USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 653 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 34 TYR OH : rot 86:sc= 1.27 USER MOD Set 1.2: A 49 ASN : amide:sc= 1.02 K(o=2.3,f=1.7) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 161:sc= -0.101 (180deg=-0.804) USER MOD Single : A 4 TYR OH : rot -152:sc= 0.313 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0.0916 USER MOD Single : A 19 HIS :FLIP no HE2:sc= -1.12 F(o=-2.4!,f=-1.1) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.0596 X(o=-0.06,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 30:sc= -0.0675 USER MOD Single : A 33 SER OG : rot 58:sc= 1.75 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot -119:sc= -0.158 USER MOD Single : A 47 HIS : no HD1:sc= -0.0859 X(o=-0.086,f=-0.33) USER MOD Single : A 48 THR OG1 : rot 170:sc= 0.455 USER MOD Single : A 51 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0191) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot -54:sc= 1.22 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 9:sc= 1.08 USER MOD Single : A 77 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0234) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 283.710 122.434 408.005 1.00 0.00 N ATOM 2 CA MET A 0 282.594 122.472 407.097 1.00 0.00 C ATOM 3 C MET A 0 283.133 122.199 405.698 1.00 0.00 C ATOM 4 O MET A 0 282.669 122.729 404.689 1.00 0.00 O ATOM 5 CB MET A 0 281.774 123.783 407.276 1.00 0.00 C ATOM 6 CG MET A 0 280.415 123.862 406.541 1.00 0.00 C ATOM 7 SD MET A 0 279.251 122.524 406.914 1.00 0.00 S ATOM 8 CE MET A 0 278.032 123.098 405.696 1.00 0.00 C ATOM 0 H1 MET A 0 283.455 122.919 408.889 1.00 0.00 H new ATOM 0 H2 MET A 0 283.956 121.445 408.212 1.00 0.00 H new ATOM 0 H3 MET A 0 284.527 122.910 407.571 1.00 0.00 H new ATOM 0 HA MET A 0 281.859 121.695 407.307 1.00 0.00 H new ATOM 0 HB2 MET A 0 281.593 123.928 408.341 1.00 0.00 H new ATOM 0 HB3 MET A 0 282.390 124.617 406.941 1.00 0.00 H new ATOM 0 HG2 MET A 0 279.942 124.812 406.789 1.00 0.00 H new ATOM 0 HG3 MET A 0 280.602 123.869 405.467 1.00 0.00 H new ATOM 0 HE1 MET A 0 277.168 122.434 405.705 1.00 0.00 H new ATOM 0 HE2 MET A 0 277.714 124.110 405.948 1.00 0.00 H new ATOM 0 HE3 MET A 0 278.481 123.096 404.703 1.00 0.00 H new ATOM 18 N GLY A 1 284.143 121.289 405.642 1.00 0.00 N ATOM 19 CA GLY A 1 284.790 120.696 404.465 1.00 0.00 C ATOM 20 C GLY A 1 285.869 121.538 403.830 1.00 0.00 C ATOM 21 O GLY A 1 286.899 121.839 404.423 1.00 0.00 O ATOM 0 H GLY A 1 284.553 120.927 406.503 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.222 119.738 404.753 1.00 0.00 H new ATOM 0 HA3 GLY A 1 284.025 120.489 403.716 1.00 0.00 H new ATOM 25 N ILE A 2 285.616 121.973 402.568 1.00 0.00 N ATOM 26 CA ILE A 2 286.417 122.920 401.790 1.00 0.00 C ATOM 27 C ILE A 2 285.759 124.284 401.972 1.00 0.00 C ATOM 28 O ILE A 2 284.540 124.370 402.123 1.00 0.00 O ATOM 29 CB ILE A 2 286.433 122.672 400.271 1.00 0.00 C ATOM 30 CG1 ILE A 2 286.731 121.185 399.951 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.389 123.699 399.583 1.00 0.00 C ATOM 32 CD1 ILE A 2 287.339 120.946 398.561 1.00 0.00 C ATOM 0 H ILE A 2 284.801 121.647 402.049 1.00 0.00 H new ATOM 0 HA ILE A 2 287.443 122.829 402.146 1.00 0.00 H new ATOM 0 HB ILE A 2 285.444 122.848 399.847 1.00 0.00 H new ATOM 0 HG12 ILE A 2 287.413 120.793 400.705 1.00 0.00 H new ATOM 0 HG13 ILE A 2 285.805 120.616 400.032 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.399 123.522 398.507 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.038 124.712 399.781 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.397 123.580 399.980 1.00 0.00 H new ATOM 0 HD11 ILE A 2 287.516 119.880 398.420 1.00 0.00 H new ATOM 0 HD12 ILE A 2 286.650 121.304 397.796 1.00 0.00 H new ATOM 0 HD13 ILE A 2 288.283 121.484 398.479 1.00 0.00 H new ATOM 44 N ASP A 3 286.504 125.421 401.916 1.00 0.00 N ATOM 45 CA ASP A 3 285.871 126.708 402.082 1.00 0.00 C ATOM 46 C ASP A 3 285.248 127.301 400.873 1.00 0.00 C ATOM 47 O ASP A 3 285.655 128.353 400.423 1.00 0.00 O ATOM 48 CB ASP A 3 286.940 127.698 402.628 1.00 0.00 C ATOM 49 CG ASP A 3 286.338 128.882 403.378 1.00 0.00 C ATOM 50 OD1 ASP A 3 287.129 129.780 403.736 1.00 0.00 O ATOM 51 OD2 ASP A 3 285.101 128.914 403.612 1.00 0.00 O1- ATOM 0 H ASP A 3 287.512 125.450 401.761 1.00 0.00 H new ATOM 0 HA ASP A 3 285.039 126.537 402.765 1.00 0.00 H new ATOM 0 HB2 ASP A 3 287.616 127.161 403.293 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.539 128.070 401.797 1.00 0.00 H new ATOM 56 N TYR A 4 284.168 126.663 400.393 1.00 0.00 N ATOM 57 CA TYR A 4 283.082 127.206 399.608 1.00 0.00 C ATOM 58 C TYR A 4 282.019 128.022 400.343 1.00 0.00 C ATOM 59 O TYR A 4 281.832 129.222 400.136 1.00 0.00 O ATOM 60 CB TYR A 4 282.556 126.295 398.489 1.00 0.00 C ATOM 61 CG TYR A 4 283.607 125.406 397.946 1.00 0.00 C ATOM 62 CD1 TYR A 4 283.575 124.035 398.122 1.00 0.00 C ATOM 63 CD2 TYR A 4 284.540 125.961 397.112 1.00 0.00 C ATOM 64 CE1 TYR A 4 284.487 123.227 397.475 1.00 0.00 C ATOM 65 CE2 TYR A 4 285.371 125.143 396.408 1.00 0.00 C ATOM 66 CZ TYR A 4 285.418 123.786 396.628 1.00 0.00 C ATOM 67 OH TYR A 4 286.312 122.992 395.871 1.00 0.00 O ATOM 0 H TYR A 4 284.035 125.667 400.568 1.00 0.00 H new ATOM 0 HA TYR A 4 283.604 127.998 399.071 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.734 125.690 398.872 1.00 0.00 H new ATOM 0 HB3 TYR A 4 282.151 126.909 397.684 1.00 0.00 H new ATOM 0 HD1 TYR A 4 282.832 123.594 398.770 1.00 0.00 H new ATOM 0 HD2 TYR A 4 284.616 127.034 397.013 1.00 0.00 H new ATOM 0 HE1 TYR A 4 284.471 122.159 397.632 1.00 0.00 H new ATOM 0 HE2 TYR A 4 286.013 125.573 395.654 1.00 0.00 H new ATOM 0 HH TYR A 4 287.134 123.497 395.701 1.00 0.00 H new ATOM 77 N SER A 5 281.215 127.298 401.200 1.00 0.00 N ATOM 78 CA SER A 5 279.932 127.709 401.793 1.00 0.00 C ATOM 79 C SER A 5 279.924 128.988 402.606 1.00 0.00 C ATOM 80 O SER A 5 279.136 129.861 402.279 1.00 0.00 O ATOM 81 CB SER A 5 279.165 126.574 402.552 1.00 0.00 C ATOM 82 OG SER A 5 279.168 125.323 401.857 1.00 0.00 O ATOM 0 H SER A 5 281.481 126.360 401.499 1.00 0.00 H new ATOM 0 HA SER A 5 279.378 127.944 400.884 1.00 0.00 H new ATOM 0 HB2 SER A 5 279.615 126.436 403.535 1.00 0.00 H new ATOM 0 HB3 SER A 5 278.134 126.888 402.715 1.00 0.00 H new ATOM 0 HG SER A 5 278.676 124.657 402.381 1.00 0.00 H new ATOM 88 N GLY A 6 280.869 129.254 403.563 1.00 0.00 N ATOM 89 CA GLY A 6 281.122 130.547 404.204 1.00 0.00 C ATOM 90 C GLY A 6 281.371 131.727 403.293 1.00 0.00 C ATOM 91 O GLY A 6 280.991 132.851 403.574 1.00 0.00 O ATOM 0 H GLY A 6 281.493 128.526 403.910 1.00 0.00 H new ATOM 0 HA2 GLY A 6 280.268 130.783 404.839 1.00 0.00 H new ATOM 0 HA3 GLY A 6 281.986 130.437 404.860 1.00 0.00 H new ATOM 95 N LEU A 7 281.988 131.492 402.108 1.00 0.00 N ATOM 96 CA LEU A 7 282.298 132.466 401.064 1.00 0.00 C ATOM 97 C LEU A 7 281.086 132.851 400.257 1.00 0.00 C ATOM 98 O LEU A 7 280.771 134.033 400.107 1.00 0.00 O ATOM 99 CB LEU A 7 283.466 132.092 400.111 1.00 0.00 C ATOM 100 CG LEU A 7 284.868 131.989 400.751 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.870 131.160 401.995 1.00 0.00 C ATOM 102 CD2 LEU A 7 285.817 131.132 399.921 1.00 0.00 C ATOM 0 H LEU A 7 282.296 130.554 401.853 1.00 0.00 H new ATOM 0 HA LEU A 7 282.647 133.325 401.637 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.233 131.135 399.644 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.508 132.834 399.314 1.00 0.00 H new ATOM 0 HG LEU A 7 285.151 133.034 400.877 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.880 131.120 402.404 1.00 0.00 H new ATOM 0 HD12 LEU A 7 284.198 131.604 402.729 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.534 130.150 401.760 1.00 0.00 H new ATOM 0 HD21 LEU A 7 286.790 131.089 400.410 1.00 0.00 H new ATOM 0 HD22 LEU A 7 285.412 130.124 399.830 1.00 0.00 H new ATOM 0 HD23 LEU A 7 285.929 131.569 398.929 1.00 0.00 H new ATOM 114 N ARG A 8 280.345 131.828 399.743 1.00 0.00 N ATOM 115 CA ARG A 8 279.083 132.022 399.020 1.00 0.00 C ATOM 116 C ARG A 8 277.917 132.503 399.854 1.00 0.00 C ATOM 117 O ARG A 8 277.029 133.212 399.388 1.00 0.00 O ATOM 118 CB ARG A 8 278.695 130.871 398.024 1.00 0.00 C ATOM 119 CG ARG A 8 279.417 129.511 398.209 1.00 0.00 C ATOM 120 CD ARG A 8 278.990 128.453 397.157 1.00 0.00 C ATOM 121 NE ARG A 8 279.776 127.127 397.200 1.00 0.00 N ATOM 122 CZ ARG A 8 279.252 126.077 397.904 1.00 0.00 C ATOM 123 NH1 ARG A 8 278.306 126.275 398.864 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.698 124.822 397.617 1.00 0.00 N ATOM 0 H ARG A 8 280.619 130.849 399.826 1.00 0.00 H new ATOM 0 HA ARG A 8 279.329 132.872 398.383 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.622 130.699 398.105 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.886 131.221 397.010 1.00 0.00 H new ATOM 0 HG2 ARG A 8 280.494 129.665 398.145 1.00 0.00 H new ATOM 0 HG3 ARG A 8 279.209 129.128 399.208 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.931 128.233 397.296 1.00 0.00 H new ATOM 0 HD3 ARG A 8 279.098 128.888 396.164 1.00 0.00 H new ATOM 0 HE ARG A 8 280.668 127.034 396.714 1.00 0.00 H new ATOM 0 HH11 ARG A 8 277.977 127.218 399.068 1.00 0.00 H new ATOM 0 HH12 ARG A 8 277.927 125.480 399.378 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.404 124.685 396.894 1.00 0.00 H new ATOM 0 HH22 ARG A 8 279.326 124.020 398.125 1.00 0.00 H new ATOM 138 N THR A 9 277.908 132.102 401.138 1.00 0.00 N ATOM 139 CA THR A 9 276.918 132.499 402.132 1.00 0.00 C ATOM 140 C THR A 9 277.223 133.859 402.760 1.00 0.00 C ATOM 141 O THR A 9 276.337 134.701 402.833 1.00 0.00 O ATOM 142 CB THR A 9 276.576 131.324 403.046 1.00 0.00 C ATOM 143 OG1 THR A 9 275.209 131.288 403.415 1.00 0.00 O ATOM 144 CG2 THR A 9 277.406 131.179 404.329 1.00 0.00 C ATOM 0 H THR A 9 278.616 131.473 401.516 1.00 0.00 H new ATOM 0 HA THR A 9 275.963 132.721 401.655 1.00 0.00 H new ATOM 0 HB THR A 9 276.835 130.484 402.402 1.00 0.00 H new ATOM 0 HG1 THR A 9 275.048 130.516 403.997 1.00 0.00 H new ATOM 0 HG21 THR A 9 277.063 130.308 404.887 1.00 0.00 H new ATOM 0 HG22 THR A 9 278.457 131.054 404.070 1.00 0.00 H new ATOM 0 HG23 THR A 9 277.287 132.072 404.942 1.00 0.00 H new ATOM 152 N ILE A 10 278.481 134.188 403.174 1.00 0.00 N ATOM 153 CA ILE A 10 278.797 135.516 403.712 1.00 0.00 C ATOM 154 C ILE A 10 279.196 136.557 402.630 1.00 0.00 C ATOM 155 O ILE A 10 278.928 137.740 402.841 1.00 0.00 O ATOM 156 CB ILE A 10 279.814 135.449 404.881 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.288 134.675 406.132 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.221 136.839 405.440 1.00 0.00 C ATOM 159 CD1 ILE A 10 279.742 133.223 406.295 1.00 0.00 C ATOM 0 H ILE A 10 279.275 133.549 403.140 1.00 0.00 H new ATOM 0 HA ILE A 10 277.861 135.890 404.127 1.00 0.00 H new ATOM 0 HB ILE A 10 280.655 134.939 404.412 1.00 0.00 H new ATOM 0 HG12 ILE A 10 279.591 135.226 407.023 1.00 0.00 H new ATOM 0 HG13 ILE A 10 278.198 134.688 406.104 1.00 0.00 H new ATOM 0 HG21 ILE A 10 280.934 136.709 406.254 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.679 137.430 404.647 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.336 137.355 405.812 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.305 132.805 407.202 1.00 0.00 H new ATOM 0 HD12 ILE A 10 279.415 132.641 405.433 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.829 133.187 406.366 1.00 0.00 H new ATOM 171 N PHE A 11 279.854 136.234 401.458 1.00 0.00 N ATOM 172 CA PHE A 11 280.346 137.324 400.576 1.00 0.00 C ATOM 173 C PHE A 11 279.663 137.306 399.217 1.00 0.00 C ATOM 174 O PHE A 11 279.388 138.352 398.628 1.00 0.00 O ATOM 175 CB PHE A 11 281.909 137.491 400.505 1.00 0.00 C ATOM 176 CG PHE A 11 282.599 136.973 401.747 1.00 0.00 C ATOM 177 CD1 PHE A 11 282.603 137.652 402.956 1.00 0.00 C ATOM 178 CD2 PHE A 11 283.262 135.769 401.678 1.00 0.00 C ATOM 179 CE1 PHE A 11 283.229 137.102 404.066 1.00 0.00 C ATOM 180 CE2 PHE A 11 283.940 135.243 402.756 1.00 0.00 C ATOM 181 CZ PHE A 11 283.905 135.904 403.961 1.00 0.00 C ATOM 0 H PHE A 11 280.040 135.286 401.131 1.00 0.00 H new ATOM 0 HA PHE A 11 280.039 138.244 401.073 1.00 0.00 H new ATOM 0 HB2 PHE A 11 282.290 136.960 399.633 1.00 0.00 H new ATOM 0 HB3 PHE A 11 282.154 138.544 400.369 1.00 0.00 H new ATOM 0 HD1 PHE A 11 282.117 138.613 403.034 1.00 0.00 H new ATOM 0 HD2 PHE A 11 283.250 135.219 400.749 1.00 0.00 H new ATOM 0 HE1 PHE A 11 283.187 137.614 405.016 1.00 0.00 H new ATOM 0 HE2 PHE A 11 284.493 134.321 402.655 1.00 0.00 H new ATOM 0 HZ PHE A 11 284.405 135.487 404.823 1.00 0.00 H new ATOM 191 N GLY A 12 279.267 136.098 398.745 1.00 0.00 N ATOM 192 CA GLY A 12 278.306 135.943 397.650 1.00 0.00 C ATOM 193 C GLY A 12 278.784 135.369 396.339 1.00 0.00 C ATOM 194 O GLY A 12 278.944 134.163 396.195 1.00 0.00 O ATOM 0 H GLY A 12 279.610 135.213 399.118 1.00 0.00 H new ATOM 0 HA2 GLY A 12 277.494 135.311 398.010 1.00 0.00 H new ATOM 0 HA3 GLY A 12 277.879 136.925 397.444 1.00 0.00 H new ATOM 198 N GLU A 13 278.942 136.226 395.290 1.00 0.00 N ATOM 199 CA GLU A 13 279.084 135.862 393.869 1.00 0.00 C ATOM 200 C GLU A 13 280.251 135.020 393.324 1.00 0.00 C ATOM 201 O GLU A 13 280.013 134.000 392.684 1.00 0.00 O ATOM 202 CB GLU A 13 278.942 137.162 393.023 1.00 0.00 C ATOM 203 CG GLU A 13 278.656 136.949 391.518 1.00 0.00 C ATOM 204 CD GLU A 13 278.439 138.301 390.839 1.00 0.00 C ATOM 205 OE1 GLU A 13 279.256 138.653 389.945 1.00 0.00 O ATOM 206 OE2 GLU A 13 277.454 138.998 391.201 1.00 0.00 O1- ATOM 0 H GLU A 13 278.974 137.236 395.431 1.00 0.00 H new ATOM 0 HA GLU A 13 278.291 135.120 393.776 1.00 0.00 H new ATOM 0 HB2 GLU A 13 278.138 137.764 393.446 1.00 0.00 H new ATOM 0 HB3 GLU A 13 279.860 137.741 393.122 1.00 0.00 H new ATOM 0 HG2 GLU A 13 279.490 136.426 391.050 1.00 0.00 H new ATOM 0 HG3 GLU A 13 277.774 136.321 391.391 1.00 0.00 H new ATOM 213 N LYS A 14 281.538 135.398 393.528 1.00 0.00 N ATOM 214 CA LYS A 14 282.700 134.635 393.051 1.00 0.00 C ATOM 215 C LYS A 14 283.303 133.963 394.275 1.00 0.00 C ATOM 216 O LYS A 14 282.605 133.514 395.179 1.00 0.00 O ATOM 217 CB LYS A 14 283.718 135.585 392.339 1.00 0.00 C ATOM 218 CG LYS A 14 284.763 134.926 391.403 1.00 0.00 C ATOM 219 CD LYS A 14 285.900 135.889 391.021 1.00 0.00 C ATOM 220 CE LYS A 14 285.453 137.071 390.151 1.00 0.00 C ATOM 221 NZ LYS A 14 286.609 137.930 389.798 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.791 136.248 394.032 1.00 0.00 H new ATOM 0 HA LYS A 14 282.419 133.885 392.312 1.00 0.00 H new ATOM 0 HB2 LYS A 14 283.152 136.311 391.756 1.00 0.00 H new ATOM 0 HB3 LYS A 14 284.255 136.142 393.107 1.00 0.00 H new ATOM 0 HG2 LYS A 14 285.184 134.048 391.894 1.00 0.00 H new ATOM 0 HG3 LYS A 14 284.267 134.577 390.497 1.00 0.00 H new ATOM 0 HD2 LYS A 14 286.357 136.275 391.932 1.00 0.00 H new ATOM 0 HD3 LYS A 14 286.671 135.331 390.489 1.00 0.00 H new ATOM 0 HE2 LYS A 14 284.978 136.701 389.242 1.00 0.00 H new ATOM 0 HE3 LYS A 14 284.706 137.659 390.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 286.285 138.724 389.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 287.045 138.299 390.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 287.309 137.371 389.270 1.00 0.00 H new ATOM 235 N LEU A 15 284.638 133.946 394.393 1.00 0.00 N ATOM 236 CA LEU A 15 285.348 133.570 395.587 1.00 0.00 C ATOM 237 C LEU A 15 286.086 134.848 395.934 1.00 0.00 C ATOM 238 O LEU A 15 286.640 135.452 395.013 1.00 0.00 O ATOM 239 CB LEU A 15 286.348 132.455 395.292 1.00 0.00 C ATOM 240 CG LEU A 15 285.734 131.066 395.274 1.00 0.00 C ATOM 241 CD1 LEU A 15 286.416 130.236 394.192 1.00 0.00 C ATOM 242 CD2 LEU A 15 285.844 130.426 396.654 1.00 0.00 C ATOM 0 H LEU A 15 285.258 134.205 393.626 1.00 0.00 H new ATOM 0 HA LEU A 15 284.700 133.197 396.380 1.00 0.00 H new ATOM 0 HB2 LEU A 15 286.817 132.647 394.327 1.00 0.00 H new ATOM 0 HB3 LEU A 15 287.139 132.482 396.041 1.00 0.00 H new ATOM 0 HG LEU A 15 284.672 131.123 395.036 1.00 0.00 H new ATOM 0 HD11 LEU A 15 285.981 129.237 394.172 1.00 0.00 H new ATOM 0 HD12 LEU A 15 286.273 130.714 393.223 1.00 0.00 H new ATOM 0 HD13 LEU A 15 287.482 130.164 394.407 1.00 0.00 H new ATOM 0 HD21 LEU A 15 285.401 129.431 396.630 1.00 0.00 H new ATOM 0 HD22 LEU A 15 286.894 130.349 396.937 1.00 0.00 H new ATOM 0 HD23 LEU A 15 285.316 131.041 397.383 1.00 0.00 H new ATOM 254 N PRO A 16 286.183 135.299 397.172 1.00 0.00 N ATOM 255 CA PRO A 16 286.909 136.505 397.538 1.00 0.00 C ATOM 256 C PRO A 16 288.409 136.279 397.711 1.00 0.00 C ATOM 257 O PRO A 16 288.875 135.150 397.845 1.00 0.00 O ATOM 258 CB PRO A 16 286.298 136.811 398.899 1.00 0.00 C ATOM 259 CG PRO A 16 286.063 135.431 399.530 1.00 0.00 C ATOM 260 CD PRO A 16 285.625 134.609 398.327 1.00 0.00 C ATOM 0 HA PRO A 16 286.827 137.284 396.780 1.00 0.00 H new ATOM 0 HB2 PRO A 16 286.968 137.418 399.508 1.00 0.00 H new ATOM 0 HB3 PRO A 16 285.366 137.367 398.800 1.00 0.00 H new ATOM 0 HG2 PRO A 16 286.967 135.033 399.990 1.00 0.00 H new ATOM 0 HG3 PRO A 16 285.297 135.461 400.305 1.00 0.00 H new ATOM 0 HD2 PRO A 16 285.996 133.586 398.392 1.00 0.00 H new ATOM 0 HD3 PRO A 16 284.538 134.550 398.264 1.00 0.00 H new ATOM 268 N GLU A 17 289.172 137.392 397.791 1.00 0.00 N ATOM 269 CA GLU A 17 290.601 137.433 398.030 1.00 0.00 C ATOM 270 C GLU A 17 291.001 137.165 399.490 1.00 0.00 C ATOM 271 O GLU A 17 290.231 137.281 400.446 1.00 0.00 O ATOM 272 CB GLU A 17 291.138 138.818 397.605 1.00 0.00 C ATOM 273 CG GLU A 17 290.868 139.144 396.123 1.00 0.00 C ATOM 274 CD GLU A 17 291.430 140.527 395.797 1.00 0.00 C ATOM 275 OE1 GLU A 17 290.624 141.431 395.451 1.00 0.00 O ATOM 276 OE2 GLU A 17 292.676 140.698 395.891 1.00 0.00 O1- ATOM 0 H GLU A 17 288.771 138.324 397.683 1.00 0.00 H new ATOM 0 HA GLU A 17 291.039 136.629 397.439 1.00 0.00 H new ATOM 0 HB2 GLU A 17 290.680 139.585 398.229 1.00 0.00 H new ATOM 0 HB3 GLU A 17 292.212 138.857 397.789 1.00 0.00 H new ATOM 0 HG2 GLU A 17 291.330 138.392 395.484 1.00 0.00 H new ATOM 0 HG3 GLU A 17 289.797 139.118 395.923 1.00 0.00 H new ATOM 283 N SER A 18 292.282 136.798 399.672 1.00 0.00 N ATOM 284 CA SER A 18 292.988 136.417 400.885 1.00 0.00 C ATOM 285 C SER A 18 293.040 137.347 402.084 1.00 0.00 C ATOM 286 O SER A 18 293.236 136.851 403.193 1.00 0.00 O ATOM 287 CB SER A 18 294.356 135.819 400.543 1.00 0.00 C ATOM 288 OG SER A 18 294.924 136.582 399.477 1.00 0.00 O ATOM 0 H SER A 18 292.912 136.761 398.870 1.00 0.00 H new ATOM 0 HA SER A 18 292.308 135.672 401.297 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.009 135.841 401.416 1.00 0.00 H new ATOM 0 HB3 SER A 18 294.251 134.775 400.249 1.00 0.00 H new ATOM 0 HG SER A 18 295.802 136.215 399.244 1.00 0.00 H new ATOM 294 N HIS A 19 292.845 138.696 401.909 1.00 0.00 N ATOM 295 CA HIS A 19 292.752 139.729 402.955 1.00 0.00 C ATOM 296 C HIS A 19 291.557 139.484 403.882 1.00 0.00 C ATOM 297 O HIS A 19 291.699 139.486 405.098 1.00 0.00 O ATOM 298 CB HIS A 19 292.762 141.182 402.394 1.00 0.00 C ATOM 299 CG HIS A 19 291.667 141.494 401.405 1.00 0.00 C ATOM 300 ND1 HIS A 19 290.391 141.921 401.622 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 291.778 141.322 400.042 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 289.700 142.003 400.429 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 290.568 141.636 399.511 1.00 0.00 N flip ATOM 0 H HIS A 19 292.745 139.095 400.976 1.00 0.00 H new ATOM 0 HA HIS A 19 293.661 139.637 403.550 1.00 0.00 H new ATOM 0 HB2 HIS A 19 292.685 141.878 403.229 1.00 0.00 H new ATOM 0 HB3 HIS A 19 293.725 141.364 401.916 1.00 0.00 H new ATOM 0 HD1 HIS A 19 290.001 142.148 402.537 1.00 0.00 H new ATOM 0 HD2 HIS A 19 292.656 141.000 399.502 1.00 0.00 H new ATOM 0 HE1 HIS A 19 288.673 142.303 400.282 1.00 0.00 H new ATOM 311 N ILE A 20 290.364 139.144 403.301 1.00 0.00 N ATOM 312 CA ILE A 20 289.276 138.489 404.036 1.00 0.00 C ATOM 313 C ILE A 20 289.512 137.001 404.230 1.00 0.00 C ATOM 314 O ILE A 20 289.328 136.500 405.339 1.00 0.00 O ATOM 315 CB ILE A 20 287.832 138.711 403.522 1.00 0.00 C ATOM 316 CG1 ILE A 20 287.421 137.882 402.285 1.00 0.00 C ATOM 317 CG2 ILE A 20 287.632 140.186 403.130 1.00 0.00 C ATOM 318 CD1 ILE A 20 285.977 138.158 401.891 1.00 0.00 C ATOM 0 H ILE A 20 290.149 139.322 402.320 1.00 0.00 H new ATOM 0 HA ILE A 20 289.324 139.016 404.989 1.00 0.00 H new ATOM 0 HB ILE A 20 287.212 138.389 404.359 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.080 138.119 401.450 1.00 0.00 H new ATOM 0 HG13 ILE A 20 287.546 136.820 402.498 1.00 0.00 H new ATOM 0 HG21 ILE A 20 286.614 140.332 402.770 1.00 0.00 H new ATOM 0 HG22 ILE A 20 287.804 140.820 404.000 1.00 0.00 H new ATOM 0 HG23 ILE A 20 288.337 140.452 402.342 1.00 0.00 H new ATOM 0 HD11 ILE A 20 285.718 137.560 401.017 1.00 0.00 H new ATOM 0 HD12 ILE A 20 285.318 137.896 402.719 1.00 0.00 H new ATOM 0 HD13 ILE A 20 285.860 139.216 401.654 1.00 0.00 H new ATOM 330 N PHE A 21 289.899 136.237 403.143 1.00 0.00 N ATOM 331 CA PHE A 21 289.895 134.773 403.128 1.00 0.00 C ATOM 332 C PHE A 21 290.831 134.147 404.200 1.00 0.00 C ATOM 333 O PHE A 21 290.364 133.368 405.023 1.00 0.00 O ATOM 334 CB PHE A 21 289.943 134.210 401.644 1.00 0.00 C ATOM 335 CG PHE A 21 289.458 132.782 401.367 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.312 131.839 402.364 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.309 132.316 400.056 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.277 130.499 402.098 1.00 0.00 C ATOM 339 CE2 PHE A 21 289.144 130.957 399.801 1.00 0.00 C ATOM 340 CZ PHE A 21 289.202 130.037 400.828 1.00 0.00 C ATOM 0 H PHE A 21 290.218 136.648 402.266 1.00 0.00 H new ATOM 0 HA PHE A 21 288.933 134.405 403.484 1.00 0.00 H new ATOM 0 HB2 PHE A 21 289.355 134.883 401.019 1.00 0.00 H new ATOM 0 HB3 PHE A 21 290.976 134.278 401.301 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.222 132.171 403.388 1.00 0.00 H new ATOM 0 HD2 PHE A 21 289.322 133.017 399.234 1.00 0.00 H new ATOM 0 HE1 PHE A 21 289.310 129.795 402.917 1.00 0.00 H new ATOM 0 HE2 PHE A 21 288.969 130.620 398.790 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.188 128.977 400.624 1.00 0.00 H new ATOM 350 N PHE A 22 292.146 134.514 404.281 1.00 0.00 N ATOM 351 CA PHE A 22 293.087 134.065 405.328 1.00 0.00 C ATOM 352 C PHE A 22 292.883 134.786 406.699 1.00 0.00 C ATOM 353 O PHE A 22 293.507 134.383 407.680 1.00 0.00 O ATOM 354 CB PHE A 22 294.630 134.095 404.907 1.00 0.00 C ATOM 355 CG PHE A 22 295.174 132.927 404.050 1.00 0.00 C ATOM 356 CD1 PHE A 22 295.847 133.167 402.854 1.00 0.00 C ATOM 357 CD2 PHE A 22 295.168 131.596 404.464 1.00 0.00 C ATOM 358 CE1 PHE A 22 296.326 132.137 402.055 1.00 0.00 C ATOM 359 CE2 PHE A 22 295.610 130.562 403.668 1.00 0.00 C ATOM 360 CZ PHE A 22 296.124 130.821 402.426 1.00 0.00 C ATOM 0 H PHE A 22 292.578 135.142 403.603 1.00 0.00 H new ATOM 0 HA PHE A 22 292.823 133.015 405.454 1.00 0.00 H new ATOM 0 HB2 PHE A 22 294.809 135.021 404.361 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.224 134.144 405.820 1.00 0.00 H new ATOM 0 HD1 PHE A 22 296.001 134.188 402.538 1.00 0.00 H new ATOM 0 HD2 PHE A 22 294.800 131.365 405.453 1.00 0.00 H new ATOM 0 HE1 PHE A 22 296.857 132.365 401.143 1.00 0.00 H new ATOM 0 HE2 PHE A 22 295.551 129.544 404.025 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.367 130.014 401.750 1.00 0.00 H new ATOM 370 N ALA A 23 292.055 135.887 406.826 1.00 0.00 N ATOM 371 CA ALA A 23 291.906 136.602 408.105 1.00 0.00 C ATOM 372 C ALA A 23 290.554 136.567 408.844 1.00 0.00 C ATOM 373 O ALA A 23 290.529 136.790 410.055 1.00 0.00 O ATOM 374 CB ALA A 23 292.311 138.078 407.900 1.00 0.00 C ATOM 0 H ALA A 23 291.502 136.273 406.061 1.00 0.00 H new ATOM 0 HA ALA A 23 292.559 136.033 408.768 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.205 138.618 408.841 1.00 0.00 H new ATOM 0 HB2 ALA A 23 293.348 138.128 407.568 1.00 0.00 H new ATOM 0 HB3 ALA A 23 291.666 138.531 407.147 1.00 0.00 H new ATOM 380 N THR A 24 289.391 136.286 408.179 1.00 0.00 N ATOM 381 CA THR A 24 288.070 136.249 408.846 1.00 0.00 C ATOM 382 C THR A 24 287.669 134.832 409.177 1.00 0.00 C ATOM 383 O THR A 24 288.025 133.884 408.480 1.00 0.00 O ATOM 384 CB THR A 24 286.909 136.922 408.069 1.00 0.00 C ATOM 385 OG1 THR A 24 285.708 137.080 408.848 1.00 0.00 O ATOM 386 CG2 THR A 24 286.518 136.177 406.779 1.00 0.00 C ATOM 0 H THR A 24 289.353 136.083 407.180 1.00 0.00 H new ATOM 0 HA THR A 24 288.220 136.841 409.749 1.00 0.00 H new ATOM 0 HB THR A 24 287.320 137.901 407.821 1.00 0.00 H new ATOM 0 HG1 THR A 24 285.018 137.511 408.302 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.700 136.704 406.288 1.00 0.00 H new ATOM 0 HG22 THR A 24 287.377 136.135 406.109 1.00 0.00 H new ATOM 0 HG23 THR A 24 286.200 135.164 407.026 1.00 0.00 H new ATOM 394 N VAL A 25 286.806 134.682 410.227 1.00 0.00 N ATOM 395 CA VAL A 25 286.208 133.424 410.705 1.00 0.00 C ATOM 396 C VAL A 25 285.159 132.894 409.761 1.00 0.00 C ATOM 397 O VAL A 25 285.036 131.682 409.609 1.00 0.00 O ATOM 398 CB VAL A 25 285.573 133.425 412.101 1.00 0.00 C ATOM 399 CG1 VAL A 25 285.544 131.990 412.688 1.00 0.00 C ATOM 400 CG2 VAL A 25 286.405 134.330 413.023 1.00 0.00 C ATOM 0 H VAL A 25 286.502 135.483 410.781 1.00 0.00 H new ATOM 0 HA VAL A 25 287.094 132.791 410.756 1.00 0.00 H new ATOM 0 HB VAL A 25 284.550 133.793 412.026 1.00 0.00 H new ATOM 0 HG11 VAL A 25 285.090 132.011 413.679 1.00 0.00 H new ATOM 0 HG12 VAL A 25 284.960 131.342 412.035 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.562 131.607 412.763 1.00 0.00 H new ATOM 0 HG21 VAL A 25 285.963 134.339 414.019 1.00 0.00 H new ATOM 0 HG22 VAL A 25 287.425 133.950 413.082 1.00 0.00 H new ATOM 0 HG23 VAL A 25 286.418 135.344 412.623 1.00 0.00 H new ATOM 410 N ALA A 26 284.437 133.816 409.035 1.00 0.00 N ATOM 411 CA ALA A 26 283.445 133.602 407.972 1.00 0.00 C ATOM 412 C ALA A 26 283.940 132.647 406.880 1.00 0.00 C ATOM 413 O ALA A 26 283.186 131.876 406.296 1.00 0.00 O ATOM 414 CB ALA A 26 283.055 134.971 407.350 1.00 0.00 C ATOM 0 H ALA A 26 284.563 134.812 409.213 1.00 0.00 H new ATOM 0 HA ALA A 26 282.574 133.131 408.426 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.319 134.816 406.561 1.00 0.00 H new ATOM 0 HB2 ALA A 26 282.630 135.613 408.121 1.00 0.00 H new ATOM 0 HB3 ALA A 26 283.942 135.446 406.931 1.00 0.00 H new ATOM 420 N ALA A 27 285.279 132.677 406.697 1.00 0.00 N ATOM 421 CA ALA A 27 286.065 131.816 405.869 1.00 0.00 C ATOM 422 C ALA A 27 286.936 130.826 406.699 1.00 0.00 C ATOM 423 O ALA A 27 287.018 129.646 406.372 1.00 0.00 O ATOM 424 CB ALA A 27 286.859 132.785 404.967 1.00 0.00 C ATOM 0 H ALA A 27 285.857 133.368 407.174 1.00 0.00 H new ATOM 0 HA ALA A 27 285.465 131.135 405.265 1.00 0.00 H new ATOM 0 HB1 ALA A 27 287.496 132.214 404.292 1.00 0.00 H new ATOM 0 HB2 ALA A 27 286.165 133.392 404.385 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.477 133.435 405.586 1.00 0.00 H new ATOM 430 N HIS A 28 287.568 131.223 407.856 1.00 0.00 N ATOM 431 CA HIS A 28 288.459 130.389 408.721 1.00 0.00 C ATOM 432 C HIS A 28 287.945 129.028 409.250 1.00 0.00 C ATOM 433 O HIS A 28 288.694 128.063 409.392 1.00 0.00 O ATOM 434 CB HIS A 28 288.954 131.159 409.987 1.00 0.00 C ATOM 435 CG HIS A 28 290.267 130.698 410.569 1.00 0.00 C ATOM 436 ND1 HIS A 28 290.625 130.905 411.886 1.00 0.00 N ATOM 437 CD2 HIS A 28 291.319 130.049 409.997 1.00 0.00 C ATOM 438 CE1 HIS A 28 291.856 130.362 412.047 1.00 0.00 C ATOM 439 NE2 HIS A 28 292.314 129.831 410.932 1.00 0.00 N ATOM 0 H HIS A 28 287.462 132.170 408.219 1.00 0.00 H new ATOM 0 HA HIS A 28 289.237 130.171 407.990 1.00 0.00 H new ATOM 0 HB2 HIS A 28 289.042 132.216 409.734 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.189 131.079 410.759 1.00 0.00 H new ATOM 0 HD2 HIS A 28 291.369 129.748 408.961 1.00 0.00 H new ATOM 0 HE1 HIS A 28 292.398 130.364 412.981 1.00 0.00 H new ATOM 0 HE2 HIS A 28 293.208 129.361 410.789 1.00 0.00 H new ATOM 447 N LYS A 29 286.618 128.942 409.547 1.00 0.00 N ATOM 448 CA LYS A 29 285.863 127.769 410.040 1.00 0.00 C ATOM 449 C LYS A 29 285.761 126.557 409.076 1.00 0.00 C ATOM 450 O LYS A 29 285.386 125.447 409.448 1.00 0.00 O ATOM 451 CB LYS A 29 284.431 128.235 410.472 1.00 0.00 C ATOM 452 CG LYS A 29 283.607 128.818 409.307 1.00 0.00 C ATOM 453 CD LYS A 29 282.323 129.608 409.617 1.00 0.00 C ATOM 454 CE LYS A 29 282.280 130.439 410.907 1.00 0.00 C ATOM 455 NZ LYS A 29 281.011 131.200 410.995 1.00 0.00 N1+ ATOM 0 H LYS A 29 286.010 129.753 409.438 1.00 0.00 H new ATOM 0 HA LYS A 29 286.444 127.386 410.879 1.00 0.00 H new ATOM 0 HB2 LYS A 29 283.894 127.389 410.901 1.00 0.00 H new ATOM 0 HB3 LYS A 29 284.521 128.986 411.257 1.00 0.00 H new ATOM 0 HG2 LYS A 29 284.265 129.472 408.735 1.00 0.00 H new ATOM 0 HG3 LYS A 29 283.333 127.991 408.653 1.00 0.00 H new ATOM 0 HD2 LYS A 29 282.135 130.281 408.780 1.00 0.00 H new ATOM 0 HD3 LYS A 29 281.495 128.900 409.649 1.00 0.00 H new ATOM 0 HE2 LYS A 29 282.378 129.783 411.772 1.00 0.00 H new ATOM 0 HE3 LYS A 29 283.125 131.127 410.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 281.000 131.756 411.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 280.933 131.840 410.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 280.209 130.538 410.994 1.00 0.00 H new ATOM 469 N TYR A 30 286.086 126.808 407.793 1.00 0.00 N ATOM 470 CA TYR A 30 286.069 125.905 406.656 1.00 0.00 C ATOM 471 C TYR A 30 287.463 125.392 406.294 1.00 0.00 C ATOM 472 O TYR A 30 287.850 124.274 406.610 1.00 0.00 O ATOM 473 CB TYR A 30 285.564 126.761 405.493 1.00 0.00 C ATOM 474 CG TYR A 30 284.094 126.956 405.522 1.00 0.00 C ATOM 475 CD1 TYR A 30 283.532 128.074 406.100 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.291 126.086 404.829 1.00 0.00 C ATOM 477 CE1 TYR A 30 282.165 128.153 406.242 1.00 0.00 C ATOM 478 CE2 TYR A 30 281.928 126.232 404.859 1.00 0.00 C ATOM 479 CZ TYR A 30 281.366 127.195 405.673 1.00 0.00 C ATOM 480 OH TYR A 30 279.976 127.335 405.826 1.00 0.00 O ATOM 0 H TYR A 30 286.394 127.740 407.514 1.00 0.00 H new ATOM 0 HA TYR A 30 285.456 125.031 406.877 1.00 0.00 H new ATOM 0 HB2 TYR A 30 286.056 127.733 405.522 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.845 126.290 404.551 1.00 0.00 H new ATOM 0 HD1 TYR A 30 284.161 128.884 406.440 1.00 0.00 H new ATOM 0 HD2 TYR A 30 283.734 125.283 404.258 1.00 0.00 H new ATOM 0 HE1 TYR A 30 281.724 128.966 406.799 1.00 0.00 H new ATOM 0 HE2 TYR A 30 281.299 125.599 404.251 1.00 0.00 H new ATOM 0 HH TYR A 30 279.748 128.286 405.892 1.00 0.00 H new ATOM 490 N VAL A 31 288.250 126.261 405.605 1.00 0.00 N ATOM 491 CA VAL A 31 289.645 126.126 405.213 1.00 0.00 C ATOM 492 C VAL A 31 290.074 127.547 405.170 1.00 0.00 C ATOM 493 O VAL A 31 289.244 128.388 404.845 1.00 0.00 O ATOM 494 CB VAL A 31 290.043 125.543 403.831 1.00 0.00 C ATOM 495 CG1 VAL A 31 289.155 124.352 403.492 1.00 0.00 C ATOM 496 CG2 VAL A 31 290.391 126.481 402.628 1.00 0.00 C ATOM 0 H VAL A 31 287.870 127.153 405.289 1.00 0.00 H new ATOM 0 HA VAL A 31 290.085 125.408 405.905 1.00 0.00 H new ATOM 0 HB VAL A 31 291.071 125.221 403.999 1.00 0.00 H new ATOM 0 HG11 VAL A 31 289.442 123.949 402.520 1.00 0.00 H new ATOM 0 HG12 VAL A 31 289.274 123.581 404.254 1.00 0.00 H new ATOM 0 HG13 VAL A 31 288.114 124.672 403.459 1.00 0.00 H new ATOM 0 HG21 VAL A 31 290.642 125.877 401.756 1.00 0.00 H new ATOM 0 HG22 VAL A 31 289.532 127.111 402.398 1.00 0.00 H new ATOM 0 HG23 VAL A 31 291.242 127.109 402.891 1.00 0.00 H new ATOM 506 N PRO A 32 291.309 127.911 405.431 1.00 0.00 N ATOM 507 CA PRO A 32 291.688 129.310 405.409 1.00 0.00 C ATOM 508 C PRO A 32 291.997 129.979 404.056 1.00 0.00 C ATOM 509 O PRO A 32 291.648 131.138 403.949 1.00 0.00 O ATOM 510 CB PRO A 32 292.931 129.238 406.317 1.00 0.00 C ATOM 511 CG PRO A 32 293.561 127.857 406.133 1.00 0.00 C ATOM 512 CD PRO A 32 292.318 127.008 405.990 1.00 0.00 C ATOM 0 HA PRO A 32 290.860 129.951 405.713 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.642 130.021 406.054 1.00 0.00 H new ATOM 0 HB3 PRO A 32 292.653 129.396 407.359 1.00 0.00 H new ATOM 0 HG2 PRO A 32 294.202 127.807 405.253 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.170 127.561 406.987 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.494 126.157 405.333 1.00 0.00 H new ATOM 0 HD3 PRO A 32 292.000 126.607 406.952 1.00 0.00 H new ATOM 520 N SER A 33 292.641 129.343 403.042 1.00 0.00 N ATOM 521 CA SER A 33 292.959 129.918 401.716 1.00 0.00 C ATOM 522 C SER A 33 293.694 128.921 400.814 1.00 0.00 C ATOM 523 O SER A 33 293.835 127.745 401.183 1.00 0.00 O ATOM 524 CB SER A 33 293.189 131.456 401.455 1.00 0.00 C ATOM 525 OG SER A 33 292.224 132.023 400.581 1.00 0.00 O ATOM 0 H SER A 33 292.963 128.380 403.133 1.00 0.00 H new ATOM 0 HA SER A 33 291.940 130.077 401.364 1.00 0.00 H new ATOM 0 HB2 SER A 33 293.165 131.987 402.406 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.183 131.602 401.033 1.00 0.00 H new ATOM 0 HG SER A 33 291.327 131.883 400.949 1.00 0.00 H new ATOM 531 N TYR A 34 294.136 129.342 399.571 1.00 0.00 N ATOM 532 CA TYR A 34 294.814 128.616 398.447 1.00 0.00 C ATOM 533 C TYR A 34 295.963 127.653 398.800 1.00 0.00 C ATOM 534 O TYR A 34 296.271 126.708 398.076 1.00 0.00 O ATOM 535 CB TYR A 34 295.413 129.624 397.403 1.00 0.00 C ATOM 536 CG TYR A 34 294.522 130.798 397.084 1.00 0.00 C ATOM 537 CD1 TYR A 34 294.615 131.912 397.894 1.00 0.00 C ATOM 538 CD2 TYR A 34 293.701 130.849 395.960 1.00 0.00 C ATOM 539 CE1 TYR A 34 293.900 133.042 397.599 1.00 0.00 C ATOM 540 CE2 TYR A 34 293.011 132.010 395.620 1.00 0.00 C ATOM 541 CZ TYR A 34 293.122 133.095 396.474 1.00 0.00 C ATOM 542 OH TYR A 34 292.530 134.331 396.192 1.00 0.00 O ATOM 0 H TYR A 34 294.004 130.320 399.312 1.00 0.00 H new ATOM 0 HA TYR A 34 293.994 128.008 398.066 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.364 129.998 397.783 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.628 129.086 396.480 1.00 0.00 H new ATOM 0 HD1 TYR A 34 295.254 131.892 398.764 1.00 0.00 H new ATOM 0 HD2 TYR A 34 293.597 129.971 395.340 1.00 0.00 H new ATOM 0 HE1 TYR A 34 293.950 133.896 398.258 1.00 0.00 H new ATOM 0 HE2 TYR A 34 292.411 132.062 394.723 1.00 0.00 H new ATOM 0 HH TYR A 34 293.154 134.882 395.674 1.00 0.00 H new ATOM 552 N ALA A 35 296.558 127.847 399.995 1.00 0.00 N ATOM 553 CA ALA A 35 297.575 127.050 400.643 1.00 0.00 C ATOM 554 C ALA A 35 297.069 125.740 401.185 1.00 0.00 C ATOM 555 O ALA A 35 297.654 124.692 400.953 1.00 0.00 O ATOM 556 CB ALA A 35 298.114 127.872 401.846 1.00 0.00 C ATOM 0 H ALA A 35 296.301 128.648 400.572 1.00 0.00 H new ATOM 0 HA ALA A 35 298.332 126.820 399.893 1.00 0.00 H new ATOM 0 HB1 ALA A 35 298.886 127.300 402.361 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.537 128.810 401.486 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.298 128.084 402.537 1.00 0.00 H new ATOM 562 N PHE A 36 295.889 125.788 401.865 1.00 0.00 N ATOM 563 CA PHE A 36 295.114 124.652 402.319 1.00 0.00 C ATOM 564 C PHE A 36 294.424 124.053 401.088 1.00 0.00 C ATOM 565 O PHE A 36 294.493 122.851 400.840 1.00 0.00 O ATOM 566 CB PHE A 36 294.107 125.086 403.444 1.00 0.00 C ATOM 567 CG PHE A 36 293.280 123.902 403.989 1.00 0.00 C ATOM 568 CD1 PHE A 36 292.295 123.295 403.213 1.00 0.00 C ATOM 569 CD2 PHE A 36 293.439 123.412 405.276 1.00 0.00 C ATOM 570 CE1 PHE A 36 291.491 122.285 403.677 1.00 0.00 C ATOM 571 CE2 PHE A 36 292.598 122.421 405.770 1.00 0.00 C ATOM 572 CZ PHE A 36 291.609 121.869 404.976 1.00 0.00 C ATOM 0 H PHE A 36 295.451 126.676 402.112 1.00 0.00 H new ATOM 0 HA PHE A 36 295.746 123.890 402.774 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.659 125.546 404.263 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.432 125.845 403.049 1.00 0.00 H new ATOM 0 HD1 PHE A 36 292.158 123.636 402.197 1.00 0.00 H new ATOM 0 HD2 PHE A 36 294.226 123.805 405.903 1.00 0.00 H new ATOM 0 HE1 PHE A 36 290.769 121.821 403.021 1.00 0.00 H new ATOM 0 HE2 PHE A 36 292.719 122.078 406.787 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.940 121.121 405.375 1.00 0.00 H new ATOM 582 N LEU A 37 293.726 124.916 400.275 1.00 0.00 N ATOM 583 CA LEU A 37 293.003 124.449 399.071 1.00 0.00 C ATOM 584 C LEU A 37 293.828 123.790 397.951 1.00 0.00 C ATOM 585 O LEU A 37 293.342 122.871 397.290 1.00 0.00 O ATOM 586 CB LEU A 37 291.800 125.304 398.571 1.00 0.00 C ATOM 587 CG LEU A 37 291.992 126.811 398.518 1.00 0.00 C ATOM 588 CD1 LEU A 37 291.975 127.340 397.076 1.00 0.00 C ATOM 589 CD2 LEU A 37 291.024 127.640 399.354 1.00 0.00 C ATOM 0 H LEU A 37 293.658 125.920 400.441 1.00 0.00 H new ATOM 0 HA LEU A 37 292.508 123.594 399.532 1.00 0.00 H new ATOM 0 HB2 LEU A 37 291.535 124.962 397.570 1.00 0.00 H new ATOM 0 HB3 LEU A 37 290.946 125.095 399.215 1.00 0.00 H new ATOM 0 HG LEU A 37 292.975 126.942 398.970 1.00 0.00 H new ATOM 0 HD11 LEU A 37 292.115 128.421 397.083 1.00 0.00 H new ATOM 0 HD12 LEU A 37 292.780 126.873 396.508 1.00 0.00 H new ATOM 0 HD13 LEU A 37 291.018 127.102 396.612 1.00 0.00 H new ATOM 0 HD21 LEU A 37 291.257 128.698 399.238 1.00 0.00 H new ATOM 0 HD22 LEU A 37 290.003 127.454 399.020 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.118 127.361 400.403 1.00 0.00 H new ATOM 601 N ARG A 38 295.142 124.149 397.744 1.00 0.00 N ATOM 602 CA ARG A 38 295.991 123.407 396.791 1.00 0.00 C ATOM 603 C ARG A 38 296.295 121.972 397.213 1.00 0.00 C ATOM 604 O ARG A 38 296.240 121.049 396.408 1.00 0.00 O ATOM 605 CB ARG A 38 297.330 124.159 396.589 1.00 0.00 C ATOM 606 CG ARG A 38 298.363 123.531 395.629 1.00 0.00 C ATOM 607 CD ARG A 38 299.598 124.428 395.440 1.00 0.00 C ATOM 608 NE ARG A 38 300.405 124.446 396.719 1.00 0.00 N ATOM 609 CZ ARG A 38 300.502 125.517 397.570 1.00 0.00 C ATOM 610 NH1 ARG A 38 299.880 126.700 397.294 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 301.221 125.388 398.724 1.00 0.00 N ATOM 0 H ARG A 38 295.607 124.924 398.216 1.00 0.00 H new ATOM 0 HA ARG A 38 295.419 123.351 395.865 1.00 0.00 H new ATOM 0 HB2 ARG A 38 297.101 125.162 396.228 1.00 0.00 H new ATOM 0 HB3 ARG A 38 297.803 124.272 397.565 1.00 0.00 H new ATOM 0 HG2 ARG A 38 298.676 122.562 396.017 1.00 0.00 H new ATOM 0 HG3 ARG A 38 297.895 123.351 394.661 1.00 0.00 H new ATOM 0 HD2 ARG A 38 300.208 124.057 394.617 1.00 0.00 H new ATOM 0 HD3 ARG A 38 299.290 125.440 395.177 1.00 0.00 H new ATOM 0 HE ARG A 38 300.915 123.598 396.967 1.00 0.00 H new ATOM 0 HH11 ARG A 38 299.330 126.800 396.441 1.00 0.00 H new ATOM 0 HH12 ARG A 38 299.965 127.484 397.941 1.00 0.00 H new ATOM 0 HH21 ARG A 38 301.678 124.503 398.944 1.00 0.00 H new ATOM 0 HH22 ARG A 38 301.301 126.177 399.366 1.00 0.00 H new ATOM 625 N ARG A 39 296.567 121.769 398.531 1.00 0.00 N ATOM 626 CA ARG A 39 296.742 120.481 399.199 1.00 0.00 C ATOM 627 C ARG A 39 295.445 119.666 399.316 1.00 0.00 C ATOM 628 O ARG A 39 295.444 118.438 399.209 1.00 0.00 O ATOM 629 CB ARG A 39 297.459 120.641 400.565 1.00 0.00 C ATOM 630 CG ARG A 39 298.729 121.524 400.515 1.00 0.00 C ATOM 631 CD ARG A 39 299.727 121.255 399.371 1.00 0.00 C ATOM 632 NE ARG A 39 300.167 119.818 399.417 1.00 0.00 N ATOM 633 CZ ARG A 39 300.924 119.238 398.433 1.00 0.00 C ATOM 634 NH1 ARG A 39 301.342 119.960 397.354 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 301.262 117.920 398.537 1.00 0.00 N ATOM 0 H ARG A 39 296.673 122.551 399.177 1.00 0.00 H new ATOM 0 HA ARG A 39 297.392 119.893 398.551 1.00 0.00 H new ATOM 0 HB2 ARG A 39 296.759 121.071 401.282 1.00 0.00 H new ATOM 0 HB3 ARG A 39 297.731 119.654 400.938 1.00 0.00 H new ATOM 0 HG2 ARG A 39 298.414 122.566 400.451 1.00 0.00 H new ATOM 0 HG3 ARG A 39 299.259 121.408 401.460 1.00 0.00 H new ATOM 0 HD2 ARG A 39 299.262 121.473 398.410 1.00 0.00 H new ATOM 0 HD3 ARG A 39 300.590 121.914 399.465 1.00 0.00 H new ATOM 0 HE ARG A 39 299.889 119.249 400.217 1.00 0.00 H new ATOM 0 HH11 ARG A 39 301.092 120.945 397.272 1.00 0.00 H new ATOM 0 HH12 ARG A 39 301.905 119.515 396.629 1.00 0.00 H new ATOM 0 HH21 ARG A 39 300.951 117.376 399.342 1.00 0.00 H new ATOM 0 HH22 ARG A 39 301.825 117.479 397.810 1.00 0.00 H new ATOM 649 N GLU A 40 294.288 120.370 399.514 1.00 0.00 N ATOM 650 CA GLU A 40 292.940 119.815 399.587 1.00 0.00 C ATOM 651 C GLU A 40 292.351 119.382 398.241 1.00 0.00 C ATOM 652 O GLU A 40 291.639 118.380 398.194 1.00 0.00 O ATOM 653 CB GLU A 40 291.959 120.796 400.297 1.00 0.00 C ATOM 654 CG GLU A 40 290.557 120.240 400.647 1.00 0.00 C ATOM 655 CD GLU A 40 290.655 119.023 401.566 1.00 0.00 C ATOM 656 OE1 GLU A 40 291.219 119.162 402.684 1.00 0.00 O ATOM 657 OE2 GLU A 40 290.163 117.936 401.161 1.00 0.00 O1- ATOM 0 H GLU A 40 294.294 121.383 399.630 1.00 0.00 H new ATOM 0 HA GLU A 40 293.053 118.906 400.178 1.00 0.00 H new ATOM 0 HB2 GLU A 40 292.429 121.141 401.218 1.00 0.00 H new ATOM 0 HB3 GLU A 40 291.830 121.670 399.659 1.00 0.00 H new ATOM 0 HG2 GLU A 40 289.966 121.017 401.131 1.00 0.00 H new ATOM 0 HG3 GLU A 40 290.033 119.965 399.731 1.00 0.00 H new ATOM 664 N LEU A 41 292.600 120.098 397.097 1.00 0.00 N ATOM 665 CA LEU A 41 291.977 119.667 395.831 1.00 0.00 C ATOM 666 C LEU A 41 292.679 118.529 395.096 1.00 0.00 C ATOM 667 O LEU A 41 292.198 118.070 394.066 1.00 0.00 O ATOM 668 CB LEU A 41 291.968 120.805 394.764 1.00 0.00 C ATOM 669 CG LEU A 41 291.096 122.031 395.086 1.00 0.00 C ATOM 670 CD1 LEU A 41 291.365 123.122 394.035 1.00 0.00 C ATOM 671 CD2 LEU A 41 289.607 121.652 395.113 1.00 0.00 C ATOM 0 H LEU A 41 293.193 120.925 397.037 1.00 0.00 H new ATOM 0 HA LEU A 41 290.991 119.357 396.177 1.00 0.00 H new ATOM 0 HB2 LEU A 41 292.993 121.143 394.615 1.00 0.00 H new ATOM 0 HB3 LEU A 41 291.631 120.384 393.817 1.00 0.00 H new ATOM 0 HG LEU A 41 291.353 122.409 396.075 1.00 0.00 H new ATOM 0 HD11 LEU A 41 290.752 123.996 394.253 1.00 0.00 H new ATOM 0 HD12 LEU A 41 292.418 123.401 394.062 1.00 0.00 H new ATOM 0 HD13 LEU A 41 291.116 122.742 393.044 1.00 0.00 H new ATOM 0 HD21 LEU A 41 289.011 122.535 395.343 1.00 0.00 H new ATOM 0 HD22 LEU A 41 289.314 121.259 394.139 1.00 0.00 H new ATOM 0 HD23 LEU A 41 289.439 120.892 395.876 1.00 0.00 H new ATOM 683 N GLY A 42 293.895 118.126 395.546 1.00 0.00 N ATOM 684 CA GLY A 42 294.787 117.178 394.876 1.00 0.00 C ATOM 685 C GLY A 42 295.483 117.681 393.621 1.00 0.00 C ATOM 686 O GLY A 42 296.407 117.042 393.131 1.00 0.00 O ATOM 0 H GLY A 42 294.285 118.474 396.422 1.00 0.00 H new ATOM 0 HA2 GLY A 42 295.550 116.864 395.588 1.00 0.00 H new ATOM 0 HA3 GLY A 42 294.210 116.291 394.615 1.00 0.00 H new ATOM 690 N LEU A 43 295.049 118.838 393.049 1.00 0.00 N ATOM 691 CA LEU A 43 295.551 119.398 391.803 1.00 0.00 C ATOM 692 C LEU A 43 296.166 120.772 391.949 1.00 0.00 C ATOM 693 O LEU A 43 295.712 121.627 392.714 1.00 0.00 O ATOM 694 CB LEU A 43 294.519 119.313 390.624 1.00 0.00 C ATOM 695 CG LEU A 43 293.601 120.523 390.276 1.00 0.00 C ATOM 696 CD1 LEU A 43 292.751 120.212 389.029 1.00 0.00 C ATOM 697 CD2 LEU A 43 292.669 120.975 391.410 1.00 0.00 C ATOM 0 H LEU A 43 294.317 119.410 393.471 1.00 0.00 H new ATOM 0 HA LEU A 43 296.379 118.746 391.523 1.00 0.00 H new ATOM 0 HB2 LEU A 43 295.082 119.069 389.723 1.00 0.00 H new ATOM 0 HB3 LEU A 43 293.866 118.465 390.831 1.00 0.00 H new ATOM 0 HG LEU A 43 294.288 121.349 390.092 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.115 121.067 388.799 1.00 0.00 H new ATOM 0 HD12 LEU A 43 293.407 120.010 388.182 1.00 0.00 H new ATOM 0 HD13 LEU A 43 292.128 119.338 389.222 1.00 0.00 H new ATOM 0 HD21 LEU A 43 292.070 121.821 391.073 1.00 0.00 H new ATOM 0 HD22 LEU A 43 292.010 120.153 391.689 1.00 0.00 H new ATOM 0 HD23 LEU A 43 293.264 121.272 392.273 1.00 0.00 H new ATOM 709 N SER A 44 297.228 121.020 391.142 1.00 0.00 N ATOM 710 CA SER A 44 297.993 122.261 391.091 1.00 0.00 C ATOM 711 C SER A 44 297.467 123.272 390.087 1.00 0.00 C ATOM 712 O SER A 44 298.212 123.843 389.297 1.00 0.00 O ATOM 713 CB SER A 44 299.510 122.040 390.837 1.00 0.00 C ATOM 714 OG SER A 44 300.069 121.296 391.917 1.00 0.00 O ATOM 0 H SER A 44 297.578 120.321 390.486 1.00 0.00 H new ATOM 0 HA SER A 44 297.859 122.675 392.090 1.00 0.00 H new ATOM 0 HB2 SER A 44 299.659 121.506 389.898 1.00 0.00 H new ATOM 0 HB3 SER A 44 300.017 123.000 390.742 1.00 0.00 H new ATOM 0 HG SER A 44 301.025 121.155 391.757 1.00 0.00 H new ATOM 720 N SER A 45 296.143 123.606 390.163 1.00 0.00 N ATOM 721 CA SER A 45 295.483 124.741 389.467 1.00 0.00 C ATOM 722 C SER A 45 295.848 126.070 390.124 1.00 0.00 C ATOM 723 O SER A 45 295.595 127.153 389.618 1.00 0.00 O ATOM 724 CB SER A 45 293.925 124.650 389.366 1.00 0.00 C ATOM 725 OG SER A 45 293.569 123.699 388.367 1.00 0.00 O ATOM 0 H SER A 45 295.489 123.069 390.732 1.00 0.00 H new ATOM 0 HA SER A 45 295.865 124.682 388.448 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.504 124.358 390.328 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.508 125.626 389.119 1.00 0.00 H new ATOM 0 HG SER A 45 293.054 124.143 387.661 1.00 0.00 H new ATOM 731 N ALA A 46 296.490 125.974 391.306 1.00 0.00 N ATOM 732 CA ALA A 46 296.871 126.962 392.295 1.00 0.00 C ATOM 733 C ALA A 46 297.962 127.967 391.948 1.00 0.00 C ATOM 734 O ALA A 46 298.368 128.739 392.809 1.00 0.00 O ATOM 735 CB ALA A 46 297.172 126.216 393.598 1.00 0.00 C ATOM 0 H ALA A 46 296.791 125.051 391.620 1.00 0.00 H new ATOM 0 HA ALA A 46 296.015 127.633 392.373 1.00 0.00 H new ATOM 0 HB1 ALA A 46 297.463 126.931 394.368 1.00 0.00 H new ATOM 0 HB2 ALA A 46 296.282 125.676 393.922 1.00 0.00 H new ATOM 0 HB3 ALA A 46 297.985 125.509 393.433 1.00 0.00 H new ATOM 741 N HIS A 47 298.452 127.975 390.684 1.00 0.00 N ATOM 742 CA HIS A 47 299.437 128.867 390.096 1.00 0.00 C ATOM 743 C HIS A 47 298.892 130.271 389.778 1.00 0.00 C ATOM 744 O HIS A 47 299.639 131.248 389.799 1.00 0.00 O ATOM 745 CB HIS A 47 300.015 128.186 388.826 1.00 0.00 C ATOM 746 CG HIS A 47 300.688 126.865 389.132 1.00 0.00 C ATOM 747 ND1 HIS A 47 301.650 126.710 390.108 1.00 0.00 N ATOM 748 CD2 HIS A 47 300.535 125.630 388.570 1.00 0.00 C ATOM 749 CE1 HIS A 47 302.026 125.407 390.094 1.00 0.00 C ATOM 750 NE2 HIS A 47 301.379 124.712 389.181 1.00 0.00 N ATOM 0 H HIS A 47 298.128 127.289 390.003 1.00 0.00 H new ATOM 0 HA HIS A 47 300.222 129.034 390.834 1.00 0.00 H new ATOM 0 HB2 HIS A 47 299.212 128.023 388.108 1.00 0.00 H new ATOM 0 HB3 HIS A 47 300.734 128.856 388.354 1.00 0.00 H new ATOM 0 HD2 HIS A 47 299.854 125.400 387.764 1.00 0.00 H new ATOM 0 HE1 HIS A 47 302.770 124.988 390.755 1.00 0.00 H new ATOM 0 HE2 HIS A 47 301.476 123.719 388.970 1.00 0.00 H new ATOM 758 N THR A 48 297.561 130.398 389.494 1.00 0.00 N ATOM 759 CA THR A 48 296.875 131.669 389.262 1.00 0.00 C ATOM 760 C THR A 48 295.554 131.645 390.020 1.00 0.00 C ATOM 761 O THR A 48 294.858 130.622 390.095 1.00 0.00 O ATOM 762 CB THR A 48 296.679 132.138 387.779 1.00 0.00 C ATOM 763 OG1 THR A 48 295.410 131.870 387.172 1.00 0.00 O ATOM 764 CG2 THR A 48 297.753 131.563 386.838 1.00 0.00 C ATOM 0 H THR A 48 296.939 129.593 389.423 1.00 0.00 H new ATOM 0 HA THR A 48 297.556 132.431 389.639 1.00 0.00 H new ATOM 0 HB THR A 48 296.759 133.219 387.891 1.00 0.00 H new ATOM 0 HG1 THR A 48 295.350 132.345 386.317 1.00 0.00 H new ATOM 0 HG21 THR A 48 297.574 131.917 385.823 1.00 0.00 H new ATOM 0 HG22 THR A 48 298.739 131.891 387.168 1.00 0.00 H new ATOM 0 HG23 THR A 48 297.708 130.474 386.856 1.00 0.00 H new ATOM 772 N ASN A 49 295.120 132.844 390.515 1.00 0.00 N ATOM 773 CA ASN A 49 293.848 133.097 391.199 1.00 0.00 C ATOM 774 C ASN A 49 292.630 132.840 390.300 1.00 0.00 C ATOM 775 O ASN A 49 291.599 132.403 390.779 1.00 0.00 O ATOM 776 CB ASN A 49 293.836 134.546 391.783 1.00 0.00 C ATOM 777 CG ASN A 49 293.173 134.700 393.160 1.00 0.00 C ATOM 778 OD1 ASN A 49 293.830 135.102 394.125 1.00 0.00 O ATOM 779 ND2 ASN A 49 291.855 134.395 393.300 1.00 0.00 N ATOM 0 H ASN A 49 295.687 133.688 390.435 1.00 0.00 H new ATOM 0 HA ASN A 49 293.767 132.385 392.021 1.00 0.00 H new ATOM 0 HB2 ASN A 49 294.865 134.899 391.853 1.00 0.00 H new ATOM 0 HB3 ASN A 49 293.323 135.199 391.077 1.00 0.00 H new ATOM 0 HD21 ASN A 49 291.401 134.498 394.208 1.00 0.00 H new ATOM 0 HD22 ASN A 49 291.320 134.064 392.497 1.00 0.00 H new ATOM 786 N ARG A 50 292.784 133.061 388.968 1.00 0.00 N ATOM 787 CA ARG A 50 291.851 132.854 387.871 1.00 0.00 C ATOM 788 C ARG A 50 291.625 131.386 387.500 1.00 0.00 C ATOM 789 O ARG A 50 290.488 130.967 387.319 1.00 0.00 O ATOM 790 CB ARG A 50 292.299 133.650 386.605 1.00 0.00 C ATOM 791 CG ARG A 50 292.834 135.075 386.889 1.00 0.00 C ATOM 792 CD ARG A 50 294.337 135.129 387.246 1.00 0.00 C ATOM 793 NE ARG A 50 294.681 136.521 387.705 1.00 0.00 N ATOM 794 CZ ARG A 50 295.715 136.802 388.561 1.00 0.00 C ATOM 795 NH1 ARG A 50 296.511 135.810 389.055 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 295.947 138.096 388.928 1.00 0.00 N ATOM 0 H ARG A 50 293.668 133.429 388.618 1.00 0.00 H new ATOM 0 HA ARG A 50 290.896 133.229 388.237 1.00 0.00 H new ATOM 0 HB2 ARG A 50 293.075 133.082 386.092 1.00 0.00 H new ATOM 0 HB3 ARG A 50 291.453 133.724 385.922 1.00 0.00 H new ATOM 0 HG2 ARG A 50 292.658 135.698 386.012 1.00 0.00 H new ATOM 0 HG3 ARG A 50 292.262 135.509 387.709 1.00 0.00 H new ATOM 0 HD2 ARG A 50 294.564 134.407 388.030 1.00 0.00 H new ATOM 0 HD3 ARG A 50 294.940 134.858 386.379 1.00 0.00 H new ATOM 0 HE ARG A 50 294.115 137.297 387.361 1.00 0.00 H new ATOM 0 HH11 ARG A 50 296.342 134.840 388.789 1.00 0.00 H new ATOM 0 HH12 ARG A 50 297.275 136.038 389.691 1.00 0.00 H new ATOM 0 HH21 ARG A 50 295.354 138.843 388.566 1.00 0.00 H new ATOM 0 HH22 ARG A 50 296.713 138.316 389.564 1.00 0.00 H new ATOM 810 N LYS A 51 292.717 130.563 387.399 1.00 0.00 N ATOM 811 CA LYS A 51 292.714 129.107 387.140 1.00 0.00 C ATOM 812 C LYS A 51 292.227 128.287 388.338 1.00 0.00 C ATOM 813 O LYS A 51 291.362 127.393 388.231 1.00 0.00 O ATOM 814 CB LYS A 51 294.104 128.581 386.666 1.00 0.00 C ATOM 815 CG LYS A 51 294.340 128.640 385.140 1.00 0.00 C ATOM 816 CD LYS A 51 294.487 130.048 384.550 1.00 0.00 C ATOM 817 CE LYS A 51 294.626 130.061 383.019 1.00 0.00 C ATOM 818 NZ LYS A 51 295.862 129.369 382.579 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.664 130.928 387.503 1.00 0.00 H new ATOM 0 HA LYS A 51 292.000 128.968 386.328 1.00 0.00 H new ATOM 0 HB2 LYS A 51 294.883 129.161 387.161 1.00 0.00 H new ATOM 0 HB3 LYS A 51 294.216 127.548 386.996 1.00 0.00 H new ATOM 0 HG2 LYS A 51 295.240 128.071 384.907 1.00 0.00 H new ATOM 0 HG3 LYS A 51 293.509 128.141 384.642 1.00 0.00 H new ATOM 0 HD2 LYS A 51 293.619 130.644 384.833 1.00 0.00 H new ATOM 0 HD3 LYS A 51 295.361 130.528 384.990 1.00 0.00 H new ATOM 0 HE2 LYS A 51 293.758 129.578 382.570 1.00 0.00 H new ATOM 0 HE3 LYS A 51 294.638 131.091 382.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 295.959 129.455 381.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 296.686 129.803 383.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 295.808 128.363 382.839 1.00 0.00 H new ATOM 832 N VAL A 52 292.742 128.616 389.580 1.00 0.00 N ATOM 833 CA VAL A 52 292.280 127.964 390.820 1.00 0.00 C ATOM 834 C VAL A 52 290.862 128.352 391.141 1.00 0.00 C ATOM 835 O VAL A 52 290.061 127.447 391.309 1.00 0.00 O ATOM 836 CB VAL A 52 293.211 128.031 392.038 1.00 0.00 C ATOM 837 CG1 VAL A 52 293.324 129.449 392.647 1.00 0.00 C ATOM 838 CG2 VAL A 52 292.889 126.918 393.091 1.00 0.00 C ATOM 0 H VAL A 52 293.465 129.321 389.724 1.00 0.00 H new ATOM 0 HA VAL A 52 292.312 126.901 390.582 1.00 0.00 H new ATOM 0 HB VAL A 52 294.213 127.812 391.669 1.00 0.00 H new ATOM 0 HG11 VAL A 52 293.997 129.424 393.504 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.716 130.137 391.897 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.339 129.786 392.969 1.00 0.00 H new ATOM 0 HG21 VAL A 52 293.574 127.006 393.934 1.00 0.00 H new ATOM 0 HG22 VAL A 52 291.864 127.035 393.442 1.00 0.00 H new ATOM 0 HG23 VAL A 52 293.005 125.937 392.630 1.00 0.00 H new ATOM 848 N TRP A 53 290.479 129.674 391.083 1.00 0.00 N ATOM 849 CA TRP A 53 289.097 130.172 391.179 1.00 0.00 C ATOM 850 C TRP A 53 288.153 129.609 390.150 1.00 0.00 C ATOM 851 O TRP A 53 286.990 129.400 390.428 1.00 0.00 O ATOM 852 CB TRP A 53 288.887 131.683 391.324 1.00 0.00 C ATOM 853 CG TRP A 53 289.191 132.362 392.623 1.00 0.00 C ATOM 854 CD1 TRP A 53 288.736 133.621 392.880 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.614 131.806 393.883 1.00 0.00 C ATOM 856 NE1 TRP A 53 288.886 133.916 394.206 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.476 132.822 394.824 1.00 0.00 C ATOM 858 CE3 TRP A 53 290.028 130.549 394.257 1.00 0.00 C ATOM 859 CZ2 TRP A 53 289.814 132.600 396.124 1.00 0.00 C ATOM 860 CZ3 TRP A 53 290.275 130.312 395.586 1.00 0.00 C ATOM 861 CH2 TRP A 53 290.206 131.336 396.497 1.00 0.00 C ATOM 0 H TRP A 53 291.157 130.426 390.965 1.00 0.00 H new ATOM 0 HA TRP A 53 288.836 129.763 392.155 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.489 132.169 390.556 1.00 0.00 H new ATOM 0 HB3 TRP A 53 287.843 131.889 391.088 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.317 134.289 392.142 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.613 134.787 394.661 1.00 0.00 H new ATOM 0 HE3 TRP A 53 290.156 129.767 393.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.775 133.401 396.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 290.525 129.315 395.917 1.00 0.00 H new ATOM 0 HH2 TRP A 53 290.465 131.145 397.528 1.00 0.00 H new ATOM 872 N LYS A 54 288.639 129.295 388.934 1.00 0.00 N ATOM 873 CA LYS A 54 287.907 128.548 387.915 1.00 0.00 C ATOM 874 C LYS A 54 287.630 127.102 388.288 1.00 0.00 C ATOM 875 O LYS A 54 286.471 126.708 388.263 1.00 0.00 O ATOM 876 CB LYS A 54 288.732 128.605 386.619 1.00 0.00 C ATOM 877 CG LYS A 54 288.710 127.450 385.607 1.00 0.00 C ATOM 878 CD LYS A 54 289.531 127.809 384.363 1.00 0.00 C ATOM 879 CE LYS A 54 289.711 126.628 383.402 1.00 0.00 C ATOM 880 NZ LYS A 54 290.524 127.021 382.228 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.576 129.564 388.634 1.00 0.00 H new ATOM 0 HA LYS A 54 286.927 129.010 387.800 1.00 0.00 H new ATOM 0 HB2 LYS A 54 288.421 129.502 386.084 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.772 128.752 386.911 1.00 0.00 H new ATOM 0 HG2 LYS A 54 289.113 126.548 386.067 1.00 0.00 H new ATOM 0 HG3 LYS A 54 287.682 127.230 385.320 1.00 0.00 H new ATOM 0 HD2 LYS A 54 289.042 128.628 383.836 1.00 0.00 H new ATOM 0 HD3 LYS A 54 290.511 128.170 384.673 1.00 0.00 H new ATOM 0 HE2 LYS A 54 290.193 125.801 383.923 1.00 0.00 H new ATOM 0 HE3 LYS A 54 288.736 126.271 383.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 290.632 126.205 381.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 290.050 127.795 381.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 291.462 127.339 382.546 1.00 0.00 H new ATOM 894 N LYS A 55 288.633 126.269 388.723 1.00 0.00 N ATOM 895 CA LYS A 55 288.299 124.900 389.209 1.00 0.00 C ATOM 896 C LYS A 55 287.501 124.873 390.534 1.00 0.00 C ATOM 897 O LYS A 55 286.577 124.083 390.769 1.00 0.00 O ATOM 898 CB LYS A 55 289.552 124.002 389.351 1.00 0.00 C ATOM 899 CG LYS A 55 290.262 123.688 388.025 1.00 0.00 C ATOM 900 CD LYS A 55 289.413 122.846 387.067 1.00 0.00 C ATOM 901 CE LYS A 55 290.227 122.306 385.885 1.00 0.00 C ATOM 902 NZ LYS A 55 289.378 121.506 384.971 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.624 126.510 388.745 1.00 0.00 H new ATOM 0 HA LYS A 55 287.651 124.498 388.430 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.260 124.490 390.021 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.260 123.064 389.824 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.531 124.624 387.534 1.00 0.00 H new ATOM 0 HG3 LYS A 55 291.192 123.160 388.235 1.00 0.00 H new ATOM 0 HD2 LYS A 55 288.973 122.011 387.613 1.00 0.00 H new ATOM 0 HD3 LYS A 55 288.588 123.450 386.690 1.00 0.00 H new ATOM 0 HE2 LYS A 55 290.673 123.136 385.338 1.00 0.00 H new ATOM 0 HE3 LYS A 55 291.047 121.691 386.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 289.955 121.153 384.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 288.972 120.701 385.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 288.610 122.101 384.600 1.00 0.00 H new ATOM 916 N PHE A 56 287.825 125.852 391.409 1.00 0.00 N ATOM 917 CA PHE A 56 287.167 126.067 392.707 1.00 0.00 C ATOM 918 C PHE A 56 285.727 126.602 392.581 1.00 0.00 C ATOM 919 O PHE A 56 284.744 126.126 393.163 1.00 0.00 O ATOM 920 CB PHE A 56 288.071 127.004 393.546 1.00 0.00 C ATOM 921 CG PHE A 56 288.189 126.617 394.967 1.00 0.00 C ATOM 922 CD1 PHE A 56 287.910 127.505 395.982 1.00 0.00 C ATOM 923 CD2 PHE A 56 288.684 125.367 395.264 1.00 0.00 C ATOM 924 CE1 PHE A 56 288.118 127.151 397.289 1.00 0.00 C ATOM 925 CE2 PHE A 56 288.928 125.015 396.566 1.00 0.00 C ATOM 926 CZ PHE A 56 288.651 125.916 397.564 1.00 0.00 C ATOM 0 H PHE A 56 288.568 126.526 391.223 1.00 0.00 H new ATOM 0 HA PHE A 56 287.052 125.107 393.210 1.00 0.00 H new ATOM 0 HB2 PHE A 56 289.066 127.023 393.102 1.00 0.00 H new ATOM 0 HB3 PHE A 56 287.677 128.018 393.489 1.00 0.00 H new ATOM 0 HD1 PHE A 56 287.525 128.486 395.746 1.00 0.00 H new ATOM 0 HD2 PHE A 56 288.880 124.662 394.469 1.00 0.00 H new ATOM 0 HE1 PHE A 56 287.867 127.832 398.089 1.00 0.00 H new ATOM 0 HE2 PHE A 56 289.333 124.042 396.803 1.00 0.00 H new ATOM 0 HZ PHE A 56 288.857 125.647 398.589 1.00 0.00 H new ATOM 936 N VAL A 57 285.542 127.610 391.694 1.00 0.00 N ATOM 937 CA VAL A 57 284.275 128.191 391.269 1.00 0.00 C ATOM 938 C VAL A 57 283.383 127.268 390.448 1.00 0.00 C ATOM 939 O VAL A 57 282.162 127.249 390.603 1.00 0.00 O ATOM 940 CB VAL A 57 284.173 129.702 391.492 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.644 130.527 390.307 1.00 0.00 C ATOM 942 CG2 VAL A 57 283.456 129.984 392.844 1.00 0.00 C ATOM 0 H VAL A 57 286.335 128.058 391.235 1.00 0.00 H new ATOM 0 HA VAL A 57 283.290 128.270 391.729 1.00 0.00 H new ATOM 0 HB VAL A 57 285.195 130.075 391.558 1.00 0.00 H new ATOM 0 HG11 VAL A 57 283.616 131.581 390.582 1.00 0.00 H new ATOM 0 HG12 VAL A 57 284.302 130.393 389.448 1.00 0.00 H new ATOM 0 HG13 VAL A 57 282.639 130.192 390.050 1.00 0.00 H new ATOM 0 HG21 VAL A 57 283.385 131.060 393.000 1.00 0.00 H new ATOM 0 HG22 VAL A 57 282.455 129.553 392.822 1.00 0.00 H new ATOM 0 HG23 VAL A 57 284.026 129.536 393.658 1.00 0.00 H new ATOM 952 N GLU A 58 284.043 126.354 389.657 1.00 0.00 N ATOM 953 CA GLU A 58 283.458 125.128 389.083 1.00 0.00 C ATOM 954 C GLU A 58 282.979 124.123 390.171 1.00 0.00 C ATOM 955 O GLU A 58 281.898 123.561 390.027 1.00 0.00 O ATOM 956 CB GLU A 58 284.427 124.443 388.079 1.00 0.00 C ATOM 957 CG GLU A 58 283.849 123.284 387.242 1.00 0.00 C ATOM 958 CD GLU A 58 282.684 123.776 386.382 1.00 0.00 C ATOM 959 OE1 GLU A 58 282.920 124.661 385.516 1.00 0.00 O ATOM 960 OE2 GLU A 58 281.546 123.274 386.580 1.00 0.00 O1- ATOM 0 H GLU A 58 285.024 126.471 389.405 1.00 0.00 H new ATOM 0 HA GLU A 58 282.572 125.445 388.533 1.00 0.00 H new ATOM 0 HB2 GLU A 58 284.802 125.204 387.394 1.00 0.00 H new ATOM 0 HB3 GLU A 58 285.284 124.066 388.636 1.00 0.00 H new ATOM 0 HG2 GLU A 58 284.627 122.864 386.605 1.00 0.00 H new ATOM 0 HG3 GLU A 58 283.510 122.485 387.901 1.00 0.00 H new ATOM 967 N ALA A 59 283.721 123.951 391.334 1.00 0.00 N ATOM 968 CA ALA A 59 283.272 123.227 392.562 1.00 0.00 C ATOM 969 C ALA A 59 282.013 123.750 393.181 1.00 0.00 C ATOM 970 O ALA A 59 281.149 122.996 393.591 1.00 0.00 O ATOM 971 CB ALA A 59 284.147 123.381 393.849 1.00 0.00 C ATOM 0 H ALA A 59 284.665 124.326 391.428 1.00 0.00 H new ATOM 0 HA ALA A 59 283.252 122.231 392.119 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.705 122.804 394.661 1.00 0.00 H new ATOM 0 HB2 ALA A 59 285.154 123.015 393.650 1.00 0.00 H new ATOM 0 HB3 ALA A 59 284.193 124.432 394.134 1.00 0.00 H new ATOM 977 N TYR A 60 281.941 125.104 393.306 1.00 0.00 N ATOM 978 CA TYR A 60 281.020 125.917 394.116 1.00 0.00 C ATOM 979 C TYR A 60 279.495 125.582 393.987 1.00 0.00 C ATOM 980 O TYR A 60 278.675 125.959 394.806 1.00 0.00 O ATOM 981 CB TYR A 60 281.193 127.417 393.675 1.00 0.00 C ATOM 982 CG TYR A 60 281.347 128.501 394.711 1.00 0.00 C ATOM 983 CD1 TYR A 60 280.720 129.722 394.519 1.00 0.00 C ATOM 984 CD2 TYR A 60 282.325 128.413 395.687 1.00 0.00 C ATOM 985 CE1 TYR A 60 281.084 130.815 395.277 1.00 0.00 C ATOM 986 CE2 TYR A 60 282.603 129.469 396.548 1.00 0.00 C ATOM 987 CZ TYR A 60 282.006 130.681 396.294 1.00 0.00 C ATOM 988 OH TYR A 60 282.369 131.792 397.069 1.00 0.00 O ATOM 0 H TYR A 60 282.590 125.699 392.791 1.00 0.00 H new ATOM 0 HA TYR A 60 281.289 125.705 395.151 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.068 127.464 393.026 1.00 0.00 H new ATOM 0 HB3 TYR A 60 280.328 127.675 393.064 1.00 0.00 H new ATOM 0 HD1 TYR A 60 279.944 129.818 393.774 1.00 0.00 H new ATOM 0 HD2 TYR A 60 282.889 127.497 395.783 1.00 0.00 H new ATOM 0 HE1 TYR A 60 280.645 131.781 395.073 1.00 0.00 H new ATOM 0 HE2 TYR A 60 283.267 129.341 397.390 1.00 0.00 H new ATOM 0 HH TYR A 60 282.673 132.515 396.482 1.00 0.00 H new ATOM 998 N GLY A 61 279.082 124.793 392.965 1.00 0.00 N ATOM 999 CA GLY A 61 277.772 124.132 392.888 1.00 0.00 C ATOM 1000 C GLY A 61 277.599 122.830 393.687 1.00 0.00 C ATOM 1001 O GLY A 61 276.487 122.322 393.776 1.00 0.00 O ATOM 0 H GLY A 61 279.671 124.599 392.155 1.00 0.00 H new ATOM 0 HA2 GLY A 61 277.015 124.840 393.226 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.562 123.917 391.840 1.00 0.00 H new ATOM 1005 N LYS A 62 278.668 122.232 394.299 1.00 0.00 N ATOM 1006 CA LYS A 62 278.654 120.958 395.039 1.00 0.00 C ATOM 1007 C LYS A 62 278.138 120.949 396.485 1.00 0.00 C ATOM 1008 O LYS A 62 277.548 119.962 396.899 1.00 0.00 O ATOM 1009 CB LYS A 62 280.007 120.172 394.920 1.00 0.00 C ATOM 1010 CG LYS A 62 281.291 120.840 395.461 1.00 0.00 C ATOM 1011 CD LYS A 62 282.040 120.168 396.622 1.00 0.00 C ATOM 1012 CE LYS A 62 281.578 120.675 397.993 1.00 0.00 C ATOM 1013 NZ LYS A 62 282.519 120.268 399.063 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.596 122.655 394.281 1.00 0.00 H new ATOM 0 HA LYS A 62 277.865 120.431 394.503 1.00 0.00 H new ATOM 0 HB2 LYS A 62 279.885 119.220 395.436 1.00 0.00 H new ATOM 0 HB3 LYS A 62 280.169 119.945 393.866 1.00 0.00 H new ATOM 0 HG2 LYS A 62 281.989 120.936 394.629 1.00 0.00 H new ATOM 0 HG3 LYS A 62 281.030 121.850 395.777 1.00 0.00 H new ATOM 0 HD2 LYS A 62 281.892 119.089 396.569 1.00 0.00 H new ATOM 0 HD3 LYS A 62 283.109 120.349 396.513 1.00 0.00 H new ATOM 0 HE2 LYS A 62 281.496 121.762 397.972 1.00 0.00 H new ATOM 0 HE3 LYS A 62 280.584 120.284 398.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 282.179 120.626 399.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 282.578 119.230 399.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 283.461 120.662 398.865 1.00 0.00 H new ATOM 1027 N ALA A 63 278.336 122.004 397.308 1.00 0.00 N ATOM 1028 CA ALA A 63 277.874 122.060 398.704 1.00 0.00 C ATOM 1029 C ALA A 63 276.903 123.206 398.930 1.00 0.00 C ATOM 1030 O ALA A 63 276.865 123.785 400.013 1.00 0.00 O ATOM 1031 CB ALA A 63 279.068 122.186 399.681 1.00 0.00 C ATOM 0 H ALA A 63 278.827 122.848 397.013 1.00 0.00 H new ATOM 0 HA ALA A 63 277.351 121.124 398.902 1.00 0.00 H new ATOM 0 HB1 ALA A 63 278.697 122.225 400.705 1.00 0.00 H new ATOM 0 HB2 ALA A 63 279.725 121.324 399.566 1.00 0.00 H new ATOM 0 HB3 ALA A 63 279.624 123.098 399.461 1.00 0.00 H new ATOM 1037 N ILE A 64 276.150 123.589 397.875 1.00 0.00 N ATOM 1038 CA ILE A 64 275.220 124.725 397.769 1.00 0.00 C ATOM 1039 C ILE A 64 273.850 124.655 398.536 1.00 0.00 C ATOM 1040 O ILE A 64 272.923 123.964 398.107 1.00 0.00 O ATOM 1041 CB ILE A 64 275.081 125.073 396.277 1.00 0.00 C ATOM 1042 CG1 ILE A 64 274.463 126.463 395.987 1.00 0.00 C ATOM 1043 CG2 ILE A 64 274.371 123.957 395.477 1.00 0.00 C ATOM 1044 CD1 ILE A 64 275.341 127.643 396.417 1.00 0.00 C ATOM 0 H ILE A 64 276.184 123.062 397.002 1.00 0.00 H new ATOM 0 HA ILE A 64 275.675 125.538 398.334 1.00 0.00 H new ATOM 0 HB ILE A 64 276.109 125.141 395.922 1.00 0.00 H new ATOM 0 HG12 ILE A 64 274.263 126.544 394.918 1.00 0.00 H new ATOM 0 HG13 ILE A 64 273.502 126.535 396.497 1.00 0.00 H new ATOM 0 HG21 ILE A 64 274.297 124.250 394.430 1.00 0.00 H new ATOM 0 HG22 ILE A 64 274.943 123.033 395.555 1.00 0.00 H new ATOM 0 HG23 ILE A 64 273.371 123.800 395.881 1.00 0.00 H new ATOM 0 HD11 ILE A 64 274.835 128.579 396.179 1.00 0.00 H new ATOM 0 HD12 ILE A 64 275.520 127.591 397.491 1.00 0.00 H new ATOM 0 HD13 ILE A 64 276.293 127.600 395.888 1.00 0.00 H new ATOM 1056 N PRO A 65 273.643 125.335 399.696 1.00 0.00 N ATOM 1057 CA PRO A 65 272.386 125.288 400.444 1.00 0.00 C ATOM 1058 C PRO A 65 271.648 126.655 400.378 1.00 0.00 C ATOM 1059 O PRO A 65 272.203 127.596 399.804 1.00 0.00 O ATOM 1060 CB PRO A 65 272.966 125.033 401.853 1.00 0.00 C ATOM 1061 CG PRO A 65 274.258 125.871 401.925 1.00 0.00 C ATOM 1062 CD PRO A 65 274.672 126.053 400.457 1.00 0.00 C ATOM 0 HA PRO A 65 271.649 124.564 400.096 1.00 0.00 H new ATOM 0 HB2 PRO A 65 272.260 125.333 402.628 1.00 0.00 H new ATOM 0 HB3 PRO A 65 273.176 123.974 402.005 1.00 0.00 H new ATOM 0 HG2 PRO A 65 274.083 126.831 402.411 1.00 0.00 H new ATOM 0 HG3 PRO A 65 275.033 125.360 402.497 1.00 0.00 H new ATOM 0 HD2 PRO A 65 274.707 127.107 400.182 1.00 0.00 H new ATOM 0 HD3 PRO A 65 275.664 125.642 400.270 1.00 0.00 H new ATOM 1070 N PRO A 66 270.423 126.845 400.923 1.00 0.00 N ATOM 1071 CA PRO A 66 269.805 128.165 401.111 1.00 0.00 C ATOM 1072 C PRO A 66 270.404 128.914 402.335 1.00 0.00 C ATOM 1073 O PRO A 66 271.064 128.314 403.183 1.00 0.00 O ATOM 1074 CB PRO A 66 268.320 127.804 401.304 1.00 0.00 C ATOM 1075 CG PRO A 66 268.334 126.436 402.002 1.00 0.00 C ATOM 1076 CD PRO A 66 269.600 125.762 401.460 1.00 0.00 C ATOM 0 HA PRO A 66 269.972 128.853 400.282 1.00 0.00 H new ATOM 0 HB2 PRO A 66 267.807 128.551 401.909 1.00 0.00 H new ATOM 0 HB3 PRO A 66 267.798 127.755 400.348 1.00 0.00 H new ATOM 0 HG2 PRO A 66 268.369 126.541 403.086 1.00 0.00 H new ATOM 0 HG3 PRO A 66 267.441 125.858 401.767 1.00 0.00 H new ATOM 0 HD2 PRO A 66 270.126 125.224 402.249 1.00 0.00 H new ATOM 0 HD3 PRO A 66 269.356 125.034 400.686 1.00 0.00 H new ATOM 1084 N ALA A 67 270.185 130.247 402.451 1.00 0.00 N ATOM 1085 CA ALA A 67 270.736 131.083 403.523 1.00 0.00 C ATOM 1086 C ALA A 67 269.669 131.777 404.390 1.00 0.00 C ATOM 1087 O ALA A 67 269.518 132.994 404.282 1.00 0.00 O ATOM 1088 CB ALA A 67 271.666 132.144 402.885 1.00 0.00 C ATOM 0 H ALA A 67 269.612 130.770 401.789 1.00 0.00 H new ATOM 0 HA ALA A 67 271.281 130.424 404.199 1.00 0.00 H new ATOM 0 HB1 ALA A 67 272.086 132.777 403.667 1.00 0.00 H new ATOM 0 HB2 ALA A 67 272.473 131.645 402.349 1.00 0.00 H new ATOM 0 HB3 ALA A 67 271.094 132.758 402.190 1.00 0.00 H new ATOM 1094 N PRO A 68 268.934 131.096 405.308 1.00 0.00 N ATOM 1095 CA PRO A 68 267.813 131.677 406.055 1.00 0.00 C ATOM 1096 C PRO A 68 268.111 132.746 407.140 1.00 0.00 C ATOM 1097 O PRO A 68 267.175 133.537 407.259 1.00 0.00 O ATOM 1098 CB PRO A 68 267.059 130.442 406.605 1.00 0.00 C ATOM 1099 CG PRO A 68 268.106 129.331 406.695 1.00 0.00 C ATOM 1100 CD PRO A 68 269.057 129.655 405.542 1.00 0.00 C ATOM 0 HA PRO A 68 267.231 132.303 405.379 1.00 0.00 H new ATOM 0 HB2 PRO A 68 266.624 130.651 407.582 1.00 0.00 H new ATOM 0 HB3 PRO A 68 266.240 130.157 405.945 1.00 0.00 H new ATOM 0 HG2 PRO A 68 268.620 129.339 407.656 1.00 0.00 H new ATOM 0 HG3 PRO A 68 267.657 128.344 406.582 1.00 0.00 H new ATOM 0 HD2 PRO A 68 270.083 129.387 405.796 1.00 0.00 H new ATOM 0 HD3 PRO A 68 268.792 129.091 404.648 1.00 0.00 H new ATOM 1108 N PRO A 69 269.182 132.896 407.962 1.00 0.00 N ATOM 1109 CA PRO A 69 269.261 133.950 408.968 1.00 0.00 C ATOM 1110 C PRO A 69 269.904 135.238 408.429 1.00 0.00 C ATOM 1111 O PRO A 69 270.293 135.337 407.268 1.00 0.00 O ATOM 1112 CB PRO A 69 270.108 133.274 410.066 1.00 0.00 C ATOM 1113 CG PRO A 69 271.091 132.373 409.310 1.00 0.00 C ATOM 1114 CD PRO A 69 270.326 131.989 408.038 1.00 0.00 C ATOM 0 HA PRO A 69 268.288 134.294 409.318 1.00 0.00 H new ATOM 0 HB2 PRO A 69 270.634 134.013 410.670 1.00 0.00 H new ATOM 0 HB3 PRO A 69 269.483 132.694 410.745 1.00 0.00 H new ATOM 0 HG2 PRO A 69 272.018 132.898 409.077 1.00 0.00 H new ATOM 0 HG3 PRO A 69 271.361 131.494 409.896 1.00 0.00 H new ATOM 0 HD2 PRO A 69 270.960 132.088 407.157 1.00 0.00 H new ATOM 0 HD3 PRO A 69 269.998 130.950 408.080 1.00 0.00 H new ATOM 1122 N ALA A 70 270.037 136.242 409.331 1.00 0.00 N ATOM 1123 CA ALA A 70 270.608 137.570 409.133 1.00 0.00 C ATOM 1124 C ALA A 70 272.119 137.673 408.853 1.00 0.00 C ATOM 1125 O ALA A 70 272.460 138.544 408.055 1.00 0.00 O ATOM 1126 CB ALA A 70 270.199 138.489 410.302 1.00 0.00 C ATOM 0 H ALA A 70 269.716 136.119 410.291 1.00 0.00 H new ATOM 0 HA ALA A 70 270.177 137.899 408.187 1.00 0.00 H new ATOM 0 HB1 ALA A 70 270.627 139.480 410.152 1.00 0.00 H new ATOM 0 HB2 ALA A 70 269.112 138.565 410.342 1.00 0.00 H new ATOM 0 HB3 ALA A 70 270.569 138.072 411.239 1.00 0.00 H new ATOM 1132 N PRO A 71 273.093 136.911 409.443 1.00 0.00 N ATOM 1133 CA PRO A 71 274.529 136.965 409.110 1.00 0.00 C ATOM 1134 C PRO A 71 274.906 136.674 407.636 1.00 0.00 C ATOM 1135 O PRO A 71 275.711 137.486 407.182 1.00 0.00 O ATOM 1136 CB PRO A 71 275.207 136.022 410.128 1.00 0.00 C ATOM 1137 CG PRO A 71 274.231 135.982 411.303 1.00 0.00 C ATOM 1138 CD PRO A 71 272.869 136.058 410.611 1.00 0.00 C ATOM 0 HA PRO A 71 274.887 137.991 409.192 1.00 0.00 H new ATOM 0 HB2 PRO A 71 275.366 135.029 409.708 1.00 0.00 H new ATOM 0 HB3 PRO A 71 276.183 136.399 410.433 1.00 0.00 H new ATOM 0 HG2 PRO A 71 274.338 135.068 411.887 1.00 0.00 H new ATOM 0 HG3 PRO A 71 274.385 136.817 411.986 1.00 0.00 H new ATOM 0 HD2 PRO A 71 272.518 135.069 410.317 1.00 0.00 H new ATOM 0 HD3 PRO A 71 272.112 136.481 411.271 1.00 0.00 H new ATOM 1146 N PRO A 72 274.489 135.632 406.863 1.00 0.00 N ATOM 1147 CA PRO A 72 274.754 135.476 405.428 1.00 0.00 C ATOM 1148 C PRO A 72 273.982 136.464 404.532 1.00 0.00 C ATOM 1149 O PRO A 72 272.997 137.070 404.944 1.00 0.00 O ATOM 1150 CB PRO A 72 274.345 134.015 405.150 1.00 0.00 C ATOM 1151 CG PRO A 72 273.265 133.719 406.175 1.00 0.00 C ATOM 1152 CD PRO A 72 273.785 134.470 407.385 1.00 0.00 C ATOM 0 HA PRO A 72 275.795 135.696 405.190 1.00 0.00 H new ATOM 0 HB2 PRO A 72 273.971 133.895 404.133 1.00 0.00 H new ATOM 0 HB3 PRO A 72 275.192 133.338 405.260 1.00 0.00 H new ATOM 0 HG2 PRO A 72 272.287 134.080 405.857 1.00 0.00 H new ATOM 0 HG3 PRO A 72 273.163 132.651 406.367 1.00 0.00 H new ATOM 0 HD2 PRO A 72 272.967 134.771 408.039 1.00 0.00 H new ATOM 0 HD3 PRO A 72 274.452 133.843 407.977 1.00 0.00 H new ATOM 1160 N LEU A 73 274.464 136.643 403.282 1.00 0.00 N ATOM 1161 CA LEU A 73 273.977 137.589 402.278 1.00 0.00 C ATOM 1162 C LEU A 73 273.150 136.876 401.220 1.00 0.00 C ATOM 1163 O LEU A 73 273.613 135.914 400.610 1.00 0.00 O ATOM 1164 CB LEU A 73 275.201 138.310 401.624 1.00 0.00 C ATOM 1165 CG LEU A 73 274.914 139.483 400.642 1.00 0.00 C ATOM 1166 CD1 LEU A 73 273.965 140.554 401.209 1.00 0.00 C ATOM 1167 CD2 LEU A 73 276.223 140.166 400.197 1.00 0.00 C ATOM 0 H LEU A 73 275.250 136.093 402.936 1.00 0.00 H new ATOM 0 HA LEU A 73 273.334 138.326 402.759 1.00 0.00 H new ATOM 0 HB2 LEU A 73 275.832 138.692 402.426 1.00 0.00 H new ATOM 0 HB3 LEU A 73 275.784 137.561 401.089 1.00 0.00 H new ATOM 0 HG LEU A 73 274.415 139.021 399.790 1.00 0.00 H new ATOM 0 HD11 LEU A 73 273.815 141.337 400.466 1.00 0.00 H new ATOM 0 HD12 LEU A 73 273.006 140.097 401.454 1.00 0.00 H new ATOM 0 HD13 LEU A 73 274.401 140.987 402.109 1.00 0.00 H new ATOM 0 HD21 LEU A 73 275.993 140.982 399.512 1.00 0.00 H new ATOM 0 HD22 LEU A 73 276.742 140.561 401.070 1.00 0.00 H new ATOM 0 HD23 LEU A 73 276.860 139.438 399.694 1.00 0.00 H new ATOM 1179 N THR A 74 271.894 137.321 400.969 1.00 0.00 N ATOM 1180 CA THR A 74 271.012 136.714 399.987 1.00 0.00 C ATOM 1181 C THR A 74 270.016 137.798 399.630 1.00 0.00 C ATOM 1182 O THR A 74 270.087 138.898 400.177 1.00 0.00 O ATOM 1183 CB THR A 74 270.398 135.381 400.462 1.00 0.00 C ATOM 1184 OG1 THR A 74 269.880 134.617 399.382 1.00 0.00 O ATOM 1185 CG2 THR A 74 269.324 135.488 401.565 1.00 0.00 C ATOM 0 H THR A 74 271.479 138.116 401.454 1.00 0.00 H new ATOM 0 HA THR A 74 271.547 136.392 399.094 1.00 0.00 H new ATOM 0 HB THR A 74 271.249 134.873 400.916 1.00 0.00 H new ATOM 0 HG1 THR A 74 269.502 133.780 399.725 1.00 0.00 H new ATOM 0 HG21 THR A 74 268.964 134.491 401.820 1.00 0.00 H new ATOM 0 HG22 THR A 74 269.757 135.955 402.450 1.00 0.00 H new ATOM 0 HG23 THR A 74 268.492 136.094 401.205 1.00 0.00 H new ATOM 1193 N LEU A 75 269.066 137.525 398.709 1.00 0.00 N ATOM 1194 CA LEU A 75 268.018 138.455 398.308 1.00 0.00 C ATOM 1195 C LEU A 75 266.711 137.699 398.417 1.00 0.00 C ATOM 1196 O LEU A 75 266.658 136.539 398.820 1.00 0.00 O ATOM 1197 CB LEU A 75 268.249 139.090 396.900 1.00 0.00 C ATOM 1198 CG LEU A 75 268.225 140.647 396.871 1.00 0.00 C ATOM 1199 CD1 LEU A 75 266.881 141.261 397.315 1.00 0.00 C ATOM 1200 CD2 LEU A 75 269.384 141.271 397.671 1.00 0.00 C ATOM 0 H LEU A 75 269.016 136.631 398.221 1.00 0.00 H new ATOM 0 HA LEU A 75 268.014 139.323 398.967 1.00 0.00 H new ATOM 0 HB2 LEU A 75 269.211 138.749 396.517 1.00 0.00 H new ATOM 0 HB3 LEU A 75 267.484 138.717 396.219 1.00 0.00 H new ATOM 0 HG LEU A 75 268.357 140.898 395.818 1.00 0.00 H new ATOM 0 HD11 LEU A 75 266.944 142.348 397.267 1.00 0.00 H new ATOM 0 HD12 LEU A 75 266.087 140.914 396.654 1.00 0.00 H new ATOM 0 HD13 LEU A 75 266.661 140.955 398.338 1.00 0.00 H new ATOM 0 HD21 LEU A 75 269.319 142.358 397.617 1.00 0.00 H new ATOM 0 HD22 LEU A 75 269.319 140.954 398.712 1.00 0.00 H new ATOM 0 HD23 LEU A 75 270.335 140.943 397.250 1.00 0.00 H new ATOM 1212 N SER A 76 265.572 138.316 398.080 1.00 0.00 N ATOM 1213 CA SER A 76 264.295 137.648 398.218 1.00 0.00 C ATOM 1214 C SER A 76 263.342 138.389 397.329 1.00 0.00 C ATOM 1215 O SER A 76 263.633 139.509 396.909 1.00 0.00 O ATOM 1216 CB SER A 76 263.775 137.590 399.685 1.00 0.00 C ATOM 1217 OG SER A 76 264.547 136.701 400.498 1.00 0.00 O ATOM 0 H SER A 76 265.519 139.267 397.715 1.00 0.00 H new ATOM 0 HA SER A 76 264.395 136.602 397.929 1.00 0.00 H new ATOM 0 HB2 SER A 76 263.801 138.590 400.118 1.00 0.00 H new ATOM 0 HB3 SER A 76 262.733 137.269 399.687 1.00 0.00 H new ATOM 0 HG SER A 76 265.343 136.414 400.004 1.00 0.00 H new ATOM 1223 N LYS A 77 262.211 137.722 396.972 1.00 0.00 N ATOM 1224 CA LYS A 77 261.149 138.178 396.071 1.00 0.00 C ATOM 1225 C LYS A 77 261.508 137.928 394.611 1.00 0.00 C ATOM 1226 O LYS A 77 260.813 137.217 393.894 1.00 0.00 O ATOM 1227 CB LYS A 77 260.645 139.633 396.321 1.00 0.00 C ATOM 1228 CG LYS A 77 259.374 140.025 395.544 1.00 0.00 C ATOM 1229 CD LYS A 77 258.902 141.449 395.877 1.00 0.00 C ATOM 1230 CE LYS A 77 257.679 141.899 395.062 1.00 0.00 C ATOM 1231 NZ LYS A 77 256.498 141.047 395.339 1.00 0.00 N1+ ATOM 0 H LYS A 77 262.017 136.790 397.338 1.00 0.00 H new ATOM 0 HA LYS A 77 260.287 137.559 396.318 1.00 0.00 H new ATOM 0 HB2 LYS A 77 260.454 139.757 397.387 1.00 0.00 H new ATOM 0 HB3 LYS A 77 261.442 140.328 396.057 1.00 0.00 H new ATOM 0 HG2 LYS A 77 259.567 139.950 394.474 1.00 0.00 H new ATOM 0 HG3 LYS A 77 258.577 139.318 395.774 1.00 0.00 H new ATOM 0 HD2 LYS A 77 258.661 141.504 396.939 1.00 0.00 H new ATOM 0 HD3 LYS A 77 259.722 142.145 395.700 1.00 0.00 H new ATOM 0 HE2 LYS A 77 257.444 142.937 395.299 1.00 0.00 H new ATOM 0 HE3 LYS A 77 257.915 141.861 393.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 255.678 141.409 394.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 256.697 140.070 395.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 256.289 141.063 396.358 1.00 0.00 H new ATOM 1245 N LEU A 78 262.649 138.503 394.152 1.00 0.00 N ATOM 1246 CA LEU A 78 263.211 138.385 392.808 1.00 0.00 C ATOM 1247 C LEU A 78 264.322 137.333 392.766 1.00 0.00 C ATOM 1248 O LEU A 78 265.067 137.207 391.798 1.00 0.00 O ATOM 1249 CB LEU A 78 263.789 139.763 392.377 1.00 0.00 C ATOM 1250 CG LEU A 78 262.769 140.927 392.418 1.00 0.00 C ATOM 1251 CD1 LEU A 78 263.466 142.256 392.086 1.00 0.00 C ATOM 1252 CD2 LEU A 78 261.571 140.691 391.485 1.00 0.00 C ATOM 0 H LEU A 78 263.224 139.092 394.755 1.00 0.00 H new ATOM 0 HA LEU A 78 262.420 138.075 392.125 1.00 0.00 H new ATOM 0 HB2 LEU A 78 264.629 140.010 393.026 1.00 0.00 H new ATOM 0 HB3 LEU A 78 264.183 139.677 391.364 1.00 0.00 H new ATOM 0 HG LEU A 78 262.372 140.976 393.432 1.00 0.00 H new ATOM 0 HD11 LEU A 78 262.738 143.067 392.118 1.00 0.00 H new ATOM 0 HD12 LEU A 78 264.253 142.446 392.816 1.00 0.00 H new ATOM 0 HD13 LEU A 78 263.902 142.199 391.089 1.00 0.00 H new ATOM 0 HD21 LEU A 78 260.886 141.536 391.551 1.00 0.00 H new ATOM 0 HD22 LEU A 78 261.924 140.590 390.459 1.00 0.00 H new ATOM 0 HD23 LEU A 78 261.052 139.780 391.782 1.00 0.00 H new ATOM 1264 N GLU A 79 264.463 136.584 393.886 1.00 0.00 N ATOM 1265 CA GLU A 79 265.510 135.609 394.128 1.00 0.00 C ATOM 1266 C GLU A 79 264.962 134.428 394.926 1.00 0.00 C ATOM 1267 O GLU A 79 264.592 133.402 394.362 1.00 0.00 O ATOM 1268 CB GLU A 79 266.683 136.333 394.853 1.00 0.00 C ATOM 1269 CG GLU A 79 268.072 135.667 394.743 1.00 0.00 C ATOM 1270 CD GLU A 79 268.239 134.483 395.691 1.00 0.00 C ATOM 1271 OE1 GLU A 79 268.406 133.337 395.194 1.00 0.00 O ATOM 1272 OE2 GLU A 79 268.211 134.713 396.927 1.00 0.00 O1- ATOM 0 H GLU A 79 263.813 136.659 394.668 1.00 0.00 H new ATOM 0 HA GLU A 79 265.883 135.195 393.191 1.00 0.00 H new ATOM 0 HB2 GLU A 79 266.757 137.346 394.457 1.00 0.00 H new ATOM 0 HB3 GLU A 79 266.429 136.422 395.909 1.00 0.00 H new ATOM 0 HG2 GLU A 79 268.228 135.330 393.718 1.00 0.00 H new ATOM 0 HG3 GLU A 79 268.843 136.408 394.956 1.00 0.00 H new ATOM 1279 N HIS A 80 264.911 134.551 396.280 1.00 0.00 N ATOM 1280 CA HIS A 80 264.438 133.515 397.191 1.00 0.00 C ATOM 1281 C HIS A 80 263.400 134.046 398.168 1.00 0.00 C ATOM 1282 O HIS A 80 262.593 134.929 397.855 1.00 0.00 O ATOM 1283 CB HIS A 80 265.652 132.876 397.928 1.00 0.00 C ATOM 1284 CG HIS A 80 265.377 131.636 398.743 1.00 0.00 C ATOM 1285 ND1 HIS A 80 265.092 131.631 400.092 1.00 0.00 N ATOM 1286 CD2 HIS A 80 265.415 130.326 398.370 1.00 0.00 C ATOM 1287 CE1 HIS A 80 264.978 130.332 400.465 1.00 0.00 C ATOM 1288 NE2 HIS A 80 265.162 129.506 399.455 1.00 0.00 N ATOM 0 H HIS A 80 265.208 135.399 396.763 1.00 0.00 H new ATOM 0 HA HIS A 80 263.937 132.743 396.607 1.00 0.00 H new ATOM 0 HB2 HIS A 80 266.411 132.633 397.185 1.00 0.00 H new ATOM 0 HB3 HIS A 80 266.083 133.628 398.589 1.00 0.00 H new ATOM 0 HD2 HIS A 80 265.615 129.977 397.368 1.00 0.00 H new ATOM 0 HE1 HIS A 80 264.761 130.012 401.473 1.00 0.00 H new ATOM 0 HE2 HIS A 80 265.126 128.487 399.470 1.00 0.00 H new TER 1296 HIS A 80