USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=22 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 -152:sc= 1.94 USER MOD Set 1.2: A 49 ASN : amide:sc= 0.159 X(o=2.1,f=1.8) USER MOD Set 2.1: A 5 SER OG : rot 130:sc= 0.0175 USER MOD Set 2.2: A 30 TYR OH : rot 30:sc= -0.879 USER MOD Single : A 0 MET CE :methyl -178:sc= 0 (180deg=-0.00641) USER MOD Single : A 0 MET N :NH3+ 175:sc= 0.0958 (180deg=-0.0491) USER MOD Single : A 4 TYR OH : rot 30:sc= 0 USER MOD Single : A 9 THR OG1 : rot -6:sc= 0.0953 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot -70:sc= 0.835 USER MOD Single : A 19 HIS :FLIP no HD1:sc= -2.68! C(o=-3.6!,f=-2.7!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 HIS :FLIP no HD1:sc= -1.88 F(o=-2.9,f=-1.9) USER MOD Single : A 29 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.432) USER MOD Single : A 33 SER OG : rot 72:sc= 1.39 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= -0.67 USER MOD Single : A 47 HIS : no HD1:sc= -0.0383 X(o=-0.038,f=-0.39) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00493) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 22:sc= 0.764 USER MOD Single : A 62 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.0161) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.351 USER MOD Single : A 76 SER OG : rot -65:sc= 1.28 USER MOD Single : A 77 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.038) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.002) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 285.270 122.426 407.553 1.00 0.00 N ATOM 2 CA MET A 0 283.892 122.256 407.139 1.00 0.00 C ATOM 3 C MET A 0 283.899 121.500 405.812 1.00 0.00 C ATOM 4 O MET A 0 282.950 121.495 405.026 1.00 0.00 O ATOM 5 CB MET A 0 283.169 123.639 407.109 1.00 0.00 C ATOM 6 CG MET A 0 281.639 123.649 406.872 1.00 0.00 C ATOM 7 SD MET A 0 280.718 122.569 408.004 1.00 0.00 S ATOM 8 CE MET A 0 279.315 122.350 406.877 1.00 0.00 C ATOM 0 H1 MET A 0 285.305 123.012 408.412 1.00 0.00 H new ATOM 0 H2 MET A 0 285.690 121.496 407.751 1.00 0.00 H new ATOM 0 H3 MET A 0 285.806 122.893 406.794 1.00 0.00 H new ATOM 0 HA MET A 0 283.314 121.660 407.845 1.00 0.00 H new ATOM 0 HB2 MET A 0 283.364 124.140 408.057 1.00 0.00 H new ATOM 0 HB3 MET A 0 283.633 124.242 406.329 1.00 0.00 H new ATOM 0 HG2 MET A 0 281.271 124.669 406.977 1.00 0.00 H new ATOM 0 HG3 MET A 0 281.437 123.342 405.846 1.00 0.00 H new ATOM 0 HE1 MET A 0 278.556 121.732 407.357 1.00 0.00 H new ATOM 0 HE2 MET A 0 278.889 123.323 406.633 1.00 0.00 H new ATOM 0 HE3 MET A 0 279.655 121.863 405.963 1.00 0.00 H new ATOM 18 N GLY A 1 285.057 120.852 405.517 1.00 0.00 N ATOM 19 CA GLY A 1 285.375 120.142 404.279 1.00 0.00 C ATOM 20 C GLY A 1 286.171 121.019 403.344 1.00 0.00 C ATOM 21 O GLY A 1 287.385 121.158 403.474 1.00 0.00 O ATOM 0 H GLY A 1 285.828 120.818 406.184 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.942 119.239 404.508 1.00 0.00 H new ATOM 0 HA3 GLY A 1 284.454 119.825 403.790 1.00 0.00 H new ATOM 25 N ILE A 2 285.498 121.676 402.365 1.00 0.00 N ATOM 26 CA ILE A 2 286.126 122.600 401.421 1.00 0.00 C ATOM 27 C ILE A 2 285.412 123.937 401.524 1.00 0.00 C ATOM 28 O ILE A 2 284.185 124.024 401.511 1.00 0.00 O ATOM 29 CB ILE A 2 286.167 122.161 399.953 1.00 0.00 C ATOM 30 CG1 ILE A 2 286.316 120.632 399.780 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.309 122.957 399.263 1.00 0.00 C ATOM 32 CD1 ILE A 2 286.672 120.218 398.345 1.00 0.00 C ATOM 0 H ILE A 2 284.494 121.569 402.218 1.00 0.00 H new ATOM 0 HA ILE A 2 287.175 122.646 401.715 1.00 0.00 H new ATOM 0 HB ILE A 2 285.213 122.387 399.477 1.00 0.00 H new ATOM 0 HG12 ILE A 2 287.089 120.270 400.458 1.00 0.00 H new ATOM 0 HG13 ILE A 2 285.384 120.147 400.071 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.369 122.671 398.213 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.104 124.025 399.337 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.256 122.735 399.755 1.00 0.00 H new ATOM 0 HD11 ILE A 2 286.762 119.133 398.291 1.00 0.00 H new ATOM 0 HD12 ILE A 2 285.888 120.551 397.665 1.00 0.00 H new ATOM 0 HD13 ILE A 2 287.619 120.675 398.059 1.00 0.00 H new ATOM 44 N ASP A 3 286.177 125.057 401.607 1.00 0.00 N ATOM 45 CA ASP A 3 285.618 126.386 401.765 1.00 0.00 C ATOM 46 C ASP A 3 285.363 127.116 400.487 1.00 0.00 C ATOM 47 O ASP A 3 285.998 128.124 400.215 1.00 0.00 O ATOM 48 CB ASP A 3 286.417 127.299 402.752 1.00 0.00 C ATOM 49 CG ASP A 3 285.703 128.617 403.126 1.00 0.00 C ATOM 50 OD1 ASP A 3 284.449 128.623 403.224 1.00 0.00 O ATOM 51 OD2 ASP A 3 286.416 129.629 403.320 1.00 0.00 O1- ATOM 0 H ASP A 3 287.196 125.042 401.564 1.00 0.00 H new ATOM 0 HA ASP A 3 284.646 126.177 402.212 1.00 0.00 H new ATOM 0 HB2 ASP A 3 286.618 126.738 403.665 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.382 127.538 402.306 1.00 0.00 H new ATOM 56 N TYR A 4 284.350 126.657 399.729 1.00 0.00 N ATOM 57 CA TYR A 4 283.474 127.443 398.871 1.00 0.00 C ATOM 58 C TYR A 4 282.442 128.241 399.676 1.00 0.00 C ATOM 59 O TYR A 4 282.110 129.403 399.454 1.00 0.00 O ATOM 60 CB TYR A 4 282.735 126.599 397.830 1.00 0.00 C ATOM 61 CG TYR A 4 283.603 125.543 397.333 1.00 0.00 C ATOM 62 CD1 TYR A 4 284.528 125.871 396.390 1.00 0.00 C ATOM 63 CD2 TYR A 4 283.475 124.246 397.794 1.00 0.00 C ATOM 64 CE1 TYR A 4 285.339 124.885 395.916 1.00 0.00 C ATOM 65 CE2 TYR A 4 284.290 123.270 397.287 1.00 0.00 C ATOM 66 CZ TYR A 4 285.256 123.600 396.381 1.00 0.00 C ATOM 67 OH TYR A 4 286.095 122.616 395.846 1.00 0.00 O ATOM 0 H TYR A 4 284.115 125.665 399.705 1.00 0.00 H new ATOM 0 HA TYR A 4 284.141 128.129 398.349 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.839 126.165 398.273 1.00 0.00 H new ATOM 0 HB3 TYR A 4 282.409 127.231 397.004 1.00 0.00 H new ATOM 0 HD1 TYR A 4 284.616 126.885 396.028 1.00 0.00 H new ATOM 0 HD2 TYR A 4 282.739 124.005 398.547 1.00 0.00 H new ATOM 0 HE1 TYR A 4 286.066 125.123 395.154 1.00 0.00 H new ATOM 0 HE2 TYR A 4 284.169 122.244 397.602 1.00 0.00 H new ATOM 0 HH TYR A 4 286.936 123.026 395.555 1.00 0.00 H new ATOM 77 N SER A 5 281.820 127.447 400.593 1.00 0.00 N ATOM 78 CA SER A 5 280.590 127.653 401.336 1.00 0.00 C ATOM 79 C SER A 5 280.472 128.824 402.312 1.00 0.00 C ATOM 80 O SER A 5 279.533 129.595 402.154 1.00 0.00 O ATOM 81 CB SER A 5 279.952 126.278 401.677 1.00 0.00 C ATOM 82 OG SER A 5 278.538 126.344 401.827 1.00 0.00 O ATOM 0 H SER A 5 282.235 126.549 400.841 1.00 0.00 H new ATOM 0 HA SER A 5 279.894 128.158 400.666 1.00 0.00 H new ATOM 0 HB2 SER A 5 280.196 125.565 400.889 1.00 0.00 H new ATOM 0 HB3 SER A 5 280.392 125.898 402.599 1.00 0.00 H new ATOM 0 HG SER A 5 278.118 125.645 401.283 1.00 0.00 H new ATOM 88 N GLY A 6 281.438 129.163 403.246 1.00 0.00 N ATOM 89 CA GLY A 6 281.488 130.479 403.927 1.00 0.00 C ATOM 90 C GLY A 6 281.564 131.705 403.016 1.00 0.00 C ATOM 91 O GLY A 6 281.114 132.803 403.312 1.00 0.00 O ATOM 0 H GLY A 6 282.184 128.528 403.530 1.00 0.00 H new ATOM 0 HA2 GLY A 6 280.603 130.574 404.556 1.00 0.00 H new ATOM 0 HA3 GLY A 6 282.353 130.490 404.590 1.00 0.00 H new ATOM 95 N LEU A 7 282.092 131.518 401.790 1.00 0.00 N ATOM 96 CA LEU A 7 282.163 132.503 400.738 1.00 0.00 C ATOM 97 C LEU A 7 280.855 132.720 400.027 1.00 0.00 C ATOM 98 O LEU A 7 280.390 133.850 399.944 1.00 0.00 O ATOM 99 CB LEU A 7 283.314 132.343 399.755 1.00 0.00 C ATOM 100 CG LEU A 7 284.693 132.110 400.411 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.979 132.918 401.677 1.00 0.00 C ATOM 102 CD2 LEU A 7 284.881 130.631 400.674 1.00 0.00 C ATOM 0 H LEU A 7 282.496 130.624 401.511 1.00 0.00 H new ATOM 0 HA LEU A 7 282.393 133.415 401.290 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.095 131.505 399.093 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.369 133.236 399.132 1.00 0.00 H new ATOM 0 HG LEU A 7 285.420 132.482 399.689 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.974 132.673 402.048 1.00 0.00 H new ATOM 0 HD12 LEU A 7 284.930 133.983 401.448 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.238 132.676 402.438 1.00 0.00 H new ATOM 0 HD21 LEU A 7 285.854 130.465 401.137 1.00 0.00 H new ATOM 0 HD22 LEU A 7 284.096 130.278 401.342 1.00 0.00 H new ATOM 0 HD23 LEU A 7 284.829 130.085 399.732 1.00 0.00 H new ATOM 114 N ARG A 8 280.181 131.645 399.530 1.00 0.00 N ATOM 115 CA ARG A 8 278.832 131.747 398.946 1.00 0.00 C ATOM 116 C ARG A 8 277.730 132.116 399.928 1.00 0.00 C ATOM 117 O ARG A 8 276.760 132.792 399.590 1.00 0.00 O ATOM 118 CB ARG A 8 278.425 130.567 397.995 1.00 0.00 C ATOM 119 CG ARG A 8 279.375 129.345 397.969 1.00 0.00 C ATOM 120 CD ARG A 8 278.951 128.289 396.916 1.00 0.00 C ATOM 121 NE ARG A 8 279.826 127.025 396.887 1.00 0.00 N ATOM 122 CZ ARG A 8 279.409 125.946 397.612 1.00 0.00 C ATOM 123 NH1 ARG A 8 278.490 126.090 398.603 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.951 124.731 397.316 1.00 0.00 N ATOM 0 H ARG A 8 280.561 130.698 399.527 1.00 0.00 H new ATOM 0 HA ARG A 8 278.934 132.614 398.293 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.432 130.222 398.284 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.344 130.958 396.981 1.00 0.00 H new ATOM 0 HG2 ARG A 8 280.389 129.681 397.754 1.00 0.00 H new ATOM 0 HG3 ARG A 8 279.395 128.883 398.956 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.919 127.996 397.110 1.00 0.00 H new ATOM 0 HD3 ARG A 8 278.971 128.751 395.929 1.00 0.00 H new ATOM 0 HE ARG A 8 280.689 126.994 396.344 1.00 0.00 H new ATOM 0 HH11 ARG A 8 278.105 127.011 398.811 1.00 0.00 H new ATOM 0 HH12 ARG A 8 278.186 125.277 399.138 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.645 124.650 396.573 1.00 0.00 H new ATOM 0 HH22 ARG A 8 279.663 123.903 397.838 1.00 0.00 H new ATOM 138 N THR A 9 277.905 131.672 401.191 1.00 0.00 N ATOM 139 CA THR A 9 277.016 131.986 402.313 1.00 0.00 C ATOM 140 C THR A 9 277.246 133.313 403.025 1.00 0.00 C ATOM 141 O THR A 9 276.293 133.855 403.579 1.00 0.00 O ATOM 142 CB THR A 9 276.650 130.769 403.149 1.00 0.00 C ATOM 143 OG1 THR A 9 275.295 130.814 403.601 1.00 0.00 O ATOM 144 CG2 THR A 9 277.563 130.457 404.353 1.00 0.00 C ATOM 0 H THR A 9 278.687 131.073 401.457 1.00 0.00 H new ATOM 0 HA THR A 9 276.065 132.250 401.851 1.00 0.00 H new ATOM 0 HB THR A 9 276.800 129.954 402.441 1.00 0.00 H new ATOM 0 HG1 THR A 9 274.900 131.679 403.365 1.00 0.00 H new ATOM 0 HG21 THR A 9 277.197 129.568 404.867 1.00 0.00 H new ATOM 0 HG22 THR A 9 278.580 130.281 404.002 1.00 0.00 H new ATOM 0 HG23 THR A 9 277.558 131.302 405.042 1.00 0.00 H new ATOM 152 N ILE A 10 278.481 133.902 403.003 1.00 0.00 N ATOM 153 CA ILE A 10 278.727 135.257 403.522 1.00 0.00 C ATOM 154 C ILE A 10 278.808 136.289 402.365 1.00 0.00 C ATOM 155 O ILE A 10 278.407 137.437 402.563 1.00 0.00 O ATOM 156 CB ILE A 10 279.932 135.358 404.503 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.699 134.667 405.882 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.299 136.820 404.869 1.00 0.00 C ATOM 159 CD1 ILE A 10 279.731 133.138 405.981 1.00 0.00 C ATOM 0 H ILE A 10 279.313 133.447 402.628 1.00 0.00 H new ATOM 0 HA ILE A 10 277.862 135.508 404.136 1.00 0.00 H new ATOM 0 HB ILE A 10 280.721 134.859 403.940 1.00 0.00 H new ATOM 0 HG12 ILE A 10 280.450 135.054 406.571 1.00 0.00 H new ATOM 0 HG13 ILE A 10 278.728 134.997 406.251 1.00 0.00 H new ATOM 0 HG21 ILE A 10 281.146 136.822 405.555 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.564 137.366 403.964 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.445 137.301 405.346 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.550 132.836 407.013 1.00 0.00 H new ATOM 0 HD12 ILE A 10 278.959 132.716 405.338 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.708 132.773 405.663 1.00 0.00 H new ATOM 171 N PHE A 11 279.344 135.982 401.140 1.00 0.00 N ATOM 172 CA PHE A 11 279.579 137.001 400.096 1.00 0.00 C ATOM 173 C PHE A 11 278.717 136.798 398.852 1.00 0.00 C ATOM 174 O PHE A 11 278.495 137.722 398.068 1.00 0.00 O ATOM 175 CB PHE A 11 281.093 137.094 399.692 1.00 0.00 C ATOM 176 CG PHE A 11 281.945 137.286 400.928 1.00 0.00 C ATOM 177 CD1 PHE A 11 282.664 136.222 401.432 1.00 0.00 C ATOM 178 CD2 PHE A 11 281.977 138.481 401.621 1.00 0.00 C ATOM 179 CE1 PHE A 11 283.320 136.297 402.643 1.00 0.00 C ATOM 180 CE2 PHE A 11 282.712 138.597 402.788 1.00 0.00 C ATOM 181 CZ PHE A 11 283.378 137.502 403.309 1.00 0.00 C ATOM 0 H PHE A 11 279.616 135.038 400.866 1.00 0.00 H new ATOM 0 HA PHE A 11 279.281 137.947 400.549 1.00 0.00 H new ATOM 0 HB2 PHE A 11 281.395 136.187 399.169 1.00 0.00 H new ATOM 0 HB3 PHE A 11 281.244 137.925 399.003 1.00 0.00 H new ATOM 0 HD1 PHE A 11 282.715 135.305 400.863 1.00 0.00 H new ATOM 0 HD2 PHE A 11 281.424 139.331 401.249 1.00 0.00 H new ATOM 0 HE1 PHE A 11 283.784 135.418 403.066 1.00 0.00 H new ATOM 0 HE2 PHE A 11 282.766 139.549 403.295 1.00 0.00 H new ATOM 0 HZ PHE A 11 283.938 137.591 404.228 1.00 0.00 H new ATOM 191 N GLY A 12 278.198 135.561 398.629 1.00 0.00 N ATOM 192 CA GLY A 12 277.295 135.191 397.529 1.00 0.00 C ATOM 193 C GLY A 12 277.891 135.027 396.149 1.00 0.00 C ATOM 194 O GLY A 12 277.912 133.934 395.584 1.00 0.00 O ATOM 0 H GLY A 12 278.411 134.772 399.239 1.00 0.00 H new ATOM 0 HA2 GLY A 12 276.809 134.253 397.797 1.00 0.00 H new ATOM 0 HA3 GLY A 12 276.514 135.949 397.468 1.00 0.00 H new ATOM 198 N GLU A 13 278.372 136.158 395.577 1.00 0.00 N ATOM 199 CA GLU A 13 278.854 136.374 394.211 1.00 0.00 C ATOM 200 C GLU A 13 280.046 135.554 393.720 1.00 0.00 C ATOM 201 O GLU A 13 280.032 135.049 392.603 1.00 0.00 O ATOM 202 CB GLU A 13 279.115 137.895 394.016 1.00 0.00 C ATOM 203 CG GLU A 13 279.351 138.350 392.559 1.00 0.00 C ATOM 204 CD GLU A 13 279.485 139.873 392.458 1.00 0.00 C ATOM 205 OE1 GLU A 13 279.659 140.363 391.309 1.00 0.00 O ATOM 206 OE2 GLU A 13 279.421 140.566 393.508 1.00 0.00 O1- ATOM 0 H GLU A 13 278.434 137.018 396.122 1.00 0.00 H new ATOM 0 HA GLU A 13 278.051 135.993 393.580 1.00 0.00 H new ATOM 0 HB2 GLU A 13 278.264 138.446 394.416 1.00 0.00 H new ATOM 0 HB3 GLU A 13 279.984 138.175 394.611 1.00 0.00 H new ATOM 0 HG2 GLU A 13 280.254 137.878 392.172 1.00 0.00 H new ATOM 0 HG3 GLU A 13 278.523 138.015 391.934 1.00 0.00 H new ATOM 213 N LYS A 14 281.099 135.398 394.546 1.00 0.00 N ATOM 214 CA LYS A 14 282.259 134.603 394.212 1.00 0.00 C ATOM 215 C LYS A 14 282.924 134.275 395.530 1.00 0.00 C ATOM 216 O LYS A 14 282.400 134.449 396.634 1.00 0.00 O ATOM 217 CB LYS A 14 283.276 135.308 393.234 1.00 0.00 C ATOM 218 CG LYS A 14 284.125 134.369 392.336 1.00 0.00 C ATOM 219 CD LYS A 14 285.521 134.933 392.009 1.00 0.00 C ATOM 220 CE LYS A 14 285.492 136.195 391.137 1.00 0.00 C ATOM 221 NZ LYS A 14 286.867 136.649 390.824 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.152 135.831 395.468 1.00 0.00 H new ATOM 0 HA LYS A 14 281.939 133.717 393.664 1.00 0.00 H new ATOM 0 HB2 LYS A 14 282.717 135.986 392.589 1.00 0.00 H new ATOM 0 HB3 LYS A 14 283.955 135.920 393.828 1.00 0.00 H new ATOM 0 HG2 LYS A 14 284.238 133.406 392.834 1.00 0.00 H new ATOM 0 HG3 LYS A 14 283.588 134.185 391.405 1.00 0.00 H new ATOM 0 HD2 LYS A 14 286.038 135.159 392.941 1.00 0.00 H new ATOM 0 HD3 LYS A 14 286.103 134.165 391.500 1.00 0.00 H new ATOM 0 HE2 LYS A 14 284.952 135.991 390.212 1.00 0.00 H new ATOM 0 HE3 LYS A 14 284.951 136.988 391.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 286.824 137.504 390.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 287.371 136.864 391.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 287.372 135.899 390.311 1.00 0.00 H new ATOM 235 N LEU A 15 284.170 133.817 395.385 1.00 0.00 N ATOM 236 CA LEU A 15 285.137 133.497 396.383 1.00 0.00 C ATOM 237 C LEU A 15 286.111 134.684 396.479 1.00 0.00 C ATOM 238 O LEU A 15 286.739 135.012 395.471 1.00 0.00 O ATOM 239 CB LEU A 15 285.950 132.286 395.917 1.00 0.00 C ATOM 240 CG LEU A 15 285.180 130.980 395.746 1.00 0.00 C ATOM 241 CD1 LEU A 15 285.922 130.077 394.768 1.00 0.00 C ATOM 242 CD2 LEU A 15 285.025 130.265 397.079 1.00 0.00 C ATOM 0 H LEU A 15 284.546 133.650 394.452 1.00 0.00 H new ATOM 0 HA LEU A 15 284.646 133.290 397.334 1.00 0.00 H new ATOM 0 HB2 LEU A 15 286.418 132.534 394.965 1.00 0.00 H new ATOM 0 HB3 LEU A 15 286.754 132.118 396.633 1.00 0.00 H new ATOM 0 HG LEU A 15 284.188 131.211 395.359 1.00 0.00 H new ATOM 0 HD11 LEU A 15 285.372 129.144 394.646 1.00 0.00 H new ATOM 0 HD12 LEU A 15 286.007 130.577 393.803 1.00 0.00 H new ATOM 0 HD13 LEU A 15 286.918 129.863 395.155 1.00 0.00 H new ATOM 0 HD21 LEU A 15 284.473 129.337 396.932 1.00 0.00 H new ATOM 0 HD22 LEU A 15 286.010 130.040 397.488 1.00 0.00 H new ATOM 0 HD23 LEU A 15 284.481 130.905 397.774 1.00 0.00 H new ATOM 254 N PRO A 16 286.270 135.374 397.596 1.00 0.00 N ATOM 255 CA PRO A 16 287.186 136.484 397.787 1.00 0.00 C ATOM 256 C PRO A 16 288.661 136.126 397.913 1.00 0.00 C ATOM 257 O PRO A 16 289.069 134.968 397.881 1.00 0.00 O ATOM 258 CB PRO A 16 286.723 137.015 399.142 1.00 0.00 C ATOM 259 CG PRO A 16 286.245 135.764 399.884 1.00 0.00 C ATOM 260 CD PRO A 16 285.445 135.182 398.763 1.00 0.00 C ATOM 0 HA PRO A 16 287.151 137.153 396.927 1.00 0.00 H new ATOM 0 HB2 PRO A 16 287.534 137.510 399.675 1.00 0.00 H new ATOM 0 HB3 PRO A 16 285.921 137.745 399.032 1.00 0.00 H new ATOM 0 HG2 PRO A 16 287.061 135.119 400.209 1.00 0.00 H new ATOM 0 HG3 PRO A 16 285.647 135.990 400.767 1.00 0.00 H new ATOM 0 HD2 PRO A 16 285.235 134.126 398.932 1.00 0.00 H new ATOM 0 HD3 PRO A 16 284.484 135.685 398.657 1.00 0.00 H new ATOM 268 N GLU A 17 289.439 137.208 398.109 1.00 0.00 N ATOM 269 CA GLU A 17 290.866 137.313 398.239 1.00 0.00 C ATOM 270 C GLU A 17 291.464 136.959 399.599 1.00 0.00 C ATOM 271 O GLU A 17 290.827 137.113 400.642 1.00 0.00 O ATOM 272 CB GLU A 17 291.171 138.793 397.926 1.00 0.00 C ATOM 273 CG GLU A 17 292.586 138.939 397.353 1.00 0.00 C ATOM 274 CD GLU A 17 292.734 140.203 396.510 1.00 0.00 C ATOM 275 OE1 GLU A 17 292.563 141.322 397.060 1.00 0.00 O ATOM 276 OE2 GLU A 17 293.027 140.063 395.291 1.00 0.00 O1- ATOM 0 H GLU A 17 289.008 138.129 398.186 1.00 0.00 H new ATOM 0 HA GLU A 17 291.318 136.581 397.570 1.00 0.00 H new ATOM 0 HB2 GLU A 17 290.442 139.178 397.213 1.00 0.00 H new ATOM 0 HB3 GLU A 17 291.076 139.390 398.833 1.00 0.00 H new ATOM 0 HG2 GLU A 17 293.307 138.962 398.170 1.00 0.00 H new ATOM 0 HG3 GLU A 17 292.822 138.067 396.743 1.00 0.00 H new ATOM 283 N SER A 18 292.755 136.517 399.616 1.00 0.00 N ATOM 284 CA SER A 18 293.543 136.073 400.772 1.00 0.00 C ATOM 285 C SER A 18 293.648 136.952 402.007 1.00 0.00 C ATOM 286 O SER A 18 293.848 136.423 403.098 1.00 0.00 O ATOM 287 CB SER A 18 294.995 135.635 400.454 1.00 0.00 C ATOM 288 OG SER A 18 295.080 134.975 399.197 1.00 0.00 O ATOM 0 H SER A 18 293.298 136.463 398.754 1.00 0.00 H new ATOM 0 HA SER A 18 292.888 135.238 401.023 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.647 136.509 400.452 1.00 0.00 H new ATOM 0 HB3 SER A 18 295.355 134.971 401.239 1.00 0.00 H new ATOM 0 HG SER A 18 294.642 134.100 399.257 1.00 0.00 H new ATOM 294 N HIS A 19 293.463 138.306 401.867 1.00 0.00 N ATOM 295 CA HIS A 19 293.430 139.296 402.951 1.00 0.00 C ATOM 296 C HIS A 19 292.202 139.112 403.830 1.00 0.00 C ATOM 297 O HIS A 19 292.321 139.027 405.044 1.00 0.00 O ATOM 298 CB HIS A 19 293.553 140.775 402.465 1.00 0.00 C ATOM 299 CG HIS A 19 292.451 141.267 401.553 1.00 0.00 C ATOM 300 ND1 HIS A 19 291.219 141.751 401.872 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 292.482 141.220 400.176 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 290.476 141.984 400.730 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 291.269 141.654 399.741 1.00 0.00 N flip ATOM 0 H HIS A 19 293.329 138.734 400.951 1.00 0.00 H new ATOM 0 HA HIS A 19 294.322 139.104 403.547 1.00 0.00 H new ATOM 0 HB2 HIS A 19 293.589 141.423 403.341 1.00 0.00 H new ATOM 0 HB3 HIS A 19 294.505 140.888 401.946 1.00 0.00 H new ATOM 0 HD2 HIS A 19 293.310 140.900 399.561 1.00 0.00 H new ATOM 0 HE1 HIS A 19 289.464 142.356 400.667 1.00 0.00 H new ATOM 0 HE2 HIS A 19 291.007 141.716 398.757 1.00 0.00 H new ATOM 311 N ILE A 20 290.987 138.942 403.227 1.00 0.00 N ATOM 312 CA ILE A 20 289.792 138.493 403.950 1.00 0.00 C ATOM 313 C ILE A 20 289.780 136.996 404.215 1.00 0.00 C ATOM 314 O ILE A 20 289.358 136.557 405.286 1.00 0.00 O ATOM 315 CB ILE A 20 288.424 138.891 403.369 1.00 0.00 C ATOM 316 CG1 ILE A 20 287.862 137.985 402.271 1.00 0.00 C ATOM 317 CG2 ILE A 20 288.480 140.258 402.675 1.00 0.00 C ATOM 318 CD1 ILE A 20 286.409 138.371 401.999 1.00 0.00 C ATOM 0 H ILE A 20 290.826 139.115 402.235 1.00 0.00 H new ATOM 0 HA ILE A 20 289.902 139.053 404.879 1.00 0.00 H new ATOM 0 HB ILE A 20 287.797 138.846 404.259 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.454 138.085 401.361 1.00 0.00 H new ATOM 0 HG13 ILE A 20 287.923 136.941 402.578 1.00 0.00 H new ATOM 0 HG21 ILE A 20 287.496 140.505 402.277 1.00 0.00 H new ATOM 0 HG22 ILE A 20 288.782 141.019 403.394 1.00 0.00 H new ATOM 0 HG23 ILE A 20 289.202 140.223 401.859 1.00 0.00 H new ATOM 0 HD11 ILE A 20 286.002 137.729 401.217 1.00 0.00 H new ATOM 0 HD12 ILE A 20 285.823 138.249 402.910 1.00 0.00 H new ATOM 0 HD13 ILE A 20 286.363 139.411 401.675 1.00 0.00 H new ATOM 330 N PHE A 21 290.214 136.165 403.201 1.00 0.00 N ATOM 331 CA PHE A 21 290.055 134.711 403.213 1.00 0.00 C ATOM 332 C PHE A 21 291.006 134.088 404.274 1.00 0.00 C ATOM 333 O PHE A 21 290.522 133.370 405.145 1.00 0.00 O ATOM 334 CB PHE A 21 289.971 134.099 401.737 1.00 0.00 C ATOM 335 CG PHE A 21 289.419 132.666 401.529 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.327 131.765 402.571 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.014 132.170 400.274 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.066 130.435 402.407 1.00 0.00 C ATOM 339 CE2 PHE A 21 288.614 130.833 400.142 1.00 0.00 C ATOM 340 CZ PHE A 21 288.749 129.929 401.189 1.00 0.00 C ATOM 0 H PHE A 21 290.681 136.513 402.364 1.00 0.00 H new ATOM 0 HA PHE A 21 289.075 134.402 403.577 1.00 0.00 H new ATOM 0 HB2 PHE A 21 289.358 134.774 401.139 1.00 0.00 H new ATOM 0 HB3 PHE A 21 290.976 134.125 401.316 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.470 132.134 403.576 1.00 0.00 H new ATOM 0 HD2 PHE A 21 289.012 132.821 399.412 1.00 0.00 H new ATOM 0 HE1 PHE A 21 289.113 129.775 403.261 1.00 0.00 H new ATOM 0 HE2 PHE A 21 288.192 130.498 399.206 1.00 0.00 H new ATOM 0 HZ PHE A 21 288.608 128.869 401.039 1.00 0.00 H new ATOM 350 N PHE A 22 292.342 134.392 404.315 1.00 0.00 N ATOM 351 CA PHE A 22 293.256 133.955 405.391 1.00 0.00 C ATOM 352 C PHE A 22 293.108 134.770 406.723 1.00 0.00 C ATOM 353 O PHE A 22 293.692 134.363 407.726 1.00 0.00 O ATOM 354 CB PHE A 22 294.786 133.833 404.960 1.00 0.00 C ATOM 355 CG PHE A 22 295.231 132.546 404.226 1.00 0.00 C ATOM 356 CD1 PHE A 22 294.947 131.256 404.673 1.00 0.00 C ATOM 357 CD2 PHE A 22 296.048 132.616 403.096 1.00 0.00 C ATOM 358 CE1 PHE A 22 295.325 130.130 403.973 1.00 0.00 C ATOM 359 CE2 PHE A 22 296.397 131.484 402.363 1.00 0.00 C ATOM 360 CZ PHE A 22 295.953 130.237 402.763 1.00 0.00 C ATOM 0 H PHE A 22 292.803 134.949 403.595 1.00 0.00 H new ATOM 0 HA PHE A 22 292.917 132.940 405.596 1.00 0.00 H new ATOM 0 HB2 PHE A 22 295.021 134.682 404.318 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.395 133.933 405.858 1.00 0.00 H new ATOM 0 HD1 PHE A 22 294.411 131.134 405.603 1.00 0.00 H new ATOM 0 HD2 PHE A 22 296.421 133.579 402.780 1.00 0.00 H new ATOM 0 HE1 PHE A 22 295.123 129.152 404.385 1.00 0.00 H new ATOM 0 HE2 PHE A 22 297.014 131.580 401.482 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.098 129.370 402.136 1.00 0.00 H new ATOM 370 N ALA A 23 292.383 135.945 406.810 1.00 0.00 N ATOM 371 CA ALA A 23 292.221 136.690 408.081 1.00 0.00 C ATOM 372 C ALA A 23 290.822 136.809 408.735 1.00 0.00 C ATOM 373 O ALA A 23 290.735 137.097 409.927 1.00 0.00 O ATOM 374 CB ALA A 23 292.847 138.101 407.975 1.00 0.00 C ATOM 0 H ALA A 23 291.914 136.377 406.014 1.00 0.00 H new ATOM 0 HA ALA A 23 292.751 136.029 408.767 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.716 138.629 408.919 1.00 0.00 H new ATOM 0 HB2 ALA A 23 293.911 138.012 407.754 1.00 0.00 H new ATOM 0 HB3 ALA A 23 292.356 138.658 407.177 1.00 0.00 H new ATOM 380 N THR A 24 289.689 136.633 407.999 1.00 0.00 N ATOM 381 CA THR A 24 288.313 136.838 408.499 1.00 0.00 C ATOM 382 C THR A 24 287.675 135.485 408.783 1.00 0.00 C ATOM 383 O THR A 24 287.798 134.554 407.990 1.00 0.00 O ATOM 384 CB THR A 24 287.446 137.622 407.489 1.00 0.00 C ATOM 385 OG1 THR A 24 288.085 138.842 407.129 1.00 0.00 O ATOM 386 CG2 THR A 24 286.054 138.020 408.020 1.00 0.00 C ATOM 0 H THR A 24 289.715 136.339 407.023 1.00 0.00 H new ATOM 0 HA THR A 24 288.369 137.428 409.414 1.00 0.00 H new ATOM 0 HB THR A 24 287.325 136.937 406.649 1.00 0.00 H new ATOM 0 HG1 THR A 24 287.525 139.327 406.487 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.513 138.566 407.248 1.00 0.00 H new ATOM 0 HG22 THR A 24 285.497 137.123 408.288 1.00 0.00 H new ATOM 0 HG23 THR A 24 286.168 138.653 408.900 1.00 0.00 H new ATOM 394 N VAL A 25 286.919 135.320 409.920 1.00 0.00 N ATOM 395 CA VAL A 25 286.260 134.062 410.381 1.00 0.00 C ATOM 396 C VAL A 25 285.254 133.459 409.419 1.00 0.00 C ATOM 397 O VAL A 25 285.096 132.244 409.377 1.00 0.00 O ATOM 398 CB VAL A 25 285.496 134.103 411.734 1.00 0.00 C ATOM 399 CG1 VAL A 25 285.523 132.714 412.421 1.00 0.00 C ATOM 400 CG2 VAL A 25 286.105 135.148 412.686 1.00 0.00 C ATOM 0 H VAL A 25 286.750 136.096 410.561 1.00 0.00 H new ATOM 0 HA VAL A 25 287.166 133.463 410.473 1.00 0.00 H new ATOM 0 HB VAL A 25 284.465 134.381 411.516 1.00 0.00 H new ATOM 0 HG11 VAL A 25 284.983 132.765 413.366 1.00 0.00 H new ATOM 0 HG12 VAL A 25 285.049 131.978 411.772 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.556 132.421 412.609 1.00 0.00 H new ATOM 0 HG21 VAL A 25 285.549 135.153 413.624 1.00 0.00 H new ATOM 0 HG22 VAL A 25 287.147 134.897 412.883 1.00 0.00 H new ATOM 0 HG23 VAL A 25 286.050 136.135 412.226 1.00 0.00 H new ATOM 410 N ALA A 26 284.607 134.336 408.582 1.00 0.00 N ATOM 411 CA ALA A 26 283.608 134.105 407.539 1.00 0.00 C ATOM 412 C ALA A 26 283.996 132.997 406.571 1.00 0.00 C ATOM 413 O ALA A 26 283.174 132.205 406.121 1.00 0.00 O ATOM 414 CB ALA A 26 283.464 135.423 406.730 1.00 0.00 C ATOM 0 H ALA A 26 284.815 135.332 408.650 1.00 0.00 H new ATOM 0 HA ALA A 26 282.682 133.800 408.026 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.724 135.287 405.941 1.00 0.00 H new ATOM 0 HB2 ALA A 26 283.142 136.225 407.395 1.00 0.00 H new ATOM 0 HB3 ALA A 26 284.425 135.684 406.286 1.00 0.00 H new ATOM 420 N ALA A 27 285.311 132.924 406.309 1.00 0.00 N ATOM 421 CA ALA A 27 285.983 131.900 405.565 1.00 0.00 C ATOM 422 C ALA A 27 286.873 130.995 406.432 1.00 0.00 C ATOM 423 O ALA A 27 287.037 129.811 406.150 1.00 0.00 O ATOM 424 CB ALA A 27 286.790 132.671 404.512 1.00 0.00 C ATOM 0 H ALA A 27 285.958 133.638 406.644 1.00 0.00 H new ATOM 0 HA ALA A 27 285.274 131.200 405.123 1.00 0.00 H new ATOM 0 HB1 ALA A 27 287.342 131.967 403.890 1.00 0.00 H new ATOM 0 HB2 ALA A 27 286.112 133.253 403.888 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.490 133.342 405.010 1.00 0.00 H new ATOM 430 N HIS A 28 287.506 131.529 407.522 1.00 0.00 N ATOM 431 CA HIS A 28 288.473 130.840 408.404 1.00 0.00 C ATOM 432 C HIS A 28 288.001 129.667 409.256 1.00 0.00 C ATOM 433 O HIS A 28 288.767 128.752 409.546 1.00 0.00 O ATOM 434 CB HIS A 28 289.228 131.819 409.338 1.00 0.00 C ATOM 435 CG HIS A 28 290.706 131.654 409.150 1.00 0.00 C ATOM 436 ND1 HIS A 28 291.428 130.521 408.931 1.00 0.00 N flip ATOM 437 CD2 HIS A 28 291.621 132.677 409.187 1.00 0.00 C flip ATOM 438 CE1 HIS A 28 292.769 130.815 408.848 1.00 0.00 C flip ATOM 439 NE2 HIS A 28 292.842 132.116 409.010 1.00 0.00 N flip ATOM 0 H HIS A 28 287.342 132.493 407.813 1.00 0.00 H new ATOM 0 HA HIS A 28 289.115 130.397 407.642 1.00 0.00 H new ATOM 0 HB2 HIS A 28 288.936 132.846 409.118 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.960 131.627 410.377 1.00 0.00 H new ATOM 0 HD2 HIS A 28 291.409 133.726 409.330 1.00 0.00 H new ATOM 0 HE1 HIS A 28 293.584 130.126 408.685 1.00 0.00 H new ATOM 0 HE2 HIS A 28 293.715 132.643 409.003 1.00 0.00 H new ATOM 447 N LYS A 29 286.696 129.650 409.636 1.00 0.00 N ATOM 448 CA LYS A 29 285.972 128.610 410.377 1.00 0.00 C ATOM 449 C LYS A 29 285.774 127.300 409.599 1.00 0.00 C ATOM 450 O LYS A 29 285.197 126.333 410.082 1.00 0.00 O ATOM 451 CB LYS A 29 284.520 129.158 410.649 1.00 0.00 C ATOM 452 CG LYS A 29 283.699 129.384 409.349 1.00 0.00 C ATOM 453 CD LYS A 29 282.380 130.187 409.337 1.00 0.00 C ATOM 454 CE LYS A 29 282.131 131.292 410.374 1.00 0.00 C ATOM 455 NZ LYS A 29 281.898 130.750 411.735 1.00 0.00 N1+ ATOM 0 H LYS A 29 286.083 130.432 409.408 1.00 0.00 H new ATOM 0 HA LYS A 29 286.563 128.394 411.267 1.00 0.00 H new ATOM 0 HB2 LYS A 29 283.987 128.456 411.290 1.00 0.00 H new ATOM 0 HB3 LYS A 29 284.590 130.099 411.195 1.00 0.00 H new ATOM 0 HG2 LYS A 29 284.367 129.869 408.637 1.00 0.00 H new ATOM 0 HG3 LYS A 29 283.468 128.397 408.949 1.00 0.00 H new ATOM 0 HD2 LYS A 29 282.291 130.644 408.352 1.00 0.00 H new ATOM 0 HD3 LYS A 29 281.565 129.469 409.430 1.00 0.00 H new ATOM 0 HE2 LYS A 29 282.988 131.965 410.396 1.00 0.00 H new ATOM 0 HE3 LYS A 29 281.268 131.884 410.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 281.229 131.363 412.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 281.503 129.790 411.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 282.799 130.716 412.254 1.00 0.00 H new ATOM 469 N TYR A 30 286.140 127.372 408.301 1.00 0.00 N ATOM 470 CA TYR A 30 285.758 126.515 407.208 1.00 0.00 C ATOM 471 C TYR A 30 286.923 125.727 406.625 1.00 0.00 C ATOM 472 O TYR A 30 287.000 124.513 406.793 1.00 0.00 O ATOM 473 CB TYR A 30 285.152 127.544 406.217 1.00 0.00 C ATOM 474 CG TYR A 30 283.798 127.175 405.766 1.00 0.00 C ATOM 475 CD1 TYR A 30 282.706 127.873 406.224 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.625 126.230 404.788 1.00 0.00 C ATOM 477 CE1 TYR A 30 281.440 127.510 405.861 1.00 0.00 C ATOM 478 CE2 TYR A 30 282.361 125.921 404.353 1.00 0.00 C ATOM 479 CZ TYR A 30 281.257 126.455 404.996 1.00 0.00 C ATOM 480 OH TYR A 30 279.958 125.954 404.781 1.00 0.00 O ATOM 0 H TYR A 30 286.770 128.109 407.985 1.00 0.00 H new ATOM 0 HA TYR A 30 285.070 125.718 407.491 1.00 0.00 H new ATOM 0 HB2 TYR A 30 285.117 128.523 406.694 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.806 127.635 405.350 1.00 0.00 H new ATOM 0 HD1 TYR A 30 282.851 128.719 406.879 1.00 0.00 H new ATOM 0 HD2 TYR A 30 284.482 125.730 404.361 1.00 0.00 H new ATOM 0 HE1 TYR A 30 280.588 128.047 406.250 1.00 0.00 H new ATOM 0 HE2 TYR A 30 282.227 125.261 403.509 1.00 0.00 H new ATOM 0 HH TYR A 30 279.306 126.677 404.891 1.00 0.00 H new ATOM 490 N VAL A 31 287.865 126.429 405.943 1.00 0.00 N ATOM 491 CA VAL A 31 289.173 126.004 405.452 1.00 0.00 C ATOM 492 C VAL A 31 289.813 127.329 405.352 1.00 0.00 C ATOM 493 O VAL A 31 289.070 128.258 405.057 1.00 0.00 O ATOM 494 CB VAL A 31 289.378 125.332 404.075 1.00 0.00 C ATOM 495 CG1 VAL A 31 288.285 124.288 403.840 1.00 0.00 C ATOM 496 CG2 VAL A 31 289.904 126.161 402.838 1.00 0.00 C ATOM 0 H VAL A 31 287.695 127.406 405.707 1.00 0.00 H new ATOM 0 HA VAL A 31 289.521 125.207 406.109 1.00 0.00 H new ATOM 0 HB VAL A 31 290.334 124.816 404.161 1.00 0.00 H new ATOM 0 HG11 VAL A 31 288.434 123.817 402.868 1.00 0.00 H new ATOM 0 HG12 VAL A 31 288.332 123.530 404.621 1.00 0.00 H new ATOM 0 HG13 VAL A 31 287.309 124.772 403.863 1.00 0.00 H new ATOM 0 HG21 VAL A 31 289.979 125.508 401.968 1.00 0.00 H new ATOM 0 HG22 VAL A 31 289.210 126.974 402.623 1.00 0.00 H new ATOM 0 HG23 VAL A 31 290.886 126.574 403.068 1.00 0.00 H new ATOM 506 N PRO A 32 291.093 127.560 405.514 1.00 0.00 N ATOM 507 CA PRO A 32 291.560 128.929 405.529 1.00 0.00 C ATOM 508 C PRO A 32 291.870 129.671 404.213 1.00 0.00 C ATOM 509 O PRO A 32 291.570 130.850 404.218 1.00 0.00 O ATOM 510 CB PRO A 32 292.847 128.700 406.355 1.00 0.00 C ATOM 511 CG PRO A 32 293.367 127.294 406.055 1.00 0.00 C ATOM 512 CD PRO A 32 292.053 126.553 405.969 1.00 0.00 C ATOM 0 HA PRO A 32 290.782 129.601 405.890 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.600 129.446 406.099 1.00 0.00 H new ATOM 0 HB3 PRO A 32 292.639 128.809 407.419 1.00 0.00 H new ATOM 0 HG2 PRO A 32 293.935 127.247 405.126 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.013 126.910 406.844 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.113 125.718 405.271 1.00 0.00 H new ATOM 0 HD3 PRO A 32 291.766 126.140 406.936 1.00 0.00 H new ATOM 520 N SER A 33 292.470 129.088 403.137 1.00 0.00 N ATOM 521 CA SER A 33 292.827 129.767 401.870 1.00 0.00 C ATOM 522 C SER A 33 293.516 128.838 400.871 1.00 0.00 C ATOM 523 O SER A 33 293.637 127.628 401.105 1.00 0.00 O ATOM 524 CB SER A 33 293.150 131.309 401.749 1.00 0.00 C ATOM 525 OG SER A 33 292.245 131.989 400.884 1.00 0.00 O ATOM 0 H SER A 33 292.724 128.100 403.134 1.00 0.00 H new ATOM 0 HA SER A 33 291.806 129.990 401.561 1.00 0.00 H new ATOM 0 HB2 SER A 33 293.113 131.764 402.739 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.167 131.436 401.378 1.00 0.00 H new ATOM 0 HG SER A 33 291.369 132.060 401.317 1.00 0.00 H new ATOM 531 N TYR A 34 293.983 129.373 399.693 1.00 0.00 N ATOM 532 CA TYR A 34 294.643 128.746 398.502 1.00 0.00 C ATOM 533 C TYR A 34 295.757 127.683 398.726 1.00 0.00 C ATOM 534 O TYR A 34 295.976 126.780 397.908 1.00 0.00 O ATOM 535 CB TYR A 34 295.246 129.877 397.614 1.00 0.00 C ATOM 536 CG TYR A 34 294.210 130.936 397.320 1.00 0.00 C ATOM 537 CD1 TYR A 34 294.097 132.031 398.152 1.00 0.00 C ATOM 538 CD2 TYR A 34 293.339 130.828 396.249 1.00 0.00 C ATOM 539 CE1 TYR A 34 293.121 132.973 397.924 1.00 0.00 C ATOM 540 CE2 TYR A 34 292.395 131.805 395.976 1.00 0.00 C ATOM 541 CZ TYR A 34 292.295 132.881 396.836 1.00 0.00 C ATOM 542 OH TYR A 34 291.386 133.937 396.646 1.00 0.00 O ATOM 0 H TYR A 34 293.892 130.378 399.542 1.00 0.00 H new ATOM 0 HA TYR A 34 293.829 128.180 398.049 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.100 130.327 398.120 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.616 129.454 396.680 1.00 0.00 H new ATOM 0 HD1 TYR A 34 294.776 132.149 398.984 1.00 0.00 H new ATOM 0 HD2 TYR A 34 293.397 129.960 395.610 1.00 0.00 H new ATOM 0 HE1 TYR A 34 293.005 133.797 398.613 1.00 0.00 H new ATOM 0 HE2 TYR A 34 291.753 131.727 395.111 1.00 0.00 H new ATOM 0 HH TYR A 34 290.594 133.606 396.173 1.00 0.00 H new ATOM 552 N ALA A 35 296.382 127.728 399.928 1.00 0.00 N ATOM 553 CA ALA A 35 297.363 126.826 400.513 1.00 0.00 C ATOM 554 C ALA A 35 296.781 125.505 400.960 1.00 0.00 C ATOM 555 O ALA A 35 297.330 124.438 400.702 1.00 0.00 O ATOM 556 CB ALA A 35 297.943 127.500 401.786 1.00 0.00 C ATOM 0 H ALA A 35 296.176 128.491 400.572 1.00 0.00 H new ATOM 0 HA ALA A 35 298.106 126.631 399.740 1.00 0.00 H new ATOM 0 HB1 ALA A 35 298.682 126.841 402.242 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.417 128.443 401.514 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.138 127.689 402.496 1.00 0.00 H new ATOM 562 N PHE A 36 295.575 125.587 401.600 1.00 0.00 N ATOM 563 CA PHE A 36 294.694 124.505 402.000 1.00 0.00 C ATOM 564 C PHE A 36 294.022 123.998 400.724 1.00 0.00 C ATOM 565 O PHE A 36 293.907 122.795 400.499 1.00 0.00 O ATOM 566 CB PHE A 36 293.662 124.981 403.087 1.00 0.00 C ATOM 567 CG PHE A 36 292.778 123.816 403.562 1.00 0.00 C ATOM 568 CD1 PHE A 36 291.712 123.355 402.795 1.00 0.00 C ATOM 569 CD2 PHE A 36 293.046 123.140 404.739 1.00 0.00 C ATOM 570 CE1 PHE A 36 290.939 122.279 403.175 1.00 0.00 C ATOM 571 CE2 PHE A 36 292.281 122.056 405.129 1.00 0.00 C ATOM 572 CZ PHE A 36 291.220 121.628 404.354 1.00 0.00 C ATOM 0 H PHE A 36 295.187 126.494 401.858 1.00 0.00 H new ATOM 0 HA PHE A 36 295.247 123.694 402.474 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.195 125.406 403.937 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.035 125.772 402.676 1.00 0.00 H new ATOM 0 HD1 PHE A 36 291.482 123.859 401.868 1.00 0.00 H new ATOM 0 HD2 PHE A 36 293.866 123.464 405.363 1.00 0.00 H new ATOM 0 HE1 PHE A 36 290.120 121.950 402.553 1.00 0.00 H new ATOM 0 HE2 PHE A 36 292.515 121.539 406.048 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.617 120.790 404.671 1.00 0.00 H new ATOM 582 N LEU A 37 293.601 124.946 399.824 1.00 0.00 N ATOM 583 CA LEU A 37 292.980 124.584 398.531 1.00 0.00 C ATOM 584 C LEU A 37 293.833 123.743 397.589 1.00 0.00 C ATOM 585 O LEU A 37 293.316 122.780 397.034 1.00 0.00 O ATOM 586 CB LEU A 37 292.481 125.750 397.655 1.00 0.00 C ATOM 587 CG LEU A 37 291.868 126.917 398.414 1.00 0.00 C ATOM 588 CD1 LEU A 37 291.420 127.941 397.404 1.00 0.00 C ATOM 589 CD2 LEU A 37 290.769 126.751 399.446 1.00 0.00 C ATOM 0 H LEU A 37 293.685 125.951 399.980 1.00 0.00 H new ATOM 0 HA LEU A 37 292.143 124.011 398.930 1.00 0.00 H new ATOM 0 HB2 LEU A 37 293.317 126.122 397.063 1.00 0.00 H new ATOM 0 HB3 LEU A 37 291.741 125.365 396.954 1.00 0.00 H new ATOM 0 HG LEU A 37 292.698 127.181 399.070 1.00 0.00 H new ATOM 0 HD11 LEU A 37 290.975 128.791 397.921 1.00 0.00 H new ATOM 0 HD12 LEU A 37 292.278 128.278 396.822 1.00 0.00 H new ATOM 0 HD13 LEU A 37 290.682 127.495 396.737 1.00 0.00 H new ATOM 0 HD21 LEU A 37 290.498 127.727 399.849 1.00 0.00 H new ATOM 0 HD22 LEU A 37 289.896 126.296 398.978 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.122 126.110 400.254 1.00 0.00 H new ATOM 601 N ARG A 38 295.172 124.025 397.420 1.00 0.00 N ATOM 602 CA ARG A 38 296.019 123.149 396.579 1.00 0.00 C ATOM 603 C ARG A 38 296.182 121.711 397.092 1.00 0.00 C ATOM 604 O ARG A 38 296.065 120.746 396.341 1.00 0.00 O ATOM 605 CB ARG A 38 297.408 123.792 396.329 1.00 0.00 C ATOM 606 CG ARG A 38 298.026 123.550 394.932 1.00 0.00 C ATOM 607 CD ARG A 38 298.437 122.120 394.561 1.00 0.00 C ATOM 608 NE ARG A 38 299.355 121.549 395.613 1.00 0.00 N ATOM 609 CZ ARG A 38 300.687 121.286 395.427 1.00 0.00 C ATOM 610 NH1 ARG A 38 301.297 121.532 394.232 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 301.413 120.766 396.459 1.00 0.00 N ATOM 0 H ARG A 38 295.655 124.819 397.841 1.00 0.00 H new ATOM 0 HA ARG A 38 295.474 123.061 395.639 1.00 0.00 H new ATOM 0 HB2 ARG A 38 297.322 124.867 396.485 1.00 0.00 H new ATOM 0 HB3 ARG A 38 298.101 123.415 397.081 1.00 0.00 H new ATOM 0 HG2 ARG A 38 297.310 123.895 394.186 1.00 0.00 H new ATOM 0 HG3 ARG A 38 298.908 124.184 394.844 1.00 0.00 H new ATOM 0 HD2 ARG A 38 297.550 121.493 394.463 1.00 0.00 H new ATOM 0 HD3 ARG A 38 298.937 122.118 393.592 1.00 0.00 H new ATOM 0 HE ARG A 38 298.956 121.344 396.529 1.00 0.00 H new ATOM 0 HH11 ARG A 38 300.760 121.919 393.456 1.00 0.00 H new ATOM 0 HH12 ARG A 38 302.290 121.329 394.115 1.00 0.00 H new ATOM 0 HH21 ARG A 38 300.963 120.578 397.355 1.00 0.00 H new ATOM 0 HH22 ARG A 38 302.405 120.565 396.334 1.00 0.00 H new ATOM 625 N ARG A 39 296.372 121.551 398.430 1.00 0.00 N ATOM 626 CA ARG A 39 296.436 120.275 399.144 1.00 0.00 C ATOM 627 C ARG A 39 295.104 119.513 399.207 1.00 0.00 C ATOM 628 O ARG A 39 295.073 118.292 399.059 1.00 0.00 O ATOM 629 CB ARG A 39 297.035 120.456 400.564 1.00 0.00 C ATOM 630 CG ARG A 39 298.397 121.190 400.585 1.00 0.00 C ATOM 631 CD ARG A 39 299.484 120.629 399.646 1.00 0.00 C ATOM 632 NE ARG A 39 299.746 119.176 399.956 1.00 0.00 N ATOM 633 CZ ARG A 39 300.658 118.740 400.882 1.00 0.00 C ATOM 634 NH1 ARG A 39 301.416 119.621 401.597 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 300.808 117.399 401.090 1.00 0.00 N ATOM 0 H ARG A 39 296.488 122.350 399.054 1.00 0.00 H new ATOM 0 HA ARG A 39 297.102 119.650 398.550 1.00 0.00 H new ATOM 0 HB2 ARG A 39 296.326 121.011 401.178 1.00 0.00 H new ATOM 0 HB3 ARG A 39 297.156 119.475 401.024 1.00 0.00 H new ATOM 0 HG2 ARG A 39 298.227 122.236 400.328 1.00 0.00 H new ATOM 0 HG3 ARG A 39 298.781 121.171 401.605 1.00 0.00 H new ATOM 0 HD2 ARG A 39 299.168 120.735 398.608 1.00 0.00 H new ATOM 0 HD3 ARG A 39 300.403 121.203 399.759 1.00 0.00 H new ATOM 0 HE ARG A 39 299.211 118.474 399.445 1.00 0.00 H new ATOM 0 HH11 ARG A 39 301.309 120.624 401.447 1.00 0.00 H new ATOM 0 HH12 ARG A 39 302.089 119.276 402.281 1.00 0.00 H new ATOM 0 HH21 ARG A 39 300.245 116.734 400.559 1.00 0.00 H new ATOM 0 HH22 ARG A 39 301.483 117.062 401.776 1.00 0.00 H new ATOM 649 N GLU A 40 293.953 120.238 399.376 1.00 0.00 N ATOM 650 CA GLU A 40 292.597 119.699 399.356 1.00 0.00 C ATOM 651 C GLU A 40 292.106 119.324 397.954 1.00 0.00 C ATOM 652 O GLU A 40 291.375 118.347 397.810 1.00 0.00 O ATOM 653 CB GLU A 40 291.609 120.691 400.036 1.00 0.00 C ATOM 654 CG GLU A 40 290.143 120.224 400.199 1.00 0.00 C ATOM 655 CD GLU A 40 290.021 119.028 401.149 1.00 0.00 C ATOM 656 OE1 GLU A 40 290.280 117.879 400.705 1.00 0.00 O ATOM 657 OE2 GLU A 40 289.647 119.250 402.332 1.00 0.00 O1- ATOM 0 H GLU A 40 293.970 121.246 399.534 1.00 0.00 H new ATOM 0 HA GLU A 40 292.629 118.769 399.923 1.00 0.00 H new ATOM 0 HB2 GLU A 40 291.999 120.933 401.025 1.00 0.00 H new ATOM 0 HB3 GLU A 40 291.607 121.616 399.459 1.00 0.00 H new ATOM 0 HG2 GLU A 40 289.540 121.050 400.577 1.00 0.00 H new ATOM 0 HG3 GLU A 40 289.738 119.954 399.223 1.00 0.00 H new ATOM 664 N LEU A 41 292.488 120.068 396.866 1.00 0.00 N ATOM 665 CA LEU A 41 292.006 119.696 395.530 1.00 0.00 C ATOM 666 C LEU A 41 292.867 118.669 394.818 1.00 0.00 C ATOM 667 O LEU A 41 292.482 118.179 393.760 1.00 0.00 O ATOM 668 CB LEU A 41 291.995 120.943 394.586 1.00 0.00 C ATOM 669 CG LEU A 41 290.596 121.509 394.272 1.00 0.00 C ATOM 670 CD1 LEU A 41 290.776 122.751 393.392 1.00 0.00 C ATOM 671 CD2 LEU A 41 289.651 120.511 393.583 1.00 0.00 C ATOM 0 H LEU A 41 293.098 120.885 396.900 1.00 0.00 H new ATOM 0 HA LEU A 41 291.015 119.279 395.711 1.00 0.00 H new ATOM 0 HB2 LEU A 41 292.595 121.730 395.042 1.00 0.00 H new ATOM 0 HB3 LEU A 41 292.481 120.674 393.648 1.00 0.00 H new ATOM 0 HG LEU A 41 290.119 121.748 395.223 1.00 0.00 H new ATOM 0 HD11 LEU A 41 289.800 123.173 393.154 1.00 0.00 H new ATOM 0 HD12 LEU A 41 291.371 123.492 393.926 1.00 0.00 H new ATOM 0 HD13 LEU A 41 291.286 122.473 392.470 1.00 0.00 H new ATOM 0 HD21 LEU A 41 288.689 120.989 393.398 1.00 0.00 H new ATOM 0 HD22 LEU A 41 290.086 120.192 392.636 1.00 0.00 H new ATOM 0 HD23 LEU A 41 289.507 119.643 394.226 1.00 0.00 H new ATOM 683 N GLY A 42 294.072 118.339 395.345 1.00 0.00 N ATOM 684 CA GLY A 42 295.009 117.373 394.759 1.00 0.00 C ATOM 685 C GLY A 42 295.742 117.791 393.492 1.00 0.00 C ATOM 686 O GLY A 42 296.677 117.115 393.073 1.00 0.00 O ATOM 0 H GLY A 42 294.419 118.752 396.210 1.00 0.00 H new ATOM 0 HA2 GLY A 42 295.755 117.126 395.514 1.00 0.00 H new ATOM 0 HA3 GLY A 42 294.458 116.457 394.544 1.00 0.00 H new ATOM 690 N LEU A 43 295.313 118.902 392.824 1.00 0.00 N ATOM 691 CA LEU A 43 295.824 119.390 391.554 1.00 0.00 C ATOM 692 C LEU A 43 296.453 120.765 391.638 1.00 0.00 C ATOM 693 O LEU A 43 295.980 121.664 392.349 1.00 0.00 O ATOM 694 CB LEU A 43 294.800 119.261 390.369 1.00 0.00 C ATOM 695 CG LEU A 43 293.922 120.476 389.944 1.00 0.00 C ATOM 696 CD1 LEU A 43 293.136 120.161 388.658 1.00 0.00 C ATOM 697 CD2 LEU A 43 292.943 120.939 391.027 1.00 0.00 C ATOM 0 H LEU A 43 294.567 119.492 393.192 1.00 0.00 H new ATOM 0 HA LEU A 43 296.640 118.710 391.311 1.00 0.00 H new ATOM 0 HB2 LEU A 43 295.364 118.949 389.490 1.00 0.00 H new ATOM 0 HB3 LEU A 43 294.121 118.446 390.618 1.00 0.00 H new ATOM 0 HG LEU A 43 294.623 121.292 389.771 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.530 121.024 388.381 1.00 0.00 H new ATOM 0 HD12 LEU A 43 293.833 119.933 387.852 1.00 0.00 H new ATOM 0 HD13 LEU A 43 292.487 119.302 388.829 1.00 0.00 H new ATOM 0 HD21 LEU A 43 292.367 121.788 390.658 1.00 0.00 H new ATOM 0 HD22 LEU A 43 292.266 120.123 391.278 1.00 0.00 H new ATOM 0 HD23 LEU A 43 293.498 121.237 391.916 1.00 0.00 H new ATOM 709 N SER A 44 297.529 120.964 390.810 1.00 0.00 N ATOM 710 CA SER A 44 298.384 122.148 390.591 1.00 0.00 C ATOM 711 C SER A 44 297.710 123.392 390.009 1.00 0.00 C ATOM 712 O SER A 44 298.232 124.081 389.137 1.00 0.00 O ATOM 713 CB SER A 44 299.608 121.816 389.683 1.00 0.00 C ATOM 714 OG SER A 44 300.280 120.657 390.171 1.00 0.00 O ATOM 0 H SER A 44 297.843 120.197 390.215 1.00 0.00 H new ATOM 0 HA SER A 44 298.678 122.400 391.610 1.00 0.00 H new ATOM 0 HB2 SER A 44 299.276 121.649 388.658 1.00 0.00 H new ATOM 0 HB3 SER A 44 300.295 122.662 389.661 1.00 0.00 H new ATOM 0 HG SER A 44 301.046 120.455 389.594 1.00 0.00 H new ATOM 720 N SER A 45 296.502 123.690 390.530 1.00 0.00 N ATOM 721 CA SER A 45 295.587 124.800 390.263 1.00 0.00 C ATOM 722 C SER A 45 296.069 126.133 390.851 1.00 0.00 C ATOM 723 O SER A 45 295.831 127.186 390.265 1.00 0.00 O ATOM 724 CB SER A 45 294.101 124.524 390.738 1.00 0.00 C ATOM 725 OG SER A 45 294.011 123.839 391.994 1.00 0.00 O ATOM 0 H SER A 45 296.102 123.074 391.237 1.00 0.00 H new ATOM 0 HA SER A 45 295.585 124.881 389.176 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.572 125.474 390.815 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.590 123.935 389.976 1.00 0.00 H new ATOM 0 HG SER A 45 293.069 123.703 392.226 1.00 0.00 H new ATOM 731 N ALA A 46 296.741 126.127 392.042 1.00 0.00 N ATOM 732 CA ALA A 46 297.089 127.279 392.884 1.00 0.00 C ATOM 733 C ALA A 46 298.140 128.272 392.398 1.00 0.00 C ATOM 734 O ALA A 46 298.466 129.223 393.102 1.00 0.00 O ATOM 735 CB ALA A 46 297.418 126.822 394.314 1.00 0.00 C ATOM 0 H ALA A 46 297.068 125.252 392.452 1.00 0.00 H new ATOM 0 HA ALA A 46 296.175 127.870 392.831 1.00 0.00 H new ATOM 0 HB1 ALA A 46 297.673 127.689 394.923 1.00 0.00 H new ATOM 0 HB2 ALA A 46 296.552 126.319 394.744 1.00 0.00 H new ATOM 0 HB3 ALA A 46 298.263 126.133 394.291 1.00 0.00 H new ATOM 741 N HIS A 47 298.651 128.092 391.155 1.00 0.00 N ATOM 742 CA HIS A 47 299.579 128.941 390.423 1.00 0.00 C ATOM 743 C HIS A 47 298.982 130.307 390.020 1.00 0.00 C ATOM 744 O HIS A 47 299.683 131.290 389.784 1.00 0.00 O ATOM 745 CB HIS A 47 300.010 128.167 389.135 1.00 0.00 C ATOM 746 CG HIS A 47 300.792 126.885 389.366 1.00 0.00 C ATOM 747 ND1 HIS A 47 301.784 126.738 390.314 1.00 0.00 N ATOM 748 CD2 HIS A 47 300.787 125.713 388.663 1.00 0.00 C ATOM 749 CE1 HIS A 47 302.318 125.500 390.143 1.00 0.00 C ATOM 750 NE2 HIS A 47 301.751 124.841 389.151 1.00 0.00 N ATOM 0 H HIS A 47 298.392 127.273 390.605 1.00 0.00 H new ATOM 0 HA HIS A 47 300.422 129.159 391.078 1.00 0.00 H new ATOM 0 HB2 HIS A 47 299.115 127.926 388.562 1.00 0.00 H new ATOM 0 HB3 HIS A 47 300.614 128.833 388.518 1.00 0.00 H new ATOM 0 HD2 HIS A 47 300.123 125.495 387.840 1.00 0.00 H new ATOM 0 HE1 HIS A 47 303.117 125.101 390.751 1.00 0.00 H new ATOM 0 HE2 HIS A 47 301.971 123.902 388.818 1.00 0.00 H new ATOM 758 N THR A 48 297.635 130.395 389.890 1.00 0.00 N ATOM 759 CA THR A 48 296.945 131.611 389.485 1.00 0.00 C ATOM 760 C THR A 48 295.599 131.636 390.177 1.00 0.00 C ATOM 761 O THR A 48 294.833 130.668 390.078 1.00 0.00 O ATOM 762 CB THR A 48 296.777 131.679 387.964 1.00 0.00 C ATOM 763 OG1 THR A 48 298.031 131.546 387.307 1.00 0.00 O ATOM 764 CG2 THR A 48 296.165 133.014 387.510 1.00 0.00 C ATOM 0 H THR A 48 297.007 129.611 390.068 1.00 0.00 H new ATOM 0 HA THR A 48 297.535 132.481 389.774 1.00 0.00 H new ATOM 0 HB THR A 48 296.110 130.858 387.699 1.00 0.00 H new ATOM 0 HG1 THR A 48 297.899 131.591 386.337 1.00 0.00 H new ATOM 0 HG21 THR A 48 296.064 133.018 386.425 1.00 0.00 H new ATOM 0 HG22 THR A 48 295.183 133.138 387.966 1.00 0.00 H new ATOM 0 HG23 THR A 48 296.813 133.835 387.817 1.00 0.00 H new ATOM 772 N ASN A 49 295.236 132.778 390.865 1.00 0.00 N ATOM 773 CA ASN A 49 293.994 133.051 391.623 1.00 0.00 C ATOM 774 C ASN A 49 292.727 132.697 390.857 1.00 0.00 C ATOM 775 O ASN A 49 291.910 131.922 391.321 1.00 0.00 O ATOM 776 CB ASN A 49 293.968 134.548 392.116 1.00 0.00 C ATOM 777 CG ASN A 49 292.761 135.032 392.956 1.00 0.00 C ATOM 778 OD1 ASN A 49 292.235 136.126 392.740 1.00 0.00 O ATOM 779 ND2 ASN A 49 292.356 134.217 393.958 1.00 0.00 N ATOM 0 H ASN A 49 295.865 133.581 390.894 1.00 0.00 H new ATOM 0 HA ASN A 49 294.006 132.392 392.491 1.00 0.00 H new ATOM 0 HB2 ASN A 49 294.870 134.718 392.704 1.00 0.00 H new ATOM 0 HB3 ASN A 49 294.036 135.187 391.236 1.00 0.00 H new ATOM 0 HD21 ASN A 49 291.589 134.501 394.568 1.00 0.00 H new ATOM 0 HD22 ASN A 49 292.818 133.319 394.103 1.00 0.00 H new ATOM 786 N ARG A 50 292.641 133.202 389.617 1.00 0.00 N ATOM 787 CA ARG A 50 291.621 133.047 388.606 1.00 0.00 C ATOM 788 C ARG A 50 291.490 131.644 387.993 1.00 0.00 C ATOM 789 O ARG A 50 290.385 131.216 387.688 1.00 0.00 O ATOM 790 CB ARG A 50 291.808 134.167 387.549 1.00 0.00 C ATOM 791 CG ARG A 50 292.211 135.532 388.171 1.00 0.00 C ATOM 792 CD ARG A 50 293.738 135.742 388.292 1.00 0.00 C ATOM 793 NE ARG A 50 293.997 137.078 388.933 1.00 0.00 N ATOM 794 CZ ARG A 50 295.226 137.449 389.412 1.00 0.00 C ATOM 795 NH1 ARG A 50 296.295 136.605 389.325 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 295.378 138.675 389.991 1.00 0.00 N ATOM 0 H ARG A 50 293.389 133.803 389.271 1.00 0.00 H new ATOM 0 HA ARG A 50 290.656 133.156 389.101 1.00 0.00 H new ATOM 0 HB2 ARG A 50 292.572 133.860 386.835 1.00 0.00 H new ATOM 0 HB3 ARG A 50 290.880 134.289 386.990 1.00 0.00 H new ATOM 0 HG2 ARG A 50 291.791 136.334 387.564 1.00 0.00 H new ATOM 0 HG3 ARG A 50 291.764 135.614 389.162 1.00 0.00 H new ATOM 0 HD2 ARG A 50 294.182 134.945 388.889 1.00 0.00 H new ATOM 0 HD3 ARG A 50 294.203 135.700 387.307 1.00 0.00 H new ATOM 0 HE ARG A 50 293.223 137.737 389.015 1.00 0.00 H new ATOM 0 HH11 ARG A 50 296.185 135.685 388.899 1.00 0.00 H new ATOM 0 HH12 ARG A 50 297.204 136.895 389.686 1.00 0.00 H new ATOM 0 HH21 ARG A 50 294.581 139.307 390.064 1.00 0.00 H new ATOM 0 HH22 ARG A 50 296.289 138.960 390.350 1.00 0.00 H new ATOM 810 N LYS A 51 292.604 130.865 387.814 1.00 0.00 N ATOM 811 CA LYS A 51 292.615 129.454 387.377 1.00 0.00 C ATOM 812 C LYS A 51 292.148 128.485 388.469 1.00 0.00 C ATOM 813 O LYS A 51 291.270 127.621 388.280 1.00 0.00 O ATOM 814 CB LYS A 51 293.970 129.013 386.775 1.00 0.00 C ATOM 815 CG LYS A 51 294.433 129.829 385.566 1.00 0.00 C ATOM 816 CD LYS A 51 293.629 129.511 384.312 1.00 0.00 C ATOM 817 CE LYS A 51 294.327 130.027 383.057 1.00 0.00 C ATOM 818 NZ LYS A 51 294.274 131.503 382.966 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.543 131.227 387.979 1.00 0.00 H new ATOM 0 HA LYS A 51 291.882 129.405 386.572 1.00 0.00 H new ATOM 0 HB2 LYS A 51 294.733 129.075 387.551 1.00 0.00 H new ATOM 0 HB3 LYS A 51 293.897 127.966 386.482 1.00 0.00 H new ATOM 0 HG2 LYS A 51 294.344 130.892 385.792 1.00 0.00 H new ATOM 0 HG3 LYS A 51 295.488 129.630 385.379 1.00 0.00 H new ATOM 0 HD2 LYS A 51 293.486 128.433 384.233 1.00 0.00 H new ATOM 0 HD3 LYS A 51 292.639 129.959 384.390 1.00 0.00 H new ATOM 0 HE2 LYS A 51 295.367 129.700 383.059 1.00 0.00 H new ATOM 0 HE3 LYS A 51 293.858 129.591 382.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 294.759 131.815 382.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 293.282 131.814 382.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 294.744 131.919 383.795 1.00 0.00 H new ATOM 832 N VAL A 52 292.695 128.682 389.728 1.00 0.00 N ATOM 833 CA VAL A 52 292.297 127.929 390.946 1.00 0.00 C ATOM 834 C VAL A 52 290.884 128.224 391.317 1.00 0.00 C ATOM 835 O VAL A 52 290.126 127.305 391.597 1.00 0.00 O ATOM 836 CB VAL A 52 293.227 128.003 392.187 1.00 0.00 C ATOM 837 CG1 VAL A 52 293.193 129.333 392.977 1.00 0.00 C ATOM 838 CG2 VAL A 52 293.042 126.793 393.157 1.00 0.00 C ATOM 0 H VAL A 52 293.424 129.373 389.906 1.00 0.00 H new ATOM 0 HA VAL A 52 292.409 126.892 390.631 1.00 0.00 H new ATOM 0 HB VAL A 52 294.220 127.953 391.741 1.00 0.00 H new ATOM 0 HG11 VAL A 52 293.880 129.272 393.821 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.493 130.152 392.323 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.182 129.513 393.344 1.00 0.00 H new ATOM 0 HG21 VAL A 52 293.718 126.900 394.005 1.00 0.00 H new ATOM 0 HG22 VAL A 52 292.013 126.767 393.515 1.00 0.00 H new ATOM 0 HG23 VAL A 52 293.266 125.866 392.629 1.00 0.00 H new ATOM 848 N TRP A 53 290.486 129.530 391.164 1.00 0.00 N ATOM 849 CA TRP A 53 289.127 130.058 391.256 1.00 0.00 C ATOM 850 C TRP A 53 288.220 129.491 390.220 1.00 0.00 C ATOM 851 O TRP A 53 287.206 128.977 390.608 1.00 0.00 O ATOM 852 CB TRP A 53 288.999 131.584 391.389 1.00 0.00 C ATOM 853 CG TRP A 53 289.174 132.168 392.770 1.00 0.00 C ATOM 854 CD1 TRP A 53 288.807 133.439 393.098 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.365 131.470 394.021 1.00 0.00 C ATOM 856 NE1 TRP A 53 288.739 133.576 394.453 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.104 132.385 395.031 1.00 0.00 C ATOM 858 CE3 TRP A 53 289.661 130.169 394.334 1.00 0.00 C ATOM 859 CZ2 TRP A 53 289.164 132.019 396.339 1.00 0.00 C ATOM 860 CZ3 TRP A 53 289.562 129.792 395.634 1.00 0.00 C ATOM 861 CH2 TRP A 53 289.364 130.697 396.634 1.00 0.00 C ATOM 0 H TRP A 53 291.163 130.265 390.962 1.00 0.00 H new ATOM 0 HA TRP A 53 288.784 129.697 392.225 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.735 132.045 390.731 1.00 0.00 H new ATOM 0 HB3 TRP A 53 288.015 131.875 391.020 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.600 134.225 392.387 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.463 134.421 394.953 1.00 0.00 H new ATOM 0 HE3 TRP A 53 289.963 129.467 393.571 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.057 132.752 397.125 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 289.642 128.744 395.884 1.00 0.00 H new ATOM 0 HH2 TRP A 53 289.365 130.370 397.663 1.00 0.00 H new ATOM 872 N LYS A 54 288.552 129.419 388.922 1.00 0.00 N ATOM 873 CA LYS A 54 287.799 128.665 387.901 1.00 0.00 C ATOM 874 C LYS A 54 287.547 127.188 388.217 1.00 0.00 C ATOM 875 O LYS A 54 286.409 126.744 388.119 1.00 0.00 O ATOM 876 CB LYS A 54 288.669 128.739 386.632 1.00 0.00 C ATOM 877 CG LYS A 54 288.727 127.578 385.625 1.00 0.00 C ATOM 878 CD LYS A 54 289.554 127.972 384.399 1.00 0.00 C ATOM 879 CE LYS A 54 289.885 126.795 383.470 1.00 0.00 C ATOM 880 NZ LYS A 54 288.655 126.164 382.936 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.371 129.894 388.541 1.00 0.00 H new ATOM 0 HA LYS A 54 286.806 129.107 387.820 1.00 0.00 H new ATOM 0 HB2 LYS A 54 288.347 129.621 386.079 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.692 128.924 386.960 1.00 0.00 H new ATOM 0 HG2 LYS A 54 289.165 126.699 386.099 1.00 0.00 H new ATOM 0 HG3 LYS A 54 287.718 127.305 385.318 1.00 0.00 H new ATOM 0 HD2 LYS A 54 289.010 128.728 383.833 1.00 0.00 H new ATOM 0 HD3 LYS A 54 290.484 128.432 384.732 1.00 0.00 H new ATOM 0 HE2 LYS A 54 290.504 127.145 382.644 1.00 0.00 H new ATOM 0 HE3 LYS A 54 290.469 126.053 384.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 288.914 125.394 382.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 288.093 125.779 383.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 288.094 126.875 382.425 1.00 0.00 H new ATOM 894 N LYS A 55 288.577 126.412 388.704 1.00 0.00 N ATOM 895 CA LYS A 55 288.364 125.026 389.209 1.00 0.00 C ATOM 896 C LYS A 55 287.481 124.976 390.479 1.00 0.00 C ATOM 897 O LYS A 55 286.522 124.209 390.615 1.00 0.00 O ATOM 898 CB LYS A 55 289.685 124.252 389.476 1.00 0.00 C ATOM 899 CG LYS A 55 290.643 124.178 388.274 1.00 0.00 C ATOM 900 CD LYS A 55 290.011 123.470 387.071 1.00 0.00 C ATOM 901 CE LYS A 55 291.022 123.145 385.966 1.00 0.00 C ATOM 902 NZ LYS A 55 290.353 122.488 384.818 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.546 126.727 388.753 1.00 0.00 H new ATOM 0 HA LYS A 55 287.838 124.528 388.395 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.205 124.725 390.309 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.438 123.238 389.789 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.939 125.187 387.985 1.00 0.00 H new ATOM 0 HG3 LYS A 55 291.551 123.651 388.567 1.00 0.00 H new ATOM 0 HD2 LYS A 55 289.539 122.546 387.407 1.00 0.00 H new ATOM 0 HD3 LYS A 55 289.222 124.100 386.660 1.00 0.00 H new ATOM 0 HE2 LYS A 55 291.510 124.061 385.633 1.00 0.00 H new ATOM 0 HE3 LYS A 55 291.802 122.493 386.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 291.056 122.277 384.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 289.908 121.603 385.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 289.626 123.122 384.431 1.00 0.00 H new ATOM 916 N PHE A 56 287.751 125.931 391.394 1.00 0.00 N ATOM 917 CA PHE A 56 286.934 126.195 392.611 1.00 0.00 C ATOM 918 C PHE A 56 285.452 126.619 392.363 1.00 0.00 C ATOM 919 O PHE A 56 284.505 126.073 392.932 1.00 0.00 O ATOM 920 CB PHE A 56 287.645 127.196 393.571 1.00 0.00 C ATOM 921 CG PHE A 56 288.108 126.541 394.839 1.00 0.00 C ATOM 922 CD1 PHE A 56 287.651 126.965 396.073 1.00 0.00 C ATOM 923 CD2 PHE A 56 288.979 125.471 394.786 1.00 0.00 C ATOM 924 CE1 PHE A 56 287.999 126.284 397.218 1.00 0.00 C ATOM 925 CE2 PHE A 56 289.337 124.791 395.930 1.00 0.00 C ATOM 926 CZ PHE A 56 288.838 125.193 397.146 1.00 0.00 C ATOM 0 H PHE A 56 288.555 126.554 391.312 1.00 0.00 H new ATOM 0 HA PHE A 56 286.860 125.218 393.089 1.00 0.00 H new ATOM 0 HB2 PHE A 56 288.500 127.639 393.061 1.00 0.00 H new ATOM 0 HB3 PHE A 56 286.962 128.010 393.814 1.00 0.00 H new ATOM 0 HD1 PHE A 56 287.017 127.836 396.139 1.00 0.00 H new ATOM 0 HD2 PHE A 56 289.386 125.162 393.834 1.00 0.00 H new ATOM 0 HE1 PHE A 56 287.614 126.605 398.174 1.00 0.00 H new ATOM 0 HE2 PHE A 56 290.007 123.946 395.871 1.00 0.00 H new ATOM 0 HZ PHE A 56 289.103 124.655 398.044 1.00 0.00 H new ATOM 936 N VAL A 57 285.214 127.576 391.429 1.00 0.00 N ATOM 937 CA VAL A 57 283.941 128.031 390.874 1.00 0.00 C ATOM 938 C VAL A 57 283.212 126.983 390.031 1.00 0.00 C ATOM 939 O VAL A 57 281.988 126.881 390.082 1.00 0.00 O ATOM 940 CB VAL A 57 283.661 129.541 390.764 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.176 129.996 392.175 1.00 0.00 C ATOM 942 CG2 VAL A 57 284.824 130.445 390.345 1.00 0.00 C ATOM 0 H VAL A 57 285.992 128.089 391.015 1.00 0.00 H new ATOM 0 HA VAL A 57 283.223 128.084 391.693 1.00 0.00 H new ATOM 0 HB VAL A 57 282.937 129.654 389.957 1.00 0.00 H new ATOM 0 HG11 VAL A 57 282.961 131.064 392.159 1.00 0.00 H new ATOM 0 HG12 VAL A 57 282.273 129.448 392.444 1.00 0.00 H new ATOM 0 HG13 VAL A 57 283.955 129.794 392.910 1.00 0.00 H new ATOM 0 HG21 VAL A 57 284.485 131.480 390.309 1.00 0.00 H new ATOM 0 HG22 VAL A 57 285.635 130.354 391.068 1.00 0.00 H new ATOM 0 HG23 VAL A 57 285.181 130.145 389.360 1.00 0.00 H new ATOM 952 N GLU A 58 283.981 126.093 389.330 1.00 0.00 N ATOM 953 CA GLU A 58 283.519 124.819 388.755 1.00 0.00 C ATOM 954 C GLU A 58 283.030 123.815 389.842 1.00 0.00 C ATOM 955 O GLU A 58 282.014 123.157 389.642 1.00 0.00 O ATOM 956 CB GLU A 58 284.612 124.200 387.844 1.00 0.00 C ATOM 957 CG GLU A 58 284.164 123.007 386.977 1.00 0.00 C ATOM 958 CD GLU A 58 285.298 122.539 386.057 1.00 0.00 C ATOM 959 OE1 GLU A 58 286.414 123.121 386.112 1.00 0.00 O ATOM 960 OE2 GLU A 58 285.051 121.576 385.281 1.00 0.00 O1- ATOM 0 H GLU A 58 284.971 126.263 389.152 1.00 0.00 H new ATOM 0 HA GLU A 58 282.649 125.039 388.136 1.00 0.00 H new ATOM 0 HB2 GLU A 58 284.995 124.980 387.186 1.00 0.00 H new ATOM 0 HB3 GLU A 58 285.442 123.877 388.472 1.00 0.00 H new ATOM 0 HG2 GLU A 58 283.849 122.184 387.619 1.00 0.00 H new ATOM 0 HG3 GLU A 58 283.299 123.293 386.378 1.00 0.00 H new ATOM 967 N ALA A 59 283.692 123.751 391.055 1.00 0.00 N ATOM 968 CA ALA A 59 283.223 123.015 392.262 1.00 0.00 C ATOM 969 C ALA A 59 281.935 123.513 392.864 1.00 0.00 C ATOM 970 O ALA A 59 281.083 122.737 393.256 1.00 0.00 O ATOM 971 CB ALA A 59 284.102 123.176 393.543 1.00 0.00 C ATOM 0 H ALA A 59 284.583 124.224 391.208 1.00 0.00 H new ATOM 0 HA ALA A 59 283.199 122.018 391.822 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.667 122.598 394.358 1.00 0.00 H new ATOM 0 HB2 ALA A 59 285.110 122.815 393.340 1.00 0.00 H new ATOM 0 HB3 ALA A 59 284.143 124.228 393.826 1.00 0.00 H new ATOM 977 N TYR A 60 281.842 124.862 393.013 1.00 0.00 N ATOM 978 CA TYR A 60 280.981 125.721 393.825 1.00 0.00 C ATOM 979 C TYR A 60 279.457 125.437 393.762 1.00 0.00 C ATOM 980 O TYR A 60 278.680 125.851 394.603 1.00 0.00 O ATOM 981 CB TYR A 60 281.325 127.164 393.335 1.00 0.00 C ATOM 982 CG TYR A 60 280.882 128.411 394.061 1.00 0.00 C ATOM 983 CD1 TYR A 60 279.790 129.124 393.591 1.00 0.00 C ATOM 984 CD2 TYR A 60 281.715 129.017 394.997 1.00 0.00 C ATOM 985 CE1 TYR A 60 279.540 130.409 394.043 1.00 0.00 C ATOM 986 CE2 TYR A 60 281.459 130.287 395.474 1.00 0.00 C ATOM 987 CZ TYR A 60 280.366 130.983 394.984 1.00 0.00 C ATOM 988 OH TYR A 60 280.103 132.284 395.456 1.00 0.00 O ATOM 0 H TYR A 60 282.478 125.448 392.473 1.00 0.00 H new ATOM 0 HA TYR A 60 281.182 125.543 394.881 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.412 127.216 393.268 1.00 0.00 H new ATOM 0 HB3 TYR A 60 280.939 127.245 392.319 1.00 0.00 H new ATOM 0 HD1 TYR A 60 279.128 128.673 392.866 1.00 0.00 H new ATOM 0 HD2 TYR A 60 282.581 128.482 395.358 1.00 0.00 H new ATOM 0 HE1 TYR A 60 278.696 130.962 393.657 1.00 0.00 H new ATOM 0 HE2 TYR A 60 282.102 130.732 396.219 1.00 0.00 H new ATOM 0 HH TYR A 60 279.159 132.502 395.306 1.00 0.00 H new ATOM 998 N GLY A 61 279.008 124.623 392.785 1.00 0.00 N ATOM 999 CA GLY A 61 277.704 123.946 392.782 1.00 0.00 C ATOM 1000 C GLY A 61 277.580 122.656 393.615 1.00 0.00 C ATOM 1001 O GLY A 61 276.549 121.996 393.536 1.00 0.00 O ATOM 0 H GLY A 61 279.562 124.415 391.954 1.00 0.00 H new ATOM 0 HA2 GLY A 61 276.955 124.653 393.140 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.449 123.707 391.749 1.00 0.00 H new ATOM 1005 N LYS A 62 278.609 122.243 394.422 1.00 0.00 N ATOM 1006 CA LYS A 62 278.671 121.025 395.242 1.00 0.00 C ATOM 1007 C LYS A 62 278.157 121.105 396.696 1.00 0.00 C ATOM 1008 O LYS A 62 277.407 120.236 397.115 1.00 0.00 O ATOM 1009 CB LYS A 62 280.059 120.306 395.103 1.00 0.00 C ATOM 1010 CG LYS A 62 281.341 121.021 395.591 1.00 0.00 C ATOM 1011 CD LYS A 62 282.081 120.414 396.794 1.00 0.00 C ATOM 1012 CE LYS A 62 281.618 121.000 398.127 1.00 0.00 C ATOM 1013 NZ LYS A 62 282.558 120.674 399.224 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.460 122.798 394.510 1.00 0.00 H new ATOM 0 HA LYS A 62 277.905 120.390 394.798 1.00 0.00 H new ATOM 0 HB2 LYS A 62 279.991 119.358 395.637 1.00 0.00 H new ATOM 0 HB3 LYS A 62 280.199 120.068 394.049 1.00 0.00 H new ATOM 0 HG2 LYS A 62 282.039 121.066 394.755 1.00 0.00 H new ATOM 0 HG3 LYS A 62 281.078 122.048 395.842 1.00 0.00 H new ATOM 0 HD2 LYS A 62 281.928 119.335 396.803 1.00 0.00 H new ATOM 0 HD3 LYS A 62 283.152 120.583 396.680 1.00 0.00 H new ATOM 0 HE2 LYS A 62 281.526 122.082 398.036 1.00 0.00 H new ATOM 0 HE3 LYS A 62 280.628 120.615 398.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 282.039 120.628 400.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 283.006 119.754 399.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 283.290 121.410 399.284 1.00 0.00 H new ATOM 1027 N ALA A 63 278.511 122.122 397.531 1.00 0.00 N ATOM 1028 CA ALA A 63 278.086 122.279 398.940 1.00 0.00 C ATOM 1029 C ALA A 63 276.989 123.325 399.128 1.00 0.00 C ATOM 1030 O ALA A 63 276.911 123.999 400.159 1.00 0.00 O ATOM 1031 CB ALA A 63 279.277 122.647 399.872 1.00 0.00 C ATOM 0 H ALA A 63 279.122 122.879 397.224 1.00 0.00 H new ATOM 0 HA ALA A 63 277.686 121.303 399.215 1.00 0.00 H new ATOM 0 HB1 ALA A 63 278.919 122.752 400.896 1.00 0.00 H new ATOM 0 HB2 ALA A 63 280.029 121.859 399.830 1.00 0.00 H new ATOM 0 HB3 ALA A 63 279.719 123.588 399.544 1.00 0.00 H new ATOM 1037 N ILE A 64 276.139 123.517 398.102 1.00 0.00 N ATOM 1038 CA ILE A 64 275.041 124.477 398.052 1.00 0.00 C ATOM 1039 C ILE A 64 273.706 123.725 398.222 1.00 0.00 C ATOM 1040 O ILE A 64 273.551 122.662 397.618 1.00 0.00 O ATOM 1041 CB ILE A 64 275.125 125.292 396.746 1.00 0.00 C ATOM 1042 CG1 ILE A 64 274.189 126.525 396.698 1.00 0.00 C ATOM 1043 CG2 ILE A 64 274.918 124.416 395.492 1.00 0.00 C ATOM 1044 CD1 ILE A 64 274.639 127.678 397.605 1.00 0.00 C ATOM 0 H ILE A 64 276.211 122.972 397.243 1.00 0.00 H new ATOM 0 HA ILE A 64 275.110 125.195 398.869 1.00 0.00 H new ATOM 0 HB ILE A 64 276.144 125.678 396.741 1.00 0.00 H new ATOM 0 HG12 ILE A 64 274.129 126.885 395.671 1.00 0.00 H new ATOM 0 HG13 ILE A 64 273.184 126.218 396.987 1.00 0.00 H new ATOM 0 HG21 ILE A 64 274.986 125.037 394.599 1.00 0.00 H new ATOM 0 HG22 ILE A 64 275.686 123.644 395.457 1.00 0.00 H new ATOM 0 HG23 ILE A 64 273.935 123.948 395.534 1.00 0.00 H new ATOM 0 HD11 ILE A 64 273.935 128.505 397.518 1.00 0.00 H new ATOM 0 HD12 ILE A 64 274.671 127.336 398.639 1.00 0.00 H new ATOM 0 HD13 ILE A 64 275.631 128.013 397.303 1.00 0.00 H new ATOM 1056 N PRO A 65 272.714 124.143 399.043 1.00 0.00 N ATOM 1057 CA PRO A 65 271.415 123.475 399.148 1.00 0.00 C ATOM 1058 C PRO A 65 270.438 123.966 398.048 1.00 0.00 C ATOM 1059 O PRO A 65 270.650 125.053 397.503 1.00 0.00 O ATOM 1060 CB PRO A 65 270.952 123.908 400.556 1.00 0.00 C ATOM 1061 CG PRO A 65 271.497 125.330 400.727 1.00 0.00 C ATOM 1062 CD PRO A 65 272.817 125.291 399.947 1.00 0.00 C ATOM 0 HA PRO A 65 271.459 122.394 399.014 1.00 0.00 H new ATOM 0 HB2 PRO A 65 269.865 123.888 400.639 1.00 0.00 H new ATOM 0 HB3 PRO A 65 271.342 123.240 401.324 1.00 0.00 H new ATOM 0 HG2 PRO A 65 270.812 126.076 400.324 1.00 0.00 H new ATOM 0 HG3 PRO A 65 271.656 125.578 401.777 1.00 0.00 H new ATOM 0 HD2 PRO A 65 272.969 126.215 399.389 1.00 0.00 H new ATOM 0 HD3 PRO A 65 273.666 125.182 400.621 1.00 0.00 H new ATOM 1070 N PRO A 66 269.346 123.245 397.686 1.00 0.00 N ATOM 1071 CA PRO A 66 268.344 123.671 396.693 1.00 0.00 C ATOM 1072 C PRO A 66 267.368 124.700 397.306 1.00 0.00 C ATOM 1073 O PRO A 66 266.204 124.390 397.550 1.00 0.00 O ATOM 1074 CB PRO A 66 267.673 122.335 396.317 1.00 0.00 C ATOM 1075 CG PRO A 66 267.712 121.509 397.608 1.00 0.00 C ATOM 1076 CD PRO A 66 269.044 121.923 398.241 1.00 0.00 C ATOM 0 HA PRO A 66 268.751 124.186 395.823 1.00 0.00 H new ATOM 0 HB2 PRO A 66 266.650 122.488 395.974 1.00 0.00 H new ATOM 0 HB3 PRO A 66 268.208 121.835 395.510 1.00 0.00 H new ATOM 0 HG2 PRO A 66 266.868 121.737 398.259 1.00 0.00 H new ATOM 0 HG3 PRO A 66 267.677 120.439 397.404 1.00 0.00 H new ATOM 0 HD2 PRO A 66 268.967 121.962 399.328 1.00 0.00 H new ATOM 0 HD3 PRO A 66 269.831 121.208 398.002 1.00 0.00 H new ATOM 1084 N ALA A 67 267.880 125.923 397.573 1.00 0.00 N ATOM 1085 CA ALA A 67 267.225 127.024 398.239 1.00 0.00 C ATOM 1086 C ALA A 67 267.896 128.309 397.739 1.00 0.00 C ATOM 1087 O ALA A 67 268.966 128.202 397.137 1.00 0.00 O ATOM 1088 CB ALA A 67 267.442 126.842 399.764 1.00 0.00 C ATOM 0 H ALA A 67 268.833 126.163 397.300 1.00 0.00 H new ATOM 0 HA ALA A 67 266.155 127.067 398.036 1.00 0.00 H new ATOM 0 HB1 ALA A 67 266.959 127.659 400.300 1.00 0.00 H new ATOM 0 HB2 ALA A 67 267.010 125.893 400.082 1.00 0.00 H new ATOM 0 HB3 ALA A 67 268.510 126.846 399.983 1.00 0.00 H new ATOM 1094 N PRO A 68 267.332 129.528 397.917 1.00 0.00 N ATOM 1095 CA PRO A 68 267.935 130.798 397.488 1.00 0.00 C ATOM 1096 C PRO A 68 269.029 131.295 398.474 1.00 0.00 C ATOM 1097 O PRO A 68 269.223 130.646 399.505 1.00 0.00 O ATOM 1098 CB PRO A 68 266.704 131.734 397.456 1.00 0.00 C ATOM 1099 CG PRO A 68 265.813 131.236 398.593 1.00 0.00 C ATOM 1100 CD PRO A 68 266.011 129.721 398.525 1.00 0.00 C ATOM 0 HA PRO A 68 268.463 130.734 396.536 1.00 0.00 H new ATOM 0 HB2 PRO A 68 266.993 132.774 397.605 1.00 0.00 H new ATOM 0 HB3 PRO A 68 266.190 131.680 396.496 1.00 0.00 H new ATOM 0 HG2 PRO A 68 266.119 131.643 399.557 1.00 0.00 H new ATOM 0 HG3 PRO A 68 264.770 131.517 398.445 1.00 0.00 H new ATOM 0 HD2 PRO A 68 265.966 129.274 399.518 1.00 0.00 H new ATOM 0 HD3 PRO A 68 265.231 129.249 397.928 1.00 0.00 H new ATOM 1108 N PRO A 69 269.770 132.407 398.229 1.00 0.00 N ATOM 1109 CA PRO A 69 270.850 132.906 399.098 1.00 0.00 C ATOM 1110 C PRO A 69 270.393 133.373 400.494 1.00 0.00 C ATOM 1111 O PRO A 69 269.527 134.239 400.599 1.00 0.00 O ATOM 1112 CB PRO A 69 271.480 134.055 398.277 1.00 0.00 C ATOM 1113 CG PRO A 69 271.129 133.730 396.825 1.00 0.00 C ATOM 1114 CD PRO A 69 269.730 133.135 396.960 1.00 0.00 C ATOM 0 HA PRO A 69 271.552 132.108 399.341 1.00 0.00 H new ATOM 0 HB2 PRO A 69 271.076 135.023 398.575 1.00 0.00 H new ATOM 0 HB3 PRO A 69 272.559 134.101 398.423 1.00 0.00 H new ATOM 0 HG2 PRO A 69 271.135 134.620 396.195 1.00 0.00 H new ATOM 0 HG3 PRO A 69 271.832 133.023 396.384 1.00 0.00 H new ATOM 0 HD2 PRO A 69 268.966 133.912 396.971 1.00 0.00 H new ATOM 0 HD3 PRO A 69 269.498 132.471 396.127 1.00 0.00 H new ATOM 1122 N ALA A 70 270.973 132.777 401.565 1.00 0.00 N ATOM 1123 CA ALA A 70 270.640 133.035 402.953 1.00 0.00 C ATOM 1124 C ALA A 70 271.925 133.296 403.764 1.00 0.00 C ATOM 1125 O ALA A 70 272.997 132.841 403.348 1.00 0.00 O ATOM 1126 CB ALA A 70 269.873 131.806 403.504 1.00 0.00 C ATOM 0 H ALA A 70 271.711 132.080 401.462 1.00 0.00 H new ATOM 0 HA ALA A 70 270.011 133.922 403.036 1.00 0.00 H new ATOM 0 HB1 ALA A 70 269.612 131.978 404.548 1.00 0.00 H new ATOM 0 HB2 ALA A 70 268.963 131.654 402.923 1.00 0.00 H new ATOM 0 HB3 ALA A 70 270.503 130.920 403.429 1.00 0.00 H new ATOM 1132 N PRO A 71 271.876 134.029 404.911 1.00 0.00 N ATOM 1133 CA PRO A 71 273.027 134.316 405.773 1.00 0.00 C ATOM 1134 C PRO A 71 273.333 133.145 406.741 1.00 0.00 C ATOM 1135 O PRO A 71 272.503 132.240 406.860 1.00 0.00 O ATOM 1136 CB PRO A 71 272.539 135.570 406.535 1.00 0.00 C ATOM 1137 CG PRO A 71 271.037 135.348 406.719 1.00 0.00 C ATOM 1138 CD PRO A 71 270.646 134.647 405.416 1.00 0.00 C ATOM 0 HA PRO A 71 273.959 134.461 405.227 1.00 0.00 H new ATOM 0 HB2 PRO A 71 273.045 135.673 407.495 1.00 0.00 H new ATOM 0 HB3 PRO A 71 272.739 136.480 405.970 1.00 0.00 H new ATOM 0 HG2 PRO A 71 270.821 134.732 407.592 1.00 0.00 H new ATOM 0 HG3 PRO A 71 270.501 136.288 406.851 1.00 0.00 H new ATOM 0 HD2 PRO A 71 269.875 133.897 405.592 1.00 0.00 H new ATOM 0 HD3 PRO A 71 270.241 135.358 404.696 1.00 0.00 H new ATOM 1146 N PRO A 72 274.479 133.105 407.448 1.00 0.00 N ATOM 1147 CA PRO A 72 274.825 132.044 408.393 1.00 0.00 C ATOM 1148 C PRO A 72 274.157 132.217 409.771 1.00 0.00 C ATOM 1149 O PRO A 72 273.989 133.325 410.282 1.00 0.00 O ATOM 1150 CB PRO A 72 276.357 132.172 408.484 1.00 0.00 C ATOM 1151 CG PRO A 72 276.613 133.672 408.318 1.00 0.00 C ATOM 1152 CD PRO A 72 275.545 134.100 407.323 1.00 0.00 C ATOM 0 HA PRO A 72 274.479 131.063 408.066 1.00 0.00 H new ATOM 0 HB2 PRO A 72 276.732 131.806 409.440 1.00 0.00 H new ATOM 0 HB3 PRO A 72 276.853 131.594 407.705 1.00 0.00 H new ATOM 0 HG2 PRO A 72 276.517 134.204 409.265 1.00 0.00 H new ATOM 0 HG3 PRO A 72 277.617 133.870 407.941 1.00 0.00 H new ATOM 0 HD2 PRO A 72 275.177 135.101 407.548 1.00 0.00 H new ATOM 0 HD3 PRO A 72 275.941 134.126 406.308 1.00 0.00 H new ATOM 1160 N LEU A 73 273.798 131.082 410.416 1.00 0.00 N ATOM 1161 CA LEU A 73 273.224 130.986 411.752 1.00 0.00 C ATOM 1162 C LEU A 73 274.333 130.431 412.644 1.00 0.00 C ATOM 1163 O LEU A 73 274.991 129.464 412.265 1.00 0.00 O ATOM 1164 CB LEU A 73 271.996 130.019 411.796 1.00 0.00 C ATOM 1165 CG LEU A 73 270.692 130.489 411.082 1.00 0.00 C ATOM 1166 CD1 LEU A 73 270.180 131.851 411.588 1.00 0.00 C ATOM 1167 CD2 LEU A 73 270.755 130.477 409.541 1.00 0.00 C ATOM 0 H LEU A 73 273.913 130.166 409.982 1.00 0.00 H new ATOM 0 HA LEU A 73 272.867 131.963 412.077 1.00 0.00 H new ATOM 0 HB2 LEU A 73 272.298 129.069 411.356 1.00 0.00 H new ATOM 0 HB3 LEU A 73 271.757 129.824 412.841 1.00 0.00 H new ATOM 0 HG LEU A 73 269.968 129.725 411.365 1.00 0.00 H new ATOM 0 HD11 LEU A 73 269.271 132.120 411.051 1.00 0.00 H new ATOM 0 HD12 LEU A 73 269.966 131.786 412.655 1.00 0.00 H new ATOM 0 HD13 LEU A 73 270.941 132.612 411.417 1.00 0.00 H new ATOM 0 HD21 LEU A 73 269.803 130.819 409.135 1.00 0.00 H new ATOM 0 HD22 LEU A 73 271.552 131.140 409.204 1.00 0.00 H new ATOM 0 HD23 LEU A 73 270.954 129.463 409.193 1.00 0.00 H new ATOM 1179 N THR A 74 274.586 131.035 413.836 1.00 0.00 N ATOM 1180 CA THR A 74 275.640 130.620 414.773 1.00 0.00 C ATOM 1181 C THR A 74 275.089 129.738 415.892 1.00 0.00 C ATOM 1182 O THR A 74 275.073 128.513 415.809 1.00 0.00 O ATOM 1183 CB THR A 74 276.419 131.825 415.337 1.00 0.00 C ATOM 1184 OG1 THR A 74 275.565 132.827 415.894 1.00 0.00 O ATOM 1185 CG2 THR A 74 277.203 132.486 414.189 1.00 0.00 C ATOM 0 H THR A 74 274.049 131.836 414.169 1.00 0.00 H new ATOM 0 HA THR A 74 276.348 130.018 414.203 1.00 0.00 H new ATOM 0 HB THR A 74 277.067 131.444 416.126 1.00 0.00 H new ATOM 0 HG1 THR A 74 276.109 133.566 416.238 1.00 0.00 H new ATOM 0 HG21 THR A 74 277.759 133.341 414.573 1.00 0.00 H new ATOM 0 HG22 THR A 74 277.898 131.764 413.760 1.00 0.00 H new ATOM 0 HG23 THR A 74 276.508 132.822 413.420 1.00 0.00 H new ATOM 1193 N LEU A 75 274.614 130.380 416.976 1.00 0.00 N ATOM 1194 CA LEU A 75 273.999 129.788 418.147 1.00 0.00 C ATOM 1195 C LEU A 75 273.072 130.925 418.532 1.00 0.00 C ATOM 1196 O LEU A 75 273.486 132.076 418.434 1.00 0.00 O ATOM 1197 CB LEU A 75 275.067 129.446 419.237 1.00 0.00 C ATOM 1198 CG LEU A 75 274.729 128.289 420.219 1.00 0.00 C ATOM 1199 CD1 LEU A 75 273.543 128.585 421.152 1.00 0.00 C ATOM 1200 CD2 LEU A 75 274.541 126.929 419.516 1.00 0.00 C ATOM 0 H LEU A 75 274.660 131.396 417.047 1.00 0.00 H new ATOM 0 HA LEU A 75 273.495 128.833 418.002 1.00 0.00 H new ATOM 0 HB2 LEU A 75 276.000 129.199 418.731 1.00 0.00 H new ATOM 0 HB3 LEU A 75 275.252 130.346 419.824 1.00 0.00 H new ATOM 0 HG LEU A 75 275.615 128.217 420.849 1.00 0.00 H new ATOM 0 HD11 LEU A 75 273.372 127.729 421.805 1.00 0.00 H new ATOM 0 HD12 LEU A 75 273.766 129.464 421.757 1.00 0.00 H new ATOM 0 HD13 LEU A 75 272.649 128.772 420.556 1.00 0.00 H new ATOM 0 HD21 LEU A 75 274.307 126.165 420.258 1.00 0.00 H new ATOM 0 HD22 LEU A 75 273.723 127.000 418.799 1.00 0.00 H new ATOM 0 HD23 LEU A 75 275.459 126.659 418.994 1.00 0.00 H new ATOM 1212 N SER A 76 271.796 130.704 418.937 1.00 0.00 N ATOM 1213 CA SER A 76 270.866 131.821 419.175 1.00 0.00 C ATOM 1214 C SER A 76 270.498 132.049 420.630 1.00 0.00 C ATOM 1215 O SER A 76 269.606 132.839 420.937 1.00 0.00 O ATOM 1216 CB SER A 76 269.570 131.680 418.336 1.00 0.00 C ATOM 1217 OG SER A 76 269.859 131.716 416.940 1.00 0.00 O ATOM 0 H SER A 76 271.399 129.779 419.101 1.00 0.00 H new ATOM 0 HA SER A 76 271.427 132.699 418.854 1.00 0.00 H new ATOM 0 HB2 SER A 76 269.072 130.743 418.584 1.00 0.00 H new ATOM 0 HB3 SER A 76 268.879 132.484 418.589 1.00 0.00 H new ATOM 0 HG SER A 76 270.219 132.596 416.703 1.00 0.00 H new ATOM 1223 N LYS A 77 271.199 131.381 421.577 1.00 0.00 N ATOM 1224 CA LYS A 77 270.965 131.458 423.019 1.00 0.00 C ATOM 1225 C LYS A 77 271.750 132.600 423.669 1.00 0.00 C ATOM 1226 O LYS A 77 272.866 132.392 424.132 1.00 0.00 O ATOM 1227 CB LYS A 77 271.324 130.091 423.664 1.00 0.00 C ATOM 1228 CG LYS A 77 270.872 129.914 425.125 1.00 0.00 C ATOM 1229 CD LYS A 77 271.299 128.563 425.731 1.00 0.00 C ATOM 1230 CE LYS A 77 270.647 127.323 425.095 1.00 0.00 C ATOM 1231 NZ LYS A 77 269.173 127.347 425.245 1.00 0.00 N1+ ATOM 0 H LYS A 77 271.968 130.755 421.338 1.00 0.00 H new ATOM 0 HA LYS A 77 269.911 131.676 423.189 1.00 0.00 H new ATOM 0 HB2 LYS A 77 270.879 129.297 423.065 1.00 0.00 H new ATOM 0 HB3 LYS A 77 272.405 129.958 423.617 1.00 0.00 H new ATOM 0 HG2 LYS A 77 271.286 130.723 425.727 1.00 0.00 H new ATOM 0 HG3 LYS A 77 269.787 130.002 425.176 1.00 0.00 H new ATOM 0 HD2 LYS A 77 272.381 128.470 425.643 1.00 0.00 H new ATOM 0 HD3 LYS A 77 271.065 128.571 426.796 1.00 0.00 H new ATOM 0 HE2 LYS A 77 270.905 127.277 424.037 1.00 0.00 H new ATOM 0 HE3 LYS A 77 271.046 126.422 425.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 268.774 126.452 424.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 268.928 127.469 426.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 268.781 128.138 424.695 1.00 0.00 H new ATOM 1245 N LEU A 78 271.160 133.832 423.666 1.00 0.00 N ATOM 1246 CA LEU A 78 271.673 135.116 424.178 1.00 0.00 C ATOM 1247 C LEU A 78 272.227 135.985 423.049 1.00 0.00 C ATOM 1248 O LEU A 78 272.081 137.205 423.049 1.00 0.00 O ATOM 1249 CB LEU A 78 272.642 135.040 425.402 1.00 0.00 C ATOM 1250 CG LEU A 78 272.996 136.376 426.106 1.00 0.00 C ATOM 1251 CD1 LEU A 78 271.754 137.140 426.595 1.00 0.00 C ATOM 1252 CD2 LEU A 78 273.963 136.123 427.276 1.00 0.00 C ATOM 0 H LEU A 78 270.229 133.949 423.266 1.00 0.00 H new ATOM 0 HA LEU A 78 270.793 135.603 424.598 1.00 0.00 H new ATOM 0 HB2 LEU A 78 272.200 134.374 426.143 1.00 0.00 H new ATOM 0 HB3 LEU A 78 273.571 134.576 425.070 1.00 0.00 H new ATOM 0 HG LEU A 78 273.482 137.007 425.361 1.00 0.00 H new ATOM 0 HD11 LEU A 78 272.064 138.066 427.079 1.00 0.00 H new ATOM 0 HD12 LEU A 78 271.112 137.372 425.745 1.00 0.00 H new ATOM 0 HD13 LEU A 78 271.205 136.524 427.307 1.00 0.00 H new ATOM 0 HD21 LEU A 78 274.203 137.069 427.761 1.00 0.00 H new ATOM 0 HD22 LEU A 78 273.494 135.454 427.998 1.00 0.00 H new ATOM 0 HD23 LEU A 78 274.878 135.666 426.899 1.00 0.00 H new ATOM 1264 N GLU A 79 272.859 135.323 422.040 1.00 0.00 N ATOM 1265 CA GLU A 79 273.471 135.835 420.813 1.00 0.00 C ATOM 1266 C GLU A 79 272.471 136.370 419.782 1.00 0.00 C ATOM 1267 O GLU A 79 272.671 137.425 419.180 1.00 0.00 O ATOM 1268 CB GLU A 79 274.255 134.691 420.092 1.00 0.00 C ATOM 1269 CG GLU A 79 275.521 134.160 420.802 1.00 0.00 C ATOM 1270 CD GLU A 79 275.191 133.241 421.977 1.00 0.00 C ATOM 1271 OE1 GLU A 79 275.528 133.607 423.134 1.00 0.00 O ATOM 1272 OE2 GLU A 79 274.607 132.152 421.724 1.00 0.00 O1- ATOM 0 H GLU A 79 272.954 134.309 422.087 1.00 0.00 H new ATOM 0 HA GLU A 79 274.108 136.655 421.144 1.00 0.00 H new ATOM 0 HB2 GLU A 79 273.573 133.854 419.942 1.00 0.00 H new ATOM 0 HB3 GLU A 79 274.544 135.048 419.103 1.00 0.00 H new ATOM 0 HG2 GLU A 79 276.137 133.619 420.083 1.00 0.00 H new ATOM 0 HG3 GLU A 79 276.114 135.002 421.159 1.00 0.00 H new ATOM 1279 N HIS A 80 271.388 135.574 419.554 1.00 0.00 N ATOM 1280 CA HIS A 80 270.286 135.784 418.624 1.00 0.00 C ATOM 1281 C HIS A 80 270.618 135.458 417.163 1.00 0.00 C ATOM 1282 O HIS A 80 270.520 134.295 416.751 1.00 0.00 O ATOM 1283 CB HIS A 80 269.610 137.169 418.815 1.00 0.00 C ATOM 1284 CG HIS A 80 268.336 137.391 418.054 1.00 0.00 C ATOM 1285 ND1 HIS A 80 267.261 136.530 418.047 1.00 0.00 N ATOM 1286 CD2 HIS A 80 267.975 138.444 417.275 1.00 0.00 C ATOM 1287 CE1 HIS A 80 266.308 137.099 417.267 1.00 0.00 C ATOM 1288 NE2 HIS A 80 266.699 138.258 416.781 1.00 0.00 N ATOM 0 H HIS A 80 271.272 134.701 420.069 1.00 0.00 H new ATOM 0 HA HIS A 80 269.537 135.038 418.891 1.00 0.00 H new ATOM 0 HB2 HIS A 80 269.404 137.307 419.876 1.00 0.00 H new ATOM 0 HB3 HIS A 80 270.322 137.942 418.525 1.00 0.00 H new ATOM 0 HD2 HIS A 80 268.597 139.303 417.071 1.00 0.00 H new ATOM 0 HE1 HIS A 80 265.344 136.654 417.069 1.00 0.00 H new ATOM 0 HE2 HIS A 80 266.173 138.884 416.171 1.00 0.00 H new TER 1296 HIS A 80