USER MOD reduce.3.24.130724 H: found=0, std=0, add=845, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 850 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 9 TYR OH : rot 180:sc= -0.136 USER MOD Set 1.2: B 19 LYS NZ :NH3+ 177:sc= 0.757 (180deg=0.712) USER MOD Single : A 11 ASN : amide:sc= -0.0282 X(o=-0.028,f=-0.22) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.897 K(o=-0.9,f=-1.5!) USER MOD Single : A 19 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0119) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 158:sc= -0.483 (180deg=-1.43!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 165:sc= 1.32 (180deg=1.05) USER MOD Single : B 9 TYR OH : rot 30:sc= -0.142 USER MOD Single : B 11 ASN : amide:sc= -0.0159 X(o=-0.016,f=-0.19) USER MOD Single : B 15 LYS NZ :NH3+ 173:sc= 0.445 (180deg=0.309) USER MOD Single : B 18 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -159:sc= -0.0312 (180deg=-0.26) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 57 THR OG1 : rot -16:sc= 0.445 USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 SER OG : rot -14:sc= 0.324 USER MOD Single : B 64 HIS : no HD1:sc= -0.972 K(o=-0.97,f=0.027) USER MOD Single : B 65 HIS : no HD1:sc= -0.667 K(o=-0.67,f=-0.11) USER MOD Single : B 66 HIS : no HD1:sc= 0 X(o=0,f=-0.03) USER MOD Single : B 67 HIS : no HD1:sc= -0.164 K(o=-0.16,f=-0.82) USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 69 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD ----------------------------------------------------------------- ATOM 56 N ILE A 4 -7.419 1.919 2.967 1.00 0.00 N ATOM 57 CA ILE A 4 -7.147 0.859 2.028 1.00 0.00 C ATOM 58 C ILE A 4 -8.200 0.818 0.935 1.00 0.00 C ATOM 59 O ILE A 4 -9.392 1.017 1.195 1.00 0.00 O ATOM 60 CB ILE A 4 -7.092 -0.522 2.712 1.00 0.00 C ATOM 61 CG1 ILE A 4 -8.281 -0.737 3.659 1.00 0.00 C ATOM 62 CG2 ILE A 4 -5.781 -0.705 3.454 1.00 0.00 C ATOM 63 CD1 ILE A 4 -8.101 -0.157 5.055 1.00 0.00 C ATOM 0 HA ILE A 4 -6.170 1.075 1.595 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.156 -1.275 1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.170 -0.294 3.209 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -8.468 -1.807 3.747 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -5.765 -1.686 3.928 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.951 -0.628 2.751 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.683 0.068 4.216 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -8.992 -0.359 5.650 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -7.235 -0.616 5.531 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -7.948 0.920 4.985 1.00 0.00 H new ATOM 75 N ILE A 5 -7.753 0.579 -0.285 1.00 0.00 N ATOM 76 CA ILE A 5 -8.660 0.376 -1.403 1.00 0.00 C ATOM 77 C ILE A 5 -8.774 -1.119 -1.663 1.00 0.00 C ATOM 78 O ILE A 5 -7.891 -1.881 -1.274 1.00 0.00 O ATOM 79 CB ILE A 5 -8.170 1.104 -2.680 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.706 2.520 -2.333 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.279 1.152 -3.727 1.00 0.00 C ATOM 82 CD1 ILE A 5 -7.292 3.345 -3.534 1.00 0.00 C ATOM 0 H ILE A 5 -6.764 0.520 -0.528 1.00 0.00 H new ATOM 0 HA ILE A 5 -9.633 0.796 -1.149 1.00 0.00 H new ATOM 0 HB ILE A 5 -7.328 0.550 -3.095 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.511 3.037 -1.810 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.866 2.457 -1.642 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.917 1.667 -4.617 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -9.575 0.137 -3.990 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -10.138 1.687 -3.323 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.977 4.335 -3.204 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.465 2.853 -4.046 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -8.136 3.442 -4.217 1.00 0.00 H new ATOM 94 N GLU A 6 -9.851 -1.549 -2.283 1.00 0.00 N ATOM 95 CA GLU A 6 -10.041 -2.964 -2.535 1.00 0.00 C ATOM 96 C GLU A 6 -9.654 -3.318 -3.961 1.00 0.00 C ATOM 97 O GLU A 6 -9.648 -2.460 -4.840 1.00 0.00 O ATOM 98 CB GLU A 6 -11.489 -3.365 -2.259 1.00 0.00 C ATOM 99 CG GLU A 6 -11.902 -3.195 -0.805 1.00 0.00 C ATOM 100 CD GLU A 6 -13.245 -3.824 -0.502 1.00 0.00 C ATOM 101 OE1 GLU A 6 -14.287 -3.179 -0.737 1.00 0.00 O ATOM 102 OE2 GLU A 6 -13.269 -4.977 -0.022 1.00 0.00 O ATOM 0 H GLU A 6 -10.603 -0.948 -2.620 1.00 0.00 H new ATOM 0 HA GLU A 6 -9.391 -3.520 -1.859 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -12.149 -2.767 -2.888 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -11.630 -4.406 -2.549 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -11.143 -3.640 -0.162 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -11.940 -2.133 -0.564 1.00 0.00 H new ATOM 109 N ALA A 7 -9.288 -4.576 -4.156 1.00 0.00 N ATOM 110 CA ALA A 7 -8.993 -5.121 -5.468 1.00 0.00 C ATOM 111 C ALA A 7 -9.344 -6.602 -5.480 1.00 0.00 C ATOM 112 O ALA A 7 -9.177 -7.294 -4.469 1.00 0.00 O ATOM 113 CB ALA A 7 -7.522 -4.926 -5.808 1.00 0.00 C ATOM 0 H ALA A 7 -9.187 -5.252 -3.399 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.586 -4.598 -6.218 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -7.319 -5.341 -6.795 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.286 -3.862 -5.806 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -6.907 -5.436 -5.067 1.00 0.00 H new ATOM 119 N VAL A 8 -9.843 -7.078 -6.607 1.00 0.00 N ATOM 120 CA VAL A 8 -10.192 -8.478 -6.748 1.00 0.00 C ATOM 121 C VAL A 8 -9.234 -9.157 -7.711 1.00 0.00 C ATOM 122 O VAL A 8 -8.974 -8.669 -8.807 1.00 0.00 O ATOM 123 CB VAL A 8 -11.625 -8.676 -7.271 1.00 0.00 C ATOM 124 CG1 VAL A 8 -12.087 -10.104 -7.046 1.00 0.00 C ATOM 125 CG2 VAL A 8 -12.589 -7.678 -6.644 1.00 0.00 C ATOM 0 H VAL A 8 -10.015 -6.513 -7.439 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.124 -8.920 -5.754 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.618 -8.489 -8.345 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.103 -10.221 -7.423 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.423 -10.789 -7.573 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.068 -10.329 -5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.592 -7.846 -7.036 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.595 -7.809 -5.562 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.271 -6.664 -6.885 1.00 0.00 H new ATOM 135 N TYR A 9 -8.731 -10.291 -7.293 1.00 0.00 N ATOM 136 CA TYR A 9 -7.774 -11.067 -8.071 1.00 0.00 C ATOM 137 C TYR A 9 -8.521 -12.016 -8.984 1.00 0.00 C ATOM 138 O TYR A 9 -9.220 -12.920 -8.525 1.00 0.00 O ATOM 139 CB TYR A 9 -6.852 -11.833 -7.116 1.00 0.00 C ATOM 140 CG TYR A 9 -5.637 -12.472 -7.761 1.00 0.00 C ATOM 141 CD1 TYR A 9 -4.474 -11.741 -7.963 1.00 0.00 C ATOM 142 CD2 TYR A 9 -5.642 -13.805 -8.142 1.00 0.00 C ATOM 143 CE1 TYR A 9 -3.353 -12.316 -8.526 1.00 0.00 C ATOM 144 CE2 TYR A 9 -4.524 -14.388 -8.708 1.00 0.00 C ATOM 145 CZ TYR A 9 -3.380 -13.640 -8.897 1.00 0.00 C ATOM 146 OH TYR A 9 -2.258 -14.223 -9.452 1.00 0.00 O ATOM 0 H TYR A 9 -8.971 -10.713 -6.396 1.00 0.00 H new ATOM 0 HA TYR A 9 -7.164 -10.406 -8.687 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.512 -11.149 -6.338 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -7.433 -12.612 -6.623 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.446 -10.701 -7.674 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -6.533 -14.397 -7.994 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -2.459 -11.729 -8.675 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -4.546 -15.427 -9.002 1.00 0.00 H new ATOM 0 HH TYR A 9 -2.445 -15.163 -9.656 1.00 0.00 H new ATOM 156 N GLU A 10 -8.397 -11.748 -10.272 1.00 0.00 N ATOM 157 CA GLU A 10 -8.997 -12.537 -11.318 1.00 0.00 C ATOM 158 C GLU A 10 -8.006 -12.707 -12.451 1.00 0.00 C ATOM 159 O GLU A 10 -7.299 -11.760 -12.793 1.00 0.00 O ATOM 160 CB GLU A 10 -10.229 -11.829 -11.855 1.00 0.00 C ATOM 161 CG GLU A 10 -11.432 -11.865 -10.935 1.00 0.00 C ATOM 162 CD GLU A 10 -12.645 -11.215 -11.565 1.00 0.00 C ATOM 163 OE1 GLU A 10 -13.261 -11.837 -12.450 1.00 0.00 O ATOM 164 OE2 GLU A 10 -12.971 -10.068 -11.199 1.00 0.00 O ATOM 0 H GLU A 10 -7.861 -10.954 -10.622 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.277 -13.509 -10.913 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.974 -10.789 -12.057 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.504 -12.281 -12.808 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.665 -12.899 -10.682 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.191 -11.356 -10.002 1.00 0.00 H new ATOM 171 N ASN A 11 -7.940 -13.912 -13.003 1.00 0.00 N ATOM 172 CA ASN A 11 -7.141 -14.193 -14.202 1.00 0.00 C ATOM 173 C ASN A 11 -5.649 -14.086 -13.906 1.00 0.00 C ATOM 174 O ASN A 11 -4.822 -13.956 -14.813 1.00 0.00 O ATOM 175 CB ASN A 11 -7.530 -13.226 -15.321 1.00 0.00 C ATOM 176 CG ASN A 11 -7.194 -13.741 -16.711 1.00 0.00 C ATOM 177 OD1 ASN A 11 -6.126 -13.461 -17.252 1.00 0.00 O ATOM 178 ND2 ASN A 11 -8.112 -14.493 -17.298 1.00 0.00 N ATOM 0 H ASN A 11 -8.436 -14.725 -12.637 1.00 0.00 H new ATOM 0 HA ASN A 11 -7.347 -15.215 -14.521 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -8.600 -13.029 -15.264 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -7.022 -12.275 -15.162 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -7.946 -14.863 -18.234 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -8.985 -14.702 -16.814 1.00 0.00 H new ATOM 185 N GLY A 12 -5.311 -14.175 -12.633 1.00 0.00 N ATOM 186 CA GLY A 12 -3.933 -14.022 -12.221 1.00 0.00 C ATOM 187 C GLY A 12 -3.560 -12.570 -12.015 1.00 0.00 C ATOM 188 O GLY A 12 -2.377 -12.222 -11.938 1.00 0.00 O ATOM 0 H GLY A 12 -5.968 -14.351 -11.873 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.768 -14.573 -11.295 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.279 -14.461 -12.974 1.00 0.00 H new ATOM 192 N VAL A 13 -4.576 -11.729 -11.909 1.00 0.00 N ATOM 193 CA VAL A 13 -4.391 -10.286 -11.793 1.00 0.00 C ATOM 194 C VAL A 13 -5.095 -9.757 -10.566 1.00 0.00 C ATOM 195 O VAL A 13 -6.135 -10.277 -10.195 1.00 0.00 O ATOM 196 CB VAL A 13 -5.049 -9.561 -12.969 1.00 0.00 C ATOM 197 CG1 VAL A 13 -4.614 -8.107 -13.034 1.00 0.00 C ATOM 198 CG2 VAL A 13 -4.784 -10.269 -14.290 1.00 0.00 C ATOM 0 H VAL A 13 -5.552 -12.024 -11.901 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.315 -10.113 -11.756 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.125 -9.583 -12.797 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -5.099 -7.620 -13.880 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.898 -7.601 -12.112 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -3.532 -8.056 -13.157 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.268 -9.722 -15.099 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -3.710 -10.310 -14.472 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -5.184 -11.282 -14.246 1.00 0.00 H new ATOM 208 N PHE A 14 -4.568 -8.711 -9.958 1.00 0.00 N ATOM 209 CA PHE A 14 -5.343 -7.960 -8.991 1.00 0.00 C ATOM 210 C PHE A 14 -5.983 -6.773 -9.696 1.00 0.00 C ATOM 211 O PHE A 14 -5.293 -5.879 -10.190 1.00 0.00 O ATOM 212 CB PHE A 14 -4.487 -7.459 -7.830 1.00 0.00 C ATOM 213 CG PHE A 14 -4.111 -8.501 -6.816 1.00 0.00 C ATOM 214 CD1 PHE A 14 -5.061 -9.008 -5.947 1.00 0.00 C ATOM 215 CD2 PHE A 14 -2.805 -8.960 -6.721 1.00 0.00 C ATOM 216 CE1 PHE A 14 -4.723 -9.955 -5.000 1.00 0.00 C ATOM 217 CE2 PHE A 14 -2.459 -9.911 -5.775 1.00 0.00 C ATOM 218 CZ PHE A 14 -3.422 -10.409 -4.915 1.00 0.00 C ATOM 0 H PHE A 14 -3.621 -8.366 -10.114 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.101 -8.623 -8.575 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.574 -7.023 -8.235 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -5.025 -6.658 -7.322 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -6.081 -8.658 -6.010 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.051 -8.572 -7.391 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -5.475 -10.340 -4.327 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.440 -10.263 -5.709 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.156 -11.152 -4.178 1.00 0.00 H new ATOM 228 N LYS A 15 -7.295 -6.779 -9.750 1.00 0.00 N ATOM 229 CA LYS A 15 -8.048 -5.723 -10.388 1.00 0.00 C ATOM 230 C LYS A 15 -8.775 -4.903 -9.335 1.00 0.00 C ATOM 231 O LYS A 15 -9.715 -5.398 -8.717 1.00 0.00 O ATOM 232 CB LYS A 15 -9.080 -6.318 -11.344 1.00 0.00 C ATOM 233 CG LYS A 15 -8.493 -7.062 -12.534 1.00 0.00 C ATOM 234 CD LYS A 15 -9.592 -7.670 -13.394 1.00 0.00 C ATOM 235 CE LYS A 15 -9.032 -8.429 -14.584 1.00 0.00 C ATOM 236 NZ LYS A 15 -10.113 -9.013 -15.425 1.00 0.00 N ATOM 0 H LYS A 15 -7.873 -7.519 -9.351 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.357 -5.089 -10.943 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -9.720 -7.001 -10.786 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -9.717 -5.515 -11.714 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.893 -6.379 -13.135 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -7.825 -7.848 -12.182 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -10.196 -8.344 -12.786 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -10.254 -6.880 -13.748 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -8.423 -7.758 -15.189 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -8.376 -9.225 -14.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.691 -9.523 -16.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.679 -9.673 -14.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -10.725 -8.252 -15.782 1.00 0.00 H new ATOM 250 N PRO A 16 -8.329 -3.668 -9.087 1.00 0.00 N ATOM 251 CA PRO A 16 -8.947 -2.777 -8.102 1.00 0.00 C ATOM 252 C PRO A 16 -10.456 -2.672 -8.167 1.00 0.00 C ATOM 253 O PRO A 16 -11.114 -3.069 -9.131 1.00 0.00 O ATOM 254 CB PRO A 16 -8.373 -1.418 -8.489 1.00 0.00 C ATOM 255 CG PRO A 16 -7.012 -1.733 -8.977 1.00 0.00 C ATOM 256 CD PRO A 16 -7.131 -3.060 -9.687 1.00 0.00 C ATOM 0 HA PRO A 16 -8.741 -3.143 -7.096 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.973 -0.936 -9.261 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -8.345 -0.739 -7.637 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.649 -0.958 -9.653 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.304 -1.793 -8.151 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.244 -2.930 -10.763 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -6.247 -3.678 -9.532 1.00 0.00 H new ATOM 264 N LEU A 17 -10.969 -2.059 -7.131 1.00 0.00 N ATOM 265 CA LEU A 17 -12.305 -1.565 -7.099 1.00 0.00 C ATOM 266 C LEU A 17 -12.189 -0.065 -7.015 1.00 0.00 C ATOM 267 O LEU A 17 -12.130 0.496 -5.928 1.00 0.00 O ATOM 268 CB LEU A 17 -13.093 -2.141 -5.921 1.00 0.00 C ATOM 269 CG LEU A 17 -13.284 -3.664 -5.948 1.00 0.00 C ATOM 270 CD1 LEU A 17 -14.074 -4.131 -4.734 1.00 0.00 C ATOM 271 CD2 LEU A 17 -13.980 -4.090 -7.232 1.00 0.00 C ATOM 0 H LEU A 17 -10.449 -1.890 -6.270 1.00 0.00 H new ATOM 0 HA LEU A 17 -12.858 -1.866 -7.988 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -12.583 -1.871 -4.996 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -14.075 -1.668 -5.894 1.00 0.00 H new ATOM 0 HG LEU A 17 -12.300 -4.132 -5.915 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -14.197 -5.213 -4.774 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -13.537 -3.860 -3.825 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -15.054 -3.654 -4.732 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -14.107 -5.173 -7.235 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -14.956 -3.609 -7.293 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -13.375 -3.794 -8.089 1.00 0.00 H new ATOM 283 N GLN A 18 -12.097 0.511 -8.210 1.00 0.00 N ATOM 284 CA GLN A 18 -11.819 1.918 -8.509 1.00 0.00 C ATOM 285 C GLN A 18 -10.319 2.204 -8.444 1.00 0.00 C ATOM 286 O GLN A 18 -9.572 1.562 -7.704 1.00 0.00 O ATOM 287 CB GLN A 18 -12.621 2.884 -7.631 1.00 0.00 C ATOM 288 CG GLN A 18 -12.019 3.138 -6.265 1.00 0.00 C ATOM 289 CD GLN A 18 -11.196 4.405 -6.176 1.00 0.00 C ATOM 290 OE1 GLN A 18 -11.461 5.391 -6.870 1.00 0.00 O ATOM 291 NE2 GLN A 18 -10.175 4.375 -5.331 1.00 0.00 N ATOM 0 H GLN A 18 -12.224 -0.034 -9.063 1.00 0.00 H new ATOM 0 HA GLN A 18 -12.153 2.096 -9.531 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -12.718 3.835 -8.154 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -13.628 2.487 -7.502 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.822 3.187 -5.530 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -11.390 2.290 -5.994 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.995 3.537 -4.778 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -9.569 5.190 -5.234 1.00 0.00 H new ATOM 300 N LYS A 19 -9.898 3.162 -9.265 1.00 0.00 N ATOM 301 CA LYS A 19 -8.488 3.387 -9.557 1.00 0.00 C ATOM 302 C LYS A 19 -7.711 3.912 -8.362 1.00 0.00 C ATOM 303 O LYS A 19 -8.252 4.583 -7.484 1.00 0.00 O ATOM 304 CB LYS A 19 -8.342 4.364 -10.729 1.00 0.00 C ATOM 305 CG LYS A 19 -9.048 5.694 -10.508 1.00 0.00 C ATOM 306 CD LYS A 19 -8.778 6.668 -11.644 1.00 0.00 C ATOM 307 CE LYS A 19 -9.678 7.896 -11.564 1.00 0.00 C ATOM 308 NZ LYS A 19 -9.485 8.666 -10.306 1.00 0.00 N ATOM 0 H LYS A 19 -10.527 3.804 -9.747 1.00 0.00 H new ATOM 0 HA LYS A 19 -8.066 2.417 -9.818 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -7.283 4.550 -10.906 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -8.739 3.898 -11.631 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -10.121 5.526 -10.420 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -8.715 6.131 -9.567 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.734 6.980 -11.615 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -8.934 6.165 -12.598 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -9.478 8.545 -12.417 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -10.720 7.584 -11.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -10.057 9.534 -10.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -9.782 8.086 -9.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -8.481 8.917 -10.203 1.00 0.00 H new ATOM 322 N VAL A 20 -6.429 3.602 -8.359 1.00 0.00 N ATOM 323 CA VAL A 20 -5.514 4.075 -7.337 1.00 0.00 C ATOM 324 C VAL A 20 -4.516 4.996 -7.964 1.00 0.00 C ATOM 325 O VAL A 20 -3.984 4.730 -9.041 1.00 0.00 O ATOM 326 CB VAL A 20 -4.766 2.918 -6.642 1.00 0.00 C ATOM 327 CG1 VAL A 20 -4.172 3.371 -5.319 1.00 0.00 C ATOM 328 CG2 VAL A 20 -5.674 1.711 -6.443 1.00 0.00 C ATOM 0 H VAL A 20 -5.991 3.013 -9.067 1.00 0.00 H new ATOM 0 HA VAL A 20 -6.101 4.593 -6.579 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.948 2.615 -7.295 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.650 2.537 -4.850 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.469 4.185 -5.496 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -4.970 3.716 -4.661 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.117 0.914 -5.951 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.525 1.994 -5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.031 1.360 -7.411 1.00 0.00 H new ATOM 338 N ASP A 21 -4.269 6.086 -7.297 1.00 0.00 N ATOM 339 CA ASP A 21 -3.330 7.038 -7.799 1.00 0.00 C ATOM 340 C ASP A 21 -1.974 6.677 -7.275 1.00 0.00 C ATOM 341 O ASP A 21 -1.541 7.083 -6.199 1.00 0.00 O ATOM 342 CB ASP A 21 -3.720 8.437 -7.398 1.00 0.00 C ATOM 343 CG ASP A 21 -2.832 9.496 -8.025 1.00 0.00 C ATOM 344 OD1 ASP A 21 -1.746 9.783 -7.483 1.00 0.00 O ATOM 345 OD2 ASP A 21 -3.220 10.045 -9.079 1.00 0.00 O ATOM 0 H ASP A 21 -4.704 6.334 -6.408 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.318 7.014 -8.889 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.755 8.618 -7.688 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.673 8.526 -6.313 1.00 0.00 H new ATOM 350 N LEU A 22 -1.367 5.834 -8.043 1.00 0.00 N ATOM 351 CA LEU A 22 -0.008 5.404 -7.835 1.00 0.00 C ATOM 352 C LEU A 22 0.784 5.568 -9.114 1.00 0.00 C ATOM 353 O LEU A 22 0.223 5.895 -10.161 1.00 0.00 O ATOM 354 CB LEU A 22 0.004 3.938 -7.420 1.00 0.00 C ATOM 355 CG LEU A 22 -0.510 3.636 -6.015 1.00 0.00 C ATOM 356 CD1 LEU A 22 -0.511 2.138 -5.768 1.00 0.00 C ATOM 357 CD2 LEU A 22 0.338 4.351 -4.976 1.00 0.00 C ATOM 0 H LEU A 22 -1.808 5.408 -8.858 1.00 0.00 H new ATOM 0 HA LEU A 22 0.443 6.012 -7.050 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -0.596 3.374 -8.134 1.00 0.00 H new ATOM 0 HB3 LEU A 22 1.026 3.567 -7.499 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.534 4.001 -5.930 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -0.880 1.935 -4.762 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.158 1.649 -6.497 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.504 1.752 -5.867 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.041 4.126 -3.979 1.00 0.00 H new ATOM 0 HD22 LEU A 22 1.372 4.014 -5.056 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.293 5.427 -5.147 1.00 0.00 H new ATOM 369 N LYS A 23 2.080 5.329 -9.039 1.00 0.00 N ATOM 370 CA LYS A 23 2.902 5.324 -10.229 1.00 0.00 C ATOM 371 C LYS A 23 3.161 3.893 -10.641 1.00 0.00 C ATOM 372 O LYS A 23 3.132 2.994 -9.806 1.00 0.00 O ATOM 373 CB LYS A 23 4.222 6.091 -10.048 1.00 0.00 C ATOM 374 CG LYS A 23 4.761 6.133 -8.625 1.00 0.00 C ATOM 375 CD LYS A 23 4.085 7.220 -7.807 1.00 0.00 C ATOM 376 CE LYS A 23 4.758 7.395 -6.455 1.00 0.00 C ATOM 377 NZ LYS A 23 4.076 8.414 -5.611 1.00 0.00 N ATOM 0 H LYS A 23 2.581 5.137 -8.172 1.00 0.00 H new ATOM 0 HA LYS A 23 2.358 5.847 -11.016 1.00 0.00 H new ATOM 0 HB2 LYS A 23 4.977 5.639 -10.691 1.00 0.00 H new ATOM 0 HB3 LYS A 23 4.079 7.114 -10.395 1.00 0.00 H new ATOM 0 HG2 LYS A 23 4.605 5.166 -8.147 1.00 0.00 H new ATOM 0 HG3 LYS A 23 5.837 6.308 -8.647 1.00 0.00 H new ATOM 0 HD2 LYS A 23 4.115 8.162 -8.355 1.00 0.00 H new ATOM 0 HD3 LYS A 23 3.034 6.969 -7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 23 4.768 6.440 -5.930 1.00 0.00 H new ATOM 0 HE3 LYS A 23 5.797 7.687 -6.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 4.571 8.498 -4.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 4.089 9.333 -6.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 3.091 8.124 -5.445 1.00 0.00 H new ATOM 391 N GLU A 24 3.399 3.690 -11.922 1.00 0.00 N ATOM 392 CA GLU A 24 3.522 2.359 -12.467 1.00 0.00 C ATOM 393 C GLU A 24 4.685 1.624 -11.837 1.00 0.00 C ATOM 394 O GLU A 24 5.807 2.127 -11.762 1.00 0.00 O ATOM 395 CB GLU A 24 3.656 2.440 -13.981 1.00 0.00 C ATOM 396 CG GLU A 24 2.498 3.181 -14.636 1.00 0.00 C ATOM 397 CD GLU A 24 2.684 3.386 -16.122 1.00 0.00 C ATOM 398 OE1 GLU A 24 3.485 4.262 -16.506 1.00 0.00 O ATOM 399 OE2 GLU A 24 2.011 2.696 -16.912 1.00 0.00 O ATOM 0 H GLU A 24 3.511 4.438 -12.606 1.00 0.00 H new ATOM 0 HA GLU A 24 2.623 1.789 -12.233 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.591 2.941 -14.232 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.715 1.432 -14.391 1.00 0.00 H new ATOM 0 HG2 GLU A 24 1.577 2.624 -14.466 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.378 4.151 -14.155 1.00 0.00 H new ATOM 406 N GLY A 25 4.375 0.429 -11.393 1.00 0.00 N ATOM 407 CA GLY A 25 5.237 -0.310 -10.515 1.00 0.00 C ATOM 408 C GLY A 25 5.458 0.442 -9.227 1.00 0.00 C ATOM 409 O GLY A 25 6.568 0.871 -8.910 1.00 0.00 O ATOM 0 H GLY A 25 3.511 -0.057 -11.635 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.798 -1.285 -10.302 1.00 0.00 H new ATOM 0 HA3 GLY A 25 6.194 -0.491 -11.005 1.00 0.00 H new ATOM 413 N GLU A 26 4.375 0.591 -8.492 1.00 0.00 N ATOM 414 CA GLU A 26 4.422 1.032 -7.109 1.00 0.00 C ATOM 415 C GLU A 26 4.204 -0.164 -6.198 1.00 0.00 C ATOM 416 O GLU A 26 3.410 -1.049 -6.522 1.00 0.00 O ATOM 417 CB GLU A 26 3.350 2.090 -6.859 1.00 0.00 C ATOM 418 CG GLU A 26 3.915 3.453 -6.537 1.00 0.00 C ATOM 419 CD GLU A 26 4.754 3.474 -5.274 1.00 0.00 C ATOM 420 OE1 GLU A 26 5.965 3.168 -5.357 1.00 0.00 O ATOM 421 OE2 GLU A 26 4.217 3.815 -4.201 1.00 0.00 O ATOM 0 H GLU A 26 3.432 0.409 -8.837 1.00 0.00 H new ATOM 0 HA GLU A 26 5.396 1.474 -6.899 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.714 2.168 -7.741 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.714 1.765 -6.035 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.524 3.793 -7.375 1.00 0.00 H new ATOM 0 HG3 GLU A 26 3.094 4.163 -6.431 1.00 0.00 H new ATOM 428 N ARG A 27 4.898 -0.202 -5.068 1.00 0.00 N ATOM 429 CA ARG A 27 4.836 -1.375 -4.215 1.00 0.00 C ATOM 430 C ARG A 27 3.802 -1.283 -3.120 1.00 0.00 C ATOM 431 O ARG A 27 3.762 -0.371 -2.275 1.00 0.00 O ATOM 432 CB ARG A 27 6.182 -1.734 -3.636 1.00 0.00 C ATOM 433 CG ARG A 27 6.913 -2.771 -4.462 1.00 0.00 C ATOM 434 CD ARG A 27 8.251 -3.120 -3.852 1.00 0.00 C ATOM 435 NE ARG A 27 8.130 -3.668 -2.498 1.00 0.00 N ATOM 436 CZ ARG A 27 8.389 -2.968 -1.392 1.00 0.00 C ATOM 437 NH1 ARG A 27 8.815 -1.712 -1.479 1.00 0.00 N ATOM 438 NH2 ARG A 27 8.228 -3.531 -0.200 1.00 0.00 N ATOM 0 H ARG A 27 5.498 0.550 -4.728 1.00 0.00 H new ATOM 0 HA ARG A 27 4.518 -2.178 -4.880 1.00 0.00 H new ATOM 0 HB2 ARG A 27 6.794 -0.835 -3.564 1.00 0.00 H new ATOM 0 HB3 ARG A 27 6.048 -2.111 -2.622 1.00 0.00 H new ATOM 0 HG2 ARG A 27 6.303 -3.670 -4.542 1.00 0.00 H new ATOM 0 HG3 ARG A 27 7.060 -2.394 -5.474 1.00 0.00 H new ATOM 0 HD2 ARG A 27 8.758 -3.845 -4.489 1.00 0.00 H new ATOM 0 HD3 ARG A 27 8.877 -2.228 -3.824 1.00 0.00 H new ATOM 0 HE ARG A 27 7.831 -4.638 -2.396 1.00 0.00 H new ATOM 0 HH11 ARG A 27 8.945 -1.280 -2.394 1.00 0.00 H new ATOM 0 HH12 ARG A 27 9.012 -1.180 -0.631 1.00 0.00 H new ATOM 0 HH21 ARG A 27 7.907 -4.497 -0.131 1.00 0.00 H new ATOM 0 HH22 ARG A 27 8.425 -2.998 0.647 1.00 0.00 H new ATOM 452 N VAL A 28 3.018 -2.318 -3.122 1.00 0.00 N ATOM 453 CA VAL A 28 1.873 -2.451 -2.255 1.00 0.00 C ATOM 454 C VAL A 28 1.862 -3.858 -1.692 1.00 0.00 C ATOM 455 O VAL A 28 2.424 -4.773 -2.299 1.00 0.00 O ATOM 456 CB VAL A 28 0.552 -2.186 -3.016 1.00 0.00 C ATOM 457 CG1 VAL A 28 0.564 -0.806 -3.662 1.00 0.00 C ATOM 458 CG2 VAL A 28 0.310 -3.258 -4.069 1.00 0.00 C ATOM 0 H VAL A 28 3.155 -3.117 -3.740 1.00 0.00 H new ATOM 0 HA VAL A 28 1.947 -1.714 -1.455 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.263 -2.221 -2.293 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.375 -0.644 -4.191 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.683 -0.044 -2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.393 -0.741 -4.367 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.624 -3.051 -4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.133 -3.258 -4.784 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.248 -4.234 -3.587 1.00 0.00 H new ATOM 468 N LYS A 29 1.244 -4.042 -0.546 1.00 0.00 N ATOM 469 CA LYS A 29 1.224 -5.338 0.069 1.00 0.00 C ATOM 470 C LYS A 29 -0.181 -5.851 0.215 1.00 0.00 C ATOM 471 O LYS A 29 -1.130 -5.098 0.465 1.00 0.00 O ATOM 472 CB LYS A 29 1.938 -5.299 1.397 1.00 0.00 C ATOM 473 CG LYS A 29 3.435 -5.412 1.233 1.00 0.00 C ATOM 474 CD LYS A 29 4.161 -5.181 2.533 1.00 0.00 C ATOM 475 CE LYS A 29 3.776 -6.183 3.608 1.00 0.00 C ATOM 476 NZ LYS A 29 4.185 -5.707 4.956 1.00 0.00 N ATOM 0 H LYS A 29 0.754 -3.312 -0.029 1.00 0.00 H new ATOM 0 HA LYS A 29 1.754 -6.034 -0.581 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.698 -4.368 1.911 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.579 -6.113 2.027 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.685 -6.401 0.848 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.775 -4.687 0.493 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.236 -5.237 2.359 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.948 -4.173 2.889 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.698 -6.346 3.588 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.248 -7.143 3.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.910 -6.410 5.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.216 -5.575 4.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.715 -4.802 5.162 1.00 0.00 H new ATOM 490 N ILE A 30 -0.296 -7.145 0.089 1.00 0.00 N ATOM 491 CA ILE A 30 -1.591 -7.783 -0.034 1.00 0.00 C ATOM 492 C ILE A 30 -1.888 -8.632 1.179 1.00 0.00 C ATOM 493 O ILE A 30 -1.005 -9.268 1.754 1.00 0.00 O ATOM 494 CB ILE A 30 -1.673 -8.690 -1.276 1.00 0.00 C ATOM 495 CG1 ILE A 30 -1.068 -8.023 -2.512 1.00 0.00 C ATOM 496 CG2 ILE A 30 -3.111 -9.071 -1.556 1.00 0.00 C ATOM 497 CD1 ILE A 30 -1.751 -6.734 -2.919 1.00 0.00 C ATOM 0 H ILE A 30 0.495 -7.788 0.068 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.320 -6.978 -0.127 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.092 -9.587 -1.059 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.014 -7.818 -2.322 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -1.111 -8.723 -3.346 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.153 -9.712 -2.437 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.519 -9.606 -0.698 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.698 -8.170 -1.735 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -1.261 -6.326 -3.803 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.799 -6.933 -3.144 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.685 -6.014 -2.103 1.00 0.00 H new ATOM 509 N LYS A 31 -3.140 -8.611 1.552 1.00 0.00 N ATOM 510 CA LYS A 31 -3.663 -9.421 2.603 1.00 0.00 C ATOM 511 C LYS A 31 -5.150 -9.607 2.368 1.00 0.00 C ATOM 512 O LYS A 31 -5.814 -8.742 1.775 1.00 0.00 O ATOM 513 CB LYS A 31 -3.401 -8.816 3.959 1.00 0.00 C ATOM 514 CG LYS A 31 -4.176 -7.565 4.248 1.00 0.00 C ATOM 515 CD LYS A 31 -3.653 -6.376 3.474 1.00 0.00 C ATOM 516 CE LYS A 31 -2.271 -5.952 3.953 1.00 0.00 C ATOM 517 NZ LYS A 31 -1.704 -4.852 3.127 1.00 0.00 N ATOM 0 H LYS A 31 -3.839 -8.010 1.116 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.160 -10.388 2.594 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.635 -9.557 4.724 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.337 -8.596 4.044 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.225 -7.725 4.000 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.130 -7.350 5.316 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.610 -6.623 2.413 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.346 -5.541 3.579 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.331 -5.630 4.992 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.599 -6.810 3.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.976 -4.348 3.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -1.279 -5.249 2.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.461 -4.189 2.865 1.00 0.00 H new ATOM 531 N LEU A 32 -5.652 -10.719 2.839 1.00 0.00 N ATOM 532 CA LEU A 32 -6.998 -11.151 2.540 1.00 0.00 C ATOM 533 C LEU A 32 -7.919 -10.761 3.674 1.00 0.00 C ATOM 534 O LEU A 32 -7.670 -11.108 4.832 1.00 0.00 O ATOM 535 CB LEU A 32 -7.027 -12.660 2.320 1.00 0.00 C ATOM 536 CG LEU A 32 -6.049 -13.179 1.262 1.00 0.00 C ATOM 537 CD1 LEU A 32 -4.680 -13.450 1.864 1.00 0.00 C ATOM 538 CD2 LEU A 32 -6.587 -14.428 0.597 1.00 0.00 C ATOM 0 H LEU A 32 -5.137 -11.357 3.446 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.339 -10.665 1.626 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.810 -13.154 3.267 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.037 -12.951 2.033 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.940 -12.402 0.505 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -4.008 -13.817 1.089 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.279 -12.528 2.285 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.770 -14.199 2.651 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.875 -14.778 -0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.736 -15.204 1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.538 -14.202 0.115 1.00 0.00 H new ATOM 606 N VAL A 36 -16.508 -9.001 10.224 1.00 0.00 N ATOM 607 CA VAL A 36 -16.563 -8.414 11.552 1.00 0.00 C ATOM 608 C VAL A 36 -17.606 -9.145 12.398 1.00 0.00 C ATOM 609 O VAL A 36 -18.530 -9.766 11.864 1.00 0.00 O ATOM 610 CB VAL A 36 -16.888 -6.902 11.487 1.00 0.00 C ATOM 611 CG1 VAL A 36 -18.302 -6.660 10.984 1.00 0.00 C ATOM 612 CG2 VAL A 36 -16.668 -6.229 12.836 1.00 0.00 C ATOM 0 HA VAL A 36 -15.582 -8.523 12.014 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.199 -6.452 10.773 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -18.498 -5.588 10.950 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.409 -7.080 9.984 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -19.014 -7.138 11.657 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -16.905 -5.168 12.756 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -17.315 -6.690 13.582 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -15.627 -6.347 13.136 1.00 0.00 H new ATOM 622 N GLU A 37 -17.443 -9.076 13.708 1.00 0.00 N ATOM 623 CA GLU A 37 -18.346 -9.744 14.633 1.00 0.00 C ATOM 624 C GLU A 37 -19.528 -8.842 14.982 1.00 0.00 C ATOM 625 O GLU A 37 -19.346 -7.662 15.297 1.00 0.00 O ATOM 626 CB GLU A 37 -17.589 -10.156 15.895 1.00 0.00 C ATOM 627 CG GLU A 37 -17.050 -11.581 15.848 1.00 0.00 C ATOM 628 CD GLU A 37 -16.224 -11.869 14.611 1.00 0.00 C ATOM 629 OE1 GLU A 37 -15.027 -11.513 14.595 1.00 0.00 O ATOM 630 OE2 GLU A 37 -16.761 -12.464 13.652 1.00 0.00 O ATOM 0 H GLU A 37 -16.688 -8.560 14.159 1.00 0.00 H new ATOM 0 HA GLU A 37 -18.739 -10.640 14.152 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -16.758 -9.468 16.051 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -18.252 -10.056 16.755 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -16.440 -11.761 16.733 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -17.886 -12.280 15.889 1.00 0.00 H new ATOM 637 N PRO A 38 -20.752 -9.389 14.920 1.00 0.00 N ATOM 638 CA PRO A 38 -21.983 -8.641 15.154 1.00 0.00 C ATOM 639 C PRO A 38 -22.291 -8.445 16.638 1.00 0.00 C ATOM 640 O PRO A 38 -21.479 -8.759 17.511 1.00 0.00 O ATOM 641 CB PRO A 38 -23.072 -9.506 14.497 1.00 0.00 C ATOM 642 CG PRO A 38 -22.371 -10.698 13.922 1.00 0.00 C ATOM 643 CD PRO A 38 -21.042 -10.786 14.610 1.00 0.00 C ATOM 0 HA PRO A 38 -21.913 -7.633 14.746 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -23.821 -9.810 15.228 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -23.594 -8.949 13.719 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -22.953 -11.605 14.085 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -22.243 -10.590 12.845 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -21.091 -11.399 15.510 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -20.280 -11.225 13.966 1.00 0.00 H new ATOM 651 N ILE A 39 -23.485 -7.942 16.908 1.00 0.00 N ATOM 652 CA ILE A 39 -23.906 -7.633 18.260 1.00 0.00 C ATOM 653 C ILE A 39 -24.478 -8.860 18.960 1.00 0.00 C ATOM 654 O ILE A 39 -24.789 -9.864 18.317 1.00 0.00 O ATOM 655 CB ILE A 39 -24.938 -6.473 18.289 1.00 0.00 C ATOM 656 CG1 ILE A 39 -25.992 -6.593 17.171 1.00 0.00 C ATOM 657 CG2 ILE A 39 -24.222 -5.133 18.191 1.00 0.00 C ATOM 658 CD1 ILE A 39 -26.993 -7.716 17.357 1.00 0.00 C ATOM 0 H ILE A 39 -24.186 -7.738 16.196 1.00 0.00 H new ATOM 0 HA ILE A 39 -23.016 -7.311 18.800 1.00 0.00 H new ATOM 0 HB ILE A 39 -25.468 -6.538 19.239 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -26.534 -5.650 17.100 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -25.478 -6.737 16.221 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -24.955 -4.326 18.212 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -23.538 -5.024 19.032 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -23.660 -5.088 17.258 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -27.693 -7.721 16.522 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -26.467 -8.670 17.395 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -27.540 -7.566 18.288 1.00 0.00 H new ATOM 670 N ASP A 40 -24.594 -8.775 20.275 1.00 0.00 N ATOM 671 CA ASP A 40 -25.149 -9.856 21.077 1.00 0.00 C ATOM 672 C ASP A 40 -26.627 -9.589 21.365 1.00 0.00 C ATOM 673 O ASP A 40 -27.109 -8.476 21.155 1.00 0.00 O ATOM 674 CB ASP A 40 -24.360 -9.994 22.384 1.00 0.00 C ATOM 675 CG ASP A 40 -24.731 -11.233 23.165 1.00 0.00 C ATOM 676 OD1 ASP A 40 -24.558 -12.347 22.630 1.00 0.00 O ATOM 677 OD2 ASP A 40 -25.196 -11.099 24.313 1.00 0.00 O ATOM 0 H ASP A 40 -24.308 -7.959 20.816 1.00 0.00 H new ATOM 0 HA ASP A 40 -25.069 -10.791 20.523 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -23.294 -10.018 22.158 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -24.535 -9.114 23.003 1.00 0.00 H new ATOM 682 N LEU A 41 -27.335 -10.602 21.844 1.00 0.00 N ATOM 683 CA LEU A 41 -28.773 -10.496 22.081 1.00 0.00 C ATOM 684 C LEU A 41 -29.079 -9.715 23.359 1.00 0.00 C ATOM 685 O LEU A 41 -28.195 -9.486 24.189 1.00 0.00 O ATOM 686 CB LEU A 41 -29.394 -11.889 22.163 1.00 0.00 C ATOM 687 CG LEU A 41 -29.216 -12.749 20.913 1.00 0.00 C ATOM 688 CD1 LEU A 41 -29.797 -14.133 21.140 1.00 0.00 C ATOM 689 CD2 LEU A 41 -29.871 -12.087 19.707 1.00 0.00 C ATOM 0 H LEU A 41 -26.937 -11.512 22.078 1.00 0.00 H new ATOM 0 HA LEU A 41 -29.208 -9.951 21.243 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -28.959 -12.415 23.013 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -30.460 -11.784 22.365 1.00 0.00 H new ATOM 0 HG LEU A 41 -28.149 -12.847 20.711 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -29.664 -14.735 20.242 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -29.285 -14.610 21.976 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -30.860 -14.049 21.366 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -29.733 -12.716 18.827 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -30.937 -11.958 19.897 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -29.413 -11.113 19.533 1.00 0.00 H new ATOM 701 N GLY A 42 -30.339 -9.324 23.515 1.00 0.00 N ATOM 702 CA GLY A 42 -30.740 -8.547 24.668 1.00 0.00 C ATOM 703 C GLY A 42 -31.443 -9.383 25.720 1.00 0.00 C ATOM 704 O GLY A 42 -31.119 -10.556 25.915 1.00 0.00 O ATOM 0 H GLY A 42 -31.091 -9.534 22.859 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -29.860 -8.079 25.110 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -31.402 -7.743 24.347 1.00 0.00 H new ATOM 708 N GLU A 43 -32.415 -8.782 26.386 1.00 0.00 N ATOM 709 CA GLU A 43 -33.101 -9.413 27.494 1.00 0.00 C ATOM 710 C GLU A 43 -34.614 -9.202 27.399 1.00 0.00 C ATOM 711 O GLU A 43 -35.075 -8.265 26.740 1.00 0.00 O ATOM 712 CB GLU A 43 -32.562 -8.829 28.796 1.00 0.00 C ATOM 713 CG GLU A 43 -32.472 -7.311 28.794 1.00 0.00 C ATOM 714 CD GLU A 43 -31.733 -6.768 29.998 1.00 0.00 C ATOM 715 OE1 GLU A 43 -30.482 -6.741 29.970 1.00 0.00 O ATOM 716 OE2 GLU A 43 -32.392 -6.361 30.974 1.00 0.00 O ATOM 0 H GLU A 43 -32.749 -7.842 26.171 1.00 0.00 H new ATOM 0 HA GLU A 43 -32.920 -10.487 27.465 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -33.203 -9.145 29.619 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -31.572 -9.243 28.987 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -31.968 -6.982 27.885 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -33.478 -6.892 28.771 1.00 0.00 H new ATOM 723 N PRO A 44 -35.407 -10.082 28.038 1.00 0.00 N ATOM 724 CA PRO A 44 -36.869 -9.971 28.043 1.00 0.00 C ATOM 725 C PRO A 44 -37.376 -8.870 28.976 1.00 0.00 C ATOM 726 O PRO A 44 -36.592 -8.173 29.626 1.00 0.00 O ATOM 727 CB PRO A 44 -37.320 -11.347 28.536 1.00 0.00 C ATOM 728 CG PRO A 44 -36.201 -11.829 29.392 1.00 0.00 C ATOM 729 CD PRO A 44 -34.939 -11.261 28.797 1.00 0.00 C ATOM 0 HA PRO A 44 -37.261 -9.701 27.062 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -38.250 -11.280 29.101 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -37.502 -12.026 27.703 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -36.329 -11.497 30.422 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -36.166 -12.918 29.410 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -34.223 -10.981 29.570 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -34.442 -11.983 28.149 1.00 0.00 H new ATOM 737 N VAL A 45 -38.695 -8.725 29.043 1.00 0.00 N ATOM 738 CA VAL A 45 -39.319 -7.703 29.877 1.00 0.00 C ATOM 739 C VAL A 45 -39.901 -8.346 31.138 1.00 0.00 C ATOM 740 O VAL A 45 -40.208 -9.539 31.143 1.00 0.00 O ATOM 741 CB VAL A 45 -40.444 -6.965 29.115 1.00 0.00 C ATOM 742 CG1 VAL A 45 -40.839 -5.683 29.830 1.00 0.00 C ATOM 743 CG2 VAL A 45 -40.030 -6.680 27.677 1.00 0.00 C ATOM 0 H VAL A 45 -39.356 -9.306 28.527 1.00 0.00 H new ATOM 0 HA VAL A 45 -38.552 -6.978 30.148 1.00 0.00 H new ATOM 0 HB VAL A 45 -41.317 -7.618 29.092 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -41.632 -5.185 29.272 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -41.195 -5.920 30.833 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -39.974 -5.023 29.899 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -40.838 -6.160 27.162 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -39.136 -6.056 27.673 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -39.819 -7.619 27.166 1.00 0.00 H new ATOM 753 N SER A 46 -40.052 -7.558 32.193 1.00 0.00 N ATOM 754 CA SER A 46 -40.549 -8.056 33.462 1.00 0.00 C ATOM 755 C SER A 46 -42.023 -7.698 33.650 1.00 0.00 C ATOM 756 O SER A 46 -42.673 -7.187 32.733 1.00 0.00 O ATOM 757 CB SER A 46 -39.715 -7.463 34.592 1.00 0.00 C ATOM 758 OG SER A 46 -38.345 -7.821 34.461 1.00 0.00 O ATOM 0 H SER A 46 -39.834 -6.562 32.191 1.00 0.00 H new ATOM 0 HA SER A 46 -40.465 -9.143 33.474 1.00 0.00 H new ATOM 0 HB2 SER A 46 -39.812 -6.377 34.588 1.00 0.00 H new ATOM 0 HB3 SER A 46 -40.095 -7.814 35.551 1.00 0.00 H new ATOM 0 HG SER A 46 -37.832 -7.427 35.197 1.00 0.00 H new ATOM 764 N VAL A 47 -42.544 -7.976 34.839 1.00 0.00 N ATOM 765 CA VAL A 47 -43.931 -7.681 35.160 1.00 0.00 C ATOM 766 C VAL A 47 -44.009 -6.549 36.182 1.00 0.00 C ATOM 767 O VAL A 47 -43.366 -6.598 37.232 1.00 0.00 O ATOM 768 CB VAL A 47 -44.662 -8.923 35.717 1.00 0.00 C ATOM 769 CG1 VAL A 47 -46.143 -8.636 35.931 1.00 0.00 C ATOM 770 CG2 VAL A 47 -44.477 -10.117 34.792 1.00 0.00 C ATOM 0 H VAL A 47 -42.021 -8.408 35.600 1.00 0.00 H new ATOM 0 HA VAL A 47 -44.422 -7.378 34.235 1.00 0.00 H new ATOM 0 HB VAL A 47 -44.221 -9.165 36.684 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -46.633 -9.527 36.323 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -46.256 -7.817 36.641 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -46.601 -8.358 34.981 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -45.000 -10.980 35.203 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -44.883 -9.882 33.808 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -43.415 -10.345 34.701 1.00 0.00 H new ATOM 780 N GLU A 48 -44.796 -5.535 35.859 1.00 0.00 N ATOM 781 CA GLU A 48 -44.959 -4.375 36.721 1.00 0.00 C ATOM 782 C GLU A 48 -46.216 -4.502 37.568 1.00 0.00 C ATOM 783 O GLU A 48 -47.032 -5.402 37.362 1.00 0.00 O ATOM 784 CB GLU A 48 -45.037 -3.089 35.885 1.00 0.00 C ATOM 785 CG GLU A 48 -43.702 -2.619 35.317 1.00 0.00 C ATOM 786 CD GLU A 48 -43.024 -3.641 34.425 1.00 0.00 C ATOM 787 OE1 GLU A 48 -43.644 -4.079 33.433 1.00 0.00 O ATOM 788 OE2 GLU A 48 -41.859 -3.993 34.703 1.00 0.00 O ATOM 0 H GLU A 48 -45.338 -5.493 34.996 1.00 0.00 H new ATOM 0 HA GLU A 48 -44.091 -4.325 37.379 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -45.732 -3.249 35.060 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -45.454 -2.294 36.503 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -43.862 -1.703 34.748 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -43.034 -2.370 36.142 1.00 0.00 H new ATOM 795 N GLU A 49 -46.366 -3.582 38.505 1.00 0.00 N ATOM 796 CA GLU A 49 -47.537 -3.533 39.368 1.00 0.00 C ATOM 797 C GLU A 49 -48.661 -2.768 38.690 1.00 0.00 C ATOM 798 O GLU A 49 -49.833 -2.923 39.028 1.00 0.00 O ATOM 799 CB GLU A 49 -47.213 -2.912 40.737 1.00 0.00 C ATOM 800 CG GLU A 49 -46.577 -1.527 40.679 1.00 0.00 C ATOM 801 CD GLU A 49 -45.127 -1.571 40.250 1.00 0.00 C ATOM 802 OE1 GLU A 49 -44.255 -1.784 41.113 1.00 0.00 O ATOM 803 OE2 GLU A 49 -44.851 -1.407 39.044 1.00 0.00 O ATOM 0 H GLU A 49 -45.682 -2.848 38.690 1.00 0.00 H new ATOM 0 HA GLU A 49 -47.860 -4.559 39.543 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -48.133 -2.849 41.318 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -46.542 -3.582 41.274 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -47.139 -0.902 39.985 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -46.648 -1.057 41.660 1.00 0.00 H new ATOM 810 N ILE A 50 -48.285 -1.913 37.751 1.00 0.00 N ATOM 811 CA ILE A 50 -49.252 -1.132 36.988 1.00 0.00 C ATOM 812 C ILE A 50 -50.038 -2.040 36.032 1.00 0.00 C ATOM 813 O ILE A 50 -51.093 -1.673 35.513 1.00 0.00 O ATOM 814 CB ILE A 50 -48.555 -0.006 36.186 1.00 0.00 C ATOM 815 CG1 ILE A 50 -47.609 0.791 37.093 1.00 0.00 C ATOM 816 CG2 ILE A 50 -49.576 0.924 35.537 1.00 0.00 C ATOM 817 CD1 ILE A 50 -48.294 1.440 38.276 1.00 0.00 C ATOM 0 H ILE A 50 -47.312 -1.741 37.497 1.00 0.00 H new ATOM 0 HA ILE A 50 -49.942 -0.673 37.697 1.00 0.00 H new ATOM 0 HB ILE A 50 -47.972 -0.472 35.392 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -46.827 0.126 37.459 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -47.119 1.564 36.501 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -49.056 1.704 34.981 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -50.207 0.353 34.856 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -50.195 1.380 36.309 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -47.559 1.984 38.868 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -49.057 2.132 37.920 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -48.760 0.672 38.893 1.00 0.00 H new ATOM 829 N LYS A 51 -49.512 -3.236 35.830 1.00 0.00 N ATOM 830 CA LYS A 51 -50.167 -4.254 35.048 1.00 0.00 C ATOM 831 C LYS A 51 -51.238 -4.928 35.900 1.00 0.00 C ATOM 832 O LYS A 51 -51.123 -4.950 37.124 1.00 0.00 O ATOM 833 CB LYS A 51 -49.112 -5.242 34.559 1.00 0.00 C ATOM 834 CG LYS A 51 -48.278 -4.687 33.408 1.00 0.00 C ATOM 835 CD LYS A 51 -47.049 -5.536 33.111 1.00 0.00 C ATOM 836 CE LYS A 51 -46.284 -4.989 31.910 1.00 0.00 C ATOM 837 NZ LYS A 51 -44.954 -5.635 31.731 1.00 0.00 N ATOM 0 H LYS A 51 -48.610 -3.524 36.210 1.00 0.00 H new ATOM 0 HA LYS A 51 -50.663 -3.826 34.176 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -48.453 -5.504 35.387 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -49.602 -6.161 34.238 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -48.897 -4.625 32.513 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -47.964 -3.672 33.649 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -46.397 -5.556 33.984 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -47.352 -6.565 32.916 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -46.879 -5.136 31.008 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -46.148 -3.914 32.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -44.590 -5.422 30.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -44.292 -5.270 32.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -45.050 -6.665 31.842 1.00 0.00 H new ATOM 1211 N ILE B 4 2.481 -12.589 3.584 1.00 0.00 N ATOM 1212 CA ILE B 4 1.940 -11.553 2.749 1.00 0.00 C ATOM 1213 C ILE B 4 2.759 -11.418 1.477 1.00 0.00 C ATOM 1214 O ILE B 4 3.987 -11.534 1.499 1.00 0.00 O ATOM 1215 CB ILE B 4 1.896 -10.194 3.478 1.00 0.00 C ATOM 1216 CG1 ILE B 4 3.303 -9.651 3.788 1.00 0.00 C ATOM 1217 CG2 ILE B 4 1.068 -10.293 4.751 1.00 0.00 C ATOM 1218 CD1 ILE B 4 4.046 -10.350 4.914 1.00 0.00 C ATOM 0 HA ILE B 4 0.918 -11.839 2.500 1.00 0.00 H new ATOM 0 HB ILE B 4 1.420 -9.484 2.802 1.00 0.00 H new ATOM 0 HG12 ILE B 4 3.906 -9.719 2.883 1.00 0.00 H new ATOM 0 HG13 ILE B 4 3.218 -8.593 4.036 1.00 0.00 H new ATOM 0 HG21 ILE B 4 1.050 -9.324 5.250 1.00 0.00 H new ATOM 0 HG22 ILE B 4 0.050 -10.591 4.501 1.00 0.00 H new ATOM 0 HG23 ILE B 4 1.510 -11.035 5.416 1.00 0.00 H new ATOM 0 HD11 ILE B 4 5.024 -9.888 5.047 1.00 0.00 H new ATOM 0 HD12 ILE B 4 3.474 -10.261 5.838 1.00 0.00 H new ATOM 0 HD13 ILE B 4 4.173 -11.404 4.667 1.00 0.00 H new ATOM 1230 N ILE B 5 2.080 -11.207 0.369 1.00 0.00 N ATOM 1231 CA ILE B 5 2.736 -11.000 -0.892 1.00 0.00 C ATOM 1232 C ILE B 5 2.755 -9.519 -1.245 1.00 0.00 C ATOM 1233 O ILE B 5 2.017 -8.719 -0.656 1.00 0.00 O ATOM 1234 CB ILE B 5 2.014 -11.771 -2.004 1.00 0.00 C ATOM 1235 CG1 ILE B 5 0.562 -11.302 -2.114 1.00 0.00 C ATOM 1236 CG2 ILE B 5 2.091 -13.276 -1.760 1.00 0.00 C ATOM 1237 CD1 ILE B 5 -0.128 -11.756 -3.376 1.00 0.00 C ATOM 0 H ILE B 5 1.062 -11.175 0.323 1.00 0.00 H new ATOM 0 HA ILE B 5 3.759 -11.364 -0.804 1.00 0.00 H new ATOM 0 HB ILE B 5 2.513 -11.565 -2.951 1.00 0.00 H new ATOM 0 HG12 ILE B 5 0.004 -11.670 -1.253 1.00 0.00 H new ATOM 0 HG13 ILE B 5 0.537 -10.213 -2.068 1.00 0.00 H new ATOM 0 HG21 ILE B 5 1.572 -13.802 -2.562 1.00 0.00 H new ATOM 0 HG22 ILE B 5 3.135 -13.588 -1.738 1.00 0.00 H new ATOM 0 HG23 ILE B 5 1.621 -13.514 -0.806 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -1.153 -11.386 -3.384 1.00 0.00 H new ATOM 0 HD12 ILE B 5 0.405 -11.366 -4.243 1.00 0.00 H new ATOM 0 HD13 ILE B 5 -0.135 -12.845 -3.415 1.00 0.00 H new ATOM 1249 N GLU B 6 3.599 -9.159 -2.197 1.00 0.00 N ATOM 1250 CA GLU B 6 3.661 -7.793 -2.675 1.00 0.00 C ATOM 1251 C GLU B 6 3.199 -7.729 -4.122 1.00 0.00 C ATOM 1252 O GLU B 6 3.220 -8.738 -4.823 1.00 0.00 O ATOM 1253 CB GLU B 6 5.084 -7.250 -2.548 1.00 0.00 C ATOM 1254 CG GLU B 6 5.593 -7.201 -1.114 1.00 0.00 C ATOM 1255 CD GLU B 6 6.912 -6.463 -0.987 1.00 0.00 C ATOM 1256 OE1 GLU B 6 7.670 -6.394 -1.979 1.00 0.00 O ATOM 1257 OE2 GLU B 6 7.190 -5.919 0.104 1.00 0.00 O ATOM 0 H GLU B 6 4.251 -9.797 -2.653 1.00 0.00 H new ATOM 0 HA GLU B 6 3.000 -7.176 -2.066 1.00 0.00 H new ATOM 0 HB2 GLU B 6 5.755 -7.871 -3.142 1.00 0.00 H new ATOM 0 HB3 GLU B 6 5.120 -6.246 -2.972 1.00 0.00 H new ATOM 0 HG2 GLU B 6 4.847 -6.715 -0.484 1.00 0.00 H new ATOM 0 HG3 GLU B 6 5.713 -8.218 -0.740 1.00 0.00 H new ATOM 1264 N ALA B 7 2.762 -6.559 -4.560 1.00 0.00 N ATOM 1265 CA ALA B 7 2.346 -6.364 -5.942 1.00 0.00 C ATOM 1266 C ALA B 7 2.737 -4.973 -6.426 1.00 0.00 C ATOM 1267 O ALA B 7 2.936 -4.063 -5.623 1.00 0.00 O ATOM 1268 CB ALA B 7 0.843 -6.581 -6.089 1.00 0.00 C ATOM 0 H ALA B 7 2.686 -5.726 -3.976 1.00 0.00 H new ATOM 0 HA ALA B 7 2.858 -7.101 -6.561 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.554 -6.430 -7.129 1.00 0.00 H new ATOM 0 HB2 ALA B 7 0.591 -7.597 -5.786 1.00 0.00 H new ATOM 0 HB3 ALA B 7 0.309 -5.871 -5.457 1.00 0.00 H new ATOM 1274 N VAL B 8 2.878 -4.828 -7.738 1.00 0.00 N ATOM 1275 CA VAL B 8 3.164 -3.549 -8.343 1.00 0.00 C ATOM 1276 C VAL B 8 1.998 -3.098 -9.222 1.00 0.00 C ATOM 1277 O VAL B 8 1.527 -3.834 -10.093 1.00 0.00 O ATOM 1278 CB VAL B 8 4.465 -3.584 -9.167 1.00 0.00 C ATOM 1279 CG1 VAL B 8 5.671 -3.663 -8.249 1.00 0.00 C ATOM 1280 CG2 VAL B 8 4.465 -4.745 -10.151 1.00 0.00 C ATOM 0 H VAL B 8 2.796 -5.596 -8.404 1.00 0.00 H new ATOM 0 HA VAL B 8 3.300 -2.831 -7.534 1.00 0.00 H new ATOM 0 HB VAL B 8 4.523 -2.660 -9.742 1.00 0.00 H new ATOM 0 HG11 VAL B 8 6.582 -3.687 -8.847 1.00 0.00 H new ATOM 0 HG12 VAL B 8 5.689 -2.791 -7.595 1.00 0.00 H new ATOM 0 HG13 VAL B 8 5.610 -4.568 -7.645 1.00 0.00 H new ATOM 0 HG21 VAL B 8 5.396 -4.742 -10.717 1.00 0.00 H new ATOM 0 HG22 VAL B 8 4.375 -5.684 -9.605 1.00 0.00 H new ATOM 0 HG23 VAL B 8 3.624 -4.641 -10.836 1.00 0.00 H new ATOM 1290 N TYR B 9 1.529 -1.893 -8.956 1.00 0.00 N ATOM 1291 CA TYR B 9 0.407 -1.297 -9.677 1.00 0.00 C ATOM 1292 C TYR B 9 0.903 -0.478 -10.852 1.00 0.00 C ATOM 1293 O TYR B 9 1.514 0.572 -10.679 1.00 0.00 O ATOM 1294 CB TYR B 9 -0.372 -0.414 -8.706 1.00 0.00 C ATOM 1295 CG TYR B 9 -1.679 0.147 -9.230 1.00 0.00 C ATOM 1296 CD1 TYR B 9 -2.787 -0.669 -9.380 1.00 0.00 C ATOM 1297 CD2 TYR B 9 -1.819 1.498 -9.517 1.00 0.00 C ATOM 1298 CE1 TYR B 9 -3.997 -0.164 -9.800 1.00 0.00 C ATOM 1299 CE2 TYR B 9 -3.028 2.012 -9.950 1.00 0.00 C ATOM 1300 CZ TYR B 9 -4.114 1.176 -10.085 1.00 0.00 C ATOM 1301 OH TYR B 9 -5.330 1.682 -10.495 1.00 0.00 O ATOM 0 H TYR B 9 1.915 -1.291 -8.229 1.00 0.00 H new ATOM 0 HA TYR B 9 -0.239 -2.082 -10.069 1.00 0.00 H new ATOM 0 HB2 TYR B 9 -0.581 -0.992 -7.806 1.00 0.00 H new ATOM 0 HB3 TYR B 9 0.266 0.418 -8.409 1.00 0.00 H new ATOM 0 HD1 TYR B 9 -2.701 -1.723 -9.163 1.00 0.00 H new ATOM 0 HD2 TYR B 9 -0.972 2.157 -9.401 1.00 0.00 H new ATOM 0 HE1 TYR B 9 -4.850 -0.817 -9.905 1.00 0.00 H new ATOM 0 HE2 TYR B 9 -3.120 3.063 -10.181 1.00 0.00 H new ATOM 0 HH TYR B 9 -6.054 1.155 -10.098 1.00 0.00 H new ATOM 1311 N GLU B 10 0.658 -0.986 -12.041 1.00 0.00 N ATOM 1312 CA GLU B 10 0.995 -0.292 -13.261 1.00 0.00 C ATOM 1313 C GLU B 10 -0.202 -0.268 -14.198 1.00 0.00 C ATOM 1314 O GLU B 10 -0.887 -1.271 -14.346 1.00 0.00 O ATOM 1315 CB GLU B 10 2.177 -0.974 -13.946 1.00 0.00 C ATOM 1316 CG GLU B 10 1.946 -2.437 -14.291 1.00 0.00 C ATOM 1317 CD GLU B 10 3.024 -2.996 -15.195 1.00 0.00 C ATOM 1318 OE1 GLU B 10 4.074 -3.430 -14.683 1.00 0.00 O ATOM 1319 OE2 GLU B 10 2.822 -3.019 -16.428 1.00 0.00 O ATOM 0 H GLU B 10 0.218 -1.895 -12.187 1.00 0.00 H new ATOM 0 HA GLU B 10 1.272 0.733 -13.014 1.00 0.00 H new ATOM 0 HB2 GLU B 10 2.414 -0.431 -14.861 1.00 0.00 H new ATOM 0 HB3 GLU B 10 3.049 -0.900 -13.297 1.00 0.00 H new ATOM 0 HG2 GLU B 10 1.907 -3.022 -13.372 1.00 0.00 H new ATOM 0 HG3 GLU B 10 0.977 -2.544 -14.778 1.00 0.00 H new ATOM 1326 N ASN B 11 -0.464 0.893 -14.790 1.00 0.00 N ATOM 1327 CA ASN B 11 -1.497 1.038 -15.820 1.00 0.00 C ATOM 1328 C ASN B 11 -2.898 0.790 -15.261 1.00 0.00 C ATOM 1329 O ASN B 11 -3.858 0.634 -16.011 1.00 0.00 O ATOM 1330 CB ASN B 11 -1.213 0.081 -16.984 1.00 0.00 C ATOM 1331 CG ASN B 11 -1.818 0.544 -18.294 1.00 0.00 C ATOM 1332 OD1 ASN B 11 -2.950 0.197 -18.632 1.00 0.00 O ATOM 1333 ND2 ASN B 11 -1.065 1.328 -19.047 1.00 0.00 N ATOM 0 H ASN B 11 0.029 1.759 -14.573 1.00 0.00 H new ATOM 0 HA ASN B 11 -1.466 2.067 -16.179 1.00 0.00 H new ATOM 0 HB2 ASN B 11 -0.135 -0.024 -17.105 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -1.604 -0.906 -16.739 1.00 0.00 H new ATOM 0 HD21 ASN B 11 -1.417 1.667 -19.942 1.00 0.00 H new ATOM 0 HD22 ASN B 11 -0.132 1.594 -18.733 1.00 0.00 H new ATOM 1340 N GLY B 12 -3.017 0.784 -13.941 1.00 0.00 N ATOM 1341 CA GLY B 12 -4.293 0.485 -13.318 1.00 0.00 C ATOM 1342 C GLY B 12 -4.407 -0.980 -12.946 1.00 0.00 C ATOM 1343 O GLY B 12 -5.478 -1.457 -12.571 1.00 0.00 O ATOM 0 H GLY B 12 -2.256 0.980 -13.291 1.00 0.00 H new ATOM 0 HA2 GLY B 12 -4.414 1.098 -12.425 1.00 0.00 H new ATOM 0 HA3 GLY B 12 -5.101 0.751 -13.999 1.00 0.00 H new ATOM 1347 N VAL B 13 -3.287 -1.677 -13.032 1.00 0.00 N ATOM 1348 CA VAL B 13 -3.233 -3.104 -12.743 1.00 0.00 C ATOM 1349 C VAL B 13 -2.392 -3.360 -11.515 1.00 0.00 C ATOM 1350 O VAL B 13 -1.387 -2.695 -11.318 1.00 0.00 O ATOM 1351 CB VAL B 13 -2.542 -3.864 -13.880 1.00 0.00 C ATOM 1352 CG1 VAL B 13 -2.714 -5.366 -13.722 1.00 0.00 C ATOM 1353 CG2 VAL B 13 -3.032 -3.399 -15.243 1.00 0.00 C ATOM 0 H VAL B 13 -2.390 -1.273 -13.303 1.00 0.00 H new ATOM 0 HA VAL B 13 -4.262 -3.437 -12.608 1.00 0.00 H new ATOM 0 HB VAL B 13 -1.477 -3.640 -13.820 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -2.213 -5.878 -14.544 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -2.277 -5.685 -12.776 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -3.775 -5.614 -13.733 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -2.520 -3.960 -16.025 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -4.106 -3.567 -15.320 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -2.821 -2.336 -15.362 1.00 0.00 H new ATOM 1363 N PHE B 14 -2.769 -4.331 -10.710 1.00 0.00 N ATOM 1364 CA PHE B 14 -1.878 -4.807 -9.666 1.00 0.00 C ATOM 1365 C PHE B 14 -1.313 -6.168 -10.064 1.00 0.00 C ATOM 1366 O PHE B 14 -2.053 -7.144 -10.203 1.00 0.00 O ATOM 1367 CB PHE B 14 -2.596 -4.950 -8.324 1.00 0.00 C ATOM 1368 CG PHE B 14 -2.834 -3.680 -7.561 1.00 0.00 C ATOM 1369 CD1 PHE B 14 -1.789 -3.035 -6.930 1.00 0.00 C ATOM 1370 CD2 PHE B 14 -4.111 -3.151 -7.446 1.00 0.00 C ATOM 1371 CE1 PHE B 14 -2.004 -1.874 -6.208 1.00 0.00 C ATOM 1372 CE2 PHE B 14 -4.335 -1.990 -6.721 1.00 0.00 C ATOM 1373 CZ PHE B 14 -3.278 -1.351 -6.102 1.00 0.00 C ATOM 0 H PHE B 14 -3.672 -4.802 -10.754 1.00 0.00 H new ATOM 0 HA PHE B 14 -1.081 -4.072 -9.553 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -3.559 -5.429 -8.500 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -2.015 -5.624 -7.695 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -0.791 -3.442 -7.001 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -4.940 -3.649 -7.926 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -1.175 -1.376 -5.727 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -5.334 -1.586 -6.641 1.00 0.00 H new ATOM 0 HZ PHE B 14 -3.447 -0.446 -5.537 1.00 0.00 H new ATOM 1383 N LYS B 15 -0.008 -6.231 -10.247 1.00 0.00 N ATOM 1384 CA LYS B 15 0.667 -7.481 -10.540 1.00 0.00 C ATOM 1385 C LYS B 15 1.618 -7.823 -9.410 1.00 0.00 C ATOM 1386 O LYS B 15 2.540 -7.063 -9.136 1.00 0.00 O ATOM 1387 CB LYS B 15 1.464 -7.369 -11.830 1.00 0.00 C ATOM 1388 CG LYS B 15 0.623 -7.247 -13.086 1.00 0.00 C ATOM 1389 CD LYS B 15 1.504 -7.223 -14.324 1.00 0.00 C ATOM 1390 CE LYS B 15 2.577 -6.154 -14.211 1.00 0.00 C ATOM 1391 NZ LYS B 15 3.446 -6.091 -15.418 1.00 0.00 N ATOM 0 H LYS B 15 0.611 -5.422 -10.197 1.00 0.00 H new ATOM 0 HA LYS B 15 -0.087 -8.261 -10.649 1.00 0.00 H new ATOM 0 HB2 LYS B 15 2.119 -6.501 -11.762 1.00 0.00 H new ATOM 0 HB3 LYS B 15 2.105 -8.246 -11.922 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -0.073 -8.083 -13.146 1.00 0.00 H new ATOM 0 HG3 LYS B 15 0.025 -6.337 -13.042 1.00 0.00 H new ATOM 0 HD2 LYS B 15 1.971 -8.198 -14.461 1.00 0.00 H new ATOM 0 HD3 LYS B 15 0.892 -7.036 -15.206 1.00 0.00 H new ATOM 0 HE2 LYS B 15 2.104 -5.184 -14.056 1.00 0.00 H new ATOM 0 HE3 LYS B 15 3.193 -6.353 -13.334 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 4.084 -5.273 -15.344 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 4.008 -6.963 -15.487 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 2.854 -5.993 -16.267 1.00 0.00 H new ATOM 1405 N PRO B 16 1.400 -8.948 -8.723 1.00 0.00 N ATOM 1406 CA PRO B 16 2.255 -9.348 -7.613 1.00 0.00 C ATOM 1407 C PRO B 16 3.716 -9.511 -7.995 1.00 0.00 C ATOM 1408 O PRO B 16 4.090 -9.541 -9.170 1.00 0.00 O ATOM 1409 CB PRO B 16 1.709 -10.709 -7.173 1.00 0.00 C ATOM 1410 CG PRO B 16 0.372 -10.861 -7.821 1.00 0.00 C ATOM 1411 CD PRO B 16 0.288 -9.870 -8.950 1.00 0.00 C ATOM 0 HA PRO B 16 2.235 -8.580 -6.840 1.00 0.00 H new ATOM 0 HB2 PRO B 16 2.380 -11.512 -7.476 1.00 0.00 H new ATOM 0 HB3 PRO B 16 1.622 -10.759 -6.088 1.00 0.00 H new ATOM 0 HG2 PRO B 16 0.243 -11.877 -8.195 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -0.424 -10.684 -7.098 1.00 0.00 H new ATOM 0 HD2 PRO B 16 0.376 -10.365 -9.917 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -0.668 -9.346 -8.945 1.00 0.00 H new ATOM 1419 N LEU B 17 4.514 -9.677 -6.973 1.00 0.00 N ATOM 1420 CA LEU B 17 5.890 -10.036 -7.105 1.00 0.00 C ATOM 1421 C LEU B 17 5.993 -11.433 -6.577 1.00 0.00 C ATOM 1422 O LEU B 17 5.892 -11.639 -5.380 1.00 0.00 O ATOM 1423 CB LEU B 17 6.822 -9.095 -6.328 1.00 0.00 C ATOM 1424 CG LEU B 17 6.929 -7.668 -6.870 1.00 0.00 C ATOM 1425 CD1 LEU B 17 5.766 -6.822 -6.393 1.00 0.00 C ATOM 1426 CD2 LEU B 17 8.247 -7.044 -6.453 1.00 0.00 C ATOM 0 H LEU B 17 4.212 -9.562 -6.006 1.00 0.00 H new ATOM 0 HA LEU B 17 6.205 -9.960 -8.146 1.00 0.00 H new ATOM 0 HB2 LEU B 17 6.479 -9.046 -5.294 1.00 0.00 H new ATOM 0 HB3 LEU B 17 7.820 -9.534 -6.312 1.00 0.00 H new ATOM 0 HG LEU B 17 6.893 -7.711 -7.959 1.00 0.00 H new ATOM 0 HD11 LEU B 17 5.864 -5.812 -6.791 1.00 0.00 H new ATOM 0 HD12 LEU B 17 4.831 -7.260 -6.741 1.00 0.00 H new ATOM 0 HD13 LEU B 17 5.766 -6.784 -5.304 1.00 0.00 H new ATOM 0 HD21 LEU B 17 8.309 -6.029 -6.846 1.00 0.00 H new ATOM 0 HD22 LEU B 17 8.309 -7.017 -5.365 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.072 -7.637 -6.848 1.00 0.00 H new ATOM 1438 N GLN B 18 6.142 -12.346 -7.524 1.00 0.00 N ATOM 1439 CA GLN B 18 6.172 -13.815 -7.348 1.00 0.00 C ATOM 1440 C GLN B 18 4.765 -14.369 -7.348 1.00 0.00 C ATOM 1441 O GLN B 18 4.531 -15.564 -7.149 1.00 0.00 O ATOM 1442 CB GLN B 18 6.872 -14.254 -6.068 1.00 0.00 C ATOM 1443 CG GLN B 18 5.980 -14.242 -4.828 1.00 0.00 C ATOM 1444 CD GLN B 18 6.623 -14.833 -3.592 1.00 0.00 C ATOM 1445 OE1 GLN B 18 7.843 -14.813 -3.431 1.00 0.00 O ATOM 1446 NE2 GLN B 18 5.796 -15.351 -2.696 1.00 0.00 N ATOM 0 H GLN B 18 6.253 -12.079 -8.502 1.00 0.00 H new ATOM 0 HA GLN B 18 6.744 -14.209 -8.188 1.00 0.00 H new ATOM 0 HB2 GLN B 18 7.264 -15.261 -6.209 1.00 0.00 H new ATOM 0 HB3 GLN B 18 7.727 -13.601 -5.893 1.00 0.00 H new ATOM 0 HG2 GLN B 18 5.688 -13.214 -4.615 1.00 0.00 H new ATOM 0 HG3 GLN B 18 5.066 -14.794 -5.047 1.00 0.00 H new ATOM 0 HE21 GLN B 18 4.791 -15.348 -2.868 1.00 0.00 H new ATOM 0 HE22 GLN B 18 6.165 -15.753 -1.834 1.00 0.00 H new ATOM 1455 N LYS B 19 3.860 -13.470 -7.643 1.00 0.00 N ATOM 1456 CA LYS B 19 2.455 -13.756 -7.777 1.00 0.00 C ATOM 1457 C LYS B 19 1.918 -14.461 -6.542 1.00 0.00 C ATOM 1458 O LYS B 19 2.503 -14.384 -5.461 1.00 0.00 O ATOM 1459 CB LYS B 19 2.201 -14.575 -9.035 1.00 0.00 C ATOM 1460 CG LYS B 19 2.683 -13.908 -10.315 1.00 0.00 C ATOM 1461 CD LYS B 19 2.223 -14.674 -11.548 1.00 0.00 C ATOM 1462 CE LYS B 19 0.705 -14.690 -11.667 1.00 0.00 C ATOM 1463 NZ LYS B 19 0.139 -13.315 -11.805 1.00 0.00 N ATOM 0 H LYS B 19 4.089 -12.489 -7.801 1.00 0.00 H new ATOM 0 HA LYS B 19 1.919 -12.811 -7.870 1.00 0.00 H new ATOM 0 HB2 LYS B 19 2.695 -15.541 -8.933 1.00 0.00 H new ATOM 0 HB3 LYS B 19 1.132 -14.770 -9.119 1.00 0.00 H new ATOM 0 HG2 LYS B 19 2.307 -12.886 -10.358 1.00 0.00 H new ATOM 0 HG3 LYS B 19 3.771 -13.847 -10.308 1.00 0.00 H new ATOM 0 HD2 LYS B 19 2.653 -14.219 -12.440 1.00 0.00 H new ATOM 0 HD3 LYS B 19 2.595 -15.697 -11.501 1.00 0.00 H new ATOM 0 HE2 LYS B 19 0.416 -15.289 -12.530 1.00 0.00 H new ATOM 0 HE3 LYS B 19 0.278 -15.171 -10.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -0.891 -13.375 -11.934 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 0.349 -12.765 -10.947 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 0.564 -12.846 -12.630 1.00 0.00 H new ATOM 1477 N VAL B 20 0.799 -15.127 -6.695 1.00 0.00 N ATOM 1478 CA VAL B 20 0.158 -15.768 -5.581 1.00 0.00 C ATOM 1479 C VAL B 20 -0.620 -16.971 -6.044 1.00 0.00 C ATOM 1480 O VAL B 20 -0.873 -17.150 -7.238 1.00 0.00 O ATOM 1481 CB VAL B 20 -0.766 -14.772 -4.866 1.00 0.00 C ATOM 1482 CG1 VAL B 20 -2.042 -14.514 -5.658 1.00 0.00 C ATOM 1483 CG2 VAL B 20 -1.048 -15.197 -3.440 1.00 0.00 C ATOM 0 H VAL B 20 0.314 -15.237 -7.586 1.00 0.00 H new ATOM 0 HA VAL B 20 0.922 -16.104 -4.880 1.00 0.00 H new ATOM 0 HB VAL B 20 -0.238 -13.820 -4.811 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -2.668 -13.804 -5.118 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -1.787 -14.103 -6.635 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -2.585 -15.450 -5.789 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -1.705 -14.468 -2.966 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -1.531 -16.174 -3.440 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -0.111 -15.255 -2.886 1.00 0.00 H new ATOM 1493 N ASP B 21 -0.973 -17.791 -5.084 1.00 0.00 N ATOM 1494 CA ASP B 21 -1.721 -19.006 -5.335 1.00 0.00 C ATOM 1495 C ASP B 21 -3.189 -18.769 -5.020 1.00 0.00 C ATOM 1496 O ASP B 21 -4.010 -19.686 -4.937 1.00 0.00 O ATOM 1497 CB ASP B 21 -1.136 -20.128 -4.489 1.00 0.00 C ATOM 1498 CG ASP B 21 -1.819 -21.468 -4.702 1.00 0.00 C ATOM 1499 OD1 ASP B 21 -1.929 -21.908 -5.867 1.00 0.00 O ATOM 1500 OD2 ASP B 21 -2.213 -22.105 -3.703 1.00 0.00 O ATOM 0 H ASP B 21 -0.750 -17.636 -4.101 1.00 0.00 H new ATOM 0 HA ASP B 21 -1.648 -19.294 -6.384 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -0.075 -20.230 -4.718 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -1.210 -19.855 -3.436 1.00 0.00 H new ATOM 1505 N LEU B 22 -3.502 -17.503 -4.864 1.00 0.00 N ATOM 1506 CA LEU B 22 -4.870 -17.053 -4.761 1.00 0.00 C ATOM 1507 C LEU B 22 -5.461 -17.001 -6.156 1.00 0.00 C ATOM 1508 O LEU B 22 -4.718 -16.878 -7.128 1.00 0.00 O ATOM 1509 CB LEU B 22 -4.916 -15.681 -4.103 1.00 0.00 C ATOM 1510 CG LEU B 22 -4.348 -15.624 -2.685 1.00 0.00 C ATOM 1511 CD1 LEU B 22 -4.396 -14.201 -2.150 1.00 0.00 C ATOM 1512 CD2 LEU B 22 -5.106 -16.573 -1.766 1.00 0.00 C ATOM 0 H LEU B 22 -2.812 -16.754 -4.805 1.00 0.00 H new ATOM 0 HA LEU B 22 -5.451 -17.740 -4.145 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -4.366 -14.977 -4.727 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -5.952 -15.342 -4.077 1.00 0.00 H new ATOM 0 HG LEU B 22 -3.306 -15.942 -2.717 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -3.988 -14.178 -1.140 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -3.806 -13.550 -2.795 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -5.429 -13.854 -2.132 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -4.687 -16.518 -0.761 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -6.158 -16.288 -1.737 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -5.016 -17.592 -2.142 1.00 0.00 H new ATOM 1524 N LYS B 23 -6.773 -17.082 -6.270 1.00 0.00 N ATOM 1525 CA LYS B 23 -7.392 -17.242 -7.574 1.00 0.00 C ATOM 1526 C LYS B 23 -8.548 -16.274 -7.763 1.00 0.00 C ATOM 1527 O LYS B 23 -8.751 -15.373 -6.952 1.00 0.00 O ATOM 1528 CB LYS B 23 -7.851 -18.693 -7.780 1.00 0.00 C ATOM 1529 CG LYS B 23 -6.933 -19.498 -8.701 1.00 0.00 C ATOM 1530 CD LYS B 23 -5.516 -19.597 -8.147 1.00 0.00 C ATOM 1531 CE LYS B 23 -4.518 -20.051 -9.202 1.00 0.00 C ATOM 1532 NZ LYS B 23 -4.631 -21.502 -9.499 1.00 0.00 N ATOM 0 H LYS B 23 -7.425 -17.040 -5.487 1.00 0.00 H new ATOM 0 HA LYS B 23 -6.643 -17.008 -8.330 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -7.906 -19.189 -6.811 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -8.859 -18.692 -8.195 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.341 -20.500 -8.835 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -6.906 -19.031 -9.685 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -5.212 -18.626 -7.755 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -5.502 -20.296 -7.311 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -4.677 -19.482 -10.118 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -3.507 -19.830 -8.861 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -3.932 -21.764 -10.223 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -4.453 -22.049 -8.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -5.587 -21.711 -9.850 1.00 0.00 H new ATOM 1546 N GLU B 24 -9.295 -16.478 -8.841 1.00 0.00 N ATOM 1547 CA GLU B 24 -10.342 -15.570 -9.265 1.00 0.00 C ATOM 1548 C GLU B 24 -11.334 -15.276 -8.153 1.00 0.00 C ATOM 1549 O GLU B 24 -11.751 -16.167 -7.407 1.00 0.00 O ATOM 1550 CB GLU B 24 -11.089 -16.157 -10.456 1.00 0.00 C ATOM 1551 CG GLU B 24 -10.288 -16.211 -11.751 1.00 0.00 C ATOM 1552 CD GLU B 24 -8.983 -16.961 -11.608 1.00 0.00 C ATOM 1553 OE1 GLU B 24 -9.016 -18.167 -11.293 1.00 0.00 O ATOM 1554 OE2 GLU B 24 -7.921 -16.339 -11.795 1.00 0.00 O ATOM 0 H GLU B 24 -9.186 -17.289 -9.449 1.00 0.00 H new ATOM 0 HA GLU B 24 -9.860 -14.633 -9.543 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -11.411 -17.167 -10.203 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -11.990 -15.568 -10.627 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -10.891 -16.686 -12.525 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -10.082 -15.195 -12.087 1.00 0.00 H new ATOM 1561 N GLY B 25 -11.694 -14.014 -8.057 1.00 0.00 N ATOM 1562 CA GLY B 25 -12.687 -13.585 -7.103 1.00 0.00 C ATOM 1563 C GLY B 25 -12.117 -13.384 -5.716 1.00 0.00 C ATOM 1564 O GLY B 25 -12.871 -13.216 -4.755 1.00 0.00 O ATOM 0 H GLY B 25 -11.310 -13.265 -8.633 1.00 0.00 H new ATOM 0 HA2 GLY B 25 -13.135 -12.652 -7.446 1.00 0.00 H new ATOM 0 HA3 GLY B 25 -13.486 -14.325 -7.059 1.00 0.00 H new ATOM 1568 N GLU B 26 -10.793 -13.396 -5.598 1.00 0.00 N ATOM 1569 CA GLU B 26 -10.154 -13.239 -4.317 1.00 0.00 C ATOM 1570 C GLU B 26 -10.162 -11.772 -3.905 1.00 0.00 C ATOM 1571 O GLU B 26 -9.845 -10.899 -4.715 1.00 0.00 O ATOM 1572 CB GLU B 26 -8.737 -13.779 -4.404 1.00 0.00 C ATOM 1573 CG GLU B 26 -8.084 -13.922 -3.064 1.00 0.00 C ATOM 1574 CD GLU B 26 -8.912 -14.765 -2.121 1.00 0.00 C ATOM 1575 OE1 GLU B 26 -8.900 -16.010 -2.257 1.00 0.00 O ATOM 1576 OE2 GLU B 26 -9.600 -14.187 -1.255 1.00 0.00 O ATOM 0 H GLU B 26 -10.150 -13.514 -6.381 1.00 0.00 H new ATOM 0 HA GLU B 26 -10.698 -13.799 -3.557 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -8.753 -14.750 -4.900 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -8.138 -13.114 -5.025 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -7.100 -14.374 -3.186 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -7.930 -12.935 -2.628 1.00 0.00 H new ATOM 1583 N ARG B 27 -10.521 -11.496 -2.655 1.00 0.00 N ATOM 1584 CA ARG B 27 -10.729 -10.119 -2.233 1.00 0.00 C ATOM 1585 C ARG B 27 -9.763 -9.699 -1.133 1.00 0.00 C ATOM 1586 O ARG B 27 -9.738 -10.242 -0.013 1.00 0.00 O ATOM 1587 CB ARG B 27 -12.166 -9.911 -1.795 1.00 0.00 C ATOM 1588 CG ARG B 27 -12.557 -8.457 -1.605 1.00 0.00 C ATOM 1589 CD ARG B 27 -14.068 -8.308 -1.557 1.00 0.00 C ATOM 1590 NE ARG B 27 -14.495 -6.924 -1.354 1.00 0.00 N ATOM 1591 CZ ARG B 27 -15.685 -6.458 -1.724 1.00 0.00 C ATOM 1592 NH1 ARG B 27 -16.525 -7.232 -2.396 1.00 0.00 N ATOM 1593 NH2 ARG B 27 -16.024 -5.205 -1.444 1.00 0.00 N ATOM 0 H ARG B 27 -10.671 -12.196 -1.929 1.00 0.00 H new ATOM 0 HA ARG B 27 -10.526 -9.482 -3.094 1.00 0.00 H new ATOM 0 HB2 ARG B 27 -12.828 -10.359 -2.536 1.00 0.00 H new ATOM 0 HB3 ARG B 27 -12.329 -10.444 -0.858 1.00 0.00 H new ATOM 0 HG2 ARG B 27 -12.120 -8.075 -0.682 1.00 0.00 H new ATOM 0 HG3 ARG B 27 -12.153 -7.857 -2.421 1.00 0.00 H new ATOM 0 HD2 ARG B 27 -14.495 -8.682 -2.487 1.00 0.00 H new ATOM 0 HD3 ARG B 27 -14.464 -8.927 -0.752 1.00 0.00 H new ATOM 0 HE ARG B 27 -13.844 -6.280 -0.904 1.00 0.00 H new ATOM 0 HH11 ARG B 27 -16.260 -8.188 -2.631 1.00 0.00 H new ATOM 0 HH12 ARG B 27 -17.436 -6.871 -2.678 1.00 0.00 H new ATOM 0 HH21 ARG B 27 -15.372 -4.600 -0.945 1.00 0.00 H new ATOM 0 HH22 ARG B 27 -16.936 -4.848 -1.728 1.00 0.00 H new ATOM 1607 N VAL B 28 -9.001 -8.688 -1.475 1.00 0.00 N ATOM 1608 CA VAL B 28 -7.925 -8.191 -0.636 1.00 0.00 C ATOM 1609 C VAL B 28 -7.970 -6.671 -0.585 1.00 0.00 C ATOM 1610 O VAL B 28 -8.699 -6.045 -1.363 1.00 0.00 O ATOM 1611 CB VAL B 28 -6.549 -8.637 -1.178 1.00 0.00 C ATOM 1612 CG1 VAL B 28 -6.444 -10.157 -1.211 1.00 0.00 C ATOM 1613 CG2 VAL B 28 -6.305 -8.050 -2.561 1.00 0.00 C ATOM 0 H VAL B 28 -9.108 -8.178 -2.352 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.059 -8.602 0.364 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.779 -8.261 -0.504 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.466 -10.446 -1.596 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.568 -10.552 -0.203 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.223 -10.562 -1.858 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.331 -8.375 -2.927 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -7.082 -8.393 -3.244 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.327 -6.962 -2.503 1.00 0.00 H new ATOM 1623 N LYS B 29 -7.205 -6.072 0.317 1.00 0.00 N ATOM 1624 CA LYS B 29 -7.159 -4.634 0.403 1.00 0.00 C ATOM 1625 C LYS B 29 -5.732 -4.130 0.328 1.00 0.00 C ATOM 1626 O LYS B 29 -4.809 -4.713 0.905 1.00 0.00 O ATOM 1627 CB LYS B 29 -7.857 -4.148 1.662 1.00 0.00 C ATOM 1628 CG LYS B 29 -9.361 -4.348 1.593 1.00 0.00 C ATOM 1629 CD LYS B 29 -10.119 -3.286 2.369 1.00 0.00 C ATOM 1630 CE LYS B 29 -10.487 -3.731 3.776 1.00 0.00 C ATOM 1631 NZ LYS B 29 -11.487 -4.834 3.763 1.00 0.00 N ATOM 0 H LYS B 29 -6.616 -6.561 0.990 1.00 0.00 H new ATOM 0 HA LYS B 29 -7.695 -4.223 -0.453 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -7.460 -4.682 2.526 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -7.639 -3.091 1.812 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -9.680 -4.331 0.551 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -9.613 -5.332 1.987 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -9.512 -2.382 2.426 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -11.028 -3.026 1.826 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -9.589 -4.060 4.300 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -10.888 -2.884 4.332 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -11.973 -4.873 4.682 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.183 -4.663 3.010 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -11.004 -5.738 3.589 1.00 0.00 H new ATOM 1645 N ILE B 30 -5.568 -3.040 -0.389 1.00 0.00 N ATOM 1646 CA ILE B 30 -4.252 -2.534 -0.730 1.00 0.00 C ATOM 1647 C ILE B 30 -3.760 -1.554 0.303 1.00 0.00 C ATOM 1648 O ILE B 30 -4.433 -0.585 0.646 1.00 0.00 O ATOM 1649 CB ILE B 30 -4.219 -1.797 -2.074 1.00 0.00 C ATOM 1650 CG1 ILE B 30 -5.347 -2.244 -3.011 1.00 0.00 C ATOM 1651 CG2 ILE B 30 -2.869 -1.996 -2.741 1.00 0.00 C ATOM 1652 CD1 ILE B 30 -5.289 -3.704 -3.401 1.00 0.00 C ATOM 0 H ILE B 30 -6.339 -2.479 -0.752 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.619 -3.420 -0.780 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.373 -0.737 -1.870 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -6.304 -2.046 -2.529 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.315 -1.637 -3.916 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.853 -1.469 -3.695 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.083 -1.602 -2.096 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.700 -3.059 -2.911 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -6.122 -3.937 -4.064 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -4.349 -3.906 -3.914 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -5.354 -4.323 -2.506 1.00 0.00 H new ATOM 1664 N LYS B 31 -2.575 -1.817 0.768 1.00 0.00 N ATOM 1665 CA LYS B 31 -1.863 -0.923 1.628 1.00 0.00 C ATOM 1666 C LYS B 31 -0.557 -0.582 0.952 1.00 0.00 C ATOM 1667 O LYS B 31 0.196 -1.480 0.568 1.00 0.00 O ATOM 1668 CB LYS B 31 -1.595 -1.603 2.959 1.00 0.00 C ATOM 1669 CG LYS B 31 -1.687 -0.688 4.154 1.00 0.00 C ATOM 1670 CD LYS B 31 -2.885 -1.057 5.008 1.00 0.00 C ATOM 1671 CE LYS B 31 -2.703 -2.411 5.689 1.00 0.00 C ATOM 1672 NZ LYS B 31 -3.871 -2.778 6.540 1.00 0.00 N ATOM 0 H LYS B 31 -2.068 -2.676 0.555 1.00 0.00 H new ATOM 0 HA LYS B 31 -2.443 -0.019 1.812 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -2.306 -2.420 3.086 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -0.600 -2.048 2.933 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -0.774 -0.759 4.746 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -1.773 0.347 3.823 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -3.042 -0.288 5.765 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -3.780 -1.080 4.387 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -2.553 -3.179 4.931 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -1.802 -2.389 6.302 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -3.702 -3.704 6.981 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -4.000 -2.060 7.281 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -4.727 -2.826 5.952 1.00 0.00 H new ATOM 1686 N LEU B 32 -0.306 0.693 0.767 1.00 0.00 N ATOM 1687 CA LEU B 32 0.948 1.130 0.188 1.00 0.00 C ATOM 1688 C LEU B 32 2.007 0.950 1.248 1.00 0.00 C ATOM 1689 O LEU B 32 1.992 1.642 2.267 1.00 0.00 O ATOM 1690 CB LEU B 32 0.842 2.591 -0.242 1.00 0.00 C ATOM 1691 CG LEU B 32 -0.460 2.940 -0.967 1.00 0.00 C ATOM 1692 CD1 LEU B 32 -0.508 4.416 -1.324 1.00 0.00 C ATOM 1693 CD2 LEU B 32 -0.626 2.090 -2.214 1.00 0.00 C ATOM 0 H LEU B 32 -0.950 1.446 1.008 1.00 0.00 H new ATOM 0 HA LEU B 32 1.200 0.550 -0.700 1.00 0.00 H new ATOM 0 HB2 LEU B 32 0.935 3.225 0.640 1.00 0.00 H new ATOM 0 HB3 LEU B 32 1.682 2.828 -0.894 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.286 2.726 -0.289 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -1.444 4.636 -1.838 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -0.445 5.013 -0.414 1.00 0.00 H new ATOM 0 HD13 LEU B 32 0.330 4.660 -1.976 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -1.558 2.355 -2.713 1.00 0.00 H new ATOM 0 HD22 LEU B 32 0.211 2.268 -2.889 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -0.650 1.036 -1.936 1.00 0.00 H new ATOM 1761 N VAL B 36 9.838 -4.379 6.837 1.00 0.00 N ATOM 1762 CA VAL B 36 10.270 -4.083 8.195 1.00 0.00 C ATOM 1763 C VAL B 36 11.758 -3.770 8.217 1.00 0.00 C ATOM 1764 O VAL B 36 12.513 -4.220 7.351 1.00 0.00 O ATOM 1765 CB VAL B 36 9.957 -5.255 9.158 1.00 0.00 C ATOM 1766 CG1 VAL B 36 10.719 -6.511 8.759 1.00 0.00 C ATOM 1767 CG2 VAL B 36 10.245 -4.875 10.607 1.00 0.00 C ATOM 0 HA VAL B 36 9.715 -3.210 8.539 1.00 0.00 H new ATOM 0 HB VAL B 36 8.892 -5.471 9.079 1.00 0.00 H new ATOM 0 HG11 VAL B 36 10.480 -7.317 9.452 1.00 0.00 H new ATOM 0 HG12 VAL B 36 10.433 -6.804 7.749 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.790 -6.312 8.790 1.00 0.00 H new ATOM 0 HG21 VAL B 36 10.015 -5.719 11.257 1.00 0.00 H new ATOM 0 HG22 VAL B 36 11.298 -4.612 10.712 1.00 0.00 H new ATOM 0 HG23 VAL B 36 9.628 -4.021 10.889 1.00 0.00 H new ATOM 1777 N GLU B 37 12.165 -2.974 9.188 1.00 0.00 N ATOM 1778 CA GLU B 37 13.539 -2.551 9.302 1.00 0.00 C ATOM 1779 C GLU B 37 14.447 -3.716 9.691 1.00 0.00 C ATOM 1780 O GLU B 37 14.146 -4.476 10.615 1.00 0.00 O ATOM 1781 CB GLU B 37 13.652 -1.418 10.323 1.00 0.00 C ATOM 1782 CG GLU B 37 13.017 -1.723 11.671 1.00 0.00 C ATOM 1783 CD GLU B 37 13.360 -0.687 12.720 1.00 0.00 C ATOM 1784 OE1 GLU B 37 12.682 0.363 12.780 1.00 0.00 O ATOM 1785 OE2 GLU B 37 14.317 -0.912 13.492 1.00 0.00 O ATOM 0 H GLU B 37 11.551 -2.606 9.915 1.00 0.00 H new ATOM 0 HA GLU B 37 13.867 -2.187 8.328 1.00 0.00 H new ATOM 0 HB2 GLU B 37 14.706 -1.186 10.475 1.00 0.00 H new ATOM 0 HB3 GLU B 37 13.186 -0.524 9.909 1.00 0.00 H new ATOM 0 HG2 GLU B 37 11.934 -1.774 11.556 1.00 0.00 H new ATOM 0 HG3 GLU B 37 13.348 -2.704 12.012 1.00 0.00 H new ATOM 1792 N PRO B 38 15.568 -3.872 8.971 1.00 0.00 N ATOM 1793 CA PRO B 38 16.575 -4.895 9.268 1.00 0.00 C ATOM 1794 C PRO B 38 17.379 -4.548 10.521 1.00 0.00 C ATOM 1795 O PRO B 38 16.885 -3.835 11.397 1.00 0.00 O ATOM 1796 CB PRO B 38 17.465 -4.878 8.019 1.00 0.00 C ATOM 1797 CG PRO B 38 17.342 -3.494 7.491 1.00 0.00 C ATOM 1798 CD PRO B 38 15.937 -3.057 7.797 1.00 0.00 C ATOM 0 HA PRO B 38 16.137 -5.872 9.474 1.00 0.00 H new ATOM 0 HB2 PRO B 38 18.499 -5.118 8.266 1.00 0.00 H new ATOM 0 HB3 PRO B 38 17.133 -5.613 7.286 1.00 0.00 H new ATOM 0 HG2 PRO B 38 18.068 -2.831 7.962 1.00 0.00 H new ATOM 0 HG3 PRO B 38 17.534 -3.467 6.418 1.00 0.00 H new ATOM 0 HD2 PRO B 38 15.888 -1.991 8.018 1.00 0.00 H new ATOM 0 HD3 PRO B 38 15.268 -3.240 6.956 1.00 0.00 H new ATOM 1806 N ILE B 39 18.609 -5.060 10.607 1.00 0.00 N ATOM 1807 CA ILE B 39 19.493 -4.778 11.735 1.00 0.00 C ATOM 1808 C ILE B 39 19.035 -5.554 12.981 1.00 0.00 C ATOM 1809 O ILE B 39 17.897 -6.022 13.043 1.00 0.00 O ATOM 1810 CB ILE B 39 19.562 -3.249 12.001 1.00 0.00 C ATOM 1811 CG1 ILE B 39 20.052 -2.515 10.745 1.00 0.00 C ATOM 1812 CG2 ILE B 39 20.462 -2.913 13.185 1.00 0.00 C ATOM 1813 CD1 ILE B 39 20.056 -1.006 10.882 1.00 0.00 C ATOM 0 H ILE B 39 19.015 -5.676 9.903 1.00 0.00 H new ATOM 0 HA ILE B 39 20.500 -5.114 11.489 1.00 0.00 H new ATOM 0 HB ILE B 39 18.554 -2.916 12.249 1.00 0.00 H new ATOM 0 HG12 ILE B 39 21.061 -2.852 10.509 1.00 0.00 H new ATOM 0 HG13 ILE B 39 19.418 -2.793 9.903 1.00 0.00 H new ATOM 0 HG21 ILE B 39 20.480 -1.833 13.334 1.00 0.00 H new ATOM 0 HG22 ILE B 39 20.078 -3.397 14.083 1.00 0.00 H new ATOM 0 HG23 ILE B 39 21.473 -3.269 12.986 1.00 0.00 H new ATOM 0 HD11 ILE B 39 20.414 -0.557 9.955 1.00 0.00 H new ATOM 0 HD12 ILE B 39 19.044 -0.657 11.087 1.00 0.00 H new ATOM 0 HD13 ILE B 39 20.713 -0.717 11.703 1.00 0.00 H new ATOM 1825 N ASP B 40 19.934 -5.690 13.958 1.00 0.00 N ATOM 1826 CA ASP B 40 19.701 -6.504 15.144 1.00 0.00 C ATOM 1827 C ASP B 40 19.355 -7.937 14.748 1.00 0.00 C ATOM 1828 O ASP B 40 18.241 -8.426 14.951 1.00 0.00 O ATOM 1829 CB ASP B 40 18.616 -5.872 16.016 1.00 0.00 C ATOM 1830 CG ASP B 40 18.309 -6.674 17.267 1.00 0.00 C ATOM 1831 OD1 ASP B 40 19.254 -7.001 18.012 1.00 0.00 O ATOM 1832 OD2 ASP B 40 17.117 -6.957 17.522 1.00 0.00 O ATOM 0 H ASP B 40 20.847 -5.235 13.945 1.00 0.00 H new ATOM 0 HA ASP B 40 20.615 -6.543 15.736 1.00 0.00 H new ATOM 0 HB2 ASP B 40 18.930 -4.869 16.304 1.00 0.00 H new ATOM 0 HB3 ASP B 40 17.704 -5.765 15.429 1.00 0.00 H new ATOM 1837 N LEU B 41 20.332 -8.588 14.140 1.00 0.00 N ATOM 1838 CA LEU B 41 20.200 -9.966 13.704 1.00 0.00 C ATOM 1839 C LEU B 41 21.357 -10.772 14.268 1.00 0.00 C ATOM 1840 O LEU B 41 22.521 -10.413 14.074 1.00 0.00 O ATOM 1841 CB LEU B 41 20.207 -10.046 12.171 1.00 0.00 C ATOM 1842 CG LEU B 41 19.103 -9.249 11.464 1.00 0.00 C ATOM 1843 CD1 LEU B 41 19.297 -9.287 9.954 1.00 0.00 C ATOM 1844 CD2 LEU B 41 17.731 -9.792 11.834 1.00 0.00 C ATOM 0 H LEU B 41 21.241 -8.174 13.935 1.00 0.00 H new ATOM 0 HA LEU B 41 19.254 -10.370 14.065 1.00 0.00 H new ATOM 0 HB2 LEU B 41 21.173 -9.694 11.810 1.00 0.00 H new ATOM 0 HB3 LEU B 41 20.120 -11.092 11.879 1.00 0.00 H new ATOM 0 HG LEU B 41 19.166 -8.212 11.795 1.00 0.00 H new ATOM 0 HD11 LEU B 41 18.504 -8.716 9.471 1.00 0.00 H new ATOM 0 HD12 LEU B 41 20.264 -8.852 9.700 1.00 0.00 H new ATOM 0 HD13 LEU B 41 19.262 -10.320 9.609 1.00 0.00 H new ATOM 0 HD21 LEU B 41 16.961 -9.214 11.323 1.00 0.00 H new ATOM 0 HD22 LEU B 41 17.660 -10.837 11.533 1.00 0.00 H new ATOM 0 HD23 LEU B 41 17.588 -9.714 12.912 1.00 0.00 H new ATOM 1856 N GLY B 42 21.047 -11.850 14.967 1.00 0.00 N ATOM 1857 CA GLY B 42 22.073 -12.616 15.616 1.00 0.00 C ATOM 1858 C GLY B 42 22.612 -13.703 14.734 1.00 0.00 C ATOM 1859 O GLY B 42 21.916 -14.663 14.390 1.00 0.00 O ATOM 0 H GLY B 42 20.099 -12.205 15.094 1.00 0.00 H new ATOM 0 HA2 GLY B 42 22.887 -11.954 15.912 1.00 0.00 H new ATOM 0 HA3 GLY B 42 21.673 -13.056 16.529 1.00 0.00 H new ATOM 1863 N GLU B 43 23.855 -13.529 14.367 1.00 0.00 N ATOM 1864 CA GLU B 43 24.586 -14.518 13.609 1.00 0.00 C ATOM 1865 C GLU B 43 25.195 -15.541 14.560 1.00 0.00 C ATOM 1866 O GLU B 43 26.018 -15.197 15.414 1.00 0.00 O ATOM 1867 CB GLU B 43 25.670 -13.846 12.757 1.00 0.00 C ATOM 1868 CG GLU B 43 26.580 -12.898 13.530 1.00 0.00 C ATOM 1869 CD GLU B 43 27.622 -12.240 12.648 1.00 0.00 C ATOM 1870 OE1 GLU B 43 27.296 -11.230 11.990 1.00 0.00 O ATOM 1871 OE2 GLU B 43 28.774 -12.724 12.607 1.00 0.00 O ATOM 0 H GLU B 43 24.395 -12.692 14.586 1.00 0.00 H new ATOM 0 HA GLU B 43 23.902 -15.032 12.933 1.00 0.00 H new ATOM 0 HB2 GLU B 43 26.282 -14.620 12.293 1.00 0.00 H new ATOM 0 HB3 GLU B 43 25.190 -13.292 11.950 1.00 0.00 H new ATOM 0 HG2 GLU B 43 25.974 -12.127 14.007 1.00 0.00 H new ATOM 0 HG3 GLU B 43 27.080 -13.449 14.327 1.00 0.00 H new ATOM 1878 N PRO B 44 24.776 -16.808 14.451 1.00 0.00 N ATOM 1879 CA PRO B 44 25.252 -17.876 15.332 1.00 0.00 C ATOM 1880 C PRO B 44 26.745 -18.137 15.160 1.00 0.00 C ATOM 1881 O PRO B 44 27.196 -18.559 14.092 1.00 0.00 O ATOM 1882 CB PRO B 44 24.447 -19.105 14.895 1.00 0.00 C ATOM 1883 CG PRO B 44 23.314 -18.573 14.082 1.00 0.00 C ATOM 1884 CD PRO B 44 23.813 -17.305 13.458 1.00 0.00 C ATOM 0 HA PRO B 44 25.117 -17.620 16.383 1.00 0.00 H new ATOM 0 HB2 PRO B 44 25.062 -19.789 14.310 1.00 0.00 H new ATOM 0 HB3 PRO B 44 24.083 -19.662 15.758 1.00 0.00 H new ATOM 0 HG2 PRO B 44 23.011 -19.290 13.319 1.00 0.00 H new ATOM 0 HG3 PRO B 44 22.441 -18.383 14.706 1.00 0.00 H new ATOM 0 HD2 PRO B 44 24.286 -17.488 12.493 1.00 0.00 H new ATOM 0 HD3 PRO B 44 23.005 -16.593 13.287 1.00 0.00 H new ATOM 1892 N VAL B 45 27.504 -17.865 16.208 1.00 0.00 N ATOM 1893 CA VAL B 45 28.934 -18.112 16.195 1.00 0.00 C ATOM 1894 C VAL B 45 29.215 -19.599 16.263 1.00 0.00 C ATOM 1895 O VAL B 45 28.475 -20.365 16.878 1.00 0.00 O ATOM 1896 CB VAL B 45 29.658 -17.366 17.338 1.00 0.00 C ATOM 1897 CG1 VAL B 45 28.982 -17.623 18.680 1.00 0.00 C ATOM 1898 CG2 VAL B 45 31.132 -17.735 17.408 1.00 0.00 C ATOM 0 H VAL B 45 27.151 -17.472 17.081 1.00 0.00 H new ATOM 0 HA VAL B 45 29.326 -17.723 15.255 1.00 0.00 H new ATOM 0 HB VAL B 45 29.590 -16.301 17.116 1.00 0.00 H new ATOM 0 HG11 VAL B 45 29.514 -17.085 19.464 1.00 0.00 H new ATOM 0 HG12 VAL B 45 27.949 -17.277 18.639 1.00 0.00 H new ATOM 0 HG13 VAL B 45 28.999 -18.691 18.897 1.00 0.00 H new ATOM 0 HG21 VAL B 45 31.605 -17.189 18.224 1.00 0.00 H new ATOM 0 HG22 VAL B 45 31.231 -18.806 17.582 1.00 0.00 H new ATOM 0 HG23 VAL B 45 31.617 -17.474 16.468 1.00 0.00 H new ATOM 1908 N SER B 46 30.281 -19.996 15.613 1.00 0.00 N ATOM 1909 CA SER B 46 30.633 -21.390 15.515 1.00 0.00 C ATOM 1910 C SER B 46 31.778 -21.736 16.458 1.00 0.00 C ATOM 1911 O SER B 46 32.538 -20.863 16.884 1.00 0.00 O ATOM 1912 CB SER B 46 31.031 -21.709 14.087 1.00 0.00 C ATOM 1913 OG SER B 46 30.135 -21.110 13.160 1.00 0.00 O ATOM 0 H SER B 46 30.927 -19.364 15.139 1.00 0.00 H new ATOM 0 HA SER B 46 29.767 -21.986 15.802 1.00 0.00 H new ATOM 0 HB2 SER B 46 32.044 -21.353 13.900 1.00 0.00 H new ATOM 0 HB3 SER B 46 31.041 -22.789 13.942 1.00 0.00 H new ATOM 0 HG SER B 46 30.414 -21.329 12.247 1.00 0.00 H new ATOM 1919 N VAL B 47 31.895 -23.017 16.757 1.00 0.00 N ATOM 1920 CA VAL B 47 32.940 -23.525 17.625 1.00 0.00 C ATOM 1921 C VAL B 47 33.803 -24.499 16.832 1.00 0.00 C ATOM 1922 O VAL B 47 33.326 -25.100 15.864 1.00 0.00 O ATOM 1923 CB VAL B 47 32.334 -24.222 18.872 1.00 0.00 C ATOM 1924 CG1 VAL B 47 31.528 -25.457 18.478 1.00 0.00 C ATOM 1925 CG2 VAL B 47 33.416 -24.576 19.886 1.00 0.00 C ATOM 0 H VAL B 47 31.265 -23.737 16.403 1.00 0.00 H new ATOM 0 HA VAL B 47 33.552 -22.696 17.979 1.00 0.00 H new ATOM 0 HB VAL B 47 31.652 -23.516 19.345 1.00 0.00 H new ATOM 0 HG11 VAL B 47 31.116 -25.923 19.373 1.00 0.00 H new ATOM 0 HG12 VAL B 47 30.714 -25.164 17.814 1.00 0.00 H new ATOM 0 HG13 VAL B 47 32.177 -26.167 17.965 1.00 0.00 H new ATOM 0 HG21 VAL B 47 32.961 -25.063 20.749 1.00 0.00 H new ATOM 0 HG22 VAL B 47 34.138 -25.251 19.427 1.00 0.00 H new ATOM 0 HG23 VAL B 47 33.924 -23.667 20.209 1.00 0.00 H new ATOM 1935 N GLU B 48 35.070 -24.626 17.204 1.00 0.00 N ATOM 1936 CA GLU B 48 35.978 -25.515 16.493 1.00 0.00 C ATOM 1937 C GLU B 48 35.591 -26.976 16.685 1.00 0.00 C ATOM 1938 O GLU B 48 35.655 -27.524 17.785 1.00 0.00 O ATOM 1939 CB GLU B 48 37.435 -25.293 16.914 1.00 0.00 C ATOM 1940 CG GLU B 48 37.646 -25.149 18.415 1.00 0.00 C ATOM 1941 CD GLU B 48 37.499 -23.720 18.902 1.00 0.00 C ATOM 1942 OE1 GLU B 48 36.362 -23.298 19.201 1.00 0.00 O ATOM 1943 OE2 GLU B 48 38.525 -23.016 18.990 1.00 0.00 O ATOM 0 H GLU B 48 35.490 -24.128 17.989 1.00 0.00 H new ATOM 0 HA GLU B 48 35.891 -25.272 15.434 1.00 0.00 H new ATOM 0 HB2 GLU B 48 38.035 -26.129 16.555 1.00 0.00 H new ATOM 0 HB3 GLU B 48 37.810 -24.397 16.420 1.00 0.00 H new ATOM 0 HG2 GLU B 48 36.929 -25.781 18.939 1.00 0.00 H new ATOM 0 HG3 GLU B 48 38.640 -25.514 18.673 1.00 0.00 H new ATOM 1950 N GLU B 49 35.186 -27.596 15.590 1.00 0.00 N ATOM 1951 CA GLU B 49 34.793 -28.997 15.592 1.00 0.00 C ATOM 1952 C GLU B 49 36.012 -29.892 15.427 1.00 0.00 C ATOM 1953 O GLU B 49 36.018 -31.042 15.859 1.00 0.00 O ATOM 1954 CB GLU B 49 33.783 -29.272 14.474 1.00 0.00 C ATOM 1955 CG GLU B 49 32.435 -28.607 14.693 1.00 0.00 C ATOM 1956 CD GLU B 49 31.452 -28.910 13.579 1.00 0.00 C ATOM 1957 OE1 GLU B 49 31.259 -30.102 13.259 1.00 0.00 O ATOM 1958 OE2 GLU B 49 30.882 -27.960 13.005 1.00 0.00 O ATOM 0 H GLU B 49 35.120 -27.146 14.677 1.00 0.00 H new ATOM 0 HA GLU B 49 34.323 -29.219 16.550 1.00 0.00 H new ATOM 0 HB2 GLU B 49 34.199 -28.927 13.527 1.00 0.00 H new ATOM 0 HB3 GLU B 49 33.637 -30.348 14.385 1.00 0.00 H new ATOM 0 HG2 GLU B 49 32.018 -28.942 15.643 1.00 0.00 H new ATOM 0 HG3 GLU B 49 32.573 -27.528 14.768 1.00 0.00 H new ATOM 1965 N ILE B 50 37.043 -29.340 14.804 1.00 0.00 N ATOM 1966 CA ILE B 50 38.270 -30.079 14.527 1.00 0.00 C ATOM 1967 C ILE B 50 39.097 -30.269 15.806 1.00 0.00 C ATOM 1968 O ILE B 50 40.007 -31.100 15.875 1.00 0.00 O ATOM 1969 CB ILE B 50 39.092 -29.347 13.431 1.00 0.00 C ATOM 1970 CG1 ILE B 50 39.557 -30.321 12.339 1.00 0.00 C ATOM 1971 CG2 ILE B 50 40.280 -28.593 14.016 1.00 0.00 C ATOM 1972 CD1 ILE B 50 40.468 -31.426 12.832 1.00 0.00 C ATOM 0 H ILE B 50 37.055 -28.374 14.477 1.00 0.00 H new ATOM 0 HA ILE B 50 38.007 -31.070 14.158 1.00 0.00 H new ATOM 0 HB ILE B 50 38.427 -28.613 12.976 1.00 0.00 H new ATOM 0 HG12 ILE B 50 38.680 -30.771 11.873 1.00 0.00 H new ATOM 0 HG13 ILE B 50 40.076 -29.757 11.564 1.00 0.00 H new ATOM 0 HG21 ILE B 50 40.826 -28.096 13.214 1.00 0.00 H new ATOM 0 HG22 ILE B 50 39.924 -27.848 14.728 1.00 0.00 H new ATOM 0 HG23 ILE B 50 40.941 -29.294 14.525 1.00 0.00 H new ATOM 0 HD11 ILE B 50 40.748 -32.067 11.996 1.00 0.00 H new ATOM 0 HD12 ILE B 50 41.365 -30.989 13.271 1.00 0.00 H new ATOM 0 HD13 ILE B 50 39.947 -32.018 13.585 1.00 0.00 H new ATOM 2090 N THR B 57 42.697 -42.811 28.881 1.00 0.00 N ATOM 2091 CA THR B 57 42.844 -42.820 30.319 1.00 0.00 C ATOM 2092 C THR B 57 42.384 -44.145 30.924 1.00 0.00 C ATOM 2093 O THR B 57 41.184 -44.408 31.048 1.00 0.00 O ATOM 2094 CB THR B 57 42.048 -41.664 30.940 1.00 0.00 C ATOM 2095 OG1 THR B 57 40.804 -41.494 30.240 1.00 0.00 O ATOM 2096 CG2 THR B 57 42.847 -40.368 30.898 1.00 0.00 C ATOM 0 HA THR B 57 43.904 -42.696 30.542 1.00 0.00 H new ATOM 0 HB THR B 57 41.846 -41.909 31.983 1.00 0.00 H new ATOM 0 HG1 THR B 57 40.847 -41.960 29.379 1.00 0.00 H new ATOM 0 HG21 THR B 57 42.261 -39.565 31.344 1.00 0.00 H new ATOM 0 HG22 THR B 57 43.774 -40.494 31.457 1.00 0.00 H new ATOM 0 HG23 THR B 57 43.079 -40.117 29.863 1.00 0.00 H new ATOM 2104 N TRP B 58 43.348 -44.987 31.267 1.00 0.00 N ATOM 2105 CA TRP B 58 43.082 -46.238 31.929 1.00 0.00 C ATOM 2106 C TRP B 58 43.345 -46.112 33.427 1.00 0.00 C ATOM 2107 O TRP B 58 43.717 -45.038 33.907 1.00 0.00 O ATOM 2108 CB TRP B 58 43.986 -47.305 31.332 1.00 0.00 C ATOM 2109 CG TRP B 58 43.604 -47.721 29.943 1.00 0.00 C ATOM 2110 CD1 TRP B 58 42.479 -48.396 29.570 1.00 0.00 C ATOM 2111 CD2 TRP B 58 44.357 -47.499 28.747 1.00 0.00 C ATOM 2112 NE1 TRP B 58 42.485 -48.604 28.210 1.00 0.00 N ATOM 2113 CE2 TRP B 58 43.629 -48.062 27.683 1.00 0.00 C ATOM 2114 CE3 TRP B 58 45.579 -46.877 28.474 1.00 0.00 C ATOM 2115 CZ2 TRP B 58 44.081 -48.020 26.365 1.00 0.00 C ATOM 2116 CZ3 TRP B 58 46.028 -46.836 27.168 1.00 0.00 C ATOM 2117 CH2 TRP B 58 45.280 -47.403 26.127 1.00 0.00 C ATOM 0 H TRP B 58 44.337 -44.813 31.090 1.00 0.00 H new ATOM 0 HA TRP B 58 42.037 -46.512 31.787 1.00 0.00 H new ATOM 0 HB2 TRP B 58 45.011 -46.933 31.320 1.00 0.00 H new ATOM 0 HB3 TRP B 58 43.973 -48.182 31.979 1.00 0.00 H new ATOM 0 HD1 TRP B 58 41.699 -48.719 30.243 1.00 0.00 H new ATOM 0 HE1 TRP B 58 41.757 -49.083 27.680 1.00 0.00 H new ATOM 0 HE3 TRP B 58 46.161 -46.437 29.270 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 43.507 -48.458 25.562 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 46.971 -46.359 26.945 1.00 0.00 H new ATOM 0 HH2 TRP B 58 45.657 -47.352 25.116 1.00 0.00 H new ATOM 2128 N MET B 59 43.146 -47.208 34.154 1.00 0.00 N ATOM 2129 CA MET B 59 43.416 -47.250 35.584 1.00 0.00 C ATOM 2130 C MET B 59 43.395 -48.692 36.076 1.00 0.00 C ATOM 2131 O MET B 59 42.720 -49.546 35.495 1.00 0.00 O ATOM 2132 CB MET B 59 42.407 -46.388 36.366 1.00 0.00 C ATOM 2133 CG MET B 59 40.948 -46.781 36.187 1.00 0.00 C ATOM 2134 SD MET B 59 40.437 -48.118 37.281 1.00 0.00 S ATOM 2135 CE MET B 59 38.730 -48.320 36.787 1.00 0.00 C ATOM 0 H MET B 59 42.795 -48.085 33.770 1.00 0.00 H new ATOM 0 HA MET B 59 44.408 -46.834 35.760 1.00 0.00 H new ATOM 0 HB2 MET B 59 42.654 -46.440 37.426 1.00 0.00 H new ATOM 0 HB3 MET B 59 42.527 -45.349 36.061 1.00 0.00 H new ATOM 0 HG2 MET B 59 40.318 -45.910 36.369 1.00 0.00 H new ATOM 0 HG3 MET B 59 40.783 -47.083 35.153 1.00 0.00 H new ATOM 0 HE1 MET B 59 38.273 -49.115 37.376 1.00 0.00 H new ATOM 0 HE2 MET B 59 38.190 -47.388 36.954 1.00 0.00 H new ATOM 0 HE3 MET B 59 38.686 -48.580 35.729 1.00 0.00 H new ATOM 2145 N SER B 60 44.153 -48.967 37.125 1.00 0.00 N ATOM 2146 CA SER B 60 44.210 -50.303 37.690 1.00 0.00 C ATOM 2147 C SER B 60 43.295 -50.397 38.906 1.00 0.00 C ATOM 2148 O SER B 60 43.312 -49.528 39.783 1.00 0.00 O ATOM 2149 CB SER B 60 45.649 -50.660 38.078 1.00 0.00 C ATOM 2150 OG SER B 60 45.751 -52.009 38.501 1.00 0.00 O ATOM 0 H SER B 60 44.738 -48.281 37.602 1.00 0.00 H new ATOM 0 HA SER B 60 43.869 -51.015 36.938 1.00 0.00 H new ATOM 0 HB2 SER B 60 46.309 -50.493 37.227 1.00 0.00 H new ATOM 0 HB3 SER B 60 45.986 -50.000 38.877 1.00 0.00 H new ATOM 0 HG SER B 60 46.680 -52.207 38.740 1.00 0.00 H new ATOM 2156 N SER B 61 42.498 -51.453 38.954 1.00 0.00 N ATOM 2157 CA SER B 61 41.555 -51.651 40.041 1.00 0.00 C ATOM 2158 C SER B 61 42.043 -52.746 40.989 1.00 0.00 C ATOM 2159 O SER B 61 41.372 -53.083 41.968 1.00 0.00 O ATOM 2160 CB SER B 61 40.180 -52.010 39.473 1.00 0.00 C ATOM 2161 OG SER B 61 39.753 -51.040 38.528 1.00 0.00 O ATOM 0 H SER B 61 42.487 -52.189 38.248 1.00 0.00 H new ATOM 0 HA SER B 61 41.475 -50.724 40.609 1.00 0.00 H new ATOM 0 HB2 SER B 61 40.223 -52.991 38.999 1.00 0.00 H new ATOM 0 HB3 SER B 61 39.454 -52.078 40.283 1.00 0.00 H new ATOM 0 HG SER B 61 40.313 -50.239 38.606 1.00 0.00 H new ATOM 2167 N LEU B 62 43.223 -53.280 40.705 1.00 0.00 N ATOM 2168 CA LEU B 62 43.790 -54.356 41.494 1.00 0.00 C ATOM 2169 C LEU B 62 44.441 -53.812 42.762 1.00 0.00 C ATOM 2170 O LEU B 62 45.441 -53.091 42.705 1.00 0.00 O ATOM 2171 CB LEU B 62 44.813 -55.129 40.664 1.00 0.00 C ATOM 2172 CG LEU B 62 45.571 -56.207 41.429 1.00 0.00 C ATOM 2173 CD1 LEU B 62 44.629 -57.317 41.876 1.00 0.00 C ATOM 2174 CD2 LEU B 62 46.707 -56.763 40.591 1.00 0.00 C ATOM 0 H LEU B 62 43.808 -52.979 39.926 1.00 0.00 H new ATOM 0 HA LEU B 62 42.986 -55.032 41.786 1.00 0.00 H new ATOM 0 HB2 LEU B 62 44.301 -55.593 39.821 1.00 0.00 H new ATOM 0 HB3 LEU B 62 45.533 -54.423 40.250 1.00 0.00 H new ATOM 0 HG LEU B 62 46.002 -55.752 42.321 1.00 0.00 H new ATOM 0 HD11 LEU B 62 45.192 -58.075 42.420 1.00 0.00 H new ATOM 0 HD12 LEU B 62 43.859 -56.901 42.526 1.00 0.00 H new ATOM 0 HD13 LEU B 62 44.160 -57.770 41.002 1.00 0.00 H new ATOM 0 HD21 LEU B 62 47.234 -57.531 41.157 1.00 0.00 H new ATOM 0 HD22 LEU B 62 46.305 -57.198 39.676 1.00 0.00 H new ATOM 0 HD23 LEU B 62 47.399 -55.960 40.337 1.00 0.00 H new ATOM 2186 N GLU B 63 43.863 -54.155 43.901 1.00 0.00 N ATOM 2187 CA GLU B 63 44.385 -53.727 45.185 1.00 0.00 C ATOM 2188 C GLU B 63 44.365 -54.910 46.146 1.00 0.00 C ATOM 2189 O GLU B 63 43.358 -55.172 46.806 1.00 0.00 O ATOM 2190 CB GLU B 63 43.541 -52.567 45.726 1.00 0.00 C ATOM 2191 CG GLU B 63 44.290 -51.607 46.643 1.00 0.00 C ATOM 2192 CD GLU B 63 44.728 -52.233 47.949 1.00 0.00 C ATOM 2193 OE1 GLU B 63 43.944 -52.194 48.921 1.00 0.00 O ATOM 2194 OE2 GLU B 63 45.860 -52.756 48.010 1.00 0.00 O ATOM 0 H GLU B 63 43.025 -54.734 43.961 1.00 0.00 H new ATOM 0 HA GLU B 63 45.412 -53.377 45.076 1.00 0.00 H new ATOM 0 HB2 GLU B 63 43.139 -52.004 44.883 1.00 0.00 H new ATOM 0 HB3 GLU B 63 42.690 -52.978 46.270 1.00 0.00 H new ATOM 0 HG2 GLU B 63 45.168 -51.228 46.119 1.00 0.00 H new ATOM 0 HG3 GLU B 63 43.652 -50.750 46.857 1.00 0.00 H new ATOM 2201 N HIS B 64 45.472 -55.640 46.205 1.00 0.00 N ATOM 2202 CA HIS B 64 45.528 -56.857 47.006 1.00 0.00 C ATOM 2203 C HIS B 64 45.917 -56.566 48.454 1.00 0.00 C ATOM 2204 O HIS B 64 47.020 -56.874 48.897 1.00 0.00 O ATOM 2205 CB HIS B 64 46.452 -57.931 46.385 1.00 0.00 C ATOM 2206 CG HIS B 64 47.827 -57.462 45.968 1.00 0.00 C ATOM 2207 ND1 HIS B 64 48.324 -57.645 44.696 1.00 0.00 N ATOM 2208 CD2 HIS B 64 48.824 -56.864 46.667 1.00 0.00 C ATOM 2209 CE1 HIS B 64 49.557 -57.182 44.632 1.00 0.00 C ATOM 2210 NE2 HIS B 64 49.884 -56.696 45.812 1.00 0.00 N ATOM 0 H HIS B 64 46.336 -55.414 45.713 1.00 0.00 H new ATOM 0 HA HIS B 64 44.518 -57.268 47.009 1.00 0.00 H new ATOM 0 HB2 HIS B 64 46.569 -58.741 47.105 1.00 0.00 H new ATOM 0 HB3 HIS B 64 45.953 -58.350 45.512 1.00 0.00 H new ATOM 0 HD2 HIS B 64 48.790 -56.573 47.707 1.00 0.00 H new ATOM 0 HE1 HIS B 64 50.192 -57.198 43.759 1.00 0.00 H new ATOM 0 HE2 HIS B 64 50.778 -56.266 46.051 1.00 0.00 H new ATOM 2219 N HIS B 65 44.992 -55.952 49.175 1.00 0.00 N ATOM 2220 CA HIS B 65 45.164 -55.716 50.603 1.00 0.00 C ATOM 2221 C HIS B 65 45.318 -57.035 51.356 1.00 0.00 C ATOM 2222 O HIS B 65 44.551 -57.977 51.152 1.00 0.00 O ATOM 2223 CB HIS B 65 44.010 -54.882 51.184 1.00 0.00 C ATOM 2224 CG HIS B 65 42.619 -55.319 50.799 1.00 0.00 C ATOM 2225 ND1 HIS B 65 41.506 -54.540 51.029 1.00 0.00 N ATOM 2226 CD2 HIS B 65 42.162 -56.446 50.200 1.00 0.00 C ATOM 2227 CE1 HIS B 65 40.431 -55.164 50.587 1.00 0.00 C ATOM 2228 NE2 HIS B 65 40.800 -56.324 50.081 1.00 0.00 N ATOM 0 H HIS B 65 44.111 -55.606 48.795 1.00 0.00 H new ATOM 0 HA HIS B 65 46.080 -55.139 50.733 1.00 0.00 H new ATOM 0 HB2 HIS B 65 44.087 -54.899 52.271 1.00 0.00 H new ATOM 0 HB3 HIS B 65 44.143 -53.846 50.872 1.00 0.00 H new ATOM 0 HD2 HIS B 65 42.760 -57.285 49.876 1.00 0.00 H new ATOM 0 HE1 HIS B 65 39.420 -54.788 50.632 1.00 0.00 H new ATOM 0 HE2 HIS B 65 40.176 -57.017 49.669 1.00 0.00 H new ATOM 2237 N HIS B 66 46.323 -57.094 52.211 1.00 0.00 N ATOM 2238 CA HIS B 66 46.653 -58.319 52.928 1.00 0.00 C ATOM 2239 C HIS B 66 45.906 -58.382 54.259 1.00 0.00 C ATOM 2240 O HIS B 66 45.675 -57.356 54.897 1.00 0.00 O ATOM 2241 CB HIS B 66 48.168 -58.396 53.145 1.00 0.00 C ATOM 2242 CG HIS B 66 48.657 -59.721 53.654 1.00 0.00 C ATOM 2243 ND1 HIS B 66 48.321 -60.923 53.069 1.00 0.00 N ATOM 2244 CD2 HIS B 66 49.469 -60.030 54.693 1.00 0.00 C ATOM 2245 CE1 HIS B 66 48.904 -61.908 53.722 1.00 0.00 C ATOM 2246 NE2 HIS B 66 49.611 -61.398 54.710 1.00 0.00 N ATOM 0 H HIS B 66 46.930 -56.304 52.429 1.00 0.00 H new ATOM 0 HA HIS B 66 46.340 -59.176 52.332 1.00 0.00 H new ATOM 0 HB2 HIS B 66 48.669 -58.176 52.202 1.00 0.00 H new ATOM 0 HB3 HIS B 66 48.461 -57.619 53.851 1.00 0.00 H new ATOM 0 HD2 HIS B 66 49.921 -59.331 55.381 1.00 0.00 H new ATOM 0 HE1 HIS B 66 48.817 -62.958 53.487 1.00 0.00 H new ATOM 0 HE2 HIS B 66 50.171 -61.929 55.377 1.00 0.00 H new ATOM 2255 N HIS B 67 45.521 -59.586 54.668 1.00 0.00 N ATOM 2256 CA HIS B 67 44.753 -59.765 55.893 1.00 0.00 C ATOM 2257 C HIS B 67 45.206 -61.030 56.620 1.00 0.00 C ATOM 2258 O HIS B 67 45.591 -62.013 55.986 1.00 0.00 O ATOM 2259 CB HIS B 67 43.260 -59.856 55.556 1.00 0.00 C ATOM 2260 CG HIS B 67 42.345 -59.660 56.726 1.00 0.00 C ATOM 2261 ND1 HIS B 67 41.713 -60.697 57.370 1.00 0.00 N ATOM 2262 CD2 HIS B 67 41.939 -58.531 57.349 1.00 0.00 C ATOM 2263 CE1 HIS B 67 40.958 -60.214 58.337 1.00 0.00 C ATOM 2264 NE2 HIS B 67 41.071 -58.898 58.347 1.00 0.00 N ATOM 0 H HIS B 67 45.728 -60.451 54.169 1.00 0.00 H new ATOM 0 HA HIS B 67 44.921 -58.910 56.547 1.00 0.00 H new ATOM 0 HB2 HIS B 67 43.025 -59.108 54.798 1.00 0.00 H new ATOM 0 HB3 HIS B 67 43.059 -60.832 55.114 1.00 0.00 H new ATOM 0 HD2 HIS B 67 42.242 -57.523 57.106 1.00 0.00 H new ATOM 0 HE1 HIS B 67 40.348 -60.798 59.010 1.00 0.00 H new ATOM 0 HE2 HIS B 67 40.594 -58.263 58.987 1.00 0.00 H new ATOM 2273 N HIS B 68 45.187 -60.986 57.948 1.00 0.00 N ATOM 2274 CA HIS B 68 45.524 -62.149 58.767 1.00 0.00 C ATOM 2275 C HIS B 68 44.298 -62.587 59.562 1.00 0.00 C ATOM 2276 O HIS B 68 43.187 -62.125 59.313 1.00 0.00 O ATOM 2277 CB HIS B 68 46.656 -61.839 59.758 1.00 0.00 C ATOM 2278 CG HIS B 68 47.898 -61.273 59.147 1.00 0.00 C ATOM 2279 ND1 HIS B 68 48.829 -62.030 58.470 1.00 0.00 N ATOM 2280 CD2 HIS B 68 48.380 -60.010 59.157 1.00 0.00 C ATOM 2281 CE1 HIS B 68 49.828 -61.256 58.096 1.00 0.00 C ATOM 2282 NE2 HIS B 68 49.583 -60.025 58.500 1.00 0.00 N ATOM 0 H HIS B 68 44.941 -60.154 58.484 1.00 0.00 H new ATOM 0 HA HIS B 68 45.855 -62.939 58.093 1.00 0.00 H new ATOM 0 HB2 HIS B 68 46.283 -61.136 60.503 1.00 0.00 H new ATOM 0 HB3 HIS B 68 46.916 -62.756 60.287 1.00 0.00 H new ATOM 0 HD2 HIS B 68 47.905 -59.148 59.601 1.00 0.00 H new ATOM 0 HE1 HIS B 68 50.702 -61.577 57.549 1.00 0.00 H new ATOM 0 HE2 HIS B 68 50.188 -59.218 58.349 1.00 0.00 H new ATOM 2291 N HIS B 69 44.500 -63.479 60.520 1.00 0.00 N ATOM 2292 CA HIS B 69 43.439 -63.882 61.423 1.00 0.00 C ATOM 2293 C HIS B 69 44.022 -64.165 62.802 1.00 0.00 C ATOM 2294 O HIS B 69 44.282 -65.341 63.118 1.00 0.00 O ATOM 2295 CB HIS B 69 42.698 -65.114 60.887 1.00 0.00 C ATOM 2296 CG HIS B 69 41.534 -65.532 61.734 1.00 0.00 C ATOM 2297 ND1 HIS B 69 41.557 -66.640 62.557 1.00 0.00 N ATOM 2298 CD2 HIS B 69 40.308 -64.984 61.885 1.00 0.00 C ATOM 2299 CE1 HIS B 69 40.396 -66.755 63.169 1.00 0.00 C ATOM 2300 NE2 HIS B 69 39.621 -65.764 62.781 1.00 0.00 N ATOM 2301 OXT HIS B 69 44.227 -63.201 63.569 1.00 0.00 O ATOM 0 H HIS B 69 45.395 -63.938 60.690 1.00 0.00 H new ATOM 0 HA HIS B 69 42.717 -63.069 61.500 1.00 0.00 H new ATOM 0 HB2 HIS B 69 42.345 -64.904 59.877 1.00 0.00 H new ATOM 0 HB3 HIS B 69 43.399 -65.945 60.813 1.00 0.00 H new ATOM 0 HD2 HIS B 69 39.938 -64.097 61.392 1.00 0.00 H new ATOM 0 HE1 HIS B 69 40.126 -67.531 63.870 1.00 0.00 H new ATOM 0 HE2 HIS B 69 38.664 -65.602 63.096 1.00 0.00 H new