYR A 30 31.089 -11.093 -25.693 1.00 71.42 C ATOM 443 CZ TYR A 30 31.767 -10.573 -24.611 1.00 43.30 C ATOM 444 OH TYR A 30 32.710 -11.336 -23.962 1.00 23.22 O ATOM 0 H TYR A 30 26.649 -7.234 -27.516 1.00 43.22 H new ATOM 0 HA TYR A 30 27.412 -8.640 -25.078 1.00 23.20 H new ATOM 0 HB2 TYR A 30 28.465 -8.735 -27.508 1.00 11.22 H new ATOM 0 HB3 TYR A 30 29.296 -7.278 -27.001 1.00 11.22 H new ATOM 0 HD1 TYR A 30 30.351 -7.525 -24.484 1.00 4.11 H new ATOM 0 HD2 TYR A 30 29.614 -10.734 -27.189 1.00 2.14 H new ATOM 0 HE1 TYR A 30 32.038 -8.886 -23.328 1.00 52.44 H new ATOM 0 HE2 TYR A 30 31.296 -12.097 -26.032 1.00 71.42 H new ATOM 0 HH TYR A 30 32.773 -12.214 -24.393 1.00 23.22 H new ATOM 454 N ARG A 31 27.943 -5.418 -25.566 1.00 70.35 N ATOM 455 CA ARG A 31 28.244 -4.164 -24.887 1.00 31.11 C ATOM 456 C ARG A 31 27.365 -3.990 -23.652 1.00 32.41 C ATOM 457 O ARG A 31 27.790 -3.414 -22.650 1.00 72.24 O ATOM 458 CB ARG A 31 28.044 -2.983 -25.839 1.00 30.15 C ATOM 459 CG ARG A 31 26.584 -2.653 -26.101 1.00 52.21 C ATOM 460 CD ARG A 31 26.070 -1.596 -25.136 1.00 54.34 C ATOM 461 NE ARG A 31 24.908 -0.888 -25.668 1.00 60.03 N ATOM 462 CZ ARG A 31 24.970 -0.033 -26.683 1.00 75.44 C ATOM 463 NH1 ARG A 31 26.130 0.218 -27.273 1.00 60.24 N ATOM 464 NH2 ARG A 31 23.869 0.572 -27.111 1.00 35.53 N ATOM 0 H ARG A 31 27.721 -5.318 -26.557 1.00 70.35 H new ATOM 0 HA ARG A 31 29.286 -4.193 -24.569 1.00 31.11 H new ATOM 0 HB2 ARG A 31 28.537 -2.104 -25.423 1.00 30.15 H new ATOM 0 HB3 ARG A 31 28.534 -3.205 -26.787 1.00 30.15 H new ATOM 0 HG2 ARG A 31 26.468 -2.299 -27.125 1.00 52.21 H new ATOM 0 HG3 ARG A 31 25.983 -3.557 -26.006 1.00 52.21 H new ATOM 0 HD2 ARG A 31 25.805 -2.067 -24.189 1.00 54.34 H new ATOM 0 HD3 ARG A 31 26.865 -0.881 -24.925 1.00 54.34 H new ATOM 0 HE ARG A 31 24.000 -1.059 -25.237 1.00 60.03 H new ATOM 0 HH11 ARG A 31 26.978 -0.246 -26.948 1.00 60.24 H new ATOM 0 HH12 ARG A 31 26.174 0.875 -28.052 1.00 60.24 H new ATOM 0 HH21 ARG A 31 22.974 0.381 -26.661 1.00 35.53 H new ATOM 0 HH22 ARG A 31 23.918 1.228 -27.890 1.00 35.53 H new ATOM 478 N VAL A 32 26.136 -4.492 -23.731 1.00 25.33 N ATOM 479 CA VAL A 32 25.197 -4.393 -22.620 1.00 24.52 C ATOM 480 C VAL A 32 25.525 -5.409 -21.531 1.00 71.43 C ATOM 481 O VAL A 32 25.372 -5.131 -20.342 1.00 75.44 O ATOM 482 CB VAL A 32 23.747 -4.611 -23.090 1.00 11.20 C ATOM 483 CG1 VAL A 32 23.587 -5.990 -23.710 1.00 65.53 C ATOM 484 CG2 VAL A 32 22.778 -4.423 -21.932 1.00 41.53 C ATOM 0 H VAL A 32 25.768 -4.971 -24.553 1.00 25.33 H new ATOM 0 HA VAL A 32 25.292 -3.386 -22.214 1.00 24.52 H new ATOM 0 HB VAL A 32 23.516 -3.867 -23.853 1.00 11.20 H new ATOM 0 HG11 VAL A 32 22.556 -6.125 -24.036 1.00 65.53 H new ATOM 0 HG12 VAL A 32 24.254 -6.083 -24.567 1.00 65.53 H new ATOM 0 HG13 VAL A 32 23.837 -6.752 -22.972 1.00 65.53 H new ATOM 0 HG21 VAL A 32 21.758 -4.581 -22.282 1.00 41.53 H new ATOM 0 HG22 VAL A 32 23.007 -5.142 -21.145 1.00 41.53 H new ATOM 0 HG23 VAL A 32 22.874 -3.411 -21.538 1.00 41.53 H new ATOM 494 N MET A 33 25.977 -6.588 -21.946 1.00 62.15 N ATOM 495 CA MET A 33 26.328 -7.646 -21.006 1.00 3.20 C ATOM 496 C MET A 33 27.421 -7.181 -20.048 1.00 72.12 C ATOM 497 O MET A 33 27.212 -7.116 -18.837 1.00 2.24 O ATOM 498 CB MET A 33 26.792 -8.894 -21.759 1.00 75.32 C ATOM 499 CG MET A 33 25.811 -10.053 -21.676 1.00 50.11 C ATOM 500 SD MET A 33 25.867 -11.116 -23.131 1.00 65.31 S ATOM 501 CE MET A 33 27.467 -11.894 -22.920 1.00 31.30 C ATOM 0 H MET A 33 26.109 -6.835 -22.927 1.00 62.15 H new ATOM 0 HA MET A 33 25.439 -7.891 -20.425 1.00 3.20 H new ATOM 0 HB2 MET A 33 26.952 -8.638 -22.806 1.00 75.32 H new ATOM 0 HB3 MET A 33 27.754 -9.213 -21.359 1.00 75.32 H new ATOM 0 HG2 MET A 33 26.030 -10.647 -20.789 1.00 50.11 H new ATOM 0 HG3 MET A 33 24.801 -9.661 -21.556 1.00 50.11 H new ATOM 0 HE1 MET A 33 27.703 -12.487 -23.804 1.00 31.30 H new ATOM 0 HE2 MET A 33 28.229 -11.127 -22.784 1.00 31.30 H new ATOM 0 HE3 MET A 33 27.444 -12.542 -22.044 1.00 31.30 H new ATOM 511 N LYS A 34 28.586 -6.859 -20.599 1.00 24.12 N ATOM 512 CA LYS A 34 29.712 -6.399 -19.794 1.00 62.33 C ATOM 513 C LYS A 34 29.381 -5.084 -19.097 1.00 0.14 C ATOM 514 O LYS A 34 29.993 -4.734 -18.087 1.00 63.23 O ATOM 515 CB LYS A 34 30.955 -6.225 -20.671 1.00 34.33 C ATOM 516 CG LYS A 34 32.261 -6.367 -19.909 1.00 30.20 C ATOM 517 CD LYS A 34 33.456 -6.023 -20.782 1.00 52.13 C ATOM 518 CE LYS A 34 34.628 -5.525 -19.951 1.00 43.53 C ATOM 519 NZ LYS A 34 35.168 -6.588 -19.060 1.00 30.14 N ATOM 0 H LYS A 34 28.776 -6.908 -21.600 1.00 24.12 H new ATOM 0 HA LYS A 34 29.914 -7.153 -19.033 1.00 62.33 H new ATOM 0 HB2 LYS A 34 30.930 -6.963 -21.473 1.00 34.33 H new ATOM 0 HB3 LYS A 34 30.923 -5.242 -21.141 1.00 34.33 H new ATOM 0 HG2 LYS A 34 32.247 -5.714 -19.036 1.00 30.20 H new ATOM 0 HG3 LYS A 34 32.360 -7.388 -19.542 1.00 30.20 H new ATOM 0 HD2 LYS A 34 33.759 -6.903 -21.349 1.00 52.13 H new ATOM 0 HD3 LYS A 34 33.171 -5.259 -21.506 1.00 52.13 H new ATOM 0 HE2 LYS A 34 35.418 -5.170 -20.613 1.00 43.53 H new ATOM 0 HE3 LYS A 34 34.310 -4.673 -19.349 1.00 43.53 H new ATOM 0 HZ1 LYS A 34 35.976 -6.213 -18.523 1.00 30.14 H new ATOM 0 HZ2 LYS A 34 34.427 -6.897 -18.399 1.00 30.14 H new ATOM 0 HZ3 LYS A 34 35.479 -7.397 -19.634 1.00 30.14 H new ATOM 533 N TYR A 35 28.409 -4.360 -19.640 1.00 34.24 N ATOM 534 CA TYR A 35 27.997 -3.083 -19.069 1.00 51.15 C ATOM 535 C TYR A 35 27.259 -3.288 -17.750 1.00 53.21 C ATOM 536 O TYR A 35 27.540 -2.616 -16.757 1.00 20.14 O ATOM 537 CB TYR A 35 27.104 -2.325 -20.054 1.00 22.23 C ATOM 538 CG TYR A 35 26.106 -1.408 -19.384 1.00 3.03 C ATOM 539 CD1 TYR A 35 26.526 -0.281 -18.689 1.00 5.33 C ATOM 540 CD2 TYR A 35 24.743 -1.668 -19.447 1.00 32.34 C ATOM 541 CE1 TYR A 35 25.618 0.559 -18.074 1.00 42.44 C ATOM 542 CE2 TYR A 35 23.827 -0.833 -18.837 1.00 2.25 C ATOM 543 CZ TYR A 35 24.270 0.279 -18.151 1.00 52.43 C ATOM 544 OH TYR A 35 23.362 1.115 -17.542 1.00 32.31 O ATOM 0 H TYR A 35 27.892 -4.635 -20.475 1.00 34.24 H new ATOM 0 HA TYR A 35 28.894 -2.495 -18.874 1.00 51.15 H new ATOM 0 HB2 TYR A 35 27.733 -1.737 -20.723 1.00 22.23 H new ATOM 0 HB3 TYR A 35 26.566 -3.044 -20.672 1.00 22.23 H new ATOM 0 HD1 TYR A 35 27.581 -0.058 -18.628 1.00 5.33 H new ATOM 0 HD2 TYR A 35 24.393 -2.538 -19.982 1.00 32.34 H new ATOM 0 HE1 TYR A 35 25.962 1.430 -17.536 1.00 42.44 H new ATOM 0 HE2 TYR A 35 22.771 -1.049 -18.897 1.00 2.25 H new ATOM 0 HH TYR A 35 22.552 1.174 -18.091 1.00 32.31 H new ATOM 554 N LEU A 36 26.313 -4.221 -17.748 1.00 1.22 N ATOM 555 CA LEU A 36 25.533 -4.517 -16.551 1.00 3.21 C ATOM 556 C LEU A 36 26.404 -5.168 -15.481 1.00 72.31 C ATOM 557 O LEU A 36 26.214 -4.938 -14.286 1.00 43.40 O ATOM 558 CB LEU A 36 24.359 -5.434 -16.897 1.00 40.13 C ATOM 559 CG LEU A 36 23.267 -4.823 -17.776 1.00 61.24 C ATOM 560 CD1 LEU A 36 22.228 -5.872 -18.142 1.00 51.52 C ATOM 561 CD2 LEU A 36 22.613 -3.644 -17.072 1.00 15.12 C ATOM 0 H LEU A 36 26.068 -4.785 -18.561 1.00 1.22 H new ATOM 0 HA LEU A 36 25.147 -3.577 -16.157 1.00 3.21 H new ATOM 0 HB2 LEU A 36 24.750 -6.318 -17.400 1.00 40.13 H new ATOM 0 HB3 LEU A 36 23.902 -5.773 -15.967 1.00 40.13 H new ATOM 0 HG LEU A 36 23.727 -4.461 -18.695 1.00 61.24 H new ATOM 0 HD11 LEU A 36 21.459 -5.419 -18.768 1.00 51.52 H new ATOM 0 HD12 LEU A 36 22.708 -6.684 -18.688 1.00 51.52 H new ATOM 0 HD13 LEU A 36 21.772 -6.265 -17.233 1.00 51.52 H new ATOM 0 HD21 LEU A 36 21.839 -3.222 -17.712 1.00 15.12 H new ATOM 0 HD22 LEU A 36 22.167 -3.981 -16.136 1.00 15.12 H new ATOM 0 HD23 LEU A 36 23.365 -2.883 -16.862 1.00 15.12 H new ATOM 573 N LEU A 37 27.359 -5.981 -15.918 1.00 25.13 N ATOM 574 CA LEU A 37 28.262 -6.665 -14.998 1.00 12.23 C ATOM 575 C LEU A 37 29.182 -5.670 -14.298 1.00 3.02 C ATOM 576 O LEU A 37 29.358 -5.722 -13.080 1.00 63.34 O ATOM 577 CB LEU A 37 29.094 -7.706 -15.748 1.00 31.21 C ATOM 578 CG LEU A 37 28.484 -9.105 -15.852 1.00 11.51 C ATOM 579 CD1 LEU A 37 29.382 -10.019 -16.670 1.00 71.14 C ATOM 580 CD2 LEU A 37 28.247 -9.687 -14.466 1.00 72.33 C ATOM 0 H LEU A 37 27.528 -6.183 -16.903 1.00 25.13 H new ATOM 0 HA LEU A 37 27.659 -7.168 -14.242 1.00 12.23 H new ATOM 0 HB2 LEU A 37 29.279 -7.336 -16.757 1.00 31.21 H new ATOM 0 HB3 LEU A 37 30.063 -7.790 -15.257 1.00 31.21 H new ATOM 0 HG LEU A 37 27.523 -9.025 -16.360 1.00 11.51 H new ATOM 0 HD11 LEU A 37 28.932 -11.010 -16.733 1.00 71.14 H new ATOM 0 HD12 LEU A 37 29.501 -9.610 -17.673 1.00 71.14 H new ATOM 0 HD13 LEU A 37 30.358 -10.094 -16.191 1.00 71.14 H new ATOM 0 HD21 LEU A 37 27.813 -10.682 -14.559 1.00 72.33 H new ATOM 0 HD22 LEU A 37 29.195 -9.753 -13.932 1.00 72.33 H new ATOM 0 HD23 LEU A 37 27.563 -9.043 -13.913 1.00 72.33 H new ATOM 592 N ASP A 38 29.765 -4.764 -15.075 1.00 0.43 N ATOM 593 CA ASP A 38 30.665 -3.754 -14.529 1.00 70.12 C ATOM 594 C ASP A 38 29.994 -2.984 -13.396 1.00 44.30 C ATOM 595 O ASP A 38 30.516 -2.919 -12.283 1.00 64.44 O ATOM 596 CB ASP A 38 31.107 -2.787 -15.628 1.00 41.24 C ATOM 597 CG ASP A 38 32.132 -1.783 -15.138 1.00 61.04 C ATOM 598 OD1 ASP A 38 33.310 -2.166 -14.983 1.00 63.33 O ATOM 599 OD2 ASP A 38 31.756 -0.614 -14.909 1.00 70.20 O ATOM 0 H ASP A 38 29.631 -4.708 -16.085 1.00 0.43 H new ATOM 0 HA ASP A 38 31.542 -4.262 -14.129 1.00 70.12 H new ATOM 0 HB2 ASP A 38 31.526 -3.354 -16.459 1.00 41.24 H new ATOM 0 HB3 ASP A 38 30.236 -2.255 -16.012 1.00 41.24 H new ATOM 604 N GLN A 39 28.836 -2.400 -13.688 1.00 64.40 N ATOM 605 CA GLN A 39 28.096 -1.633 -12.694 1.00 1.24 C ATOM 606 C GLN A 39 27.792 -2.484 -11.465 1.00 54.12 C ATOM 607 O GLN A 39 27.610 -1.962 -10.366 1.00 30.52 O ATOM 608 CB GLN A 39 26.794 -1.100 -13.295 1.00 65.21 C ATOM 609 CG GLN A 39 27.005 -0.203 -14.504 1.00 3.53 C ATOM 610 CD GLN A 39 28.113 0.811 -14.292 1.00 32.21 C ATOM 611 OE1 GLN A 39 28.112 1.455 -13.131 1.00 43.42 O flip ATOM 612 NE2 GLN A 39 28.960 1.012 -15.162 1.00 12.41 N flip ATOM 0 H GLN A 39 28.391 -2.444 -14.605 1.00 64.40 H new ATOM 0 HA GLN A 39 28.717 -0.791 -12.386 1.00 1.24 H new ATOM 0 HB2 GLN A 39 26.165 -1.942 -13.583 1.00 65.21 H new ATOM 0 HB3 GLN A 39 26.251 -0.544 -12.531 1.00 65.21 H new ATOM 0 HG2 GLN A 39 27.242 -0.819 -15.372 1.00 3.53 H new ATOM 0 HG3 GLN A 39 26.076 0.321 -14.729 1.00 3.53 H new ATOM 0 HE21 GLN A 39 28.922 0.494 -16.040 1.00 12.41 H new ATOM 0 HE22 GLN A 39 29.700 1.697 -15.005 1.00 12.41 H new ATOM 621 N GLY A 40 27.737 -3.798 -11.660 1.00 72.14 N ATOM 622 CA GLY A 40 27.453 -4.700 -10.560 1.00 23.34 C ATOM 623 C GLY A 40 26.006 -5.149 -10.536 1.00 14.24 C ATOM 624 O GLY A 40 25.286 -4.896 -9.569 1.00 23.53 O ATOM 0 H GLY A 40 27.884 -4.254 -12.561 1.00 72.14 H new ATOM 0 HA2 GLY A 40 28.100 -5.574 -10.635 1.00 23.34 H new ATOM 0 HA3 GLY A 40 27.692 -4.206 -9.618 1.00 23.34 H new ATOM 628 N TYR A 41 25.576 -5.814 -11.602 1.00 43.02 N ATOM 629 CA TYR A 41 24.203 -6.295 -11.702 1.00 5.14 C ATOM 630 C TYR A 41 24.170 -7.781 -12.045 1.00 23.13 C ATOM 631 O TYR A 41 25.113 -8.317 -12.628 1.00 41.34 O ATOM 632 CB TYR A 41 23.437 -5.499 -12.759 1.00 43.42 C ATOM 633 CG TYR A 41 23.069 -4.101 -12.316 1.00 45.41 C ATOM 634 CD1 TYR A 41 24.000 -3.070 -12.357 1.00 43.00 C ATOM 635 CD2 TYR A 41 21.790 -3.810 -11.857 1.00 64.32 C ATOM 636 CE1 TYR A 41 23.669 -1.792 -11.952 1.00 54.53 C ATOM 637 CE2 TYR A 41 21.449 -2.534 -11.452 1.00 25.32 C ATOM 638 CZ TYR A 41 22.392 -1.529 -11.501 1.00 1.42 C ATOM 639 OH TYR A 41 22.057 -0.256 -11.098 1.00 65.01 O ATOM 0 H TYR A 41 26.159 -6.033 -12.410 1.00 43.02 H new ATOM 0 HA TYR A 41 23.724 -6.154 -10.733 1.00 5.14 H new ATOM 0 HB2 TYR A 41 24.042 -5.437 -13.664 1.00 43.42 H new ATOM 0 HB3 TYR A 41 22.527 -6.040 -13.020 1.00 43.42 H new ATOM 0 HD1 TYR A 41 25.000 -3.272 -12.712 1.00 43.00 H new ATOM 0 HD2 TYR A 41 21.050 -4.595 -11.816 1.00 64.32 H new ATOM 0 HE1 TYR A 41 24.406 -1.003 -11.988 1.00 54.53 H new ATOM 0 HE2 TYR A 41 20.450 -2.325 -11.099 1.00 25.32 H new ATOM 0 HH TYR A 41 21.120 -0.240 -10.810 1.00 65.01 H new ATOM 649 N HIS A 42 23.077 -8.442 -11.678 1.00 72.13 N ATOM 650 CA HIS A 42 22.918 -9.867 -11.948 1.00 3.22 C ATOM 651 C HIS A 42 22.626 -10.111 -13.425 1.00 52.02 C ATOM 652 O HIS A 42 21.538 -9.803 -13.912 1.00 72.43 O ATOM 653 CB HIS A 42 21.794 -10.448 -11.090 1.00 55.54 C ATOM 654 CG HIS A 42 21.924 -11.920 -10.848 1.00 40.24 C ATOM 655 ND1 HIS A 42 21.700 -12.503 -9.619 1.00 72.22 N ATOM 656 CD2 HIS A 42 22.256 -12.929 -11.687 1.00 42.12 C ATOM 657 CE1 HIS A 42 21.890 -13.807 -9.712 1.00 22.20 C ATOM 658 NE2 HIS A 42 22.228 -14.091 -10.957 1.00 22.42 N ATOM 0 H HIS A 42 22.288 -8.014 -11.193 1.00 72.13 H new ATOM 0 HA HIS A 42 23.853 -10.366 -11.694 1.00 3.22 H new ATOM 0 HB2 HIS A 42 21.776 -9.931 -10.131 1.00 55.54 H new ATOM 0 HB3 HIS A 42 20.838 -10.251 -11.576 1.00 55.54 H new ATOM 0 HD2 HIS A 42 22.498 -12.837 -12.736 1.00 42.12 H new ATOM 0 HE1 HIS A 42 21.787 -14.520 -8.907 1.00 22.20 H new ATOM 0 HE2 HIS A 42 22.435 -15.023 -11.317 1.00 22.42 H new ATOM 666 N VAL A 43 23.605 -10.665 -14.134 1.00 35.23 N ATOM 667 CA VAL A 43 23.452 -10.951 -15.555 1.00 40.12 C ATOM 668 C VAL A 43 23.296 -12.447 -15.801 1.00 60.34 C ATOM 669 O VAL A 43 24.033 -13.259 -15.240 1.00 52.14 O ATOM 670 CB VAL A 43 24.655 -10.431 -16.364 1.00 63.44 C ATOM 671 CG1 VAL A 43 24.397 -10.574 -17.857 1.00 11.44 C ATOM 672 CG2 VAL A 43 24.956 -8.985 -16.002 1.00 55.34 C ATOM 0 H VAL A 43 24.512 -10.924 -13.747 1.00 35.23 H new ATOM 0 HA VAL A 43 22.550 -10.436 -15.887 1.00 40.12 H new ATOM 0 HB VAL A 43 25.528 -11.033 -16.112 1.00 63.44 H new ATOM 0 HG11 VAL A 43 25.258 -10.201 -18.412 1.00 11.44 H new ATOM 0 HG12 VAL A 43 24.236 -11.624 -18.099 1.00 11.44 H new ATOM 0 HG13 VAL A 43 23.512 -9.999 -18.130 1.00 11.44 H new ATOM 0 HG21 VAL A 43 25.809 -8.634 -16.583 1.00 55.34 H new ATOM 0 HG22 VAL A 43 24.087 -8.366 -16.224 1.00 55.34 H new ATOM 0 HG23 VAL A 43 25.189 -8.917 -14.939 1.00 55.34 H new ATOM 682 N ILE A 44 22.333 -12.805 -16.644 1.00 32.43 N ATOM 683 CA ILE A 44 22.081 -14.205 -16.965 1.00 43.34 C ATOM 684 C ILE A 44 22.024 -14.420 -18.474 1.00 23.21 C ATOM 685 O ILE A 44 20.953 -14.549 -19.068 1.00 4.44 O ATOM 686 CB ILE A 44 20.765 -14.699 -16.337 1.00 52.14 C ATOM 687 CG1 ILE A 44 20.698 -14.302 -14.861 1.00 71.12 C ATOM 688 CG2 ILE A 44 20.637 -16.207 -16.492 1.00 43.04 C ATOM 689 CD1 ILE A 44 19.402 -14.695 -14.188 1.00 33.21 C ATOM 0 H ILE A 44 21.715 -12.146 -17.117 1.00 32.43 H new ATOM 0 HA ILE A 44 22.909 -14.779 -16.549 1.00 43.34 H new ATOM 0 HB ILE A 44 19.932 -14.228 -16.859 1.00 52.14 H new ATOM 0 HG12 ILE A 44 21.529 -14.766 -14.330 1.00 71.12 H new ATOM 0 HG13 ILE A 44 20.829 -13.223 -14.777 1.00 71.12 H new ATOM 0 HG21 ILE A 44 19.702 -16.541 -16.043 1.00 43.04 H new ATOM 0 HG22 ILE A 44 20.644 -16.466 -17.551 1.00 43.04 H new ATOM 0 HG23 ILE A 44 21.474 -16.696 -15.993 1.00 43.04 H new ATOM 0 HD11 ILE A 44 19.425 -14.382 -13.144 1.00 33.21 H new ATOM 0 HD12 ILE A 44 18.567 -14.210 -14.694 1.00 33.21 H new ATOM 0 HD13 ILE A 44 19.278 -15.777 -14.240 1.00 33.21 H new ATOM 701 N PRO A 45 23.204 -14.463 -19.110 1.00 61.15 N ATOM 702 CA PRO A 45 23.316 -14.666 -20.558 1.00 13.20 C ATOM 703 C PRO A 45 22.927 -16.080 -20.977 1.00 44.50 C ATOM 704 O PRO A 45 23.423 -17.061 -20.423 1.00 3.53 O ATOM 705 CB PRO A 45 24.799 -14.414 -20.838 1.00 43.52 C ATOM 706 CG PRO A 45 25.484 -14.713 -19.550 1.00 24.42 C ATOM 707 CD PRO A 45 24.520 -14.318 -18.466 1.00 42.50 C ATOM 0 HA PRO A 45 22.646 -14.011 -21.114 1.00 13.20 H new ATOM 0 HB2 PRO A 45 25.165 -15.056 -21.639 1.00 43.52 H new ATOM 0 HB3 PRO A 45 24.974 -13.384 -21.149 1.00 43.52 H new ATOM 0 HG2 PRO A 45 25.738 -15.771 -19.480 1.00 24.42 H new ATOM 0 HG3 PRO A 45 26.416 -14.155 -19.465 1.00 24.42 H new ATOM 0 HD2 PRO A 45 24.613 -14.962 -17.592 1.00 42.50 H new ATOM 0 HD3 PRO A 45 24.692 -13.296 -18.128 1.00 42.50 H new ATOM 715 N VAL A 46 22.037 -16.177 -21.960 1.00 24.34 N ATOM 716 CA VAL A 46 21.584 -17.472 -22.454 1.00 54.42 C ATOM 717 C VAL A 46 21.788 -17.587 -23.960 1.00 44.25 C ATOM 718 O VAL A 46 21.269 -16.780 -24.731 1.00 43.34 O ATOM 719 CB VAL A 46 20.096 -17.706 -22.130 1.00 23.31 C ATOM 720 CG1 VAL A 46 19.660 -19.087 -22.595 1.00 32.33 C ATOM 721 CG2 VAL A 46 19.842 -17.531 -20.640 1.00 61.03 C ATOM 0 H VAL A 46 21.616 -15.375 -22.429 1.00 24.34 H new ATOM 0 HA VAL A 46 22.183 -18.231 -21.950 1.00 54.42 H new ATOM 0 HB VAL A 46 19.504 -16.964 -22.666 1.00 23.31 H new ATOM 0 HG11 VAL A 46 18.606 -19.235 -22.358 1.00 32.33 H new ATOM 0 HG12 VAL A 46 19.805 -19.171 -23.672 1.00 32.33 H new ATOM 0 HG13 VAL A 46 20.256 -19.846 -22.089 1.00 32.33 H new ATOM 0 HG21 VAL A 46 18.786 -17.700 -20.429 1.00 61.03 H new ATOM 0 HG22 VAL A 46 20.443 -18.249 -20.082 1.00 61.03 H new ATOM 0 HG23 VAL A 46 20.115 -16.519 -20.341 1.00 61.03 H new ATOM 731 N SER A 47 22.548 -18.596 -24.373 1.00 62.24 N ATOM 732 CA SER A 47 22.825 -18.816 -25.788 1.00 52.11 C ATOM 733 C SER A 47 22.957 -20.305 -26.091 1.00 24.41 C ATOM 734 O SER A 47 23.330 -21.108 -25.235 1.00 61.20 O ATOM 735 CB SER A 47 24.104 -18.085 -26.199 1.00 3.41 C ATOM 736 OG SER A 47 24.904 -18.892 -27.046 1.00 55.21 O ATOM 0 H SER A 47 22.983 -19.274 -23.748 1.00 62.24 H new ATOM 0 HA SER A 47 21.988 -18.419 -26.362 1.00 52.11 H new ATOM 0 HB2 SER A 47 23.848 -17.158 -26.711 1.00 3.41 H new ATOM 0 HB3 SER A 47 24.672 -17.812 -25.310 1.00 3.41 H new ATOM 0 HG SER A 47 25.630 -18.352 -27.423 1.00 55.21 H new ATOM 742 N PRO A 48 22.645 -20.685 -27.339 1.00 0.31 N ATOM 743 CA PRO A 48 22.722 -22.079 -27.785 1.00 55.11 C ATOM 744 C PRO A 48 24.159 -22.576 -27.889 1.00 22.31 C ATOM 745 O PRO A 48 24.403 -23.771 -28.062 1.00 3.42 O ATOM 746 CB PRO A 48 22.066 -22.045 -29.168 1.00 21.30 C ATOM 747 CG PRO A 48 22.251 -20.645 -29.641 1.00 12.32 C ATOM 748 CD PRO A 48 22.194 -19.782 -28.411 1.00 15.52 C ATOM 0 HA PRO A 48 22.237 -22.759 -27.084 1.00 55.11 H new ATOM 0 HB2 PRO A 48 22.536 -22.757 -29.846 1.00 21.30 H new ATOM 0 HB3 PRO A 48 21.010 -22.307 -29.112 1.00 21.30 H new ATOM 0 HG2 PRO A 48 23.205 -20.530 -30.155 1.00 12.32 H new ATOM 0 HG3 PRO A 48 21.471 -20.366 -30.350 1.00 12.32 H new ATOM 0 HD2 PRO A 48 22.842 -18.910 -28.501 1.00 15.52 H new ATOM 0 HD3 PRO A 48 21.186 -19.411 -28.227 1.00 15.52 H new ATOM 756 N LYS A 49 25.109 -21.653 -27.782 1.00 71.20 N ATOM 757 CA LYS A 49 26.524 -21.997 -27.862 1.00 35.20 C ATOM 758 C LYS A 49 27.178 -21.930 -26.486 1.00 45.11 C ATOM 759 O LYS A 49 28.089 -22.701 -26.183 1.00 2.35 O ATOM 760 CB LYS A 49 27.245 -21.055 -28.829 1.00 32.14 C ATOM 761 CG LYS A 49 26.771 -21.180 -30.266 1.00 45.14 C ATOM 762 CD LYS A 49 27.254 -22.473 -30.902 1.00 44.43 C ATOM 763 CE LYS A 49 28.614 -22.296 -31.560 1.00 64.12 C ATOM 764 NZ LYS A 49 29.723 -22.361 -30.568 1.00 40.31 N ATOM 0 H LYS A 49 24.924 -20.660 -27.640 1.00 71.20 H new ATOM 0 HA LYS A 49 26.604 -23.019 -28.233 1.00 35.20 H new ATOM 0 HB2 LYS A 49 27.102 -20.027 -28.496 1.00 32.14 H new ATOM 0 HB3 LYS A 49 28.315 -21.257 -28.789 1.00 32.14 H new ATOM 0 HG2 LYS A 49 25.682 -21.144 -30.295 1.00 45.14 H new ATOM 0 HG3 LYS A 49 27.134 -20.331 -30.845 1.00 45.14 H new ATOM 0 HD2 LYS A 49 27.315 -23.253 -30.143 1.00 44.43 H new ATOM 0 HD3 LYS A 49 26.530 -22.807 -31.645 1.00 44.43 H new ATOM 0 HE2 LYS A 49 28.756 -23.070 -32.314 1.00 64.12 H new ATOM 0 HE3 LYS A 49 28.645 -21.337 -32.077 1.00 64.12 H new ATOM 0 HZ1 LYS A 49 30.567 -22.771 -31.017 1.00 40.31 H new ATOM 0 HZ2 LYS A 49 29.942 -21.403 -30.229 1.00 40.31 H new ATOM 0 HZ3 LYS A 49 29.435 -22.955 -29.764 1.00 40.31 H new ATOM 778 N VAL A 50 26.708 -21.004 -25.656 1.00 40.03 N ATOM 779 CA VAL A 50 27.246 -20.838 -24.312 1.00 23.15 C ATOM 780 C VAL A 50 26.714 -21.912 -23.370 1.00 71.40 C ATOM 781 O VAL A 50 27.178 -22.046 -22.238 1.00 52.50 O ATOM 782 CB VAL A 50 26.903 -19.451 -23.737 1.00 33.04 C ATOM 783 CG1 VAL A 50 25.429 -19.376 -23.367 1.00 40.05 C ATOM 784 CG2 VAL A 50 27.779 -19.142 -22.532 1.00 71.11 C ATOM 0 H VAL A 50 25.955 -20.357 -25.892 1.00 40.03 H new ATOM 0 HA VAL A 50 28.329 -20.933 -24.391 1.00 23.15 H new ATOM 0 HB VAL A 50 27.100 -18.701 -24.503 1.00 33.04 H new ATOM 0 HG11 VAL A 50 25.205 -18.389 -22.962 1.00 40.05 H new ATOM 0 HG12 VAL A 50 24.822 -19.550 -24.255 1.00 40.05 H new ATOM 0 HG13 VAL A 50 25.203 -20.135 -22.618 1.00 40.05 H new ATOM 0 HG21 VAL A 50 27.523 -18.158 -22.139 1.00 71.11 H new ATOM 0 HG22 VAL A 50 27.616 -19.895 -21.761 1.00 71.11 H new ATOM 0 HG23 VAL A 50 28.827 -19.151 -22.832 1.00 71.11 H new ATOM 794 N ALA A 51 25.737 -22.677 -23.846 1.00 60.52 N ATOM 795 CA ALA A 51 25.143 -23.742 -23.048 1.00 33.50 C ATOM 796 C ALA A 51 26.210 -24.700 -22.529 1.00 12.05 C ATOM 797 O ALA A 51 26.713 -25.544 -23.268 1.00 64.13 O ATOM 798 CB ALA A 51 24.105 -24.498 -23.865 1.00 63.31 C ATOM 0 H ALA A 51 25.340 -22.579 -24.781 1.00 60.52 H new ATOM 0 HA ALA A 51 24.652 -23.287 -22.188 1.00 33.50 H new ATOM 0 HB1 ALA A 51 23.670 -25.291 -23.256 1.00 63.31 H new ATOM 0 HB2 ALA A 51 23.320 -23.811 -24.182 1.00 63.31 H new ATOM 0 HB3 ALA A 51 24.581 -24.935 -24.743 1.00 63.31 H new ATOM 804 N GLY A 52 26.551 -24.562 -21.251 1.00 31.13 N ATOM 805 CA GLY A 52 27.557 -25.421 -20.655 1.00 22.33 C ATOM 806 C GLY A 52 28.898 -24.730 -20.511 1.00 44.10 C ATOM 807 O GLY A 52 29.926 -25.383 -20.331 1.00 24.20 O ATOM 0 H GLY A 52 26.148 -23.871 -20.618 1.00 31.13 H new ATOM 0 HA2 GLY A 52 27.214 -25.750 -19.674 1.00 22.33 H new ATOM 0 HA3 GLY A 52 27.676 -26.315 -21.267 1.00 22.33 H new ATOM 811 N LYS A 53 28.890 -23.404 -20.592 1.00 44.32 N ATOM 812 CA LYS A 53 30.115 -22.622 -20.470 1.00 50.25 C ATOM 813 C LYS A 53 29.913 -21.438 -19.530 1.00 44.21 C ATOM 814 O LYS A 53 28.814 -21.216 -19.020 1.00 65.13 O ATOM 815 CB LYS A 53 30.565 -22.124 -21.846 1.00 1.53 C ATOM 816 CG LYS A 53 30.602 -23.212 -22.905 1.00 4.24 C ATOM 817 CD LYS A 53 31.625 -22.903 -23.986 1.00 32.25 C ATOM 818 CE LYS A 53 31.275 -21.627 -24.735 1.00 44.13 C ATOM 819 NZ LYS A 53 32.129 -21.440 -25.941 1.00 23.31 N ATOM 0 H LYS A 53 28.048 -22.848 -20.742 1.00 44.32 H new ATOM 0 HA LYS A 53 30.889 -23.267 -20.053 1.00 50.25 H new ATOM 0 HB2 LYS A 53 29.892 -21.332 -22.174 1.00 1.53 H new ATOM 0 HB3 LYS A 53 31.557 -21.682 -21.756 1.00 1.53 H new ATOM 0 HG2 LYS A 53 30.842 -24.167 -22.438 1.00 4.24 H new ATOM 0 HG3 LYS A 53 29.615 -23.316 -23.356 1.00 4.24 H new ATOM 0 HD2 LYS A 53 32.613 -22.803 -23.536 1.00 32.25 H new ATOM 0 HD3 LYS A 53 31.677 -23.735 -24.688 1.00 32.25 H new ATOM 0 HE2 LYS A 53 30.227 -21.657 -25.033 1.00 44.13 H new ATOM 0 HE3 LYS A 53 31.393 -20.771 -24.070 1.00 44.13 H new ATOM 0 HZ1 LYS A 53 31.859 -20.559 -26.424 1.00 23.31 H new ATOM 0 HZ2 LYS A 53 33.127 -21.386 -25.654 1.00 23.31 H new ATOM 0 HZ3 LYS A 53 31.997 -22.244 -26.588 1.00 23.31 H new ATOM 833 N THR A 54 30.981 -20.678 -19.305 1.00 31.11 N ATOM 834 CA THR A 54 30.921 -19.517 -18.426 1.00 50.24 C ATOM 835 C THR A 54 31.341 -18.249 -19.162 1.00 34.14 C ATOM 836 O THR A 54 32.518 -18.057 -19.467 1.00 64.33 O ATOM 837 CB THR A 54 31.820 -19.701 -17.190 1.00 4.14 C ATOM 838 OG1 THR A 54 32.672 -20.838 -17.368 1.00 62.11 O ATOM 839 CG2 THR A 54 30.982 -19.881 -15.933 1.00 22.11 C ATOM 0 H THR A 54 31.898 -20.846 -19.720 1.00 31.11 H new ATOM 0 HA THR A 54 29.885 -19.420 -18.101 1.00 50.24 H new ATOM 0 HB THR A 54 32.430 -18.805 -17.076 1.00 4.14 H new ATOM 0 HG1 THR A 54 33.242 -20.947 -16.578 1.00 62.11 H new ATOM 0 HG21 THR A 54 31.639 -20.009 -15.073 1.00 22.11 H new ATOM 0 HG22 THR A 54 30.356 -19.001 -15.784 1.00 22.11 H new ATOM 0 HG23 THR A 54 30.349 -20.762 -16.041 1.00 22.11 H new ATOM 847 N LEU A 55 30.371 -17.385 -19.442 1.00 62.44 N ATOM 848 CA LEU A 55 30.640 -16.134 -20.142 1.00 5.22 C ATOM 849 C LEU A 55 30.763 -14.975 -19.157 1.00 62.32 C ATOM 850 O LEU A 55 29.781 -14.568 -18.536 1.00 12.31 O ATOM 851 CB LEU A 55 29.530 -15.843 -21.153 1.00 44.14 C ATOM 852 CG LEU A 55 29.861 -16.139 -22.617 1.00 3.14 C ATOM 853 CD1 LEU A 55 28.615 -16.020 -23.480 1.00 43.33 C ATOM 854 CD2 LEU A 55 30.951 -15.202 -23.117 1.00 70.00 C ATOM 0 H LEU A 55 29.392 -17.528 -19.195 1.00 62.44 H new ATOM 0 HA LEU A 55 31.587 -16.239 -20.672 1.00 5.22 H new ATOM 0 HB2 LEU A 55 28.651 -16.425 -20.875 1.00 44.14 H new ATOM 0 HB3 LEU A 55 29.256 -14.791 -21.069 1.00 44.14 H new ATOM 0 HG LEU A 55 30.230 -17.162 -22.687 1.00 3.14 H new ATOM 0 HD11 LEU A 55 28.870 -16.234 -24.518 1.00 43.33 H new ATOM 0 HD12 LEU A 55 27.865 -16.732 -23.136 1.00 43.33 H new ATOM 0 HD13 LEU A 55 28.216 -15.008 -23.405 1.00 43.33 H new ATOM 0 HD21 LEU A 55 31.174 -15.427 -24.160 1.00 70.00 H new ATOM 0 HD22 LEU A 55 30.610 -14.170 -23.033 1.00 70.00 H new ATOM 0 HD23 LEU A 55 31.851 -15.337 -22.517 1.00 70.00 H new ATOM 866 N LEU A 56 31.975 -14.447 -19.021 1.00 74.41 N ATOM 867 CA LEU A 56 32.226 -13.333 -18.114 1.00 21.24 C ATOM 868 C LEU A 56 31.927 -13.728 -16.671 1.00 24.12 C ATOM 869 O LEU A 56 31.628 -12.878 -15.833 1.00 65.21 O ATOM 870 CB LEU A 56 31.376 -12.125 -18.510 1.00 40.10 C ATOM 871 CG LEU A 56 31.446 -11.708 -19.980 1.00 20.24 C ATOM 872 CD1 LEU A 56 30.652 -10.432 -20.211 1.00 11.01 C ATOM 873 CD2 LEU A 56 32.893 -11.524 -20.413 1.00 71.14 C ATOM 0 H LEU A 56 32.799 -14.773 -19.527 1.00 74.41 H new ATOM 0 HA LEU A 56 33.281 -13.067 -18.188 1.00 21.24 H new ATOM 0 HB2 LEU A 56 30.336 -12.341 -18.263 1.00 40.10 H new ATOM 0 HB3 LEU A 56 31.679 -11.276 -17.897 1.00 40.10 H new ATOM 0 HG LEU A 56 31.005 -12.500 -20.585 1.00 20.24 H new ATOM 0 HD11 LEU A 56 30.713 -10.151 -21.262 1.00 11.01 H new ATOM 0 HD12 LEU A 56 29.609 -10.598 -19.940 1.00 11.01 H new ATOM 0 HD13 LEU A 56 31.063 -9.631 -19.597 1.00 11.01 H new ATOM 0 HD21 LEU A 56 32.924 -11.227 -21.461 1.00 71.14 H new ATOM 0 HD22 LEU A 56 33.360 -10.751 -19.803 1.00 71.14 H new ATOM 0 HD23 LEU A 56 33.433 -12.462 -20.285 1.00 71.14 H new ATOM 885 N GLY A 57 32.013 -15.024 -16.387 1.00 73.44 N ATOM 886 CA GLY A 57 31.751 -15.509 -15.045 1.00 31.12 C ATOM 887 C GLY A 57 30.304 -15.914 -14.847 1.00 33.23 C ATOM 888 O GLY A 57 29.934 -16.420 -13.788 1.00 24.45 O ATOM 0 H GLY A 57 32.260 -15.747 -17.063 1.00 73.44 H new ATOM 0 HA2 GLY A 57 32.396 -16.363 -14.838 1.00 31.12 H new ATOM 0 HA3 GLY A 57 32.010 -14.733 -14.325 1.00 31.12 H new ATOM 892 N GLN A 58 29.483 -15.690 -15.868 1.00 12.34 N ATOM 893 CA GLN A 58 28.067 -16.033 -15.799 1.00 24.01 C ATOM 894 C GLN A 58 27.811 -17.410 -16.402 1.00 64.14 C ATOM 895 O GLN A 58 28.416 -17.778 -17.409 1.00 22.41 O ATOM 896 CB GLN A 58 27.230 -14.980 -16.527 1.00 34.32 C ATOM 897 CG GLN A 58 27.600 -13.551 -16.165 1.00 22.21 C ATOM 898 CD GLN A 58 27.732 -13.343 -14.669 1.00 63.40 C ATOM 899 OE1 GLN A 58 28.967 -13.230 -14.193 1.00 75.23 O flip ATOM 900 NE2 GLN A 58 26.736 -13.285 -13.948 1.00 71.54 N flip ATOM 0 H GLN A 58 29.774 -15.273 -16.752 1.00 12.34 H new ATOM 0 HA GLN A 58 27.775 -16.057 -14.749 1.00 24.01 H new ATOM 0 HB2 GLN A 58 27.347 -15.115 -17.602 1.00 34.32 H new ATOM 0 HB3 GLN A 58 26.177 -15.143 -16.298 1.00 34.32 H new ATOM 0 HG2 GLN A 58 28.541 -13.290 -16.649 1.00 22.21 H new ATOM 0 HG3 GLN A 58 26.842 -12.873 -16.557 1.00 22.21 H new ATOM 0 HE21 GLN A 58 25.805 -13.377 -14.355 1.00 71.54 H new ATOM 0 HE22 GLN A 58 26.841 -13.145 -12.943 1.00 71.54 H new ATOM 909 N GLN A 59 26.912 -18.166 -15.780 1.00 41.52 N ATOM 910 CA GLN A 59 26.578 -19.503 -16.256 1.00 54.53 C ATOM 911 C GLN A 59 25.892 -19.440 -17.617 1.00 72.11 C ATOM 912 O GLN A 59 25.115 -18.526 -17.891 1.00 22.13 O ATOM 913 CB GLN A 59 25.673 -20.214 -15.248 1.00 64.34 C ATOM 914 CG GLN A 59 25.430 -21.678 -15.578 1.00 33.24 C ATOM 915 CD GLN A 59 26.585 -22.569 -15.165 1.00 73.31 C ATOM 916 OE1 GLN A 59 26.697 -22.962 -14.003 1.00 40.34 O ATOM 917 NE2 GLN A 59 27.451 -22.894 -16.117 1.00 65.22 N ATOM 0 H GLN A 59 26.402 -17.876 -14.946 1.00 41.52 H new ATOM 0 HA GLN A 59 27.505 -20.066 -16.362 1.00 54.53 H new ATOM 0 HB2 GLN A 59 26.120 -20.143 -14.257 1.00 64.34 H new ATOM 0 HB3 GLN A 59 24.715 -19.696 -15.203 1.00 64.34 H new ATOM 0 HG2 GLN A 59 24.521 -22.013 -15.078 1.00 33.24 H new ATOM 0 HG3 GLN A 59 25.261 -21.782 -16.650 1.00 33.24 H new ATOM 0 HE21 GLN A 59 27.319 -22.546 -17.067 1.00 65.22 H new ATOM 0 HE22 GLN A 59 28.248 -23.492 -15.899 1.00 65.22 H new ATOM 926 N GLY A 60 26.185 -20.419 -18.468 1.00 21.12 N ATOM 927 CA GLY A 60 25.589 -20.456 -19.790 1.00 73.12 C ATOM 928 C GLY A 60 24.376 -21.363 -19.854 1.00 61.42 C ATOM 929 O GLY A 60 24.234 -22.279 -19.043 1.00 53.03 O ATOM 0 H GLY A 60 26.825 -21.187 -18.265 1.00 21.12 H new ATOM 0 HA2 GLY A 60 25.300 -19.447 -20.083 1.00 73.12 H new ATOM 0 HA3 GLY A 60 26.332 -20.797 -20.511 1.00 73.12 H new ATOM 933 N TYR A 61 23.499 -21.109 -20.819 1.00 1.12 N ATOM 934 CA TYR A 61 22.290 -21.907 -20.983 1.00 21.22 C ATOM 935 C TYR A 61 21.863 -21.954 -22.447 1.00 34.14 C ATOM 936 O TYR A 61 21.828 -20.930 -23.128 1.00 12.23 O ATOM 937 CB TYR A 61 21.158 -21.337 -20.127 1.00 75.41 C ATOM 938 CG TYR A 61 21.143 -21.867 -18.711 1.00 71.41 C ATOM 939 CD1 TYR A 61 20.618 -23.121 -18.423 1.00 60.44 C ATOM 940 CD2 TYR A 61 21.653 -21.114 -17.661 1.00 71.10 C ATOM 941 CE1 TYR A 61 20.602 -23.610 -17.131 1.00 51.41 C ATOM 942 CE2 TYR A 61 21.642 -21.595 -16.366 1.00 43.10 C ATOM 943 CZ TYR A 61 21.116 -22.843 -16.106 1.00 55.11 C ATOM 944 OH TYR A 61 21.102 -23.325 -14.817 1.00 52.32 O ATOM 0 H TYR A 61 23.603 -20.356 -21.500 1.00 1.12 H new ATOM 0 HA TYR A 61 22.508 -22.923 -20.655 1.00 21.22 H new ATOM 0 HB2 TYR A 61 21.247 -20.251 -20.098 1.00 75.41 H new ATOM 0 HB3 TYR A 61 20.204 -21.566 -20.602 1.00 75.41 H new ATOM 0 HD1 TYR A 61 20.215 -23.724 -19.223 1.00 60.44 H new ATOM 0 HD2 TYR A 61 22.065 -20.136 -17.860 1.00 71.10 H new ATOM 0 HE1 TYR A 61 20.190 -24.587 -16.925 1.00 51.41 H new ATOM 0 HE2 TYR A 61 22.043 -20.997 -15.561 1.00 43.10 H new ATOM 0 HH TYR A 61 21.502 -22.662 -14.216 1.00 52.32 H new ATOM 954 N ALA A 62 21.537 -23.151 -22.923 1.00 63.31 N ATOM 955 CA ALA A 62 21.109 -23.333 -24.305 1.00 22.14 C ATOM 956 C ALA A 62 19.769 -22.651 -24.558 1.00 71.52 C ATOM 957 O ALA A 62 19.518 -22.136 -25.648 1.00 64.55 O ATOM 958 CB ALA A 62 21.022 -24.815 -24.639 1.00 52.23 C ATOM 0 H ALA A 62 21.561 -24.009 -22.372 1.00 63.31 H new ATOM 0 HA ALA A 62 21.851 -22.869 -24.955 1.00 22.14 H new ATOM 0 HB1 ALA A 62 20.701 -24.937 -25.674 1.00 52.23 H new ATOM 0 HB2 ALA A 62 22.001 -25.276 -24.506 1.00 52.23 H new ATOM 0 HB3 ALA A 62 20.302 -25.295 -23.977 1.00 52.23 H new ATOM 964 N THR A 63 18.909 -22.652 -23.545 1.00 34.14 N ATOM 965 CA THR A 63 17.593 -22.036 -23.658 1.00 51.45 C ATOM 966 C THR A 63 17.162 -21.410 -22.336 1.00 64.55 C ATOM 967 O THR A 63 17.519 -21.897 -21.263 1.00 4.25 O ATOM 968 CB THR A 63 16.529 -23.059 -24.100 1.00 4.40 C ATOM 969 OG1 THR A 63 15.221 -22.489 -23.977 1.00 22.51 O ATOM 970 CG2 THR A 63 16.617 -24.326 -23.263 1.00 44.02 C ATOM 0 H THR A 63 19.100 -23.073 -22.636 1.00 34.14 H new ATOM 0 HA THR A 63 17.674 -21.257 -24.416 1.00 51.45 H new ATOM 0 HB THR A 63 16.715 -23.318 -25.142 1.00 4.40 H new ATOM 0 HG1 THR A 63 14.550 -23.145 -24.261 1.00 22.51 H new ATOM 0 HG21 THR A 63 15.856 -25.034 -23.593 1.00 44.02 H new ATOM 0 HG22 THR A 63 17.604 -24.773 -23.382 1.00 44.02 H new ATOM 0 HG23 THR A 63 16.454 -24.081 -22.214 1.00 44.02 H new ATOM 978 N LEU A 64 16.393 -20.331 -22.421 1.00 0.21 N ATOM 979 CA LEU A 64 15.912 -19.639 -21.230 1.00 4.11 C ATOM 980 C LEU A 64 14.955 -20.522 -20.436 1.00 62.10 C ATOM 981 O LEU A 64 14.720 -20.291 -19.251 1.00 1.45 O ATOM 982 CB LEU A 64 15.216 -18.334 -21.620 1.00 74.34 C ATOM 983 CG LEU A 64 14.137 -18.446 -22.699 1.00 5.00 C ATOM 984 CD1 LEU A 64 12.926 -17.604 -22.332 1.00 13.33 C ATOM 985 CD2 LEU A 64 14.691 -18.025 -24.052 1.00 65.14 C ATOM 0 H LEU A 64 16.089 -19.916 -23.302 1.00 0.21 H new ATOM 0 HA LEU A 64 16.772 -19.410 -20.601 1.00 4.11 H new ATOM 0 HB2 LEU A 64 14.764 -17.905 -20.726 1.00 74.34 H new ATOM 0 HB3 LEU A 64 15.974 -17.630 -21.964 1.00 74.34 H new ATOM 0 HG LEU A 64 13.823 -19.488 -22.765 1.00 5.00 H new ATOM 0 HD11 LEU A 64 12.169 -17.696 -23.111 1.00 13.33 H new ATOM 0 HD12 LEU A 64 12.515 -17.951 -21.384 1.00 13.33 H new ATOM 0 HD13 LEU A 64 13.224 -16.560 -22.237 1.00 13.33 H new ATOM 0 HD21 LEU A 64 13.910 -18.111 -24.808 1.00 65.14 H new ATOM 0 HD22 LEU A 64 15.033 -16.991 -23.999 1.00 65.14 H new ATOM 0 HD23 LEU A 64 15.527 -18.671 -24.320 1.00 65.14 H new ATOM 997 N ALA A 65 14.408 -21.536 -21.098 1.00 34.44 N ATOM 998 CA ALA A 65 13.480 -22.457 -20.453 1.00 13.03 C ATOM 999 C ALA A 65 14.203 -23.358 -19.458 1.00 31.05 C ATOM 1000 O ALA A 65 13.571 -24.038 -18.648 1.00 44.41 O ATOM 1001 CB ALA A 65 12.756 -23.294 -21.497 1.00 30.53 C ATOM 0 H ALA A 65 14.591 -21.741 -22.080 1.00 34.44 H new ATOM 0 HA ALA A 65 12.746 -21.868 -19.903 1.00 13.03 H new ATOM 0 HB1 ALA A 65 12.066 -23.977 -21.001 1.00 30.53 H new ATOM 0 HB2 ALA A 65 12.199 -22.639 -22.166 1.00 30.53 H new ATOM 0 HB3 ALA A 65 13.483 -23.867 -22.072 1.00 30.53 H new ATOM 1007 N ASP A 66 15.530 -23.359 -19.524 1.00 33.24 N ATOM 1008 CA ASP A 66 16.339 -24.177 -18.628 1.00 1.04 C ATOM 1009 C ASP A 66 16.670 -23.416 -17.348 1.00 20.04 C ATOM 1010 O ASP A 66 16.809 -24.010 -16.278 1.00 41.22 O ATOM 1011 CB ASP A 66 17.629 -24.612 -19.325 1.00 50.21 C ATOM 1012 CG ASP A 66 18.434 -25.592 -18.495 1.00 32.40 C ATOM 1013 OD1 ASP A 66 17.919 -26.049 -17.453 1.00 4.12 O ATOM 1014 OD2 ASP A 66 19.578 -25.903 -18.887 1.00 44.20 O ATOM 0 H ASP A 66 16.068 -22.803 -20.188 1.00 33.24 H new ATOM 0 HA ASP A 66 15.761 -25.063 -18.364 1.00 1.04 H new ATOM 0 HB2 ASP A 66 17.384 -25.068 -20.284 1.00 50.21 H new ATOM 0 HB3 ASP A 66 18.238 -23.733 -19.536 1.00 50.21 H new ATOM 1019 N VAL A 67 16.796 -22.098 -17.464 1.00 50.14 N ATOM 1020 CA VAL A 67 17.111 -21.255 -16.317 1.00 33.20 C ATOM 1021 C VAL A 67 16.180 -21.551 -15.146 1.00 62.12 C ATOM 1022 O VAL A 67 14.995 -21.219 -15.164 1.00 12.44 O ATOM 1023 CB VAL A 67 17.009 -19.760 -16.674 1.00 25.31 C ATOM 1024 CG1 VAL A 67 17.457 -18.900 -15.502 1.00 15.11 C ATOM 1025 CG2 VAL A 67 17.832 -19.453 -17.916 1.00 51.30 C ATOM 0 H VAL A 67 16.685 -21.591 -18.342 1.00 50.14 H new ATOM 0 HA VAL A 67 18.137 -21.483 -16.029 1.00 33.20 H new ATOM 0 HB VAL A 67 15.967 -19.525 -16.889 1.00 25.31 H new ATOM 0 HG11 VAL A 67 17.378 -17.847 -15.772 1.00 15.11 H new ATOM 0 HG12 VAL A 67 16.822 -19.102 -14.639 1.00 15.11 H new ATOM 0 HG13 VAL A 67 18.492 -19.134 -15.253 1.00 15.11 H new ATOM 0 HG21 VAL A 67 17.749 -18.393 -18.155 1.00 51.30 H new ATOM 0 HG22 VAL A 67 18.877 -19.703 -17.731 1.00 51.30 H new ATOM 0 HG23 VAL A 67 17.461 -20.043 -18.754 1.00 51.30 H new ATOM 1035 N PRO A 68 16.728 -22.191 -14.102 1.00 73.13 N ATOM 1036 CA PRO A 68 15.964 -22.545 -12.902 1.00 24.40 C ATOM 1037 C PRO A 68 15.582 -21.322 -12.076 1.00 54.24 C ATOM 1038 O PRO A 68 14.451 -21.211 -11.603 1.00 42.32 O ATOM 1039 CB PRO A 68 16.930 -23.438 -12.119 1.00 33.45 C ATOM 1040 CG PRO A 68 18.286 -23.020 -12.572 1.00 73.23 C ATOM 1041 CD PRO A 68 18.134 -22.618 -14.013 1.00 43.23 C ATOM 0 HA PRO A 68 15.018 -23.028 -13.148 1.00 24.40 H new ATOM 0 HB2 PRO A 68 16.812 -23.301 -11.044 1.00 33.45 H new ATOM 0 HB3 PRO A 68 16.751 -24.493 -12.327 1.00 33.45 H new ATOM 0 HG2 PRO A 68 18.659 -22.190 -11.972 1.00 73.23 H new ATOM 0 HG3 PRO A 68 19.001 -23.836 -12.468 1.00 73.23 H new ATOM 0 HD2 PRO A 68 18.817 -21.811 -14.279 1.00 43.23 H new ATOM 0 HD3 PRO A 68 18.345 -23.449 -14.686 1.00 43.23 H new ATOM 1049 N GLU A 69 16.531 -20.406 -11.908 1.00 72.33 N ATOM 1050 CA GLU A 69 16.291 -19.191 -11.139 1.00 2.00 C ATOM 1051 C GLU A 69 15.343 -18.255 -11.882 1.00 55.21 C ATOM 1052 O GLU A 69 15.698 -17.680 -12.911 1.00 43.11 O ATOM 1053 CB GLU A 69 17.612 -18.474 -10.852 1.00 40.20 C ATOM 1054 CG GLU A 69 17.482 -17.334 -9.856 1.00 31.24 C ATOM 1055 CD GLU A 69 17.729 -17.777 -8.427 1.00 22.53 C ATOM 1056 OE1 GLU A 69 16.815 -18.379 -7.825 1.00 3.32 O ATOM 1057 OE2 GLU A 69 18.838 -17.523 -7.911 1.00 13.13 O ATOM 0 H GLU A 69 17.472 -20.482 -12.294 1.00 72.33 H new ATOM 0 HA GLU A 69 15.827 -19.475 -10.195 1.00 2.00 H new ATOM 0 HB2 GLU A 69 18.333 -19.197 -10.471 1.00 40.20 H new ATOM 0 HB3 GLU A 69 18.015 -18.084 -11.787 1.00 40.20 H new ATOM 0 HG2 GLU A 69 18.190 -16.547 -10.116 1.00 31.24 H new ATOM 0 HG3 GLU A 69 16.484 -16.903 -9.931 1.00 31.24 H new ATOM 1064 N LYS A 70 14.132 -18.107 -11.354 1.00 4.03 N ATOM 1065 CA LYS A 70 13.131 -17.241 -11.964 1.00 51.14 C ATOM 1066 C LYS A 70 13.697 -15.847 -12.214 1.00 51.34 C ATOM 1067 O LYS A 70 14.095 -15.151 -11.280 1.00 44.13 O ATOM 1068 CB LYS A 70 11.893 -17.148 -11.069 1.00 43.50 C ATOM 1069 CG LYS A 70 12.200 -16.693 -9.653 1.00 23.35 C ATOM 1070 CD LYS A 70 11.088 -17.077 -8.691 1.00 3.14 C ATOM 1071 CE LYS A 70 11.589 -17.137 -7.256 1.00 13.45 C ATOM 1072 NZ LYS A 70 10.481 -17.386 -6.292 1.00 1.32 N ATOM 0 H LYS A 70 13.821 -18.577 -10.504 1.00 4.03 H new ATOM 0 HA LYS A 70 12.847 -17.675 -12.922 1.00 51.14 H new ATOM 0 HB2 LYS A 70 11.181 -16.455 -11.518 1.00 43.50 H new ATOM 0 HB3 LYS A 70 11.408 -18.123 -11.031 1.00 43.50 H new ATOM 0 HG2 LYS A 70 13.138 -17.138 -9.322 1.00 23.35 H new ATOM 0 HG3 LYS A 70 12.337 -15.612 -9.639 1.00 23.35 H new ATOM 0 HD2 LYS A 70 10.276 -16.353 -8.764 1.00 3.14 H new ATOM 0 HD3 LYS A 70 10.678 -18.046 -8.975 1.00 3.14 H new ATOM 0 HE2 LYS A 70 12.335 -17.927 -7.164 1.00 13.45 H new ATOM 0 HE3 LYS A 70 12.085 -16.199 -7.005 1.00 13.45 H new ATOM 0 HZ1 LYS A 70 10.863 -17.420 -5.325 1.00 1.32 H new ATOM 0 HZ2 LYS A 70 9.782 -16.619 -6.361 1.00 1.32 H new ATOM 0 HZ3 LYS A 70 10.024 -18.293 -6.516 1.00 1.32 H new ATOM 1086 N VAL A 71 13.728 -15.444 -13.481 1.00 10.22 N ATOM 1087 CA VAL A 71 14.243 -14.131 -13.853 1.00 75.41 C ATOM 1088 C VAL A 71 13.258 -13.029 -13.480 1.00 51.00 C ATOM 1089 O VAL A 71 12.044 -13.235 -13.497 1.00 42.41 O ATOM 1090 CB VAL A 71 14.538 -14.052 -15.363 1.00 14.13 C ATOM 1091 CG1 VAL A 71 13.246 -13.905 -16.152 1.00 71.24 C ATOM 1092 CG2 VAL A 71 15.487 -12.901 -15.660 1.00 22.24 C ATOM 0 H VAL A 71 13.403 -16.008 -14.266 1.00 10.22 H new ATOM 0 HA VAL A 71 15.172 -13.986 -13.301 1.00 75.41 H new ATOM 0 HB VAL A 71 15.020 -14.980 -15.671 1.00 14.13 H new ATOM 0 HG11 VAL A 71 13.474 -13.851 -17.217 1.00 71.24 H new ATOM 0 HG12 VAL A 71 12.604 -14.765 -15.962 1.00 71.24 H new ATOM 0 HG13 VAL A 71 12.733 -12.994 -15.844 1.00 71.24 H new ATOM 0 HG21 VAL A 71 15.685 -12.860 -16.731 1.00 22.24 H new ATOM 0 HG22 VAL A 71 15.034 -11.963 -15.338 1.00 22.24 H new ATOM 0 HG23 VAL A 71 16.424 -13.054 -15.124 1.00 22.24 H new ATOM 1102 N ASP A 72 13.789 -11.859 -13.144 1.00 15.53 N ATOM 1103 CA ASP A 72 12.956 -10.722 -12.768 1.00 4.54 C ATOM 1104 C ASP A 72 12.751 -9.783 -13.953 1.00 33.23 C ATOM 1105 O ASP A 72 11.705 -9.146 -14.078 1.00 61.43 O ATOM 1106 CB ASP A 72 13.592 -9.961 -11.603 1.00 14.51 C ATOM 1107 CG ASP A 72 12.617 -9.016 -10.928 1.00 54.43 C ATOM 1108 OD1 ASP A 72 11.710 -9.504 -10.223 1.00 35.02 O ATOM 1109 OD2 ASP A 72 12.760 -7.788 -11.107 1.00 1.35 O ATOM 0 H ASP A 72 14.792 -11.673 -13.124 1.00 15.53 H new ATOM 0 HA ASP A 72 11.983 -11.102 -12.456 1.00 4.54 H new ATOM 0 HB2 ASP A 72 13.969 -10.674 -10.870 1.00 14.51 H new ATOM 0 HB3 ASP A 72 14.449 -9.395 -11.967 1.00 14.51 H new ATOM 1114 N MET A 73 13.756 -9.703 -14.819 1.00 13.55 N ATOM 1115 CA MET A 73 13.684 -8.842 -15.994 1.00 4.25 C ATOM 1116 C MET A 73 14.538 -9.399 -17.128 1.00 41.12 C ATOM 1117 O MET A 73 15.728 -9.660 -16.952 1.00 63.23 O ATOM 1118 CB MET A 73 14.143 -7.425 -15.643 1.00 0.01 C ATOM 1119 CG MET A 73 13.930 -6.422 -16.765 1.00 61.11 C ATOM 1120 SD MET A 73 15.066 -5.025 -16.673 1.00 11.34 S ATOM 1121 CE MET A 73 15.694 -4.988 -18.349 1.00 44.25 C ATOM 0 H MET A 73 14.629 -10.223 -14.729 1.00 13.55 H new ATOM 0 HA MET A 73 12.646 -8.808 -16.326 1.00 4.25 H new ATOM 0 HB2 MET A 73 13.605 -7.087 -14.757 1.00 0.01 H new ATOM 0 HB3 MET A 73 15.201 -7.448 -15.384 1.00 0.01 H new ATOM 0 HG2 MET A 73 14.055 -6.924 -17.724 1.00 61.11 H new ATOM 0 HG3 MET A 73 12.905 -6.054 -16.729 1.00 61.11 H new ATOM 0 HE1 MET A 73 16.778 -4.878 -18.329 1.00 44.25 H new ATOM 0 HE2 MET A 73 15.433 -5.917 -18.856 1.00 44.25 H new ATOM 0 HE3 MET A 73 15.254 -4.147 -18.884 1.00 44.25 H new ATOM 1131 N VAL A 74 13.923 -9.579 -18.293 1.00 13.14 N ATOM 1132 CA VAL A 74 14.627 -10.104 -19.456 1.00 73.42 C ATOM 1133 C VAL A 74 14.733 -9.053 -20.555 1.00 62.11 C ATOM 1134 O VAL A 74 13.746 -8.410 -20.911 1.00 15.21 O ATOM 1135 CB VAL A 74 13.923 -11.353 -20.022 1.00 2.45 C ATOM 1136 CG1 VAL A 74 14.770 -11.997 -21.108 1.00 24.21 C ATOM 1137 CG2 VAL A 74 13.624 -12.345 -18.908 1.00 52.01 C ATOM 0 H VAL A 74 12.938 -9.369 -18.456 1.00 13.14 H new ATOM 0 HA VAL A 74 15.628 -10.379 -19.122 1.00 73.42 H new ATOM 0 HB VAL A 74 12.977 -11.046 -20.468 1.00 2.45 H new ATOM 0 HG11 VAL A 74 14.257 -12.877 -21.496 1.00 24.21 H new ATOM 0 HG12 VAL A 74 14.928 -11.284 -21.917 1.00 24.21 H new ATOM 0 HG13 VAL A 74 15.733 -12.293 -20.691 1.00 24.21 H new ATOM 0 HG21 VAL A 74 13.127 -13.221 -19.325 1.00 52.01 H new ATOM 0 HG22 VAL A 74 14.556 -12.649 -18.432 1.00 52.01 H new ATOM 0 HG23 VAL A 74 12.974 -11.877 -18.168 1.00 52.01 H new ATOM 1147 N ASP A 75 15.938 -8.884 -21.090 1.00 15.04 N ATOM 1148 CA ASP A 75 16.174 -7.911 -22.150 1.00 73.32 C ATOM 1149 C ASP A 75 16.512 -8.610 -23.463 1.00 62.41 C ATOM 1150 O ASP A 75 17.063 -9.712 -23.468 1.00 53.53 O ATOM 1151 CB ASP A 75 17.306 -6.961 -21.757 1.00 71.21 C ATOM 1152 CG ASP A 75 18.371 -7.644 -20.921 1.00 52.14 C ATOM 1153 OD1 ASP A 75 18.683 -8.820 -21.203 1.00 45.25 O ATOM 1154 OD2 ASP A 75 18.892 -7.002 -19.986 1.00 21.01 O ATOM 0 H ASP A 75 16.766 -9.408 -20.807 1.00 15.04 H new ATOM 0 HA ASP A 75 15.260 -7.335 -22.291 1.00 73.32 H new ATOM 0 HB2 ASP A 75 17.763 -6.552 -22.658 1.00 71.21 H new ATOM 0 HB3 ASP A 75 16.894 -6.120 -21.199 1.00 71.21 H new ATOM 1159 N VAL A 76 16.178 -7.964 -24.575 1.00 44.54 N ATOM 1160 CA VAL A 76 16.447 -8.523 -25.895 1.00 12.22 C ATOM 1161 C VAL A 76 17.231 -7.541 -26.759 1.00 32.24 C ATOM 1162 O VAL A 76 16.767 -6.436 -27.038 1.00 52.41 O ATOM 1163 CB VAL A 76 15.142 -8.900 -26.621 1.00 13.41 C ATOM 1164 CG1 VAL A 76 15.444 -9.657 -27.905 1.00 3.12 C ATOM 1165 CG2 VAL A 76 14.242 -9.719 -25.708 1.00 63.20 C ATOM 0 H VAL A 76 15.720 -7.053 -24.589 1.00 44.54 H new ATOM 0 HA VAL A 76 17.042 -9.423 -25.742 1.00 12.22 H new ATOM 0 HB VAL A 76 14.615 -7.983 -26.884 1.00 13.41 H new ATOM 0 HG11 VAL A 76 14.510 -9.915 -28.404 1.00 3.12 H new ATOM 0 HG12 VAL A 76 16.046 -9.031 -28.563 1.00 3.12 H new ATOM 0 HG13 VAL A 76 15.993 -10.569 -27.669 1.00 3.12 H new ATOM 0 HG21 VAL A 76 13.325 -9.977 -26.237 1.00 63.20 H new ATOM 0 HG22 VAL A 76 14.758 -10.632 -25.412 1.00 63.20 H new ATOM 0 HG23 VAL A 76 13.997 -9.136 -24.820 1.00 63.20 H new ATOM 1175 N PHE A 77 18.422 -7.953 -27.179 1.00 43.34 N ATOM 1176 CA PHE A 77 19.272 -7.109 -28.012 1.00 22.42 C ATOM 1177 C PHE A 77 19.538 -7.769 -29.362 1.00 33.11 C ATOM 1178 O PHE A 77 20.073 -7.142 -30.276 1.00 72.45 O ATOM 1179 CB PHE A 77 20.597 -6.825 -27.301 1.00 41.12 C ATOM 1180 CG PHE A 77 20.447 -5.977 -26.070 1.00 62.24 C ATOM 1181 CD1 PHE A 77 20.142 -6.555 -24.848 1.00 45.23 C ATOM 1182 CD2 PHE A 77 20.612 -4.603 -26.135 1.00 75.03 C ATOM 1183 CE1 PHE A 77 20.003 -5.777 -23.715 1.00 2.25 C ATOM 1184 CE2 PHE A 77 20.474 -3.820 -25.005 1.00 11.13 C ATOM 1185 CZ PHE A 77 20.170 -4.408 -23.792 1.00 44.15 C ATOM 0 H PHE A 77 18.821 -8.865 -26.957 1.00 43.34 H new ATOM 0 HA PHE A 77 18.750 -6.168 -28.184 1.00 22.42 H new ATOM 0 HB2 PHE A 77 21.063 -7.771 -27.026 1.00 41.12 H new ATOM 0 HB3 PHE A 77 21.273 -6.327 -27.996 1.00 41.12 H new ATOM 0 HD1 PHE A 77 20.012 -7.625 -24.781 1.00 45.23 H new ATOM 0 HD2 PHE A 77 20.851 -4.138 -27.080 1.00 75.03 H new ATOM 0 HE1 PHE A 77 19.764 -6.239 -22.769 1.00 2.25 H new ATOM 0 HE2 PHE A 77 20.604 -2.750 -25.070 1.00 11.13 H new ATOM 0 HZ PHE A 77 20.063 -3.799 -22.907 1.00 44.15 H new ATOM 1195 N ARG A 78 19.160 -9.038 -29.478 1.00 61.11 N ATOM 1196 CA ARG A 78 19.359 -9.784 -30.715 1.00 34.01 C ATOM 1197 C ARG A 78 18.799 -9.016 -31.909 1.00 31.12 C ATOM 1198 O ARG A 78 19.551 -8.490 -32.728 1.00 75.04 O ATOM 1199 CB ARG A 78 18.691 -11.157 -30.620 1.00 22.31 C ATOM 1200 CG ARG A 78 19.550 -12.205 -29.931 1.00 34.32 C ATOM 1201 CD ARG A 78 19.138 -13.613 -30.331 1.00 20.50 C ATOM 1202 NE ARG A 78 19.463 -13.903 -31.725 1.00 21.51 N ATOM 1203 CZ ARG A 78 19.515 -15.132 -32.227 1.00 63.11 C ATOM 1204 NH1 ARG A 78 19.265 -16.179 -31.453 1.00 74.34 N ATOM 1205 NH2 ARG A 78 19.818 -15.315 -33.506 1.00 23.21 N ATOM 0 H ARG A 78 18.715 -9.571 -28.731 1.00 61.11 H new ATOM 0 HA ARG A 78 20.431 -9.918 -30.861 1.00 34.01 H new ATOM 0 HB2 ARG A 78 17.750 -11.057 -30.079 1.00 22.31 H new ATOM 0 HB3 ARG A 78 18.446 -11.503 -31.624 1.00 22.31 H new ATOM 0 HG2 ARG A 78 20.597 -12.044 -30.187 1.00 34.32 H new ATOM 0 HG3 ARG A 78 19.465 -12.093 -28.850 1.00 34.32 H new ATOM 0 HD2 ARG A 78 19.638 -14.334 -29.685 1.00 20.50 H new ATOM 0 HD3 ARG A 78 18.066 -13.735 -30.176 1.00 20.50 H new ATOM 0 HE ARG A 78 19.661 -13.119 -32.347 1.00 21.51 H new ATOM 0 HH11 ARG A 78 19.032 -16.042 -30.469 1.00 74.34 H new ATOM 0 HH12 ARG A 78 19.306 -17.121 -31.841 1.00 74.34 H new ATOM 0 HH21 ARG A 78 20.011 -14.512 -34.104 1.00 23.21 H new ATOM 0 HH22 ARG A 78 19.858 -16.259 -33.891 1.00 23.21 H new ATOM 1219 N ASN A 79 17.474 -8.957 -32.000 1.00 23.14 N ATOM 1220 CA ASN A 79 16.814 -8.255 -33.094 1.00 13.43 C ATOM 1221 C ASN A 79 15.395 -7.852 -32.704 1.00 11.45 C ATOM 1222 O ASN A 79 14.884 -8.267 -31.663 1.00 65.13 O ATOM 1223 CB ASN A 79 16.780 -9.134 -34.345 1.00 42.24 C ATOM 1224 CG ASN A 79 18.062 -9.041 -35.151 1.00 75.53 C ATOM 1225 OD1 ASN A 79 18.552 -7.949 -35.435 1.00 2.42 O ATOM 1226 ND2 ASN A 79 18.610 -10.192 -35.525 1.00 14.03 N ATOM 0 H ASN A 79 16.837 -9.387 -31.329 1.00 23.14 H new ATOM 0 HA ASN A 79 17.384 -7.351 -33.309 1.00 13.43 H new ATOM 0 HB2 ASN A 79 16.612 -10.171 -34.053 1.00 42.24 H new ATOM 0 HB3 ASN A 79 15.938 -8.838 -34.971 1.00 42.24 H new ATOM 0 HD21 ASN A 79 19.472 -10.193 -36.070 1.00 14.03 H new ATOM 0 HD22 ASN A 79 18.169 -11.075 -35.267 1.00 14.03 H new ATOM 1233 N SER A 80 14.763 -7.040 -33.546 1.00 22.22 N ATOM 1234 CA SER A 80 13.404 -6.578 -33.288 1.00 24.21 C ATOM 1235 C SER A 80 12.398 -7.706 -33.496 1.00 24.35 C ATOM 1236 O SER A 80 11.643 -8.053 -32.588 1.00 51.42 O ATOM 1237 CB SER A 80 13.062 -5.400 -34.201 1.00 52.33 C ATOM 1238 OG SER A 80 13.263 -5.735 -35.563 1.00 74.05 O ATOM 0 H SER A 80 15.170 -6.689 -34.413 1.00 22.22 H new ATOM 0 HA SER A 80 13.348 -6.252 -32.249 1.00 24.21 H new ATOM 0 HB2 SER A 80 12.024 -5.105 -34.045 1.00 52.33 H new ATOM 0 HB3 SER A 80 13.681 -4.542 -33.939 1.00 52.33 H new ATOM 0 HG SER A 80 13.036 -4.966 -36.126 1.00 74.05 H new ATOM 1244 N GLU A 81 12.396 -8.275 -34.697 1.00 40.12 N ATOM 1245 CA GLU A 81 11.483 -9.363 -35.025 1.00 34.44 C ATOM 1246 C GLU A 81 11.635 -10.517 -34.037 1.00 53.04 C ATOM 1247 O GLU A 81 10.694 -11.274 -33.801 1.00 14.31 O ATOM 1248 CB GLU A 81 11.736 -9.860 -36.449 1.00 71.35 C ATOM 1249 CG GLU A 81 11.657 -8.765 -37.499 1.00 54.33 C ATOM 1250 CD GLU A 81 10.291 -8.108 -37.555 1.00 1.20 C ATOM 1251 OE1 GLU A 81 9.400 -8.647 -38.244 1.00 22.22 O ATOM 1252 OE2 GLU A 81 10.114 -7.054 -36.909 1.00 13.22 O ATOM 0 H GLU A 81 13.016 -8.001 -35.459 1.00 40.12 H new ATOM 0 HA GLU A 81 10.464 -8.981 -34.958 1.00 34.44 H new ATOM 0 HB2 GLU A 81 12.721 -10.324 -36.493 1.00 71.35 H new ATOM 0 HB3 GLU A 81 11.008 -10.635 -36.689 1.00 71.35 H new ATOM 0 HG2 GLU A 81 12.412 -8.008 -37.287 1.00 54.33 H new ATOM 0 HG3 GLU A 81 11.894 -9.186 -38.476 1.00 54.33 H new ATOM 1259 N ALA A 82 12.827 -10.644 -33.465 1.00 22.53 N ATOM 1260 CA ALA A 82 13.103 -11.704 -32.502 1.00 41.14 C ATOM 1261 C ALA A 82 12.309 -11.498 -31.217 1.00 21.41 C ATOM 1262 O ALA A 82 12.055 -12.447 -30.475 1.00 11.41 O ATOM 1263 CB ALA A 82 14.593 -11.768 -32.200 1.00 40.42 C ATOM 0 H ALA A 82 13.617 -10.027 -33.651 1.00 22.53 H new ATOM 0 HA ALA A 82 12.792 -12.651 -32.942 1.00 41.14 H new ATOM 0 HB1 ALA A 82 14.784 -12.564 -31.480 1.00 40.42 H new ATOM 0 HB2 ALA A 82 15.142 -11.971 -33.119 1.00 40.42 H new ATOM 0 HB3 ALA A 82 14.921 -10.815 -31.784 1.00 40.42 H new ATOM 1269 N ALA A 83 11.921 -10.254 -30.959 1.00 54.24 N ATOM 1270 CA ALA A 83 11.154 -9.925 -29.764 1.00 42.40 C ATOM 1271 C ALA A 83 9.933 -10.828 -29.628 1.00 64.23 C ATOM 1272 O ALA A 83 9.596 -11.271 -28.530 1.00 65.03 O ATOM 1273 CB ALA A 83 10.731 -8.463 -29.794 1.00 70.42 C ATOM 0 H ALA A 83 12.125 -9.457 -31.562 1.00 54.24 H new ATOM 0 HA ALA A 83 11.793 -10.090 -28.896 1.00 42.40 H new ATOM 0 HB1 ALA A 83 10.159 -8.231 -28.896 1.00 70.42 H new ATOM 0 HB2 ALA A 83 11.617 -7.829 -29.834 1.00 70.42 H new ATOM 0 HB3 ALA A 83 10.114 -8.281 -30.674 1.00 70.42 H new ATOM 1279 N TRP A 84 9.275 -11.097 -30.750 1.00 11.12 N ATOM 1280 CA TRP A 84 8.090 -11.948 -30.755 1.00 43.21 C ATOM 1281 C TRP A 84 8.453 -13.389 -30.414 1.00 5.30 C ATOM 1282 O TRP A 84 7.890 -13.980 -29.494 1.00 2.55 O ATOM 1283 CB TRP A 84 7.403 -11.892 -32.120 1.00 51.44 C ATOM 1284 CG TRP A 84 6.292 -12.887 -32.267 1.00 53.44 C ATOM 1285 CD1 TRP A 84 6.359 -14.106 -32.879 1.00 51.20 C ATOM 1286 CD2 TRP A 84 4.947 -12.746 -31.795 1.00 44.24 C ATOM 1287 NE1 TRP A 84 5.137 -14.731 -32.816 1.00 21.43 N ATOM 1288 CE2 TRP A 84 4.255 -13.918 -32.155 1.00 74.32 C ATOM 1289 CE3 TRP A 84 4.262 -11.745 -31.102 1.00 40.41 C ATOM 1290 CZ2 TRP A 84 2.911 -14.114 -31.845 1.00 43.44 C ATOM 1291 CZ3 TRP A 84 2.929 -11.940 -30.796 1.00 12.33 C ATOM 1292 CH2 TRP A 84 2.265 -13.117 -31.166 1.00 51.22 C ATOM 0 H TRP A 84 9.541 -10.739 -31.667 1.00 11.12 H new ATOM 0 HA TRP A 84 7.403 -11.576 -29.995 1.00 43.21 H new ATOM 0 HB2 TRP A 84 7.006 -10.889 -32.278 1.00 51.44 H new ATOM 0 HB3 TRP A 84 8.144 -12.068 -32.899 1.00 51.44 H new ATOM 0 HD1 TRP A 84 7.242 -14.518 -33.344 1.00 51.20 H new ATOM 0 HE1 TRP A 84 4.922 -15.651 -33.199 1.00 21.43 H new ATOM 0 HE3 TRP A 84 4.765 -10.835 -30.811 1.00 40.41 H new ATOM 0 HZ2 TRP A 84 2.397 -15.020 -32.130 1.00 43.44 H new ATOM 0 HZ3 TRP A 84 2.389 -11.172 -30.262 1.00 12.33 H new ATOM 0 HH2 TRP A 84 1.223 -13.240 -30.910 1.00 51.22 H new ATOM 1303 N GLY A 85 9.399 -13.950 -31.162 1.00 52.42 N ATOM 1304 CA GLY A 85 9.820 -15.317 -30.922 1.00 65.35 C ATOM 1305 C GLY A 85 10.291 -15.538 -29.499 1.00 4.24 C ATOM 1306 O GLY A 85 10.036 -16.587 -28.908 1.00 21.30 O ATOM 0 H GLY A 85 9.881 -13.482 -31.929 1.00 52.42 H new ATOM 0 HA2 GLY A 85 8.991 -15.992 -31.136 1.00 65.35 H new ATOM 0 HA3 GLY A 85 10.625 -15.572 -31.611 1.00 65.35 H new ATOM 1310 N VAL A 86 10.983 -14.546 -28.945 1.00 71.44 N ATOM 1311 CA VAL A 86 11.491 -14.637 -27.582 1.00 45.10 C ATOM 1312 C VAL A 86 10.390 -14.360 -26.565 1.00 71.41 C ATOM 1313 O VAL A 86 10.402 -14.900 -25.459 1.00 61.44 O ATOM 1314 CB VAL A 86 12.650 -13.649 -27.349 1.00 23.55 C ATOM 1315 CG1 VAL A 86 13.245 -13.842 -25.962 1.00 22.31 C ATOM 1316 CG2 VAL A 86 13.715 -13.815 -28.422 1.00 41.33 C ATOM 0 H VAL A 86 11.204 -13.671 -29.420 1.00 71.44 H new ATOM 0 HA VAL A 86 11.857 -15.655 -27.448 1.00 45.10 H new ATOM 0 HB VAL A 86 12.258 -12.634 -27.412 1.00 23.55 H new ATOM 0 HG11 VAL A 86 14.062 -13.136 -25.815 1.00 22.31 H new ATOM 0 HG12 VAL A 86 12.476 -13.669 -25.209 1.00 22.31 H new ATOM 0 HG13 VAL A 86 13.624 -14.860 -25.867 1.00 22.31 H new ATOM 0 HG21 VAL A 86 14.526 -13.109 -28.242 1.00 41.33 H new ATOM 0 HG22 VAL A 86 14.106 -14.832 -28.393 1.00 41.33 H new ATOM 0 HG23 VAL A 86 13.278 -13.623 -29.402 1.00 41.33 H new ATOM 1326 N ALA A 87 9.438 -13.516 -26.947 1.00 53.34 N ATOM 1327 CA ALA A 87 8.327 -13.169 -26.070 1.00 33.11 C ATOM 1328 C ALA A 87 7.512 -14.404 -25.702 1.00 74.31 C ATOM 1329 O ALA A 87 7.348 -14.723 -24.525 1.00 4.44 O ATOM 1330 CB ALA A 87 7.438 -12.126 -26.730 1.00 41.55 C ATOM 0 H ALA A 87 9.414 -13.059 -27.859 1.00 53.34 H new ATOM 0 HA ALA A 87 8.739 -12.750 -25.152 1.00 33.11 H new ATOM 0 HB1 ALA A 87 6.613 -11.877 -26.063 1.00 41.55 H new ATOM 0 HB2 ALA A 87 8.021 -11.229 -26.936 1.00 41.55 H new ATOM 0 HB3 ALA A 87 7.042 -12.524 -27.664 1.00 41.55 H new ATOM 1336 N GLN A 88 7.002 -15.095 -26.717 1.00 21.12 N ATOM 1337 CA GLN A 88 6.203 -16.295 -26.499 1.00 14.24 C ATOM 1338 C GLN A 88 6.932 -17.277 -25.589 1.00 24.34 C ATOM 1339 O GLN A 88 6.332 -17.871 -24.693 1.00 44.03 O ATOM 1340 CB GLN A 88 5.875 -16.965 -27.834 1.00 41.11 C ATOM 1341 CG GLN A 88 7.093 -17.195 -28.714 1.00 41.33 C ATOM 1342 CD GLN A 88 6.730 -17.729 -30.086 1.00 14.33 C ATOM 1343 OE1 GLN A 88 7.293 -18.721 -30.548 1.00 25.24 O ATOM 1344 NE2 GLN A 88 5.783 -17.072 -30.745 1.00 52.33 N ATOM 0 H GLN A 88 7.128 -14.844 -27.698 1.00 21.12 H new ATOM 0 HA GLN A 88 5.274 -15.998 -26.012 1.00 14.24 H new ATOM 0 HB2 GLN A 88 5.390 -17.922 -27.641 1.00 41.11 H new ATOM 0 HB3 GLN A 88 5.158 -16.347 -28.375 1.00 41.11 H new ATOM 0 HG2 GLN A 88 7.638 -16.258 -28.826 1.00 41.33 H new ATOM 0 HG3 GLN A 88 7.765 -17.897 -28.221 1.00 41.33 H new ATOM 0 HE21 GLN A 88 5.343 -16.254 -30.324 1.00 52.33 H new ATOM 0 HE22 GLN A 88 5.496 -17.385 -31.672 1.00 52.33 H new ATOM 1353 N GLU A 89 8.230 -17.443 -25.825 1.00 20.40 N ATOM 1354 CA GLU A 89 9.041 -18.355 -25.027 1.00 34.45 C ATOM 1355 C GLU A 89 9.032 -17.946 -23.557 1.00 4.34 C ATOM 1356 O GLU A 89 8.897 -18.786 -22.668 1.00 22.02 O ATOM 1357 CB GLU A 89 10.478 -18.387 -25.550 1.00 71.54 C ATOM 1358 CG GLU A 89 10.589 -18.841 -26.996 1.00 53.34 C ATOM 1359 CD GLU A 89 10.742 -20.344 -27.127 1.00 2.35 C ATOM 1360 OE1 GLU A 89 11.885 -20.835 -27.012 1.00 52.20 O ATOM 1361 OE2 GLU A 89 9.721 -21.028 -27.343 1.00 32.51 O ATOM 0 H GLU A 89 8.742 -16.958 -26.562 1.00 20.40 H new ATOM 0 HA GLU A 89 8.610 -19.352 -25.112 1.00 34.45 H new ATOM 0 HB2 GLU A 89 10.912 -17.392 -25.456 1.00 71.54 H new ATOM 0 HB3 GLU A 89 11.070 -19.053 -24.922 1.00 71.54 H new ATOM 0 HG2 GLU A 89 9.702 -18.521 -27.542 1.00 53.34 H new ATOM 0 HG3 GLU A 89 11.444 -18.351 -27.462 1.00 53.34 H new ATOM 1368 N ALA A 90 9.179 -16.648 -23.309 1.00 72.13 N ATOM 1369 CA ALA A 90 9.187 -16.126 -21.948 1.00 51.15 C ATOM 1370 C ALA A 90 7.826 -16.304 -21.284 1.00 20.21 C ATOM 1371 O ALA A 90 7.741 -16.609 -20.094 1.00 3.01 O ATOM 1372 CB ALA A 90 9.588 -14.658 -21.949 1.00 21.33 C ATOM 0 H ALA A 90 9.294 -15.939 -24.033 1.00 72.13 H new ATOM 0 HA ALA A 90 9.920 -16.691 -21.372 1.00 51.15 H new ATOM 0 HB1 ALA A 90 9.590 -14.281 -20.926 1.00 21.33 H new ATOM 0 HB2 ALA A 90 10.585 -14.554 -22.376 1.00 21.33 H new ATOM 0 HB3 ALA A 90 8.876 -14.087 -22.545 1.00 21.33 H new ATOM 1378 N ILE A 91 6.764 -16.112 -22.059 1.00 44.24 N ATOM 1379 CA ILE A 91 5.408 -16.252 -21.545 1.00 52.00 C ATOM 1380 C ILE A 91 5.080 -17.712 -21.249 1.00 41.44 C ATOM 1381 O ILE A 91 4.285 -18.012 -20.359 1.00 42.13 O ATOM 1382 CB ILE A 91 4.369 -15.695 -22.537 1.00 24.03 C ATOM 1383 CG1 ILE A 91 4.646 -14.218 -22.822 1.00 41.45 C ATOM 1384 CG2 ILE A 91 2.962 -15.880 -21.989 1.00 50.41 C ATOM 1385 CD1 ILE A 91 3.997 -13.716 -24.094 1.00 25.33 C ATOM 0 H ILE A 91 6.817 -15.859 -23.046 1.00 44.24 H new ATOM 0 HA ILE A 91 5.360 -15.677 -20.620 1.00 52.00 H new ATOM 0 HB ILE A 91 4.449 -16.247 -23.473 1.00 24.03 H new ATOM 0 HG12 ILE A 91 4.290 -13.621 -21.982 1.00 41.45 H new ATOM 0 HG13 ILE A 91 5.723 -14.065 -22.888 1.00 41.45 H new ATOM 0 HG21 ILE A 91 2.239 -15.482 -22.701 1.00 50.41 H new ATOM 0 HG22 ILE A 91 2.769 -16.941 -21.832 1.00 50.41 H new ATOM 0 HG23 ILE A 91 2.868 -15.350 -21.041 1.00 50.41 H new ATOM 0 HD11 ILE A 91 4.236 -12.662 -24.233 1.00 25.33 H new ATOM 0 HD12 ILE A 91 4.371 -14.287 -24.943 1.00 25.33 H new ATOM 0 HD13 ILE A 91 2.916 -13.837 -24.023 1.00 25.33 H new ATOM 1397 N ALA A 92 5.700 -18.615 -22.001 1.00 74.54 N ATOM 1398 CA ALA A 92 5.477 -20.044 -21.818 1.00 30.24 C ATOM 1399 C ALA A 92 6.083 -20.530 -20.505 1.00 53.21 C ATOM 1400 O ALA A 92 5.416 -21.194 -19.711 1.00 53.11 O ATOM 1401 CB ALA A 92 6.056 -20.824 -22.989 1.00 4.41 C ATOM 0 H ALA A 92 6.361 -18.383 -22.743 1.00 74.54 H new ATOM 0 HA ALA A 92 4.401 -20.216 -21.778 1.00 30.24 H new ATOM 0 HB1 ALA A 92 5.882 -21.889 -22.838 1.00 4.41 H new ATOM 0 HB2 ALA A 92 5.574 -20.505 -23.913 1.00 4.41 H new ATOM 0 HB3 ALA A 92 7.128 -20.638 -23.056 1.00 4.41 H new ATOM 1407 N ILE A 93 7.349 -20.195 -20.284 1.00 25.30 N ATOM 1408 CA ILE A 93 8.044 -20.598 -19.067 1.00 40.53 C ATOM 1409 C ILE A 93 7.611 -19.744 -17.880 1.00 25.33 C ATOM 1410 O ILE A 93 7.603 -20.207 -16.740 1.00 2.22 O ATOM 1411 CB ILE A 93 9.572 -20.493 -19.231 1.00 31.25 C ATOM 1412 CG1 ILE A 93 9.991 -19.030 -19.385 1.00 44.13 C ATOM 1413 CG2 ILE A 93 10.034 -21.312 -20.427 1.00 11.32 C ATOM 1414 CD1 ILE A 93 11.485 -18.842 -19.534 1.00 71.03 C ATOM 0 H ILE A 93 7.915 -19.646 -20.931 1.00 25.30 H new ATOM 0 HA ILE A 93 7.778 -21.638 -18.880 1.00 40.53 H new ATOM 0 HB ILE A 93 10.047 -20.894 -18.336 1.00 31.25 H new ATOM 0 HG12 ILE A 93 9.491 -18.607 -20.256 1.00 44.13 H new ATOM 0 HG13 ILE A 93 9.647 -18.469 -18.516 1.00 44.13 H new ATOM 0 HG21 ILE A 93 11.116 -21.228 -20.530 1.00 11.32 H new ATOM 0 HG22 ILE A 93 9.764 -22.357 -20.278 1.00 11.32 H new ATOM 0 HG23 ILE A 93 9.554 -20.938 -21.331 1.00 11.32 H new ATOM 0 HD11 ILE A 93 11.709 -17.781 -19.639 1.00 71.03 H new ATOM 0 HD12 ILE A 93 11.991 -19.235 -18.652 1.00 71.03 H new ATOM 0 HD13 ILE A 93 11.832 -19.375 -20.419 1.00 71.03 H new ATOM 1426 N GLY A 94 7.250 -18.495 -18.156 1.00 3.31 N ATOM 1427 CA GLY A 94 6.819 -17.597 -17.101 1.00 5.45 C ATOM 1428 C GLY A 94 7.858 -16.541 -16.778 1.00 2.04 C ATOM 1429 O GLY A 94 8.609 -16.674 -15.812 1.00 31.43 O ATOM 0 H GLY A 94 7.248 -18.089 -19.092 1.00 3.31 H new ATOM 0 HA2 GLY A 94 5.891 -17.110 -17.400 1.00 5.45 H new ATOM 0 HA3 GLY A 94 6.601 -18.175 -16.203 1.00 5.45 H new ATOM 1433 N ALA A 95 7.903 -15.489 -17.589 1.00 32.32 N ATOM 1434 CA ALA A 95 8.857 -14.407 -17.384 1.00 40.42 C ATOM 1435 C ALA A 95 8.303 -13.361 -16.422 1.00 50.04 C ATOM 1436 O ALA A 95 7.274 -13.575 -15.781 1.00 60.21 O ATOM 1437 CB ALA A 95 9.219 -13.763 -18.715 1.00 31.42 C ATOM 0 H ALA A 95 7.290 -15.364 -18.394 1.00 32.32 H new ATOM 0 HA ALA A 95 9.758 -14.830 -16.940 1.00 40.42 H new ATOM 0 HB1 ALA A 95 9.932 -12.956 -18.547 1.00 31.42 H new ATOM 0 HB2 ALA A 95 9.664 -14.510 -19.372 1.00 31.42 H new ATOM 0 HB3 ALA A 95 8.320 -13.361 -19.181 1.00 31.42 H new ATOM 1443 N LYS A 96 8.992 -12.229 -16.326 1.00 13.23 N ATOM 1444 CA LYS A 96 8.569 -11.148 -15.443 1.00 31.55 C ATOM 1445 C LYS A 96 8.550 -9.816 -16.184 1.00 11.52 C ATOM 1446 O LYS A 96 7.610 -9.031 -16.048 1.00 45.24 O ATOM 1447 CB LYS A 96 9.501 -11.058 -14.232 1.00 13.41 C ATOM 1448 CG LYS A 96 9.341 -12.209 -13.254 1.00 3.31 C ATOM 1449 CD LYS A 96 7.987 -12.172 -12.566 1.00 30.42 C ATOM 1450 CE LYS A 96 7.825 -10.918 -11.720 1.00 72.44 C ATOM 1451 NZ LYS A 96 6.876 -9.951 -12.339 1.00 65.21 N ATOM 0 H LYS A 96 9.846 -12.036 -16.849 1.00 13.23 H new ATOM 0 HA LYS A 96 7.558 -11.366 -15.100 1.00 31.55 H new ATOM 0 HB2 LYS A 96 10.533 -11.029 -14.580 1.00 13.41 H new ATOM 0 HB3 LYS A 96 9.314 -10.120 -13.710 1.00 13.41 H new ATOM 0 HG2 LYS A 96 9.456 -13.155 -13.783 1.00 3.31 H new ATOM 0 HG3 LYS A 96 10.132 -12.164 -12.505 1.00 3.31 H new ATOM 0 HD2 LYS A 96 7.196 -12.211 -13.315 1.00 30.42 H new ATOM 0 HD3 LYS A 96 7.874 -13.054 -11.936 1.00 30.42 H new ATOM 0 HE2 LYS A 96 7.468 -11.193 -10.728 1.00 72.44 H new ATOM 0 HE3 LYS A 96 8.796 -10.441 -11.588 1.00 72.44 H new ATOM 0 HZ1 LYS A 96 6.491 -9.323 -11.604 1.00 65.21 H new ATOM 0 HZ2 LYS A 96 7.375 -9.383 -13.053 1.00 65.21 H new ATOM 0 HZ3 LYS A 96 6.098 -10.471 -12.793 1.00 65.21 H new ATOM 1465 N THR A 97 9.593 -9.565 -16.970 1.00 33.44 N ATOM 1466 CA THR A 97 9.695 -8.328 -17.733 1.00 4.03 C ATOM 1467 C THR A 97 10.296 -8.580 -19.111 1.00 22.12 C ATOM 1468 O THR A 97 10.981 -9.581 -19.327 1.00 42.32 O ATOM 1469 CB THR A 97 10.553 -7.282 -16.995 1.00 33.53 C ATOM 1470 OG1 THR A 97 10.427 -7.457 -15.579 1.00 42.10 O ATOM 1471 CG2 THR A 97 10.132 -5.871 -17.376 1.00 62.22 C ATOM 0 H THR A 97 10.379 -10.203 -17.094 1.00 33.44 H new ATOM 0 HA THR A 97 8.682 -7.942 -17.846 1.00 4.03 H new ATOM 0 HB THR A 97 11.593 -7.425 -17.288 1.00 33.53 H new ATOM 0 HG1 THR A 97 10.838 -8.307 -15.317 1.00 42.10 H new ATOM 0 HG21 THR A 97 10.752 -5.150 -16.843 1.00 62.22 H new ATOM 0 HG22 THR A 97 10.256 -5.732 -18.450 1.00 62.22 H new ATOM 0 HG23 THR A 97 9.086 -5.719 -17.109 1.00 62.22 H new ATOM 1479 N LEU A 98 10.037 -7.667 -20.040 1.00 53.00 N ATOM 1480 CA LEU A 98 10.553 -7.790 -21.399 1.00 22.02 C ATOM 1481 C LEU A 98 11.039 -6.442 -21.921 1.00 2.32 C ATOM 1482 O LEU A 98 10.238 -5.570 -22.258 1.00 31.22 O ATOM 1483 CB LEU A 98 9.474 -8.350 -22.327 1.00 31.00 C ATOM 1484 CG LEU A 98 9.957 -8.871 -23.681 1.00 23.32 C ATOM 1485 CD1 LEU A 98 10.665 -10.208 -23.517 1.00 15.44 C ATOM 1486 CD2 LEU A 98 8.791 -8.998 -24.650 1.00 64.45 C ATOM 0 H LEU A 98 9.473 -6.833 -19.877 1.00 53.00 H new ATOM 0 HA LEU A 98 11.399 -8.477 -21.379 1.00 22.02 H new ATOM 0 HB2 LEU A 98 8.963 -9.162 -21.809 1.00 31.00 H new ATOM 0 HB3 LEU A 98 8.734 -7.569 -22.504 1.00 31.00 H new ATOM 0 HG LEU A 98 10.668 -8.155 -24.092 1.00 23.32 H new ATOM 0 HD11 LEU A 98 11.002 -10.563 -24.491 1.00 15.44 H new ATOM 0 HD12 LEU A 98 11.525 -10.086 -22.858 1.00 15.44 H new ATOM 0 HD13 LEU A 98 9.976 -10.934 -23.084 1.00 15.44 H new ATOM 0 HD21 LEU A 98 9.153 -9.370 -25.608 1.00 64.45 H new ATOM 0 HD22 LEU A 98 8.056 -9.693 -24.245 1.00 64.45 H new ATOM 0 HD23 LEU A 98 8.328 -8.022 -24.792 1.00 64.45 H new ATOM 1498 N TRP A 99 12.356 -6.279 -21.987 1.00 15.44 N ATOM 1499 CA TRP A 99 12.948 -5.037 -22.470 1.00 44.20 C ATOM 1500 C TRP A 99 13.473 -5.201 -23.892 1.00 73.42 C ATOM 1501 O TRP A 99 14.081 -6.219 -24.226 1.00 40.04 O ATOM 1502 CB TRP A 99 14.082 -4.594 -21.543 1.00 70.24 C ATOM 1503 CG TRP A 99 14.137 -3.110 -21.339 1.00 31.42 C ATOM 1504 CD1 TRP A 99 14.919 -2.218 -22.015 1.00 71.23 C ATOM 1505 CD2 TRP A 99 13.380 -2.347 -20.393 1.00 23.22 C ATOM 1506 NE1 TRP A 99 14.694 -0.946 -21.547 1.00 30.23 N ATOM 1507 CE2 TRP A 99 13.754 -0.998 -20.552 1.00 32.31 C ATOM 1508 CE3 TRP A 99 12.422 -2.671 -19.429 1.00 23.44 C ATOM 1509 CZ2 TRP A 99 13.203 0.022 -19.781 1.00 50.13 C ATOM 1510 CZ3 TRP A 99 11.877 -1.658 -18.664 1.00 52.43 C ATOM 1511 CH2 TRP A 99 12.267 -0.324 -18.845 1.00 24.04 C ATOM 0 H TRP A 99 13.033 -6.991 -21.712 1.00 15.44 H new ATOM 0 HA TRP A 99 12.172 -4.272 -22.475 1.00 44.20 H new ATOM 0 HB2 TRP A 99 13.963 -5.082 -20.576 1.00 70.24 H new ATOM 0 HB3 TRP A 99 15.032 -4.932 -21.956 1.00 70.24 H new ATOM 0 HD1 TRP A 99 15.613 -2.475 -22.802 1.00 71.23 H new ATOM 0 HE1 TRP A 99 15.153 -0.100 -21.886 1.00 30.23 H new ATOM 0 HE3 TRP A 99 12.113 -3.696 -19.284 1.00 23.44 H new ATOM 0 HZ2 TRP A 99 13.504 1.050 -19.917 1.00 50.13 H new ATOM 0 HZ3 TRP A 99 11.138 -1.898 -17.914 1.00 52.43 H new ATOM 0 HH2 TRP A 99 11.820 0.446 -18.234 1.00 24.04 H new ATOM 1522 N LEU A 100 13.234 -4.195 -24.726 1.00 60.32 N ATOM 1523 CA LEU A 100 13.683 -4.229 -26.114 1.00 0.22 C ATOM 1524 C LEU A 100 14.791 -3.208 -26.352 1.00 61.14 C ATOM 1525 O LEU A 100 15.201 -2.498 -25.435 1.00 25.34 O ATOM 1526 CB LEU A 100 12.510 -3.955 -27.057 1.00 21.12 C ATOM 1527 CG LEU A 100 11.299 -4.877 -26.907 1.00 43.30 C ATOM 1528 CD1 LEU A 100 10.265 -4.579 -27.982 1.00 4.22 C ATOM 1529 CD2 LEU A 100 11.729 -6.335 -26.967 1.00 74.42 C ATOM 0 H LEU A 100 12.732 -3.346 -24.466 1.00 60.32 H new ATOM 0 HA LEU A 100 14.080 -5.223 -26.318 1.00 0.22 H new ATOM 0 HB2 LEU A 100 12.180 -2.927 -26.905 1.00 21.12 H new ATOM 0 HB3 LEU A 100 12.871 -4.026 -28.083 1.00 21.12 H new ATOM 0 HG LEU A 100 10.844 -4.693 -25.934 1.00 43.30 H new ATOM 0 HD11 LEU A 100 9.411 -5.245 -27.859 1.00 4.22 H new ATOM 0 HD12 LEU A 100 9.935 -3.544 -27.892 1.00 4.22 H new ATOM 0 HD13 LEU A 100 10.708 -4.734 -28.966 1.00 4.22 H new ATOM 0 HD21 LEU A 100 10.855 -6.977 -26.859 1.00 74.42 H new ATOM 0 HD22 LEU A 100 12.209 -6.534 -27.925 1.00 74.42 H new ATOM 0 HD23 LEU A 100 12.432 -6.540 -26.160 1.00 74.42 H new ATOM 1541 N GLN A 101 15.269 -3.139 -27.591 1.00 33.42 N ATOM 1542 CA GLN A 101 16.328 -2.204 -27.950 1.00 1.04 C ATOM 1543 C GLN A 101 15.748 -0.848 -28.339 1.00 63.33 C ATOM 1544 O GLN A 101 14.729 -0.771 -29.026 1.00 74.50 O ATOM 1545 CB GLN A 101 17.164 -2.765 -29.102 1.00 11.34 C ATOM 1546 CG GLN A 101 18.370 -1.908 -29.451 1.00 61.13 C ATOM 1547 CD GLN A 101 19.610 -2.300 -28.672 1.00 31.11 C ATOM 1548 OE1 GLN A 101 20.483 -3.002 -29.184 1.00 12.24 O ATOM 1549 NE2 GLN A 101 19.694 -1.848 -27.426 1.00 42.44 N ATOM 0 H GLN A 101 14.939 -3.719 -28.362 1.00 33.42 H new ATOM 0 HA GLN A 101 16.969 -2.068 -27.079 1.00 1.04 H new ATOM 0 HB2 GLN A 101 17.504 -3.767 -28.839 1.00 11.34 H new ATOM 0 HB3 GLN A 101 16.532 -2.864 -29.984 1.00 11.34 H new ATOM 0 HG2 GLN A 101 18.574 -1.993 -30.518 1.00 61.13 H new ATOM 0 HG3 GLN A 101 18.137 -0.862 -29.253 1.00 61.13 H new ATOM 0 HE21 GLN A 101 18.947 -1.269 -27.042 1.00 42.44 H new ATOM 0 HE22 GLN A 101 20.505 -2.080 -26.853 1.00 42.44 H new ATOM 1558 N LEU A 102 16.404 0.219 -27.897 1.00 12.12 N ATOM 1559 CA LEU A 102 15.953 1.573 -28.199 1.00 42.31 C ATOM 1560 C LEU A 102 15.734 1.753 -29.698 1.00 23.51 C ATOM 1561 O LEU A 102 16.553 1.325 -30.511 1.00 1.33 O ATOM 1562 CB LEU A 102 16.973 2.596 -27.695 1.00 64.33 C ATOM 1563 CG LEU A 102 16.601 3.340 -26.412 1.00 73.34 C ATOM 1564 CD1 LEU A 102 17.764 4.193 -25.933 1.00 5.20 C ATOM 1565 CD2 LEU A 102 15.363 4.197 -26.634 1.00 4.53 C ATOM 0 H LEU A 102 17.250 0.173 -27.329 1.00 12.12 H new ATOM 0 HA LEU A 102 15.003 1.735 -27.690 1.00 42.31 H new ATOM 0 HB2 LEU A 102 17.921 2.084 -27.532 1.00 64.33 H new ATOM 0 HB3 LEU A 102 17.139 3.331 -28.482 1.00 64.33 H new ATOM 0 HG LEU A 102 16.376 2.605 -25.640 1.00 73.34 H new ATOM 0 HD11 LEU A 102 17.480 4.715 -25.019 1.00 5.20 H new ATOM 0 HD12 LEU A 102 18.625 3.555 -25.734 1.00 5.20 H new ATOM 0 HD13 LEU A 102 18.022 4.922 -26.702 1.00 5.20 H new ATOM 0 HD21 LEU A 102 15.112 4.720 -25.711 1.00 4.53 H new ATOM 0 HD22 LEU A 102 15.561 4.925 -27.421 1.00 4.53 H new ATOM 0 HD23 LEU A 102 14.528 3.561 -26.929 1.00 4.53 H new ATOM 1577 N GLY A 103 14.624 2.390 -30.057 1.00 32.32 N ATOM 1578 CA GLY A 103 14.318 2.616 -31.457 1.00 42.42 C ATOM 1579 C GLY A 103 13.655 1.418 -32.107 1.00 40.32 C ATOM 1580 O GLY A 103 13.628 1.303 -33.333 1.00 2.33 O ATOM 0 H GLY A 103 13.931 2.754 -29.403 1.00 32.32 H new ATOM 0 HA2 GLY A 103 13.663 3.483 -31.547 1.00 42.42 H new ATOM 0 HA3 GLY A 103 15.237 2.854 -31.993 1.00 42.42 H new ATOM 1584 N VAL A 104 13.119 0.522 -31.285 1.00 23.21 N ATOM 1585 CA VAL A 104 12.454 -0.674 -31.787 1.00 35.33 C ATOM 1586 C VAL A 104 11.037 -0.788 -31.234 1.00 42.42 C ATOM 1587 O VAL A 104 10.825 -0.718 -30.023 1.00 62.42 O ATOM 1588 CB VAL A 104 13.238 -1.948 -31.422 1.00 65.31 C ATOM 1589 CG1 VAL A 104 12.518 -3.185 -31.936 1.00 73.22 C ATOM 1590 CG2 VAL A 104 14.654 -1.878 -31.975 1.00 1.24 C ATOM 0 H VAL A 104 13.132 0.602 -30.268 1.00 23.21 H new ATOM 0 HA VAL A 104 12.412 -0.580 -32.872 1.00 35.33 H new ATOM 0 HB VAL A 104 13.298 -2.017 -30.336 1.00 65.31 H new ATOM 0 HG11 VAL A 104 13.087 -4.075 -31.668 1.00 73.22 H new ATOM 0 HG12 VAL A 104 11.526 -3.241 -31.488 1.00 73.22 H new ATOM 0 HG13 VAL A 104 12.424 -3.127 -33.020 1.00 73.22 H new ATOM 0 HG21 VAL A 104 15.194 -2.786 -31.708 1.00 1.24 H new ATOM 0 HG22 VAL A 104 14.617 -1.784 -33.060 1.00 1.24 H new ATOM 0 HG23 VAL A 104 15.167 -1.014 -31.553 1.00 1.24 H new ATOM 1600 N ILE A 105 10.071 -0.962 -32.129 1.00 60.45 N ATOM 1601 CA ILE A 105 8.675 -1.087 -31.731 1.00 75.11 C ATOM 1602 C ILE A 105 8.031 -2.318 -32.361 1.00 11.30 C ATOM 1603 O ILE A 105 7.894 -2.403 -33.580 1.00 72.25 O ATOM 1604 CB ILE A 105 7.863 0.161 -32.125 1.00 41.21 C ATOM 1605 CG1 ILE A 105 8.464 1.412 -31.480 1.00 63.40 C ATOM 1606 CG2 ILE A 105 6.407 -0.003 -31.718 1.00 34.54 C ATOM 1607 CD1 ILE A 105 8.389 1.408 -29.969 1.00 62.23 C ATOM 0 H ILE A 105 10.230 -1.020 -33.135 1.00 60.45 H new ATOM 0 HA ILE A 105 8.665 -1.190 -30.646 1.00 75.11 H new ATOM 0 HB ILE A 105 7.906 0.276 -33.208 1.00 41.21 H new ATOM 0 HG12 ILE A 105 9.507 1.502 -31.784 1.00 63.40 H new ATOM 0 HG13 ILE A 105 7.944 2.292 -31.859 1.00 63.40 H new ATOM 0 HG21 ILE A 105 5.847 0.887 -32.003 1.00 34.54 H new ATOM 0 HG22 ILE A 105 5.985 -0.874 -32.220 1.00 34.54 H new ATOM 0 HG23 ILE A 105 6.344 -0.141 -30.639 1.00 34.54 H new ATOM 0 HD11 ILE A 105 8.833 2.324 -29.580 1.00 62.23 H new ATOM 0 HD12 ILE A 105 7.346 1.349 -29.657 1.00 62.23 H new ATOM 0 HD13 ILE A 105 8.933 0.547 -29.580 1.00 62.23 H new ATOM 1619 N ASN A 106 7.636 -3.268 -31.520 1.00 22.20 N ATOM 1620 CA ASN A 106 7.005 -4.495 -31.994 1.00 41.53 C ATOM 1621 C ASN A 106 5.610 -4.654 -31.399 1.00 13.24 C ATOM 1622 O ASN A 106 5.447 -5.218 -30.317 1.00 50.12 O ATOM 1623 CB ASN A 106 7.866 -5.707 -31.636 1.00 63.41 C ATOM 1624 CG ASN A 106 7.591 -6.898 -32.534 1.00 53.33 C ATOM 1625 OD1 ASN A 106 6.439 -7.278 -32.743 1.00 34.40 O ATOM 1626 ND2 ASN A 106 8.650 -7.492 -33.071 1.00 3.13 N ATOM 0 H ASN A 106 7.742 -3.212 -30.507 1.00 22.20 H new ATOM 0 HA ASN A 106 6.913 -4.431 -33.078 1.00 41.53 H new ATOM 0 HB2 ASN A 106 8.919 -5.435 -31.710 1.00 63.41 H new ATOM 0 HB3 ASN A 106 7.681 -5.987 -30.599 1.00 63.41 H new ATOM 0 HD21 ASN A 106 8.526 -8.297 -33.685 1.00 3.13 H new ATOM 0 HD22 ASN A 106 9.587 -7.143 -32.870 1.00 3.13 H new ATOM 1633 N GLU A 107 4.606 -4.153 -32.113 1.00 25.02 N ATOM 1634 CA GLU A 107 3.225 -4.240 -31.654 1.00 1.00 C ATOM 1635 C GLU A 107 2.862 -5.677 -31.290 1.00 51.24 C ATOM 1636 O GLU A 107 2.121 -5.918 -30.338 1.00 1.13 O ATOM 1637 CB GLU A 107 2.273 -3.719 -32.732 1.00 55.21 C ATOM 1638 CG GLU A 107 1.021 -3.063 -32.173 1.00 43.51 C ATOM 1639 CD GLU A 107 0.288 -2.229 -33.206 1.00 61.55 C ATOM 1640 OE1 GLU A 107 0.015 -2.755 -34.306 1.00 71.20 O ATOM 1641 OE2 GLU A 107 -0.012 -1.053 -32.916 1.00 51.33 O ATOM 0 H GLU A 107 4.724 -3.683 -33.011 1.00 25.02 H new ATOM 0 HA GLU A 107 3.126 -3.622 -30.762 1.00 1.00 H new ATOM 0 HB2 GLU A 107 2.803 -2.999 -33.356 1.00 55.21 H new ATOM 0 HB3 GLU A 107 1.982 -4.547 -33.378 1.00 55.21 H new ATOM 0 HG2 GLU A 107 0.351 -3.834 -31.792 1.00 43.51 H new ATOM 0 HG3 GLU A 107 1.293 -2.431 -31.328 1.00 43.51 H new ATOM 1648 N GLN A 108 3.389 -6.626 -32.057 1.00 31.21 N ATOM 1649 CA GLN A 108 3.119 -8.039 -31.816 1.00 43.24 C ATOM 1650 C GLN A 108 3.752 -8.499 -30.507 1.00 45.34 C ATOM 1651 O GLN A 108 3.082 -9.075 -29.651 1.00 41.41 O ATOM 1652 CB GLN A 108 3.646 -8.885 -32.977 1.00 24.04 C ATOM 1653 CG GLN A 108 2.566 -9.686 -33.685 1.00 41.03 C ATOM 1654 CD GLN A 108 1.952 -8.935 -34.850 1.00 43.23 C ATOM 1655 OE1 GLN A 108 2.597 -8.084 -35.464 1.00 52.11 O ATOM 1656 NE2 GLN A 108 0.700 -9.246 -35.162 1.00 35.22 N ATOM 0 H GLN A 108 4.004 -6.443 -32.849 1.00 31.21 H new ATOM 0 HA GLN A 108 2.039 -8.170 -31.741 1.00 43.24 H new ATOM 0 HB2 GLN A 108 4.134 -8.231 -33.700 1.00 24.04 H new ATOM 0 HB3 GLN A 108 4.407 -9.569 -32.601 1.00 24.04 H new ATOM 0 HG2 GLN A 108 2.991 -10.623 -34.045 1.00 41.03 H new ATOM 0 HG3 GLN A 108 1.784 -9.944 -32.971 1.00 41.03 H new ATOM 0 HE21 GLN A 108 0.203 -9.958 -34.627 1.00 35.22 H new ATOM 0 HE22 GLN A 108 0.235 -8.773 -35.937 1.00 35.22 H new ATOM 1665 N ALA A 109 5.048 -8.241 -30.360 1.00 12.34 N ATOM 1666 CA ALA A 109 5.771 -8.627 -29.154 1.00 51.33 C ATOM 1667 C ALA A 109 5.106 -8.052 -27.908 1.00 24.22 C ATOM 1668 O ALA A 109 5.236 -8.602 -26.815 1.00 21.25 O ATOM 1669 CB ALA A 109 7.220 -8.171 -29.240 1.00 21.23 C ATOM 0 H ALA A 109 5.618 -7.767 -31.060 1.00 12.34 H new ATOM 0 HA ALA A 109 5.747 -9.714 -29.077 1.00 51.33 H new ATOM 0 HB1 ALA A 109 7.749 -8.465 -28.333 1.00 21.23 H new ATOM 0 HB2 ALA A 109 7.696 -8.634 -30.104 1.00 21.23 H new ATOM 0 HB3 ALA A 109 7.255 -7.087 -29.344 1.00 21.23 H new ATOM 1675 N ALA A 110 4.395 -6.943 -28.080 1.00 4.31 N ATOM 1676 CA ALA A 110 3.710 -6.295 -26.969 1.00 13.23 C ATOM 1677 C ALA A 110 2.432 -7.042 -26.602 1.00 12.43 C ATOM 1678 O ALA A 110 2.131 -7.237 -25.424 1.00 3.00 O ATOM 1679 CB ALA A 110 3.396 -4.847 -27.314 1.00 43.42 C ATOM 0 H ALA A 110 4.278 -6.474 -28.978 1.00 4.31 H new ATOM 0 HA ALA A 110 4.373 -6.315 -26.104 1.00 13.23 H new ATOM 0 HB1 ALA A 110 2.884 -4.376 -26.475 1.00 43.42 H new ATOM 0 HB2 ALA A 110 4.323 -4.313 -27.520 1.00 43.42 H new ATOM 0 HB3 ALA A 110 2.755 -4.814 -28.195 1.00 43.42 H new ATOM 1685 N VAL A 111 1.682 -7.457 -27.618 1.00 12.43 N ATOM 1686 CA VAL A 111 0.436 -8.182 -27.402 1.00 32.42 C ATOM 1687 C VAL A 111 0.680 -9.479 -26.637 1.00 43.43 C ATOM 1688 O VAL A 111 -0.018 -9.783 -25.669 1.00 50.43 O ATOM 1689 CB VAL A 111 -0.262 -8.510 -28.736 1.00 5.44 C ATOM 1690 CG1 VAL A 111 -1.647 -9.085 -28.487 1.00 14.04 C ATOM 1691 CG2 VAL A 111 -0.340 -7.270 -29.614 1.00 3.14 C ATOM 0 H VAL A 111 1.916 -7.303 -28.599 1.00 12.43 H new ATOM 0 HA VAL A 111 -0.210 -7.531 -26.813 1.00 32.42 H new ATOM 0 HB VAL A 111 0.328 -9.262 -29.260 1.00 5.44 H new ATOM 0 HG11 VAL A 111 -2.124 -9.310 -29.441 1.00 14.04 H new ATOM 0 HG12 VAL A 111 -1.561 -9.999 -27.899 1.00 14.04 H new ATOM 0 HG13 VAL A 111 -2.250 -8.359 -27.942 1.00 14.04 H new ATOM 0 HG21 VAL A 111 -0.836 -7.519 -30.552 1.00 3.14 H new ATOM 0 HG22 VAL A 111 -0.907 -6.494 -29.099 1.00 3.14 H new ATOM 0 HG23 VAL A 111 0.667 -6.907 -29.821 1.00 3.14 H new ATOM 1701 N LEU A 112 1.676 -10.239 -27.077 1.00 63.55 N ATOM 1702 CA LEU A 112 2.015 -11.504 -26.434 1.00 74.43 C ATOM 1703 C LEU A 112 2.204 -11.318 -24.932 1.00 74.12 C ATOM 1704 O LEU A 112 1.599 -12.027 -24.128 1.00 50.30 O ATOM 1705 CB LEU A 112 3.287 -12.089 -27.051 1.00 54.32 C ATOM 1706 CG LEU A 112 3.116 -13.392 -27.833 1.00 51.42 C ATOM 1707 CD1 LEU A 112 4.393 -13.734 -28.585 1.00 53.02 C ATOM 1708 CD2 LEU A 112 2.724 -14.527 -26.899 1.00 23.12 C ATOM 0 H LEU A 112 2.263 -10.002 -27.876 1.00 63.55 H new ATOM 0 HA LEU A 112 1.189 -12.197 -26.595 1.00 74.43 H new ATOM 0 HB2 LEU A 112 3.720 -11.343 -27.717 1.00 54.32 H new ATOM 0 HB3 LEU A 112 4.009 -12.260 -26.252 1.00 54.32 H new ATOM 0 HG LEU A 112 2.316 -13.255 -28.561 1.00 51.42 H new ATOM 0 HD11 LEU A 112 4.253 -14.664 -29.136 1.00 53.02 H new ATOM 0 HD12 LEU A 112 4.630 -12.931 -29.283 1.00 53.02 H new ATOM 0 HD13 LEU A 112 5.212 -13.852 -27.876 1.00 53.02 H new ATOM 0 HD21 LEU A 112 2.607 -15.446 -27.473 1.00 23.12 H new ATOM 0 HD22 LEU A 112 3.502 -14.665 -26.148 1.00 23.12 H new ATOM 0 HD23 LEU A 112 1.782 -14.284 -26.406 1.00 23.12 H new ATOM 1720 N ALA A 113 3.045 -10.359 -24.561 1.00 41.44 N ATOM 1721 CA ALA A 113 3.310 -10.076 -23.156 1.00 62.12 C ATOM 1722 C ALA A 113 2.059 -9.557 -22.455 1.00 64.30 C ATOM 1723 O ALA A 113 1.845 -9.821 -21.272 1.00 3.03 O ATOM 1724 CB ALA A 113 4.446 -9.072 -23.025 1.00 20.21 C ATOM 0 H ALA A 113 3.555 -9.764 -25.214 1.00 41.44 H new ATOM 0 HA ALA A 113 3.605 -11.007 -22.673 1.00 62.12 H new ATOM 0 HB1 ALA A 113 4.633 -8.870 -21.970 1.00 20.21 H new ATOM 0 HB2 ALA A 113 5.347 -9.481 -23.482 1.00 20.21 H new ATOM 0 HB3 ALA A 113 4.172 -8.145 -23.529 1.00 20.21 H new ATOM 1730 N ARG A 114 1.237 -8.818 -23.192 1.00 70.22 N ATOM 1731 CA ARG A 114 0.008 -8.261 -22.640 1.00 2.22 C ATOM 1732 C ARG A 114 -0.991 -9.366 -22.312 1.00 71.42 C ATOM 1733 O ARG A 114 -1.754 -9.261 -21.353 1.00 35.20 O ATOM 1734 CB ARG A 114 -0.616 -7.270 -23.625 1.00 25.32 C ATOM 1735 CG ARG A 114 -1.253 -6.064 -22.954 1.00 62.33 C ATOM 1736 CD ARG A 114 -1.684 -5.023 -23.975 1.00 14.21 C ATOM 1737 NE ARG A 114 -0.619 -4.068 -24.267 1.00 4.03 N ATOM 1738 CZ ARG A 114 -0.241 -3.109 -23.429 1.00 15.23 C ATOM 1739 NH1 ARG A 114 -0.840 -2.978 -22.253 1.00 11.01 N ATOM 1740 NH2 ARG A 114 0.737 -2.278 -23.766 1.00 32.20 N ATOM 0 H ARG A 114 1.400 -8.591 -24.173 1.00 70.22 H new ATOM 0 HA ARG A 114 0.259 -7.737 -21.718 1.00 2.22 H new ATOM 0 HB2 ARG A 114 0.152 -6.926 -24.317 1.00 25.32 H new ATOM 0 HB3 ARG A 114 -1.371 -7.786 -24.218 1.00 25.32 H new ATOM 0 HG2 ARG A 114 -2.117 -6.384 -22.372 1.00 62.33 H new ATOM 0 HG3 ARG A 114 -0.545 -5.619 -22.255 1.00 62.33 H new ATOM 0 HD2 ARG A 114 -1.986 -5.522 -24.896 1.00 14.21 H new ATOM 0 HD3 ARG A 114 -2.557 -4.489 -23.601 1.00 14.21 H new ATOM 0 HE ARG A 114 -0.139 -4.141 -25.164 1.00 4.03 H new ATOM 0 HH11 ARG A 114 -1.593 -3.614 -21.990 1.00 11.01 H new ATOM 0 HH12 ARG A 114 -0.548 -2.241 -21.611 1.00 11.01 H new ATOM 0 HH21 ARG A 114 1.200 -2.375 -24.670 1.00 32.20 H new ATOM 0 HH22 ARG A 114 1.026 -1.542 -23.121 1.00 32.20 H new ATOM 1754 N GLU A 115 -0.980 -10.425 -23.116 1.00 44.15 N ATOM 1755 CA GLU A 115 -1.886 -11.549 -22.912 1.00 51.40 C ATOM 1756 C GLU A 115 -1.626 -12.219 -21.566 1.00 73.31 C ATOM 1757 O GLU A 115 -2.557 -12.512 -20.816 1.00 54.44 O ATOM 1758 CB GLU A 115 -1.731 -12.570 -24.041 1.00 52.52 C ATOM 1759 CG GLU A 115 -2.454 -12.178 -25.319 1.00 43.22 C ATOM 1760 CD GLU A 115 -3.945 -11.996 -25.114 1.00 11.00 C ATOM 1761 OE1 GLU A 115 -4.579 -12.901 -24.534 1.00 35.53 O ATOM 1762 OE2 GLU A 115 -4.478 -10.947 -25.534 1.00 25.11 O ATOM 0 H GLU A 115 -0.354 -10.528 -23.914 1.00 44.15 H new ATOM 0 HA GLU A 115 -2.906 -11.166 -22.917 1.00 51.40 H new ATOM 0 HB2 GLU A 115 -0.671 -12.701 -24.259 1.00 52.52 H new ATOM 0 HB3 GLU A 115 -2.108 -13.535 -23.701 1.00 52.52 H new ATOM 0 HG2 GLU A 115 -2.028 -11.251 -25.703 1.00 43.22 H new ATOM 0 HG3 GLU A 115 -2.286 -12.944 -26.076 1.00 43.22 H new ATOM 1769 N ALA A 116 -0.354 -12.460 -21.268 1.00 21.44 N ATOM 1770 CA ALA A 116 0.029 -13.095 -20.013 1.00 3.14 C ATOM 1771 C ALA A 116 0.086 -12.078 -18.878 1.00 41.40 C ATOM 1772 O ALA A 116 -0.049 -12.431 -17.707 1.00 45.33 O ATOM 1773 CB ALA A 116 1.371 -13.795 -20.164 1.00 25.44 C ATOM 0 H ALA A 116 0.429 -12.225 -21.878 1.00 21.44 H new ATOM 0 HA ALA A 116 -0.730 -13.837 -19.764 1.00 3.14 H new ATOM 0 HB1 ALA A 116 1.645 -14.265 -19.219 1.00 25.44 H new ATOM 0 HB2 ALA A 116 1.299 -14.557 -20.940 1.00 25.44 H new ATOM 0 HB3 ALA A 116 2.133 -13.066 -20.441 1.00 25.44 H new ATOM 1779 N GLY A 117 0.287 -10.812 -19.233 1.00 62.13 N ATOM 1780 CA GLY A 117 0.359 -9.763 -18.233 1.00 22.20 C ATOM 1781 C GLY A 117 1.775 -9.269 -18.012 1.00 21.45 C ATOM 1782 O GLY A 117 2.000 -8.323 -17.256 1.00 14.11 O ATOM 0 H GLY A 117 0.401 -10.495 -20.196 1.00 62.13 H new ATOM 0 HA2 GLY A 117 -0.270 -8.928 -18.541 1.00 22.20 H new ATOM 0 HA3 GLY A 117 -0.044 -10.135 -17.291 1.00 22.20 H new ATOM 1786 N LEU A 118 2.734 -9.912 -18.670 1.00 14.31 N ATOM 1787 CA LEU A 118 4.137 -9.533 -18.540 1.00 75.43 C ATOM 1788 C LEU A 118 4.323 -8.040 -18.790 1.00 22.23 C ATOM 1789 O LEU A 118 3.534 -7.416 -19.498 1.00 53.42 O ATOM 1790 CB LEU A 118 4.994 -10.337 -19.519 1.00 44.34 C ATOM 1791 CG LEU A 118 6.295 -10.912 -18.957 1.00 12.21 C ATOM 1792 CD1 LEU A 118 6.015 -12.159 -18.133 1.00 15.11 C ATOM 1793 CD2 LEU A 118 7.271 -11.222 -20.082 1.00 4.11 C ATOM 0 H LEU A 118 2.566 -10.698 -19.298 1.00 14.31 H new ATOM 0 HA LEU A 118 4.456 -9.754 -17.521 1.00 75.43 H new ATOM 0 HB2 LEU A 118 4.393 -11.160 -19.905 1.00 44.34 H new ATOM 0 HB3 LEU A 118 5.239 -9.697 -20.366 1.00 44.34 H new ATOM 0 HG LEU A 118 6.748 -10.165 -18.305 1.00 12.21 H new ATOM 0 HD11 LEU A 118 6.952 -12.554 -17.741 1.00 15.11 H new ATOM 0 HD12 LEU A 118 5.353 -11.907 -17.305 1.00 15.11 H new ATOM 0 HD13 LEU A 118 5.539 -12.911 -18.762 1.00 15.11 H new ATOM 0 HD21 LEU A 118 8.191 -11.630 -19.663 1.00 4.11 H new ATOM 0 HD22 LEU A 118 6.826 -11.951 -20.759 1.00 4.11 H new ATOM 0 HD23 LEU A 118 7.497 -10.307 -20.630 1.00 4.11 H new ATOM 1805 N SER A 119 5.374 -7.474 -18.204 1.00 71.43 N ATOM 1806 CA SER A 119 5.664 -6.054 -18.362 1.00 33.03 C ATOM 1807 C SER A 119 6.590 -5.817 -19.551 1.00 30.13 C ATOM 1808 O SER A 119 7.811 -5.925 -19.433 1.00 13.23 O ATOM 1809 CB SER A 119 6.300 -5.497 -17.086 1.00 74.35 C ATOM 1810 OG SER A 119 5.309 -5.080 -16.163 1.00 21.22 O ATOM 0 H SER A 119 6.038 -7.977 -17.616 1.00 71.43 H new ATOM 0 HA SER A 119 4.724 -5.535 -18.548 1.00 33.03 H new ATOM 0 HB2 SER A 119 6.931 -6.259 -16.628 1.00 74.35 H new ATOM 0 HB3 SER A 119 6.946 -4.656 -17.335 1.00 74.35 H new ATOM 0 HG SER A 119 5.740 -4.730 -15.356 1.00 21.22 H new ATOM 1816 N VAL A 120 6.000 -5.493 -20.697 1.00 61.51 N ATOM 1817 CA VAL A 120 6.771 -5.240 -21.909 1.00 13.15 C ATOM 1818 C VAL A 120 7.116 -3.761 -22.041 1.00 14.31 C ATOM 1819 O VAL A 120 6.249 -2.896 -21.911 1.00 71.04 O ATOM 1820 CB VAL A 120 6.005 -5.692 -23.166 1.00 54.40 C ATOM 1821 CG1 VAL A 120 4.645 -5.013 -23.236 1.00 30.34 C ATOM 1822 CG2 VAL A 120 6.819 -5.402 -24.418 1.00 73.20 C ATOM 0 H VAL A 120 4.991 -5.399 -20.812 1.00 61.51 H new ATOM 0 HA VAL A 120 7.691 -5.819 -21.826 1.00 13.15 H new ATOM 0 HB VAL A 120 5.844 -6.768 -23.105 1.00 54.40 H new ATOM 0 HG11 VAL A 120 4.118 -5.345 -24.131 1.00 30.34 H new ATOM 0 HG12 VAL A 120 4.062 -5.275 -22.353 1.00 30.34 H new ATOM 0 HG13 VAL A 120 4.780 -3.932 -23.274 1.00 30.34 H new ATOM 0 HG21 VAL A 120 6.263 -5.728 -25.297 1.00 73.20 H new ATOM 0 HG22 VAL A 120 7.012 -4.331 -24.487 1.00 73.20 H new ATOM 0 HG23 VAL A 120 7.766 -5.939 -24.369 1.00 73.20 H new ATOM 1832 N VAL A 121 8.388 -3.476 -22.300 1.00 71.23 N ATOM 1833 CA VAL A 121 8.848 -2.101 -22.452 1.00 62.22 C ATOM 1834 C VAL A 121 9.765 -1.959 -23.662 1.00 1.01 C ATOM 1835 O VAL A 121 10.872 -2.497 -23.681 1.00 74.32 O ATOM 1836 CB VAL A 121 9.596 -1.617 -21.195 1.00 72.54 C ATOM 1837 CG1 VAL A 121 9.891 -0.128 -21.290 1.00 24.43 C ATOM 1838 CG2 VAL A 121 8.791 -1.931 -19.943 1.00 71.54 C ATOM 0 H VAL A 121 9.119 -4.179 -22.409 1.00 71.23 H new ATOM 0 HA VAL A 121 7.961 -1.485 -22.598 1.00 62.22 H new ATOM 0 HB VAL A 121 10.546 -2.148 -21.131 1.00 72.54 H new ATOM 0 HG11 VAL A 121 10.420 0.196 -20.394 1.00 24.43 H new ATOM 0 HG12 VAL A 121 10.510 0.065 -22.166 1.00 24.43 H new ATOM 0 HG13 VAL A 121 8.955 0.423 -21.379 1.00 24.43 H new ATOM 0 HG21 VAL A 121 9.334 -1.582 -19.064 1.00 71.54 H new ATOM 0 HG22 VAL A 121 7.825 -1.428 -19.996 1.00 71.54 H new ATOM 0 HG23 VAL A 121 8.636 -3.008 -19.870 1.00 71.54 H new ATOM 1848 N MET A 122 9.297 -1.230 -24.670 1.00 2.03 N ATOM 1849 CA MET A 122 10.077 -1.015 -25.884 1.00 35.45 C ATOM 1850 C MET A 122 10.537 0.435 -25.985 1.00 11.34 C ATOM 1851 O MET A 122 10.221 1.258 -25.125 1.00 22.13 O ATOM 1852 CB MET A 122 9.252 -1.388 -27.117 1.00 60.11 C ATOM 1853 CG MET A 122 7.938 -0.632 -27.221 1.00 13.41 C ATOM 1854 SD MET A 122 6.554 -1.542 -26.508 1.00 2.33 S ATOM 1855 CE MET A 122 5.639 -0.212 -25.730 1.00 64.42 C ATOM 0 H MET A 122 8.382 -0.778 -24.671 1.00 2.03 H new ATOM 0 HA MET A 122 10.959 -1.654 -25.838 1.00 35.45 H new ATOM 0 HB2 MET A 122 9.844 -1.196 -28.012 1.00 60.11 H new ATOM 0 HB3 MET A 122 9.045 -2.458 -27.095 1.00 60.11 H new ATOM 0 HG2 MET A 122 8.035 0.329 -26.715 1.00 13.41 H new ATOM 0 HG3 MET A 122 7.727 -0.420 -28.269 1.00 13.41 H new ATOM 0 HE1 MET A 122 4.751 -0.617 -25.244 1.00 64.42 H new ATOM 0 HE2 MET A 122 6.269 0.276 -24.986 1.00 64.42 H new ATOM 0 HE3 MET A 122 5.340 0.514 -26.486 1.00 64.42 H new ATOM 1865 N ASP A 123 11.284 0.742 -27.039 1.00 63.01 N ATOM 1866 CA ASP A 123 11.787 2.094 -27.253 1.00 24.04 C ATOM 1867 C ASP A 123 12.513 2.606 -26.012 1.00 70.12 C ATOM 1868 O ASP A 123 12.523 3.806 -25.738 1.00 12.02 O ATOM 1869 CB ASP A 123 10.639 3.038 -27.613 1.00 31.43 C ATOM 1870 CG ASP A 123 10.973 3.934 -28.789 1.00 71.52 C ATOM 1871 OD1 ASP A 123 10.708 3.526 -29.940 1.00 14.22 O ATOM 1872 OD2 ASP A 123 11.499 5.042 -28.559 1.00 53.54 O ATOM 0 H ASP A 123 11.555 0.073 -27.759 1.00 63.01 H new ATOM 0 HA ASP A 123 12.495 2.065 -28.081 1.00 24.04 H new ATOM 0 HB2 ASP A 123 9.751 2.452 -27.848 1.00 31.43 H new ATOM 0 HB3 ASP A 123 10.395 3.655 -26.748 1.00 31.43 H new ATOM 1877 N ARG A 124 13.118 1.688 -25.266 1.00 22.12 N ATOM 1878 CA ARG A 124 13.844 2.046 -24.053 1.00 41.23 C ATOM 1879 C ARG A 124 15.141 1.251 -23.941 1.00 65.12 C ATOM 1880 O ARG A 124 15.305 0.217 -24.590 1.00 22.32 O ATOM 1881 CB ARG A 124 12.973 1.798 -22.820 1.00 44.41 C ATOM 1882 CG ARG A 124 13.101 2.878 -21.758 1.00 31.13 C ATOM 1883 CD ARG A 124 12.556 4.210 -22.249 1.00 1.02 C ATOM 1884 NE ARG A 124 11.185 4.440 -21.800 1.00 64.44 N ATOM 1885 CZ ARG A 124 10.607 5.635 -21.787 1.00 2.53 C ATOM 1886 NH1 ARG A 124 11.277 6.704 -22.195 1.00 3.21 N ATOM 1887 NH2 ARG A 124 9.356 5.764 -21.364 1.00 72.15 N ATOM 0 H ARG A 124 13.120 0.691 -25.480 1.00 22.12 H new ATOM 0 HA ARG A 124 14.092 3.106 -24.107 1.00 41.23 H new ATOM 0 HB2 ARG A 124 11.930 1.727 -23.130 1.00 44.41 H new ATOM 0 HB3 ARG A 124 13.242 0.836 -22.383 1.00 44.41 H new ATOM 0 HG2 ARG A 124 12.564 2.572 -20.860 1.00 31.13 H new ATOM 0 HG3 ARG A 124 14.148 2.993 -21.479 1.00 31.13 H new ATOM 0 HD2 ARG A 124 13.195 5.017 -21.891 1.00 1.02 H new ATOM 0 HD3 ARG A 124 12.590 4.236 -23.338 1.00 1.02 H new ATOM 0 HE ARG A 124 10.642 3.638 -21.479 1.00 64.44 H new ATOM 0 HH11 ARG A 124 12.239 6.609 -22.520 1.00 3.21 H new ATOM 0 HH12 ARG A 124 10.830 7.621 -22.184 1.00 3.21 H new ATOM 0 HH21 ARG A 124 8.837 4.944 -21.048 1.00 72.15 H new ATOM 0 HH22 ARG A 124 8.913 6.683 -21.354 1.00 72.15 H new ATOM 1901 N CYS A 125 16.060 1.740 -23.116 1.00 12.43 N ATOM 1902 CA CYS A 125 17.344 1.076 -22.920 1.00 15.24 C ATOM 1903 C CYS A 125 17.956 1.462 -21.577 1.00 42.53 C ATOM 1904 O CYS A 125 18.065 2.639 -21.233 1.00 3.44 O ATOM 1905 CB CYS A 125 18.305 1.433 -24.054 1.00 53.43 C ATOM 1906 SG CYS A 125 19.816 0.442 -24.081 1.00 63.31 S ATOM 0 H CYS A 125 15.940 2.594 -22.572 1.00 12.43 H new ATOM 0 HA CYS A 125 17.173 -0.000 -22.925 1.00 15.24 H new ATOM 0 HB2 CYS A 125 17.787 1.313 -25.006 1.00 53.43 H new ATOM 0 HB3 CYS A 125 18.575 2.486 -23.969 1.00 53.43 H new ATOM 0 HG CYS A 125 20.563 0.817 -25.077 1.00 63.31 H new ATOM 1912 N PRO A 126 18.365 0.449 -20.799 1.00 74.05 N ATOM 1913 CA PRO A 126 18.972 0.658 -19.482 1.00 21.52 C ATOM 1914 C PRO A 126 20.363 1.275 -19.576 1.00 1.11 C ATOM 1915 O PRO A 126 20.843 1.895 -18.627 1.00 53.23 O ATOM 1916 CB PRO A 126 19.053 -0.756 -18.901 1.00 31.33 C ATOM 1917 CG PRO A 126 19.096 -1.653 -20.090 1.00 12.32 C ATOM 1918 CD PRO A 126 18.265 -0.979 -21.147 1.00 4.43 C ATOM 0 HA PRO A 126 18.394 1.352 -18.872 1.00 21.52 H new ATOM 0 HB2 PRO A 126 19.941 -0.879 -18.280 1.00 31.33 H new ATOM 0 HB3 PRO A 126 18.191 -0.975 -18.271 1.00 31.33 H new ATOM 0 HG2 PRO A 126 20.121 -1.798 -20.433 1.00 12.32 H new ATOM 0 HG3 PRO A 126 18.698 -2.639 -19.850 1.00 12.32 H new ATOM 0 HD2 PRO A 126 18.650 -1.177 -22.148 1.00 4.43 H new ATOM 0 HD3 PRO A 126 17.232 -1.326 -21.128 1.00 4.43 H new ATOM 1926 N ALA A 127 21.006 1.102 -20.726 1.00 71.41 N ATOM 1927 CA ALA A 127 22.341 1.644 -20.944 1.00 40.35 C ATOM 1928 C ALA A 127 22.349 3.161 -20.788 1.00 5.15 C ATOM 1929 O ALA A 127 23.279 3.730 -20.213 1.00 73.24 O ATOM 1930 CB ALA A 127 22.851 1.252 -22.323 1.00 24.40 C ATOM 0 H ALA A 127 20.624 0.590 -21.521 1.00 71.41 H new ATOM 0 HA ALA A 127 23.005 1.223 -20.189 1.00 40.35 H new ATOM 0 HB1 ALA A 127 23.849 1.664 -22.472 1.00 24.40 H new ATOM 0 HB2 ALA A 127 22.891 0.166 -22.401 1.00 24.40 H new ATOM 0 HB3 ALA A 127 22.178 1.646 -23.085 1.00 24.40 H new ATOM 1936 N ILE A 128 21.310 3.810 -21.302 1.00 3.25 N ATOM 1937 CA ILE A 128 21.199 5.261 -21.218 1.00 11.15 C ATOM 1938 C ILE A 128 20.286 5.677 -20.069 1.00 72.22 C ATOM 1939 O ILE A 128 20.319 6.822 -19.621 1.00 11.31 O ATOM 1940 CB ILE A 128 20.661 5.861 -22.530 1.00 14.43 C ATOM 1941 CG1 ILE A 128 21.502 5.387 -23.716 1.00 63.21 C ATOM 1942 CG2 ILE A 128 20.653 7.381 -22.453 1.00 74.21 C ATOM 1943 CD1 ILE A 128 20.954 5.820 -25.058 1.00 34.53 C ATOM 0 H ILE A 128 20.533 3.354 -21.781 1.00 3.25 H new ATOM 0 HA ILE A 128 22.203 5.645 -21.038 1.00 11.15 H new ATOM 0 HB ILE A 128 19.637 5.518 -22.676 1.00 14.43 H new ATOM 0 HG12 ILE A 128 22.517 5.769 -23.607 1.00 63.21 H new ATOM 0 HG13 ILE A 128 21.567 4.299 -23.693 1.00 63.21 H new ATOM 0 HG21 ILE A 128 20.270 7.791 -23.388 1.00 74.21 H new ATOM 0 HG22 ILE A 128 20.015 7.700 -21.629 1.00 74.21 H new ATOM 0 HG23 ILE A 128 21.668 7.742 -22.287 1.00 74.21 H new ATOM 0 HD11 ILE A 128 21.601 5.448 -25.852 1.00 34.53 H new ATOM 0 HD12 ILE A 128 19.950 5.416 -25.189 1.00 34.53 H new ATOM 0 HD13 ILE A 128 20.915 6.908 -25.101 1.00 34.53 H new