USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=21 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 89:sc= 1.33 USER MOD Set 1.2: A 49 ASN : amide:sc= 1.05 X(o=2.4,f=2) USER MOD Set 2.1: A 29 LYS NZ :NH3+ -178:sc= 1.01 (180deg=0.921) USER MOD Set 2.2: A 30 TYR OH : rot 100:sc= -0.229 USER MOD Set 3.1: A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 5 SER OG : rot -150:sc= 0 USER MOD Single : A 0 MET N :NH3+ -175:sc= 0 (180deg=-0.0348) USER MOD Single : A 4 TYR OH : rot -133:sc= 0.00399 USER MOD Single : A 9 THR OG1 : rot 152:sc= 1.21 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0.062 USER MOD Single : A 19 HIS :FLIP no HD1:sc= -1.19 F(o=-3.2,f=-1.2) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 HIS :FLIP no HD1:sc= -1.73! F(o=-2.4,f=-1.7!) USER MOD Single : A 33 SER OG : rot 62:sc= 2.07 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 40:sc= -0.948 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=-0.006) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.607 USER MOD Single : A 51 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0279) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.874) USER MOD Single : A 60 TYR OH : rot 30:sc= 0.676 USER MOD Single : A 62 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.485) USER MOD Single : A 74 THR OG1 : rot -15:sc= 1.23 USER MOD Single : A 76 SER OG : rot 9:sc= 1.25 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.416 K(o=-0.42,f=-0.93) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 280.994 121.025 405.434 1.00 0.00 N ATOM 2 CA MET A 0 281.765 121.994 404.712 1.00 0.00 C ATOM 3 C MET A 0 283.241 121.785 404.992 1.00 0.00 C ATOM 4 O MET A 0 283.887 122.615 405.630 1.00 0.00 O ATOM 5 CB MET A 0 281.308 123.461 405.012 1.00 0.00 C ATOM 6 CG MET A 0 279.813 123.744 404.711 1.00 0.00 C ATOM 7 SD MET A 0 279.254 123.095 403.098 1.00 0.00 S ATOM 8 CE MET A 0 277.462 123.178 403.396 1.00 0.00 C ATOM 0 H1 MET A 0 279.991 121.116 405.175 1.00 0.00 H new ATOM 0 H2 MET A 0 281.328 120.069 405.196 1.00 0.00 H new ATOM 0 H3 MET A 0 281.103 121.186 406.456 1.00 0.00 H new ATOM 0 HA MET A 0 281.591 121.845 403.646 1.00 0.00 H new ATOM 0 HB2 MET A 0 281.502 123.681 406.062 1.00 0.00 H new ATOM 0 HB3 MET A 0 281.920 124.146 404.425 1.00 0.00 H new ATOM 0 HG2 MET A 0 279.203 123.305 405.501 1.00 0.00 H new ATOM 0 HG3 MET A 0 279.643 124.820 404.738 1.00 0.00 H new ATOM 0 HE1 MET A 0 276.930 122.819 402.515 1.00 0.00 H new ATOM 0 HE2 MET A 0 277.206 122.555 404.253 1.00 0.00 H new ATOM 0 HE3 MET A 0 277.174 124.210 403.599 1.00 0.00 H new ATOM 18 N GLY A 1 283.849 120.671 404.473 1.00 0.00 N ATOM 19 CA GLY A 1 285.282 120.342 404.616 1.00 0.00 C ATOM 20 C GLY A 1 286.225 121.115 403.706 1.00 0.00 C ATOM 21 O GLY A 1 287.439 121.161 403.899 1.00 0.00 O ATOM 0 H GLY A 1 283.335 119.972 403.936 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.576 120.520 405.650 1.00 0.00 H new ATOM 0 HA3 GLY A 1 285.413 119.277 404.426 1.00 0.00 H new ATOM 25 N ILE A 2 285.652 121.772 402.671 1.00 0.00 N ATOM 26 CA ILE A 2 286.348 122.652 401.742 1.00 0.00 C ATOM 27 C ILE A 2 285.649 123.999 401.871 1.00 0.00 C ATOM 28 O ILE A 2 284.444 124.059 402.136 1.00 0.00 O ATOM 29 CB ILE A 2 286.326 122.194 400.285 1.00 0.00 C ATOM 30 CG1 ILE A 2 286.273 120.651 400.148 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.532 122.860 399.571 1.00 0.00 C ATOM 32 CD1 ILE A 2 286.780 120.138 398.798 1.00 0.00 C ATOM 0 H ILE A 2 284.656 121.692 402.464 1.00 0.00 H new ATOM 0 HA ILE A 2 287.407 122.674 402.000 1.00 0.00 H new ATOM 0 HB ILE A 2 285.408 122.517 399.794 1.00 0.00 H new ATOM 0 HG12 ILE A 2 286.868 120.203 400.944 1.00 0.00 H new ATOM 0 HG13 ILE A 2 285.245 120.317 400.292 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.549 122.555 398.525 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.437 123.944 399.632 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.458 122.549 400.055 1.00 0.00 H new ATOM 0 HD11 ILE A 2 286.714 119.050 398.774 1.00 0.00 H new ATOM 0 HD12 ILE A 2 286.170 120.557 397.997 1.00 0.00 H new ATOM 0 HD13 ILE A 2 287.818 120.441 398.660 1.00 0.00 H new ATOM 44 N ASP A 3 286.357 125.144 401.687 1.00 0.00 N ATOM 45 CA ASP A 3 285.776 126.447 401.950 1.00 0.00 C ATOM 46 C ASP A 3 284.943 127.050 400.837 1.00 0.00 C ATOM 47 O ASP A 3 285.240 128.108 400.314 1.00 0.00 O ATOM 48 CB ASP A 3 287.018 127.422 402.148 1.00 0.00 C ATOM 49 CG ASP A 3 287.968 127.334 400.922 1.00 0.00 C ATOM 50 OD1 ASP A 3 287.915 128.268 400.078 1.00 0.00 O ATOM 51 OD2 ASP A 3 288.707 126.327 400.782 1.00 0.00 O1- ATOM 0 H ASP A 3 287.323 125.171 401.359 1.00 0.00 H new ATOM 0 HA ASP A 3 285.100 126.327 402.797 1.00 0.00 H new ATOM 0 HB2 ASP A 3 286.669 128.447 402.274 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.558 127.155 403.056 1.00 0.00 H new ATOM 56 N TYR A 4 283.817 126.434 400.469 1.00 0.00 N ATOM 57 CA TYR A 4 282.710 127.003 399.715 1.00 0.00 C ATOM 58 C TYR A 4 281.671 127.895 400.358 1.00 0.00 C ATOM 59 O TYR A 4 281.513 129.066 400.038 1.00 0.00 O ATOM 60 CB TYR A 4 282.220 126.198 398.502 1.00 0.00 C ATOM 61 CG TYR A 4 283.287 125.331 397.983 1.00 0.00 C ATOM 62 CD1 TYR A 4 283.358 123.975 398.250 1.00 0.00 C ATOM 63 CD2 TYR A 4 284.191 125.921 397.142 1.00 0.00 C ATOM 64 CE1 TYR A 4 284.381 123.236 397.695 1.00 0.00 C ATOM 65 CE2 TYR A 4 285.183 125.167 396.603 1.00 0.00 C ATOM 66 CZ TYR A 4 285.339 123.850 396.932 1.00 0.00 C ATOM 67 OH TYR A 4 286.368 123.112 396.329 1.00 0.00 O ATOM 0 H TYR A 4 283.648 125.457 400.709 1.00 0.00 H new ATOM 0 HA TYR A 4 283.324 127.818 399.331 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.359 125.592 398.786 1.00 0.00 H new ATOM 0 HB3 TYR A 4 281.886 126.879 397.719 1.00 0.00 H new ATOM 0 HD1 TYR A 4 282.623 123.502 398.884 1.00 0.00 H new ATOM 0 HD2 TYR A 4 284.116 126.973 396.910 1.00 0.00 H new ATOM 0 HE1 TYR A 4 284.427 122.170 397.862 1.00 0.00 H new ATOM 0 HE2 TYR A 4 285.865 125.619 395.898 1.00 0.00 H new ATOM 0 HH TYR A 4 287.226 123.557 396.489 1.00 0.00 H new ATOM 77 N SER A 5 280.835 127.247 401.233 1.00 0.00 N ATOM 78 CA SER A 5 279.497 127.708 401.659 1.00 0.00 C ATOM 79 C SER A 5 279.313 129.074 402.308 1.00 0.00 C ATOM 80 O SER A 5 278.518 129.860 401.806 1.00 0.00 O ATOM 81 CB SER A 5 278.727 126.579 402.399 1.00 0.00 C ATOM 82 OG SER A 5 277.316 126.604 402.173 1.00 0.00 O ATOM 0 H SER A 5 281.096 126.362 401.667 1.00 0.00 H new ATOM 0 HA SER A 5 279.042 127.931 400.694 1.00 0.00 H new ATOM 0 HB2 SER A 5 279.120 125.614 402.080 1.00 0.00 H new ATOM 0 HB3 SER A 5 278.916 126.663 403.469 1.00 0.00 H new ATOM 0 HG SER A 5 276.853 126.244 402.958 1.00 0.00 H new ATOM 88 N GLY A 6 280.138 129.483 403.324 1.00 0.00 N ATOM 89 CA GLY A 6 280.318 130.820 403.892 1.00 0.00 C ATOM 90 C GLY A 6 280.861 131.797 402.892 1.00 0.00 C ATOM 91 O GLY A 6 280.559 132.970 402.883 1.00 0.00 O ATOM 0 H GLY A 6 280.740 128.807 403.795 1.00 0.00 H new ATOM 0 HA2 GLY A 6 279.362 131.183 404.269 1.00 0.00 H new ATOM 0 HA3 GLY A 6 280.995 130.762 404.744 1.00 0.00 H new ATOM 95 N LEU A 7 281.638 131.356 401.888 1.00 0.00 N ATOM 96 CA LEU A 7 282.125 132.230 400.834 1.00 0.00 C ATOM 97 C LEU A 7 281.000 132.566 399.826 1.00 0.00 C ATOM 98 O LEU A 7 280.830 133.722 399.438 1.00 0.00 O ATOM 99 CB LEU A 7 283.441 131.705 400.232 1.00 0.00 C ATOM 100 CG LEU A 7 284.601 131.498 401.260 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.353 130.417 402.334 1.00 0.00 C ATOM 102 CD2 LEU A 7 285.818 131.019 400.511 1.00 0.00 C ATOM 0 H LEU A 7 281.939 130.386 401.794 1.00 0.00 H new ATOM 0 HA LEU A 7 282.401 133.196 401.256 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.242 130.756 399.735 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.776 132.403 399.464 1.00 0.00 H new ATOM 0 HG LEU A 7 284.704 132.462 401.759 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.218 130.355 402.994 1.00 0.00 H new ATOM 0 HD12 LEU A 7 283.470 130.679 402.917 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.196 129.453 401.850 1.00 0.00 H new ATOM 0 HD21 LEU A 7 286.640 130.868 401.211 1.00 0.00 H new ATOM 0 HD22 LEU A 7 285.590 130.078 400.011 1.00 0.00 H new ATOM 0 HD23 LEU A 7 286.105 131.764 399.769 1.00 0.00 H new ATOM 114 N ARG A 8 280.124 131.569 399.485 1.00 0.00 N ATOM 115 CA ARG A 8 278.866 131.805 398.752 1.00 0.00 C ATOM 116 C ARG A 8 277.786 132.544 399.515 1.00 0.00 C ATOM 117 O ARG A 8 277.139 133.435 398.973 1.00 0.00 O ATOM 118 CB ARG A 8 278.271 130.573 397.970 1.00 0.00 C ATOM 119 CG ARG A 8 278.833 129.172 398.307 1.00 0.00 C ATOM 120 CD ARG A 8 278.633 128.132 397.180 1.00 0.00 C ATOM 121 NE ARG A 8 279.452 126.841 397.342 1.00 0.00 N ATOM 122 CZ ARG A 8 278.887 125.772 397.983 1.00 0.00 C ATOM 123 NH1 ARG A 8 277.853 125.923 398.855 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.385 124.534 397.704 1.00 0.00 N ATOM 0 H ARG A 8 280.282 130.588 399.716 1.00 0.00 H new ATOM 0 HA ARG A 8 279.226 132.493 397.987 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.195 130.554 398.142 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.420 130.747 396.904 1.00 0.00 H new ATOM 0 HG2 ARG A 8 279.898 129.260 398.523 1.00 0.00 H new ATOM 0 HG3 ARG A 8 278.353 128.807 399.215 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.576 127.871 397.129 1.00 0.00 H new ATOM 0 HD3 ARG A 8 278.894 128.594 396.228 1.00 0.00 H new ATOM 0 HE ARG A 8 280.403 126.782 396.977 1.00 0.00 H new ATOM 0 HH11 ARG A 8 277.478 126.852 399.046 1.00 0.00 H new ATOM 0 HH12 ARG A 8 277.453 125.107 399.318 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.151 124.431 397.039 1.00 0.00 H new ATOM 0 HH22 ARG A 8 278.992 123.711 398.161 1.00 0.00 H new ATOM 138 N THR A 9 277.573 132.200 400.803 1.00 0.00 N ATOM 139 CA THR A 9 276.563 132.825 401.656 1.00 0.00 C ATOM 140 C THR A 9 276.950 134.159 402.318 1.00 0.00 C ATOM 141 O THR A 9 276.084 134.933 402.720 1.00 0.00 O ATOM 142 CB THR A 9 275.816 131.761 402.452 1.00 0.00 C ATOM 143 OG1 THR A 9 274.491 132.172 402.741 1.00 0.00 O ATOM 144 CG2 THR A 9 276.469 131.264 403.758 1.00 0.00 C ATOM 0 H THR A 9 278.108 131.472 401.276 1.00 0.00 H new ATOM 0 HA THR A 9 275.791 133.266 401.026 1.00 0.00 H new ATOM 0 HB THR A 9 275.844 130.908 401.775 1.00 0.00 H new ATOM 0 HG1 THR A 9 273.914 131.384 402.822 1.00 0.00 H new ATOM 0 HG21 THR A 9 275.831 130.511 404.220 1.00 0.00 H new ATOM 0 HG22 THR A 9 277.443 130.828 403.535 1.00 0.00 H new ATOM 0 HG23 THR A 9 276.595 132.102 404.443 1.00 0.00 H new ATOM 152 N ILE A 10 278.273 134.484 402.401 1.00 0.00 N ATOM 153 CA ILE A 10 278.812 135.774 402.847 1.00 0.00 C ATOM 154 C ILE A 10 279.260 136.651 401.649 1.00 0.00 C ATOM 155 O ILE A 10 279.097 137.869 401.728 1.00 0.00 O ATOM 156 CB ILE A 10 279.885 135.650 403.970 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.389 134.640 405.044 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.211 136.999 404.646 1.00 0.00 C ATOM 159 CD1 ILE A 10 280.324 134.139 406.144 1.00 0.00 C ATOM 0 H ILE A 10 279.006 133.822 402.147 1.00 0.00 H new ATOM 0 HA ILE A 10 277.989 136.304 403.327 1.00 0.00 H new ATOM 0 HB ILE A 10 280.804 135.299 403.500 1.00 0.00 H new ATOM 0 HG12 ILE A 10 278.530 135.095 405.538 1.00 0.00 H new ATOM 0 HG13 ILE A 10 279.023 133.762 404.512 1.00 0.00 H new ATOM 0 HG21 ILE A 10 280.964 136.846 405.419 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.592 137.697 403.900 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.307 137.408 405.097 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.787 133.444 406.789 1.00 0.00 H new ATOM 0 HD12 ILE A 10 281.177 133.631 405.693 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.676 134.984 406.735 1.00 0.00 H new ATOM 171 N PHE A 11 279.852 136.145 400.506 1.00 0.00 N ATOM 172 CA PHE A 11 280.393 137.053 399.465 1.00 0.00 C ATOM 173 C PHE A 11 279.574 137.057 398.179 1.00 0.00 C ATOM 174 O PHE A 11 279.507 138.067 397.475 1.00 0.00 O ATOM 175 CB PHE A 11 281.919 136.832 399.184 1.00 0.00 C ATOM 176 CG PHE A 11 282.638 136.772 400.515 1.00 0.00 C ATOM 177 CD1 PHE A 11 283.123 135.560 400.964 1.00 0.00 C ATOM 178 CD2 PHE A 11 282.668 137.853 401.383 1.00 0.00 C ATOM 179 CE1 PHE A 11 283.472 135.378 402.289 1.00 0.00 C ATOM 180 CE2 PHE A 11 283.119 137.698 402.681 1.00 0.00 C ATOM 181 CZ PHE A 11 283.520 136.458 403.138 1.00 0.00 C ATOM 0 H PHE A 11 279.956 135.151 400.303 1.00 0.00 H new ATOM 0 HA PHE A 11 280.297 138.051 399.892 1.00 0.00 H new ATOM 0 HB2 PHE A 11 282.073 135.909 398.626 1.00 0.00 H new ATOM 0 HB3 PHE A 11 282.315 137.643 398.574 1.00 0.00 H new ATOM 0 HD1 PHE A 11 283.231 134.741 400.269 1.00 0.00 H new ATOM 0 HD2 PHE A 11 282.337 138.823 401.043 1.00 0.00 H new ATOM 0 HE1 PHE A 11 283.706 134.390 402.656 1.00 0.00 H new ATOM 0 HE2 PHE A 11 283.158 138.552 403.341 1.00 0.00 H new ATOM 0 HZ PHE A 11 283.868 136.338 404.153 1.00 0.00 H new ATOM 191 N GLY A 12 278.885 135.928 397.874 1.00 0.00 N ATOM 192 CA GLY A 12 277.934 135.808 396.770 1.00 0.00 C ATOM 193 C GLY A 12 278.454 135.100 395.544 1.00 0.00 C ATOM 194 O GLY A 12 278.420 133.873 395.466 1.00 0.00 O ATOM 0 H GLY A 12 278.986 135.065 398.408 1.00 0.00 H new ATOM 0 HA2 GLY A 12 277.052 135.278 397.129 1.00 0.00 H new ATOM 0 HA3 GLY A 12 277.610 136.808 396.482 1.00 0.00 H new ATOM 198 N GLU A 13 278.926 135.864 394.527 1.00 0.00 N ATOM 199 CA GLU A 13 279.311 135.404 393.188 1.00 0.00 C ATOM 200 C GLU A 13 280.650 134.678 393.004 1.00 0.00 C ATOM 201 O GLU A 13 280.762 133.779 392.175 1.00 0.00 O ATOM 202 CB GLU A 13 279.221 136.619 392.219 1.00 0.00 C ATOM 203 CG GLU A 13 279.259 136.278 390.714 1.00 0.00 C ATOM 204 CD GLU A 13 279.048 137.551 389.893 1.00 0.00 C ATOM 205 OE1 GLU A 13 277.946 138.154 390.004 1.00 0.00 O ATOM 206 OE2 GLU A 13 279.985 137.937 389.143 1.00 0.00 O1- ATOM 0 H GLU A 13 279.051 136.871 394.635 1.00 0.00 H new ATOM 0 HA GLU A 13 278.601 134.606 392.969 1.00 0.00 H new ATOM 0 HB2 GLU A 13 278.297 137.159 392.427 1.00 0.00 H new ATOM 0 HB3 GLU A 13 280.044 137.298 392.440 1.00 0.00 H new ATOM 0 HG2 GLU A 13 280.216 135.823 390.458 1.00 0.00 H new ATOM 0 HG3 GLU A 13 278.485 135.548 390.477 1.00 0.00 H new ATOM 213 N LYS A 14 281.710 135.059 393.747 1.00 0.00 N ATOM 214 CA LYS A 14 283.034 134.478 393.626 1.00 0.00 C ATOM 215 C LYS A 14 283.626 134.502 395.017 1.00 0.00 C ATOM 216 O LYS A 14 283.120 135.182 395.912 1.00 0.00 O ATOM 217 CB LYS A 14 283.894 135.270 392.582 1.00 0.00 C ATOM 218 CG LYS A 14 285.351 134.808 392.370 1.00 0.00 C ATOM 219 CD LYS A 14 286.097 135.525 391.230 1.00 0.00 C ATOM 220 CE LYS A 14 285.657 135.067 389.832 1.00 0.00 C ATOM 221 NZ LYS A 14 286.439 135.752 388.777 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.654 135.791 394.455 1.00 0.00 H new ATOM 0 HA LYS A 14 283.003 133.455 393.251 1.00 0.00 H new ATOM 0 HB2 LYS A 14 283.383 135.225 391.620 1.00 0.00 H new ATOM 0 HB3 LYS A 14 283.913 136.317 392.885 1.00 0.00 H new ATOM 0 HG2 LYS A 14 285.903 134.958 393.298 1.00 0.00 H new ATOM 0 HG3 LYS A 14 285.352 133.737 392.168 1.00 0.00 H new ATOM 0 HD2 LYS A 14 285.936 136.599 391.320 1.00 0.00 H new ATOM 0 HD3 LYS A 14 287.168 135.352 391.341 1.00 0.00 H new ATOM 0 HE2 LYS A 14 285.785 133.988 389.742 1.00 0.00 H new ATOM 0 HE3 LYS A 14 284.596 135.274 389.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 286.122 135.425 387.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 286.296 136.779 388.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 287.449 135.533 388.896 1.00 0.00 H new ATOM 235 N LEU A 15 284.744 133.760 395.230 1.00 0.00 N ATOM 236 CA LEU A 15 285.489 133.694 396.471 1.00 0.00 C ATOM 237 C LEU A 15 286.405 134.919 396.668 1.00 0.00 C ATOM 238 O LEU A 15 286.924 135.459 395.689 1.00 0.00 O ATOM 239 CB LEU A 15 286.397 132.433 396.480 1.00 0.00 C ATOM 240 CG LEU A 15 285.739 131.155 397.000 1.00 0.00 C ATOM 241 CD1 LEU A 15 284.980 130.364 395.948 1.00 0.00 C ATOM 242 CD2 LEU A 15 286.824 130.257 397.582 1.00 0.00 C ATOM 0 H LEU A 15 285.150 133.176 394.499 1.00 0.00 H new ATOM 0 HA LEU A 15 284.752 133.663 397.273 1.00 0.00 H new ATOM 0 HB2 LEU A 15 286.749 132.253 395.464 1.00 0.00 H new ATOM 0 HB3 LEU A 15 287.276 132.643 397.090 1.00 0.00 H new ATOM 0 HG LEU A 15 285.005 131.468 397.743 1.00 0.00 H new ATOM 0 HD11 LEU A 15 284.546 129.474 396.404 1.00 0.00 H new ATOM 0 HD12 LEU A 15 284.185 130.982 395.531 1.00 0.00 H new ATOM 0 HD13 LEU A 15 285.664 130.067 395.153 1.00 0.00 H new ATOM 0 HD21 LEU A 15 286.373 129.339 397.959 1.00 0.00 H new ATOM 0 HD22 LEU A 15 287.549 130.013 396.806 1.00 0.00 H new ATOM 0 HD23 LEU A 15 287.327 130.776 398.398 1.00 0.00 H new ATOM 254 N PRO A 16 286.673 135.358 397.902 1.00 0.00 N ATOM 255 CA PRO A 16 287.566 136.463 398.197 1.00 0.00 C ATOM 256 C PRO A 16 289.055 136.143 398.095 1.00 0.00 C ATOM 257 O PRO A 16 289.497 135.003 397.924 1.00 0.00 O ATOM 258 CB PRO A 16 287.254 136.739 399.677 1.00 0.00 C ATOM 259 CG PRO A 16 286.929 135.353 400.238 1.00 0.00 C ATOM 260 CD PRO A 16 286.070 134.814 399.114 1.00 0.00 C ATOM 0 HA PRO A 16 287.405 137.274 397.487 1.00 0.00 H new ATOM 0 HB2 PRO A 16 288.104 137.190 400.189 1.00 0.00 H new ATOM 0 HB3 PRO A 16 286.414 137.424 399.789 1.00 0.00 H new ATOM 0 HG2 PRO A 16 287.822 134.751 400.407 1.00 0.00 H new ATOM 0 HG3 PRO A 16 286.394 135.401 401.186 1.00 0.00 H new ATOM 0 HD2 PRO A 16 286.069 133.724 399.102 1.00 0.00 H new ATOM 0 HD3 PRO A 16 285.033 135.132 399.219 1.00 0.00 H new ATOM 268 N GLU A 17 289.812 137.233 398.325 1.00 0.00 N ATOM 269 CA GLU A 17 291.239 137.319 398.416 1.00 0.00 C ATOM 270 C GLU A 17 291.695 136.998 399.840 1.00 0.00 C ATOM 271 O GLU A 17 290.961 137.108 400.834 1.00 0.00 O ATOM 272 CB GLU A 17 291.695 138.749 398.027 1.00 0.00 C ATOM 273 CG GLU A 17 291.026 139.302 396.754 1.00 0.00 C ATOM 274 CD GLU A 17 291.821 140.500 396.237 1.00 0.00 C ATOM 275 OE1 GLU A 17 292.316 140.431 395.081 1.00 0.00 O ATOM 276 OE2 GLU A 17 291.940 141.502 396.993 1.00 0.00 O1- ATOM 0 H GLU A 17 289.378 138.146 398.461 1.00 0.00 H new ATOM 0 HA GLU A 17 291.686 136.597 397.733 1.00 0.00 H new ATOM 0 HB2 GLU A 17 291.484 139.424 398.857 1.00 0.00 H new ATOM 0 HB3 GLU A 17 292.776 138.747 397.884 1.00 0.00 H new ATOM 0 HG2 GLU A 17 290.979 138.527 395.989 1.00 0.00 H new ATOM 0 HG3 GLU A 17 290.000 139.599 396.970 1.00 0.00 H new ATOM 283 N SER A 18 292.974 136.610 399.976 1.00 0.00 N ATOM 284 CA SER A 18 293.634 136.178 401.194 1.00 0.00 C ATOM 285 C SER A 18 293.672 137.101 402.410 1.00 0.00 C ATOM 286 O SER A 18 293.768 136.585 403.518 1.00 0.00 O ATOM 287 CB SER A 18 295.013 135.574 400.886 1.00 0.00 C ATOM 288 OG SER A 18 295.658 136.307 399.838 1.00 0.00 O ATOM 0 H SER A 18 293.607 136.593 399.176 1.00 0.00 H new ATOM 0 HA SER A 18 292.939 135.421 401.556 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.632 135.589 401.783 1.00 0.00 H new ATOM 0 HB3 SER A 18 294.902 134.530 400.593 1.00 0.00 H new ATOM 0 HG SER A 18 296.536 135.911 399.654 1.00 0.00 H new ATOM 294 N HIS A 19 293.536 138.462 402.256 1.00 0.00 N ATOM 295 CA HIS A 19 293.430 139.463 403.336 1.00 0.00 C ATOM 296 C HIS A 19 292.212 139.234 404.244 1.00 0.00 C ATOM 297 O HIS A 19 292.352 139.154 405.459 1.00 0.00 O ATOM 298 CB HIS A 19 293.453 140.943 402.811 1.00 0.00 C ATOM 299 CG HIS A 19 292.310 141.356 401.901 1.00 0.00 C ATOM 300 ND1 HIS A 19 291.584 140.601 401.037 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 291.779 142.629 401.803 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 290.609 141.351 400.421 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 290.752 142.556 400.911 1.00 0.00 N flip ATOM 0 H HIS A 19 293.498 138.891 401.331 1.00 0.00 H new ATOM 0 HA HIS A 19 294.326 139.317 403.939 1.00 0.00 H new ATOM 0 HB2 HIS A 19 293.462 141.611 403.673 1.00 0.00 H new ATOM 0 HB3 HIS A 19 294.389 141.101 402.276 1.00 0.00 H new ATOM 0 HD2 HIS A 19 292.113 143.510 402.331 1.00 0.00 H new ATOM 0 HE1 HIS A 19 289.884 141.018 399.693 1.00 0.00 H new ATOM 0 HE2 HIS A 19 290.163 143.348 400.655 1.00 0.00 H new ATOM 311 N ILE A 20 290.999 138.998 403.655 1.00 0.00 N ATOM 312 CA ILE A 20 289.838 138.450 404.371 1.00 0.00 C ATOM 313 C ILE A 20 289.921 136.957 404.571 1.00 0.00 C ATOM 314 O ILE A 20 289.517 136.451 405.618 1.00 0.00 O ATOM 315 CB ILE A 20 288.424 138.820 403.842 1.00 0.00 C ATOM 316 CG1 ILE A 20 287.655 137.686 403.096 1.00 0.00 C ATOM 317 CG2 ILE A 20 288.524 140.074 402.951 1.00 0.00 C ATOM 318 CD1 ILE A 20 286.345 138.128 402.467 1.00 0.00 C ATOM 0 H ILE A 20 290.815 139.188 402.670 1.00 0.00 H new ATOM 0 HA ILE A 20 289.927 138.970 405.325 1.00 0.00 H new ATOM 0 HB ILE A 20 287.825 139.008 404.733 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.299 137.278 402.317 1.00 0.00 H new ATOM 0 HG13 ILE A 20 287.453 136.877 403.798 1.00 0.00 H new ATOM 0 HG21 ILE A 20 287.534 140.336 402.579 1.00 0.00 H new ATOM 0 HG22 ILE A 20 288.923 140.904 403.534 1.00 0.00 H new ATOM 0 HG23 ILE A 20 289.186 139.870 402.109 1.00 0.00 H new ATOM 0 HD11 ILE A 20 285.876 137.279 401.969 1.00 0.00 H new ATOM 0 HD12 ILE A 20 285.679 138.508 403.242 1.00 0.00 H new ATOM 0 HD13 ILE A 20 286.539 138.915 401.738 1.00 0.00 H new ATOM 330 N PHE A 21 290.375 136.176 403.538 1.00 0.00 N ATOM 331 CA PHE A 21 290.250 134.729 403.588 1.00 0.00 C ATOM 332 C PHE A 21 291.198 134.050 404.606 1.00 0.00 C ATOM 333 O PHE A 21 290.725 133.257 405.421 1.00 0.00 O ATOM 334 CB PHE A 21 290.060 134.190 402.138 1.00 0.00 C ATOM 335 CG PHE A 21 289.728 132.740 401.913 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.441 131.840 402.923 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.700 132.275 400.606 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.411 130.493 402.698 1.00 0.00 C ATOM 339 CE2 PHE A 21 289.646 130.917 400.388 1.00 0.00 C ATOM 340 CZ PHE A 21 289.639 130.035 401.442 1.00 0.00 C ATOM 0 H PHE A 21 290.816 136.538 402.693 1.00 0.00 H new ATOM 0 HA PHE A 21 289.335 134.394 404.076 1.00 0.00 H new ATOM 0 HB2 PHE A 21 289.269 134.780 401.674 1.00 0.00 H new ATOM 0 HB3 PHE A 21 290.979 134.401 401.590 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.235 132.212 403.916 1.00 0.00 H new ATOM 0 HD2 PHE A 21 289.720 132.965 399.776 1.00 0.00 H new ATOM 0 HE1 PHE A 21 289.209 129.805 403.506 1.00 0.00 H new ATOM 0 HE2 PHE A 21 289.609 130.540 399.377 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.814 128.983 401.271 1.00 0.00 H new ATOM 350 N PHE A 22 292.520 134.407 404.666 1.00 0.00 N ATOM 351 CA PHE A 22 293.464 133.918 405.688 1.00 0.00 C ATOM 352 C PHE A 22 293.254 134.611 407.073 1.00 0.00 C ATOM 353 O PHE A 22 293.840 134.167 408.059 1.00 0.00 O ATOM 354 CB PHE A 22 295.000 133.934 405.268 1.00 0.00 C ATOM 355 CG PHE A 22 295.514 132.769 404.392 1.00 0.00 C ATOM 356 CD1 PHE A 22 295.382 131.421 404.724 1.00 0.00 C ATOM 357 CD2 PHE A 22 296.267 133.030 403.252 1.00 0.00 C ATOM 358 CE1 PHE A 22 295.832 130.412 403.897 1.00 0.00 C ATOM 359 CE2 PHE A 22 296.682 132.026 402.389 1.00 0.00 C ATOM 360 CZ PHE A 22 296.397 130.707 402.680 1.00 0.00 C ATOM 0 H PHE A 22 292.948 135.046 403.996 1.00 0.00 H new ATOM 0 HA PHE A 22 293.209 132.863 405.783 1.00 0.00 H new ATOM 0 HB2 PHE A 22 295.193 134.865 404.736 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.597 133.958 406.179 1.00 0.00 H new ATOM 0 HD1 PHE A 22 294.912 131.158 405.660 1.00 0.00 H new ATOM 0 HD2 PHE A 22 296.539 134.052 403.031 1.00 0.00 H new ATOM 0 HE1 PHE A 22 295.739 129.382 404.209 1.00 0.00 H new ATOM 0 HE2 PHE A 22 297.227 132.276 401.491 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.613 129.925 401.967 1.00 0.00 H new ATOM 370 N ALA A 23 292.442 135.723 407.207 1.00 0.00 N ATOM 371 CA ALA A 23 292.170 136.355 408.506 1.00 0.00 C ATOM 372 C ALA A 23 290.730 136.300 409.064 1.00 0.00 C ATOM 373 O ALA A 23 290.547 136.450 410.268 1.00 0.00 O ATOM 374 CB ALA A 23 292.630 137.832 408.465 1.00 0.00 C ATOM 0 H ALA A 23 291.979 136.178 406.421 1.00 0.00 H new ATOM 0 HA ALA A 23 292.739 135.737 409.201 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.429 138.302 409.427 1.00 0.00 H new ATOM 0 HB2 ALA A 23 293.699 137.874 408.256 1.00 0.00 H new ATOM 0 HB3 ALA A 23 292.086 138.361 407.682 1.00 0.00 H new ATOM 380 N THR A 24 289.657 136.101 408.243 1.00 0.00 N ATOM 381 CA THR A 24 288.238 136.170 408.672 1.00 0.00 C ATOM 382 C THR A 24 287.540 134.803 408.628 1.00 0.00 C ATOM 383 O THR A 24 287.527 134.105 407.613 1.00 0.00 O ATOM 384 CB THR A 24 287.413 137.182 407.831 1.00 0.00 C ATOM 385 OG1 THR A 24 288.102 138.418 407.692 1.00 0.00 O ATOM 386 CG2 THR A 24 286.055 137.565 408.459 1.00 0.00 C ATOM 0 H THR A 24 289.762 135.885 407.252 1.00 0.00 H new ATOM 0 HA THR A 24 288.274 136.513 409.706 1.00 0.00 H new ATOM 0 HB THR A 24 287.261 136.664 406.884 1.00 0.00 H new ATOM 0 HG1 THR A 24 287.561 139.036 407.157 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.541 138.275 407.810 1.00 0.00 H new ATOM 0 HG22 THR A 24 285.443 136.671 408.575 1.00 0.00 H new ATOM 0 HG23 THR A 24 286.221 138.020 409.435 1.00 0.00 H new ATOM 394 N VAL A 25 286.846 134.406 409.746 1.00 0.00 N ATOM 395 CA VAL A 25 286.019 133.208 410.085 1.00 0.00 C ATOM 396 C VAL A 25 284.770 133.079 409.229 1.00 0.00 C ATOM 397 O VAL A 25 284.035 132.110 409.300 1.00 0.00 O ATOM 398 CB VAL A 25 285.639 133.148 411.584 1.00 0.00 C ATOM 399 CG1 VAL A 25 285.399 131.695 412.049 1.00 0.00 C ATOM 400 CG2 VAL A 25 286.739 133.758 412.486 1.00 0.00 C ATOM 0 H VAL A 25 286.863 135.026 410.556 1.00 0.00 H new ATOM 0 HA VAL A 25 286.664 132.358 409.861 1.00 0.00 H new ATOM 0 HB VAL A 25 284.722 133.730 411.681 1.00 0.00 H new ATOM 0 HG11 VAL A 25 285.134 131.690 413.106 1.00 0.00 H new ATOM 0 HG12 VAL A 25 284.586 131.257 411.469 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.307 131.111 411.900 1.00 0.00 H new ATOM 0 HG21 VAL A 25 286.430 133.695 413.529 1.00 0.00 H new ATOM 0 HG22 VAL A 25 287.669 133.207 412.349 1.00 0.00 H new ATOM 0 HG23 VAL A 25 286.893 134.803 412.216 1.00 0.00 H new ATOM 410 N ALA A 26 284.508 134.063 408.328 1.00 0.00 N ATOM 411 CA ALA A 26 283.532 134.032 407.259 1.00 0.00 C ATOM 412 C ALA A 26 283.993 133.026 406.201 1.00 0.00 C ATOM 413 O ALA A 26 283.204 132.245 405.679 1.00 0.00 O ATOM 414 CB ALA A 26 283.366 135.432 406.617 1.00 0.00 C ATOM 0 H ALA A 26 285.018 134.946 408.350 1.00 0.00 H new ATOM 0 HA ALA A 26 282.566 133.734 407.667 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.627 135.380 405.817 1.00 0.00 H new ATOM 0 HB2 ALA A 26 283.032 136.142 407.374 1.00 0.00 H new ATOM 0 HB3 ALA A 26 284.321 135.760 406.208 1.00 0.00 H new ATOM 420 N ALA A 27 285.318 133.006 405.916 1.00 0.00 N ATOM 421 CA ALA A 27 285.939 132.043 405.031 1.00 0.00 C ATOM 422 C ALA A 27 286.853 131.006 405.672 1.00 0.00 C ATOM 423 O ALA A 27 286.904 129.867 405.205 1.00 0.00 O ATOM 424 CB ALA A 27 286.581 132.831 403.881 1.00 0.00 C ATOM 0 H ALA A 27 285.978 133.677 406.310 1.00 0.00 H new ATOM 0 HA ALA A 27 285.157 131.382 404.656 1.00 0.00 H new ATOM 0 HB1 ALA A 27 287.061 132.139 403.189 1.00 0.00 H new ATOM 0 HB2 ALA A 27 285.812 133.396 403.354 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.326 133.518 404.282 1.00 0.00 H new ATOM 430 N HIS A 28 287.590 131.391 406.759 1.00 0.00 N ATOM 431 CA HIS A 28 288.584 130.622 407.534 1.00 0.00 C ATOM 432 C HIS A 28 288.145 129.320 408.136 1.00 0.00 C ATOM 433 O HIS A 28 288.917 128.381 408.303 1.00 0.00 O ATOM 434 CB HIS A 28 289.093 131.402 408.788 1.00 0.00 C ATOM 435 CG HIS A 28 290.590 131.355 408.936 1.00 0.00 C ATOM 436 ND1 HIS A 28 291.448 130.296 408.909 1.00 0.00 N flip ATOM 437 CD2 HIS A 28 291.362 132.451 409.236 1.00 0.00 C flip ATOM 438 CE1 HIS A 28 292.733 130.714 409.194 1.00 0.00 C flip ATOM 439 NE2 HIS A 28 292.636 132.011 409.384 1.00 0.00 N flip ATOM 0 H HIS A 28 287.485 132.332 407.139 1.00 0.00 H new ATOM 0 HA HIS A 28 289.322 130.447 406.751 1.00 0.00 H new ATOM 0 HB2 HIS A 28 288.772 132.441 408.719 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.631 130.984 409.682 1.00 0.00 H new ATOM 0 HD2 HIS A 28 291.019 133.470 409.335 1.00 0.00 H new ATOM 0 HE1 HIS A 28 293.624 130.107 409.249 1.00 0.00 H new ATOM 0 HE2 HIS A 28 293.425 132.615 409.615 1.00 0.00 H new ATOM 447 N LYS A 29 286.861 129.326 408.555 1.00 0.00 N ATOM 448 CA LYS A 29 286.164 128.344 409.344 1.00 0.00 C ATOM 449 C LYS A 29 285.863 127.037 408.669 1.00 0.00 C ATOM 450 O LYS A 29 285.378 126.104 409.297 1.00 0.00 O ATOM 451 CB LYS A 29 284.987 129.061 410.037 1.00 0.00 C ATOM 452 CG LYS A 29 283.555 129.050 409.468 1.00 0.00 C ATOM 453 CD LYS A 29 283.216 129.507 408.035 1.00 0.00 C ATOM 454 CE LYS A 29 281.707 129.774 407.847 1.00 0.00 C ATOM 455 NZ LYS A 29 280.862 128.693 408.404 1.00 0.00 N1+ ATOM 0 H LYS A 29 286.246 130.103 408.314 1.00 0.00 H new ATOM 0 HA LYS A 29 286.835 127.957 410.111 1.00 0.00 H new ATOM 0 HB2 LYS A 29 284.924 128.652 411.045 1.00 0.00 H new ATOM 0 HB3 LYS A 29 285.275 130.108 410.135 1.00 0.00 H new ATOM 0 HG2 LYS A 29 283.194 128.026 409.559 1.00 0.00 H new ATOM 0 HG3 LYS A 29 282.951 129.662 410.138 1.00 0.00 H new ATOM 0 HD2 LYS A 29 283.775 130.414 407.803 1.00 0.00 H new ATOM 0 HD3 LYS A 29 283.539 128.744 407.327 1.00 0.00 H new ATOM 0 HE2 LYS A 29 281.446 130.717 408.327 1.00 0.00 H new ATOM 0 HE3 LYS A 29 281.492 129.887 406.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 279.861 128.906 408.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 281.112 127.790 407.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 281.019 128.623 409.430 1.00 0.00 H new ATOM 469 N TYR A 30 286.228 126.948 407.369 1.00 0.00 N ATOM 470 CA TYR A 30 286.176 125.707 406.612 1.00 0.00 C ATOM 471 C TYR A 30 287.569 125.232 406.271 1.00 0.00 C ATOM 472 O TYR A 30 287.920 124.076 406.475 1.00 0.00 O ATOM 473 CB TYR A 30 285.457 125.916 405.290 1.00 0.00 C ATOM 474 CG TYR A 30 284.094 126.471 405.477 1.00 0.00 C ATOM 475 CD1 TYR A 30 283.202 125.965 406.401 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.680 127.451 404.608 1.00 0.00 C ATOM 477 CE1 TYR A 30 281.901 126.409 406.410 1.00 0.00 C ATOM 478 CE2 TYR A 30 282.354 127.708 404.457 1.00 0.00 C ATOM 479 CZ TYR A 30 281.460 127.220 405.393 1.00 0.00 C ATOM 480 OH TYR A 30 280.089 127.518 405.367 1.00 0.00 O ATOM 0 H TYR A 30 286.565 127.744 406.828 1.00 0.00 H new ATOM 0 HA TYR A 30 285.654 124.978 407.232 1.00 0.00 H new ATOM 0 HB2 TYR A 30 286.040 126.591 404.664 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.391 124.966 404.759 1.00 0.00 H new ATOM 0 HD1 TYR A 30 283.525 125.222 407.115 1.00 0.00 H new ATOM 0 HD2 TYR A 30 284.408 128.017 404.045 1.00 0.00 H new ATOM 0 HE1 TYR A 30 281.233 126.123 407.209 1.00 0.00 H new ATOM 0 HE2 TYR A 30 282.002 128.287 403.616 1.00 0.00 H new ATOM 0 HH TYR A 30 279.940 128.408 405.749 1.00 0.00 H new ATOM 490 N VAL A 31 288.398 126.146 405.716 1.00 0.00 N ATOM 491 CA VAL A 31 289.791 125.947 405.371 1.00 0.00 C ATOM 492 C VAL A 31 290.278 127.347 405.416 1.00 0.00 C ATOM 493 O VAL A 31 289.442 128.229 405.228 1.00 0.00 O ATOM 494 CB VAL A 31 290.166 125.359 403.991 1.00 0.00 C ATOM 495 CG1 VAL A 31 289.066 124.462 403.425 1.00 0.00 C ATOM 496 CG2 VAL A 31 290.780 126.285 402.896 1.00 0.00 C ATOM 0 H VAL A 31 288.078 127.088 405.492 1.00 0.00 H new ATOM 0 HA VAL A 31 290.210 125.195 406.040 1.00 0.00 H new ATOM 0 HB VAL A 31 291.038 124.766 404.267 1.00 0.00 H new ATOM 0 HG11 VAL A 31 289.377 124.073 402.455 1.00 0.00 H new ATOM 0 HG12 VAL A 31 288.886 123.632 404.108 1.00 0.00 H new ATOM 0 HG13 VAL A 31 288.149 125.040 403.308 1.00 0.00 H new ATOM 0 HG21 VAL A 31 290.979 125.702 401.997 1.00 0.00 H new ATOM 0 HG22 VAL A 31 290.079 127.086 402.662 1.00 0.00 H new ATOM 0 HG23 VAL A 31 291.712 126.715 403.264 1.00 0.00 H new ATOM 506 N PRO A 32 291.546 127.657 405.649 1.00 0.00 N ATOM 507 CA PRO A 32 291.960 129.039 405.751 1.00 0.00 C ATOM 508 C PRO A 32 292.210 129.801 404.436 1.00 0.00 C ATOM 509 O PRO A 32 291.874 130.972 404.417 1.00 0.00 O ATOM 510 CB PRO A 32 293.287 128.831 406.532 1.00 0.00 C ATOM 511 CG PRO A 32 293.838 127.470 406.111 1.00 0.00 C ATOM 512 CD PRO A 32 292.543 126.687 406.096 1.00 0.00 C ATOM 0 HA PRO A 32 291.189 129.667 406.196 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.999 129.624 406.303 1.00 0.00 H new ATOM 0 HB3 PRO A 32 293.112 128.861 407.607 1.00 0.00 H new ATOM 0 HG2 PRO A 32 294.326 127.496 405.137 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.563 127.071 406.820 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.601 125.834 405.420 1.00 0.00 H new ATOM 0 HD3 PRO A 32 292.303 126.295 407.084 1.00 0.00 H new ATOM 520 N SER A 33 292.810 129.197 403.369 1.00 0.00 N ATOM 521 CA SER A 33 293.141 129.791 402.053 1.00 0.00 C ATOM 522 C SER A 33 293.844 128.774 401.131 1.00 0.00 C ATOM 523 O SER A 33 293.964 127.588 401.481 1.00 0.00 O ATOM 524 CB SER A 33 293.464 131.322 401.850 1.00 0.00 C ATOM 525 OG SER A 33 292.564 132.006 400.996 1.00 0.00 O ATOM 0 H SER A 33 293.091 128.218 403.416 1.00 0.00 H new ATOM 0 HA SER A 33 292.137 129.998 401.681 1.00 0.00 H new ATOM 0 HB2 SER A 33 293.464 131.812 402.824 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.472 131.417 401.445 1.00 0.00 H new ATOM 0 HG SER A 33 291.665 131.987 401.385 1.00 0.00 H new ATOM 531 N TYR A 34 294.305 129.204 399.898 1.00 0.00 N ATOM 532 CA TYR A 34 295.012 128.500 398.776 1.00 0.00 C ATOM 533 C TYR A 34 296.165 127.545 399.122 1.00 0.00 C ATOM 534 O TYR A 34 296.497 126.632 398.368 1.00 0.00 O ATOM 535 CB TYR A 34 295.531 129.486 397.667 1.00 0.00 C ATOM 536 CG TYR A 34 294.615 130.653 397.368 1.00 0.00 C ATOM 537 CD1 TYR A 34 294.720 131.768 398.179 1.00 0.00 C ATOM 538 CD2 TYR A 34 293.769 130.712 396.258 1.00 0.00 C ATOM 539 CE1 TYR A 34 294.017 132.909 397.894 1.00 0.00 C ATOM 540 CE2 TYR A 34 293.082 131.882 395.936 1.00 0.00 C ATOM 541 CZ TYR A 34 293.233 132.972 396.777 1.00 0.00 C ATOM 542 OH TYR A 34 292.717 134.234 396.467 1.00 0.00 O ATOM 0 H TYR A 34 294.166 130.182 399.645 1.00 0.00 H new ATOM 0 HA TYR A 34 294.199 127.867 398.420 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.502 129.875 397.974 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.689 128.923 396.747 1.00 0.00 H new ATOM 0 HD1 TYR A 34 295.363 131.739 399.046 1.00 0.00 H new ATOM 0 HD2 TYR A 34 293.645 129.836 395.638 1.00 0.00 H new ATOM 0 HE1 TYR A 34 294.083 133.761 398.554 1.00 0.00 H new ATOM 0 HE2 TYR A 34 292.453 131.936 395.060 1.00 0.00 H new ATOM 0 HH TYR A 34 293.353 134.717 395.899 1.00 0.00 H new ATOM 552 N ALA A 35 296.747 127.705 400.329 1.00 0.00 N ATOM 553 CA ALA A 35 297.760 126.869 400.940 1.00 0.00 C ATOM 554 C ALA A 35 297.228 125.568 401.497 1.00 0.00 C ATOM 555 O ALA A 35 297.828 124.519 401.298 1.00 0.00 O ATOM 556 CB ALA A 35 298.409 127.672 402.095 1.00 0.00 C ATOM 0 H ALA A 35 296.490 128.485 400.934 1.00 0.00 H new ATOM 0 HA ALA A 35 298.473 126.604 400.159 1.00 0.00 H new ATOM 0 HB1 ALA A 35 299.177 127.065 402.574 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.860 128.581 401.697 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.647 127.936 402.828 1.00 0.00 H new ATOM 562 N PHE A 36 296.026 125.598 402.148 1.00 0.00 N ATOM 563 CA PHE A 36 295.251 124.427 402.544 1.00 0.00 C ATOM 564 C PHE A 36 294.598 123.876 401.286 1.00 0.00 C ATOM 565 O PHE A 36 294.674 122.680 400.994 1.00 0.00 O ATOM 566 CB PHE A 36 294.178 124.757 403.638 1.00 0.00 C ATOM 567 CG PHE A 36 293.269 123.551 404.012 1.00 0.00 C ATOM 568 CD1 PHE A 36 293.414 122.892 405.219 1.00 0.00 C ATOM 569 CD2 PHE A 36 292.254 123.083 403.168 1.00 0.00 C ATOM 570 CE1 PHE A 36 292.542 121.879 405.591 1.00 0.00 C ATOM 571 CE2 PHE A 36 291.374 122.086 403.531 1.00 0.00 C ATOM 572 CZ PHE A 36 291.506 121.490 404.761 1.00 0.00 C ATOM 0 H PHE A 36 295.574 126.474 402.410 1.00 0.00 H new ATOM 0 HA PHE A 36 295.912 123.689 402.998 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.685 125.110 404.536 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.552 125.576 403.284 1.00 0.00 H new ATOM 0 HD1 PHE A 36 294.219 123.170 405.883 1.00 0.00 H new ATOM 0 HD2 PHE A 36 292.156 123.524 402.187 1.00 0.00 H new ATOM 0 HE1 PHE A 36 292.674 121.387 406.543 1.00 0.00 H new ATOM 0 HE2 PHE A 36 290.590 121.777 402.856 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.810 120.727 405.076 1.00 0.00 H new ATOM 582 N LEU A 37 293.909 124.776 400.505 1.00 0.00 N ATOM 583 CA LEU A 37 293.223 124.334 399.278 1.00 0.00 C ATOM 584 C LEU A 37 294.092 123.705 398.181 1.00 0.00 C ATOM 585 O LEU A 37 293.656 122.719 397.622 1.00 0.00 O ATOM 586 CB LEU A 37 292.029 125.187 398.741 1.00 0.00 C ATOM 587 CG LEU A 37 292.234 126.688 398.685 1.00 0.00 C ATOM 588 CD1 LEU A 37 292.377 127.185 397.241 1.00 0.00 C ATOM 589 CD2 LEU A 37 291.194 127.565 399.374 1.00 0.00 C ATOM 0 H LEU A 37 293.826 125.772 400.709 1.00 0.00 H new ATOM 0 HA LEU A 37 292.701 123.484 399.718 1.00 0.00 H new ATOM 0 HB2 LEU A 37 291.787 124.839 397.737 1.00 0.00 H new ATOM 0 HB3 LEU A 37 291.159 124.986 399.366 1.00 0.00 H new ATOM 0 HG LEU A 37 293.153 126.804 399.260 1.00 0.00 H new ATOM 0 HD11 LEU A 37 292.522 128.265 397.241 1.00 0.00 H new ATOM 0 HD12 LEU A 37 293.236 126.703 396.774 1.00 0.00 H new ATOM 0 HD13 LEU A 37 291.474 126.940 396.681 1.00 0.00 H new ATOM 0 HD21 LEU A 37 291.466 128.614 399.255 1.00 0.00 H new ATOM 0 HD22 LEU A 37 290.216 127.390 398.925 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.156 127.318 400.435 1.00 0.00 H new ATOM 601 N ARG A 38 295.362 124.103 397.863 1.00 0.00 N ATOM 602 CA ARG A 38 296.168 123.347 396.876 1.00 0.00 C ATOM 603 C ARG A 38 296.548 121.920 397.288 1.00 0.00 C ATOM 604 O ARG A 38 296.564 121.016 396.461 1.00 0.00 O ATOM 605 CB ARG A 38 297.446 124.130 396.478 1.00 0.00 C ATOM 606 CG ARG A 38 298.314 123.501 395.368 1.00 0.00 C ATOM 607 CD ARG A 38 299.524 124.374 395.026 1.00 0.00 C ATOM 608 NE ARG A 38 300.574 124.232 396.093 1.00 0.00 N ATOM 609 CZ ARG A 38 301.713 124.992 396.109 1.00 0.00 C ATOM 610 NH1 ARG A 38 301.943 125.926 395.142 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 302.631 124.814 397.104 1.00 0.00 N ATOM 0 H ARG A 38 295.829 124.916 398.265 1.00 0.00 H new ATOM 0 HA ARG A 38 295.502 123.241 396.020 1.00 0.00 H new ATOM 0 HB2 ARG A 38 297.150 125.128 396.156 1.00 0.00 H new ATOM 0 HB3 ARG A 38 298.064 124.252 397.368 1.00 0.00 H new ATOM 0 HG2 ARG A 38 298.655 122.517 395.688 1.00 0.00 H new ATOM 0 HG3 ARG A 38 297.709 123.353 394.474 1.00 0.00 H new ATOM 0 HD2 ARG A 38 299.933 124.081 394.059 1.00 0.00 H new ATOM 0 HD3 ARG A 38 299.219 125.417 394.940 1.00 0.00 H new ATOM 0 HE ARG A 38 300.433 123.544 396.832 1.00 0.00 H new ATOM 0 HH11 ARG A 38 301.262 126.065 394.395 1.00 0.00 H new ATOM 0 HH12 ARG A 38 302.796 126.485 395.166 1.00 0.00 H new ATOM 0 HH21 ARG A 38 302.467 124.117 397.831 1.00 0.00 H new ATOM 0 HH22 ARG A 38 303.481 125.378 397.120 1.00 0.00 H new ATOM 625 N ARG A 39 296.785 121.701 398.610 1.00 0.00 N ATOM 626 CA ARG A 39 296.971 120.406 399.256 1.00 0.00 C ATOM 627 C ARG A 39 295.699 119.542 399.323 1.00 0.00 C ATOM 628 O ARG A 39 295.739 118.336 399.074 1.00 0.00 O ATOM 629 CB ARG A 39 297.602 120.562 400.666 1.00 0.00 C ATOM 630 CG ARG A 39 298.876 121.433 400.700 1.00 0.00 C ATOM 631 CD ARG A 39 299.959 121.044 399.682 1.00 0.00 C ATOM 632 NE ARG A 39 301.207 121.824 399.989 1.00 0.00 N ATOM 633 CZ ARG A 39 302.305 121.827 399.171 1.00 0.00 C ATOM 634 NH1 ARG A 39 302.299 121.153 397.985 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 303.420 122.520 399.548 1.00 0.00 N ATOM 0 H ARG A 39 296.852 122.473 399.273 1.00 0.00 H new ATOM 0 HA ARG A 39 297.664 119.866 398.611 1.00 0.00 H new ATOM 0 HB2 ARG A 39 296.861 120.997 401.337 1.00 0.00 H new ATOM 0 HB3 ARG A 39 297.842 119.573 401.055 1.00 0.00 H new ATOM 0 HG2 ARG A 39 298.592 122.471 400.527 1.00 0.00 H new ATOM 0 HG3 ARG A 39 299.305 121.383 401.701 1.00 0.00 H new ATOM 0 HD2 ARG A 39 300.159 119.974 399.733 1.00 0.00 H new ATOM 0 HD3 ARG A 39 299.619 121.257 398.668 1.00 0.00 H new ATOM 0 HE ARG A 39 301.237 122.376 400.846 1.00 0.00 H new ATOM 0 HH11 ARG A 39 301.468 120.637 397.696 1.00 0.00 H new ATOM 0 HH12 ARG A 39 303.125 121.165 397.387 1.00 0.00 H new ATOM 0 HH21 ARG A 39 303.430 123.029 400.432 1.00 0.00 H new ATOM 0 HH22 ARG A 39 304.243 122.528 398.946 1.00 0.00 H new ATOM 649 N GLU A 40 294.523 120.148 399.677 1.00 0.00 N ATOM 650 CA GLU A 40 293.249 119.445 399.797 1.00 0.00 C ATOM 651 C GLU A 40 292.446 119.312 398.494 1.00 0.00 C ATOM 652 O GLU A 40 291.585 118.441 398.386 1.00 0.00 O ATOM 653 CB GLU A 40 292.427 120.059 400.963 1.00 0.00 C ATOM 654 CG GLU A 40 291.377 119.122 401.606 1.00 0.00 C ATOM 655 CD GLU A 40 290.002 119.264 400.958 1.00 0.00 C ATOM 656 OE1 GLU A 40 289.489 120.413 400.925 1.00 0.00 O ATOM 657 OE2 GLU A 40 289.440 118.232 400.503 1.00 0.00 O1- ATOM 0 H GLU A 40 294.456 121.145 399.884 1.00 0.00 H new ATOM 0 HA GLU A 40 293.485 118.407 400.033 1.00 0.00 H new ATOM 0 HB2 GLU A 40 293.119 120.386 401.739 1.00 0.00 H new ATOM 0 HB3 GLU A 40 291.917 120.949 400.595 1.00 0.00 H new ATOM 0 HG2 GLU A 40 291.713 118.089 401.518 1.00 0.00 H new ATOM 0 HG3 GLU A 40 291.299 119.343 402.671 1.00 0.00 H new ATOM 664 N LEU A 41 292.689 120.158 397.449 1.00 0.00 N ATOM 665 CA LEU A 41 291.940 120.128 396.181 1.00 0.00 C ATOM 666 C LEU A 41 292.439 119.080 395.191 1.00 0.00 C ATOM 667 O LEU A 41 291.894 118.901 394.107 1.00 0.00 O ATOM 668 CB LEU A 41 292.015 121.533 395.513 1.00 0.00 C ATOM 669 CG LEU A 41 290.756 122.078 394.772 1.00 0.00 C ATOM 670 CD1 LEU A 41 291.147 123.301 393.935 1.00 0.00 C ATOM 671 CD2 LEU A 41 289.855 121.118 393.978 1.00 0.00 C ATOM 0 H LEU A 41 293.413 120.876 397.475 1.00 0.00 H new ATOM 0 HA LEU A 41 290.915 119.855 396.433 1.00 0.00 H new ATOM 0 HB2 LEU A 41 292.281 122.253 396.287 1.00 0.00 H new ATOM 0 HB3 LEU A 41 292.838 121.516 394.798 1.00 0.00 H new ATOM 0 HG LEU A 41 290.087 122.325 395.596 1.00 0.00 H new ATOM 0 HD11 LEU A 41 290.268 123.683 393.416 1.00 0.00 H new ATOM 0 HD12 LEU A 41 291.548 124.076 394.588 1.00 0.00 H new ATOM 0 HD13 LEU A 41 291.904 123.015 393.204 1.00 0.00 H new ATOM 0 HD21 LEU A 41 289.032 121.676 393.533 1.00 0.00 H new ATOM 0 HD22 LEU A 41 290.437 120.640 393.190 1.00 0.00 H new ATOM 0 HD23 LEU A 41 289.456 120.356 394.647 1.00 0.00 H new ATOM 683 N GLY A 42 293.572 118.408 395.522 1.00 0.00 N ATOM 684 CA GLY A 42 294.288 117.425 394.711 1.00 0.00 C ATOM 685 C GLY A 42 295.061 117.956 393.524 1.00 0.00 C ATOM 686 O GLY A 42 295.873 117.236 392.951 1.00 0.00 O ATOM 0 H GLY A 42 294.028 118.558 396.422 1.00 0.00 H new ATOM 0 HA2 GLY A 42 294.984 116.892 395.359 1.00 0.00 H new ATOM 0 HA3 GLY A 42 293.566 116.694 394.347 1.00 0.00 H new ATOM 690 N LEU A 43 294.841 119.234 393.109 1.00 0.00 N ATOM 691 CA LEU A 43 295.477 119.813 391.938 1.00 0.00 C ATOM 692 C LEU A 43 296.156 121.148 392.084 1.00 0.00 C ATOM 693 O LEU A 43 295.775 122.025 392.862 1.00 0.00 O ATOM 694 CB LEU A 43 294.591 119.751 390.650 1.00 0.00 C ATOM 695 CG LEU A 43 293.636 120.937 390.352 1.00 0.00 C ATOM 696 CD1 LEU A 43 292.834 120.697 389.061 1.00 0.00 C ATOM 697 CD2 LEU A 43 292.686 121.247 391.512 1.00 0.00 C ATOM 0 H LEU A 43 294.213 119.876 393.592 1.00 0.00 H new ATOM 0 HA LEU A 43 296.318 119.130 391.817 1.00 0.00 H new ATOM 0 HB2 LEU A 43 295.257 119.638 389.794 1.00 0.00 H new ATOM 0 HB3 LEU A 43 293.987 118.845 390.706 1.00 0.00 H new ATOM 0 HG LEU A 43 294.275 121.809 390.218 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.174 121.545 388.880 1.00 0.00 H new ATOM 0 HD12 LEU A 43 293.520 120.585 388.222 1.00 0.00 H new ATOM 0 HD13 LEU A 43 292.238 119.790 389.166 1.00 0.00 H new ATOM 0 HD21 LEU A 43 292.044 122.086 391.242 1.00 0.00 H new ATOM 0 HD22 LEU A 43 292.071 120.372 391.722 1.00 0.00 H new ATOM 0 HD23 LEU A 43 293.266 121.504 392.398 1.00 0.00 H new ATOM 709 N SER A 44 297.200 121.348 391.232 1.00 0.00 N ATOM 710 CA SER A 44 298.013 122.553 391.120 1.00 0.00 C ATOM 711 C SER A 44 297.410 123.559 390.159 1.00 0.00 C ATOM 712 O SER A 44 298.033 124.029 389.211 1.00 0.00 O ATOM 713 CB SER A 44 299.490 122.277 390.735 1.00 0.00 C ATOM 714 OG SER A 44 300.120 121.575 391.802 1.00 0.00 O ATOM 0 H SER A 44 297.498 120.624 390.578 1.00 0.00 H new ATOM 0 HA SER A 44 298.017 122.978 392.124 1.00 0.00 H new ATOM 0 HB2 SER A 44 299.537 121.690 389.818 1.00 0.00 H new ATOM 0 HB3 SER A 44 300.011 123.215 390.541 1.00 0.00 H new ATOM 0 HG SER A 44 301.054 121.394 391.568 1.00 0.00 H new ATOM 720 N SER A 45 296.163 123.984 390.495 1.00 0.00 N ATOM 721 CA SER A 45 295.349 125.061 389.919 1.00 0.00 C ATOM 722 C SER A 45 295.899 126.440 390.326 1.00 0.00 C ATOM 723 O SER A 45 295.481 127.476 389.827 1.00 0.00 O ATOM 724 CB SER A 45 293.859 124.972 390.427 1.00 0.00 C ATOM 725 OG SER A 45 293.792 124.499 391.777 1.00 0.00 O ATOM 0 H SER A 45 295.661 123.526 391.256 1.00 0.00 H new ATOM 0 HA SER A 45 295.386 124.944 388.836 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.392 125.955 390.361 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.291 124.305 389.778 1.00 0.00 H new ATOM 0 HG SER A 45 294.517 124.900 392.300 1.00 0.00 H new ATOM 731 N ALA A 46 296.864 126.456 391.280 1.00 0.00 N ATOM 732 CA ALA A 46 297.469 127.542 392.041 1.00 0.00 C ATOM 733 C ALA A 46 298.362 128.521 391.309 1.00 0.00 C ATOM 734 O ALA A 46 299.006 129.387 391.901 1.00 0.00 O ATOM 735 CB ALA A 46 298.215 126.953 393.236 1.00 0.00 C ATOM 0 H ALA A 46 297.285 125.570 391.561 1.00 0.00 H new ATOM 0 HA ALA A 46 296.619 128.162 392.327 1.00 0.00 H new ATOM 0 HB1 ALA A 46 298.672 127.758 393.812 1.00 0.00 H new ATOM 0 HB2 ALA A 46 297.515 126.406 393.868 1.00 0.00 H new ATOM 0 HB3 ALA A 46 298.991 126.275 392.882 1.00 0.00 H new ATOM 741 N HIS A 47 298.440 128.383 389.971 1.00 0.00 N ATOM 742 CA HIS A 47 299.183 129.230 389.057 1.00 0.00 C ATOM 743 C HIS A 47 298.545 130.617 388.854 1.00 0.00 C ATOM 744 O HIS A 47 299.261 131.608 388.738 1.00 0.00 O ATOM 745 CB HIS A 47 299.366 128.445 387.735 1.00 0.00 C ATOM 746 CG HIS A 47 300.290 129.075 386.728 1.00 0.00 C ATOM 747 ND1 HIS A 47 301.564 129.518 387.019 1.00 0.00 N ATOM 748 CD2 HIS A 47 300.116 129.297 385.399 1.00 0.00 C ATOM 749 CE1 HIS A 47 302.092 129.989 385.863 1.00 0.00 C ATOM 750 NE2 HIS A 47 301.250 129.873 384.856 1.00 0.00 N ATOM 0 H HIS A 47 297.953 127.630 389.485 1.00 0.00 H new ATOM 0 HA HIS A 47 300.158 129.460 389.486 1.00 0.00 H new ATOM 0 HB2 HIS A 47 299.741 127.450 387.973 1.00 0.00 H new ATOM 0 HB3 HIS A 47 298.388 128.315 387.272 1.00 0.00 H new ATOM 0 HD2 HIS A 47 299.220 129.058 384.846 1.00 0.00 H new ATOM 0 HE1 HIS A 47 303.083 130.409 385.777 1.00 0.00 H new ATOM 0 HE2 HIS A 47 301.402 130.149 383.886 1.00 0.00 H new ATOM 758 N THR A 48 297.177 130.718 388.844 1.00 0.00 N ATOM 759 CA THR A 48 296.430 131.980 388.743 1.00 0.00 C ATOM 760 C THR A 48 295.223 131.940 389.689 1.00 0.00 C ATOM 761 O THR A 48 294.547 130.910 389.826 1.00 0.00 O ATOM 762 CB THR A 48 295.998 132.434 387.306 1.00 0.00 C ATOM 763 OG1 THR A 48 294.749 131.942 386.815 1.00 0.00 O ATOM 764 CG2 THR A 48 297.037 132.053 386.238 1.00 0.00 C ATOM 0 H THR A 48 296.569 129.901 388.908 1.00 0.00 H new ATOM 0 HA THR A 48 297.145 132.747 389.041 1.00 0.00 H new ATOM 0 HB THR A 48 295.904 133.510 387.454 1.00 0.00 H new ATOM 0 HG1 THR A 48 294.590 132.294 385.914 1.00 0.00 H new ATOM 0 HG21 THR A 48 296.693 132.388 385.260 1.00 0.00 H new ATOM 0 HG22 THR A 48 297.989 132.529 386.471 1.00 0.00 H new ATOM 0 HG23 THR A 48 297.166 130.971 386.226 1.00 0.00 H new ATOM 772 N ASN A 49 294.841 133.114 390.307 1.00 0.00 N ATOM 773 CA ASN A 49 293.659 133.288 391.175 1.00 0.00 C ATOM 774 C ASN A 49 292.348 133.134 390.398 1.00 0.00 C ATOM 775 O ASN A 49 291.333 132.776 390.971 1.00 0.00 O ATOM 776 CB ASN A 49 293.680 134.646 391.955 1.00 0.00 C ATOM 777 CG ASN A 49 293.169 134.614 393.411 1.00 0.00 C ATOM 778 OD1 ASN A 49 293.979 134.798 394.324 1.00 0.00 O ATOM 779 ND2 ASN A 49 291.850 134.412 393.682 1.00 0.00 N ATOM 0 H ASN A 49 295.375 133.976 390.199 1.00 0.00 H new ATOM 0 HA ASN A 49 293.711 132.487 391.912 1.00 0.00 H new ATOM 0 HB2 ASN A 49 294.704 135.020 391.961 1.00 0.00 H new ATOM 0 HB3 ASN A 49 293.081 135.367 391.399 1.00 0.00 H new ATOM 0 HD21 ASN A 49 291.522 134.412 394.648 1.00 0.00 H new ATOM 0 HD22 ASN A 49 291.190 134.261 392.919 1.00 0.00 H new ATOM 786 N ARG A 50 292.395 133.354 389.051 1.00 0.00 N ATOM 787 CA ARG A 50 291.342 133.165 388.064 1.00 0.00 C ATOM 788 C ARG A 50 291.060 131.693 387.750 1.00 0.00 C ATOM 789 O ARG A 50 289.906 131.285 387.710 1.00 0.00 O ATOM 790 CB ARG A 50 291.647 133.916 386.735 1.00 0.00 C ATOM 791 CG ARG A 50 292.158 135.365 386.897 1.00 0.00 C ATOM 792 CD ARG A 50 293.684 135.473 387.108 1.00 0.00 C ATOM 793 NE ARG A 50 294.097 136.921 387.124 1.00 0.00 N ATOM 794 CZ ARG A 50 294.090 137.710 388.244 1.00 0.00 C ATOM 795 NH1 ARG A 50 293.687 137.219 389.450 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 294.491 139.013 388.147 1.00 0.00 N ATOM 0 H ARG A 50 293.251 133.696 388.614 1.00 0.00 H new ATOM 0 HA ARG A 50 290.450 133.588 388.526 1.00 0.00 H new ATOM 0 HB2 ARG A 50 292.391 133.346 386.178 1.00 0.00 H new ATOM 0 HB3 ARG A 50 290.740 133.934 386.131 1.00 0.00 H new ATOM 0 HG2 ARG A 50 291.883 135.938 386.011 1.00 0.00 H new ATOM 0 HG3 ARG A 50 291.651 135.826 387.745 1.00 0.00 H new ATOM 0 HD2 ARG A 50 293.965 134.995 388.046 1.00 0.00 H new ATOM 0 HD3 ARG A 50 294.208 134.945 386.312 1.00 0.00 H new ATOM 0 HE ARG A 50 294.401 137.341 386.246 1.00 0.00 H new ATOM 0 HH11 ARG A 50 293.384 136.248 389.530 1.00 0.00 H new ATOM 0 HH12 ARG A 50 293.689 137.822 390.273 1.00 0.00 H new ATOM 0 HH21 ARG A 50 294.791 139.389 387.247 1.00 0.00 H new ATOM 0 HH22 ARG A 50 294.490 139.610 388.974 1.00 0.00 H new ATOM 810 N LYS A 51 292.130 130.865 387.531 1.00 0.00 N ATOM 811 CA LYS A 51 292.090 129.418 387.281 1.00 0.00 C ATOM 812 C LYS A 51 291.739 128.594 388.504 1.00 0.00 C ATOM 813 O LYS A 51 290.851 127.729 388.462 1.00 0.00 O ATOM 814 CB LYS A 51 293.433 128.902 386.695 1.00 0.00 C ATOM 815 CG LYS A 51 293.487 127.390 386.380 1.00 0.00 C ATOM 816 CD LYS A 51 294.710 126.963 385.554 1.00 0.00 C ATOM 817 CE LYS A 51 296.039 127.065 386.308 1.00 0.00 C ATOM 818 NZ LYS A 51 297.160 126.588 385.463 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.084 131.225 387.528 1.00 0.00 H new ATOM 0 HA LYS A 51 291.289 129.285 386.554 1.00 0.00 H new ATOM 0 HB2 LYS A 51 293.645 129.454 385.779 1.00 0.00 H new ATOM 0 HB3 LYS A 51 294.230 129.137 387.400 1.00 0.00 H new ATOM 0 HG2 LYS A 51 293.484 126.834 387.318 1.00 0.00 H new ATOM 0 HG3 LYS A 51 292.582 127.110 385.840 1.00 0.00 H new ATOM 0 HD2 LYS A 51 294.570 125.934 385.223 1.00 0.00 H new ATOM 0 HD3 LYS A 51 294.764 127.582 384.658 1.00 0.00 H new ATOM 0 HE2 LYS A 51 296.216 128.099 386.605 1.00 0.00 H new ATOM 0 HE3 LYS A 51 295.990 126.474 387.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 298.038 126.586 386.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 296.958 125.623 385.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 297.271 127.220 384.645 1.00 0.00 H new ATOM 832 N VAL A 52 292.389 128.883 389.690 1.00 0.00 N ATOM 833 CA VAL A 52 292.076 128.181 390.956 1.00 0.00 C ATOM 834 C VAL A 52 290.707 128.487 391.433 1.00 0.00 C ATOM 835 O VAL A 52 289.966 127.559 391.745 1.00 0.00 O ATOM 836 CB VAL A 52 293.103 128.268 392.112 1.00 0.00 C ATOM 837 CG1 VAL A 52 293.299 129.703 392.660 1.00 0.00 C ATOM 838 CG2 VAL A 52 292.808 127.230 393.243 1.00 0.00 C ATOM 0 H VAL A 52 293.119 129.590 389.776 1.00 0.00 H new ATOM 0 HA VAL A 52 292.146 127.136 390.653 1.00 0.00 H new ATOM 0 HB VAL A 52 294.063 127.995 391.674 1.00 0.00 H new ATOM 0 HG11 VAL A 52 294.032 129.687 393.467 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.654 130.353 391.860 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.349 130.080 393.039 1.00 0.00 H new ATOM 0 HG21 VAL A 52 293.554 127.329 394.031 1.00 0.00 H new ATOM 0 HG22 VAL A 52 291.817 127.415 393.657 1.00 0.00 H new ATOM 0 HG23 VAL A 52 292.847 126.222 392.831 1.00 0.00 H new ATOM 848 N TRP A 53 290.305 129.794 391.374 1.00 0.00 N ATOM 849 CA TRP A 53 288.957 130.268 391.678 1.00 0.00 C ATOM 850 C TRP A 53 287.898 129.746 390.765 1.00 0.00 C ATOM 851 O TRP A 53 286.833 129.440 391.252 1.00 0.00 O ATOM 852 CB TRP A 53 288.797 131.753 391.988 1.00 0.00 C ATOM 853 CG TRP A 53 289.220 132.251 393.338 1.00 0.00 C ATOM 854 CD1 TRP A 53 288.865 133.487 393.781 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.672 131.517 394.499 1.00 0.00 C ATOM 856 NE1 TRP A 53 289.057 133.576 395.124 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.615 132.398 395.571 1.00 0.00 C ATOM 858 CE3 TRP A 53 290.057 130.216 394.686 1.00 0.00 C ATOM 859 CZ2 TRP A 53 290.015 132.010 396.815 1.00 0.00 C ATOM 860 CZ3 TRP A 53 290.421 129.819 395.941 1.00 0.00 C ATOM 861 CH2 TRP A 53 290.454 130.713 396.977 1.00 0.00 C ATOM 0 H TRP A 53 290.939 130.547 391.106 1.00 0.00 H new ATOM 0 HA TRP A 53 288.787 129.798 392.647 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.358 132.311 391.238 1.00 0.00 H new ATOM 0 HB3 TRP A 53 287.746 132.008 391.855 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.486 134.282 393.157 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.826 134.382 395.705 1.00 0.00 H new ATOM 0 HE3 TRP A 53 290.072 129.520 393.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.989 132.697 397.648 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 290.686 128.787 396.118 1.00 0.00 H new ATOM 0 HH2 TRP A 53 290.831 130.397 397.939 1.00 0.00 H new ATOM 872 N LYS A 54 288.192 129.519 389.469 1.00 0.00 N ATOM 873 CA LYS A 54 287.351 128.790 388.505 1.00 0.00 C ATOM 874 C LYS A 54 287.193 127.298 388.807 1.00 0.00 C ATOM 875 O LYS A 54 286.072 126.811 388.758 1.00 0.00 O ATOM 876 CB LYS A 54 288.061 128.916 387.140 1.00 0.00 C ATOM 877 CG LYS A 54 287.988 127.796 386.088 1.00 0.00 C ATOM 878 CD LYS A 54 288.660 128.247 384.788 1.00 0.00 C ATOM 879 CE LYS A 54 288.669 127.161 383.707 1.00 0.00 C ATOM 880 NZ LYS A 54 289.362 127.635 382.487 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.060 129.854 389.050 1.00 0.00 H new ATOM 0 HA LYS A 54 286.350 129.220 388.540 1.00 0.00 H new ATOM 0 HB2 LYS A 54 287.678 129.820 386.667 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.117 129.087 387.347 1.00 0.00 H new ATOM 0 HG2 LYS A 54 288.478 126.899 386.467 1.00 0.00 H new ATOM 0 HG3 LYS A 54 286.947 127.534 385.896 1.00 0.00 H new ATOM 0 HD2 LYS A 54 288.143 129.127 384.406 1.00 0.00 H new ATOM 0 HD3 LYS A 54 289.686 128.547 385.002 1.00 0.00 H new ATOM 0 HE2 LYS A 54 289.164 126.268 384.088 1.00 0.00 H new ATOM 0 HE3 LYS A 54 287.645 126.878 383.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 289.355 126.882 381.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 288.873 128.474 382.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 290.345 127.882 382.720 1.00 0.00 H new ATOM 894 N LYS A 55 288.267 126.514 389.184 1.00 0.00 N ATOM 895 CA LYS A 55 288.116 125.098 389.631 1.00 0.00 C ATOM 896 C LYS A 55 287.332 124.999 390.957 1.00 0.00 C ATOM 897 O LYS A 55 286.394 124.213 391.164 1.00 0.00 O ATOM 898 CB LYS A 55 289.469 124.352 389.789 1.00 0.00 C ATOM 899 CG LYS A 55 290.360 124.358 388.539 1.00 0.00 C ATOM 900 CD LYS A 55 289.667 123.720 387.334 1.00 0.00 C ATOM 901 CE LYS A 55 290.603 123.520 386.136 1.00 0.00 C ATOM 902 NZ LYS A 55 291.057 124.820 385.591 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.231 126.846 389.183 1.00 0.00 H new ATOM 0 HA LYS A 55 287.556 124.610 388.833 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.022 124.803 390.613 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.267 123.318 390.068 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.636 125.384 388.296 1.00 0.00 H new ATOM 0 HG3 LYS A 55 291.285 123.821 388.751 1.00 0.00 H new ATOM 0 HD2 LYS A 55 289.254 122.756 387.629 1.00 0.00 H new ATOM 0 HD3 LYS A 55 288.828 124.347 387.031 1.00 0.00 H new ATOM 0 HE2 LYS A 55 291.466 122.928 386.440 1.00 0.00 H new ATOM 0 HE3 LYS A 55 290.088 122.956 385.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 291.054 124.781 384.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 290.416 125.574 385.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 292.021 125.020 385.927 1.00 0.00 H new ATOM 916 N PHE A 56 287.658 125.988 391.835 1.00 0.00 N ATOM 917 CA PHE A 56 286.916 126.294 393.086 1.00 0.00 C ATOM 918 C PHE A 56 285.427 126.642 392.854 1.00 0.00 C ATOM 919 O PHE A 56 284.502 126.055 393.410 1.00 0.00 O ATOM 920 CB PHE A 56 287.605 127.422 393.916 1.00 0.00 C ATOM 921 CG PHE A 56 288.146 126.858 395.185 1.00 0.00 C ATOM 922 CD1 PHE A 56 287.548 127.175 396.381 1.00 0.00 C ATOM 923 CD2 PHE A 56 289.147 125.911 395.161 1.00 0.00 C ATOM 924 CE1 PHE A 56 287.857 126.474 397.520 1.00 0.00 C ATOM 925 CE2 PHE A 56 289.486 125.231 396.311 1.00 0.00 C ATOM 926 CZ PHE A 56 288.827 125.500 397.486 1.00 0.00 C ATOM 0 H PHE A 56 288.458 126.604 391.688 1.00 0.00 H new ATOM 0 HA PHE A 56 286.944 125.368 393.660 1.00 0.00 H new ATOM 0 HB2 PHE A 56 288.410 127.873 393.336 1.00 0.00 H new ATOM 0 HB3 PHE A 56 286.889 128.214 394.136 1.00 0.00 H new ATOM 0 HD1 PHE A 56 286.830 127.981 396.425 1.00 0.00 H new ATOM 0 HD2 PHE A 56 289.667 125.701 394.238 1.00 0.00 H new ATOM 0 HE1 PHE A 56 287.338 126.687 398.443 1.00 0.00 H new ATOM 0 HE2 PHE A 56 290.269 124.487 396.288 1.00 0.00 H new ATOM 0 HZ PHE A 56 289.070 124.947 398.381 1.00 0.00 H new ATOM 936 N VAL A 57 285.160 127.582 391.919 1.00 0.00 N ATOM 937 CA VAL A 57 283.867 127.985 391.366 1.00 0.00 C ATOM 938 C VAL A 57 283.070 126.909 390.622 1.00 0.00 C ATOM 939 O VAL A 57 281.848 126.840 390.712 1.00 0.00 O ATOM 940 CB VAL A 57 283.471 129.468 391.386 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.437 129.934 392.889 1.00 0.00 C ATOM 942 CG2 VAL A 57 284.269 130.439 390.491 1.00 0.00 C ATOM 0 H VAL A 57 285.919 128.120 391.501 1.00 0.00 H new ATOM 0 HA VAL A 57 283.058 128.076 392.091 1.00 0.00 H new ATOM 0 HB VAL A 57 282.490 129.521 390.915 1.00 0.00 H new ATOM 0 HG11 VAL A 57 283.158 130.987 392.937 1.00 0.00 H new ATOM 0 HG12 VAL A 57 282.707 129.339 393.438 1.00 0.00 H new ATOM 0 HG13 VAL A 57 284.423 129.799 393.334 1.00 0.00 H new ATOM 0 HG21 VAL A 57 283.877 131.449 390.610 1.00 0.00 H new ATOM 0 HG22 VAL A 57 285.320 130.421 390.781 1.00 0.00 H new ATOM 0 HG23 VAL A 57 284.175 130.134 389.449 1.00 0.00 H new ATOM 952 N GLU A 58 283.778 125.958 389.960 1.00 0.00 N ATOM 953 CA GLU A 58 283.272 124.666 389.469 1.00 0.00 C ATOM 954 C GLU A 58 282.799 123.747 390.637 1.00 0.00 C ATOM 955 O GLU A 58 281.710 123.178 390.579 1.00 0.00 O ATOM 956 CB GLU A 58 284.328 123.970 388.564 1.00 0.00 C ATOM 957 CG GLU A 58 283.807 122.763 387.764 1.00 0.00 C ATOM 958 CD GLU A 58 284.916 122.257 386.844 1.00 0.00 C ATOM 959 OE1 GLU A 58 285.981 121.836 387.373 1.00 0.00 O ATOM 960 OE2 GLU A 58 284.717 122.286 385.600 1.00 0.00 O1- ATOM 0 H GLU A 58 284.767 126.086 389.747 1.00 0.00 H new ATOM 0 HA GLU A 58 282.392 124.861 388.857 1.00 0.00 H new ATOM 0 HB2 GLU A 58 284.726 124.705 387.865 1.00 0.00 H new ATOM 0 HB3 GLU A 58 285.159 123.641 389.188 1.00 0.00 H new ATOM 0 HG2 GLU A 58 283.490 121.971 388.442 1.00 0.00 H new ATOM 0 HG3 GLU A 58 282.934 123.049 387.178 1.00 0.00 H new ATOM 967 N ALA A 59 283.566 123.670 391.786 1.00 0.00 N ATOM 968 CA ALA A 59 283.113 123.015 393.048 1.00 0.00 C ATOM 969 C ALA A 59 281.881 123.604 393.712 1.00 0.00 C ATOM 970 O ALA A 59 281.067 122.921 394.311 1.00 0.00 O ATOM 971 CB ALA A 59 284.065 123.202 394.254 1.00 0.00 C ATOM 0 H ALA A 59 284.506 124.061 391.849 1.00 0.00 H new ATOM 0 HA ALA A 59 282.999 122.006 392.653 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.653 122.692 395.125 1.00 0.00 H new ATOM 0 HB2 ALA A 59 285.042 122.781 394.015 1.00 0.00 H new ATOM 0 HB3 ALA A 59 284.171 124.265 394.472 1.00 0.00 H new ATOM 977 N TYR A 60 281.819 124.958 393.699 1.00 0.00 N ATOM 978 CA TYR A 60 280.903 125.877 394.369 1.00 0.00 C ATOM 979 C TYR A 60 279.374 125.602 394.148 1.00 0.00 C ATOM 980 O TYR A 60 278.485 126.075 394.841 1.00 0.00 O ATOM 981 CB TYR A 60 281.290 127.282 393.860 1.00 0.00 C ATOM 982 CG TYR A 60 280.908 128.526 394.611 1.00 0.00 C ATOM 983 CD1 TYR A 60 279.955 129.373 394.075 1.00 0.00 C ATOM 984 CD2 TYR A 60 281.691 128.983 395.662 1.00 0.00 C ATOM 985 CE1 TYR A 60 279.809 130.659 394.558 1.00 0.00 C ATOM 986 CE2 TYR A 60 281.565 130.272 396.140 1.00 0.00 C ATOM 987 CZ TYR A 60 280.628 131.110 395.570 1.00 0.00 C ATOM 988 OH TYR A 60 280.490 132.427 396.040 1.00 0.00 O ATOM 0 H TYR A 60 282.498 125.482 393.148 1.00 0.00 H new ATOM 0 HA TYR A 60 281.015 125.755 395.446 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.375 127.294 393.760 1.00 0.00 H new ATOM 0 HB3 TYR A 60 280.876 127.379 392.856 1.00 0.00 H new ATOM 0 HD1 TYR A 60 279.320 129.026 393.273 1.00 0.00 H new ATOM 0 HD2 TYR A 60 282.412 128.318 396.114 1.00 0.00 H new ATOM 0 HE1 TYR A 60 279.054 131.310 394.143 1.00 0.00 H new ATOM 0 HE2 TYR A 60 282.191 130.620 396.949 1.00 0.00 H new ATOM 0 HH TYR A 60 279.559 132.715 395.938 1.00 0.00 H new ATOM 998 N GLY A 61 279.057 124.762 393.139 1.00 0.00 N ATOM 999 CA GLY A 61 277.746 124.162 392.878 1.00 0.00 C ATOM 1000 C GLY A 61 277.546 122.742 393.409 1.00 0.00 C ATOM 1001 O GLY A 61 276.526 122.134 393.108 1.00 0.00 O ATOM 0 H GLY A 61 279.753 124.473 392.451 1.00 0.00 H new ATOM 0 HA2 GLY A 61 276.980 124.804 393.314 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.579 124.154 391.801 1.00 0.00 H new ATOM 1005 N LYS A 62 278.511 122.161 394.185 1.00 0.00 N ATOM 1006 CA LYS A 62 278.513 120.796 394.726 1.00 0.00 C ATOM 1007 C LYS A 62 278.076 120.638 396.188 1.00 0.00 C ATOM 1008 O LYS A 62 277.507 119.609 396.535 1.00 0.00 O ATOM 1009 CB LYS A 62 279.820 120.016 394.318 1.00 0.00 C ATOM 1010 CG LYS A 62 280.753 119.333 395.357 1.00 0.00 C ATOM 1011 CD LYS A 62 281.893 120.173 395.989 1.00 0.00 C ATOM 1012 CE LYS A 62 281.588 120.746 397.387 1.00 0.00 C ATOM 1013 NZ LYS A 62 282.610 120.347 398.389 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.349 122.676 394.456 1.00 0.00 H new ATOM 0 HA LYS A 62 277.685 120.290 394.230 1.00 0.00 H new ATOM 0 HB2 LYS A 62 279.512 119.238 393.619 1.00 0.00 H new ATOM 0 HB3 LYS A 62 280.439 120.718 393.760 1.00 0.00 H new ATOM 0 HG2 LYS A 62 280.129 118.958 396.168 1.00 0.00 H new ATOM 0 HG3 LYS A 62 281.207 118.466 394.877 1.00 0.00 H new ATOM 0 HD2 LYS A 62 282.786 119.552 396.055 1.00 0.00 H new ATOM 0 HD3 LYS A 62 282.128 121.000 395.318 1.00 0.00 H new ATOM 0 HE2 LYS A 62 281.541 121.834 397.330 1.00 0.00 H new ATOM 0 HE3 LYS A 62 280.607 120.401 397.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 282.574 120.998 399.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 282.418 119.378 398.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 283.555 120.386 397.956 1.00 0.00 H new ATOM 1027 N ALA A 63 278.294 121.629 397.101 1.00 0.00 N ATOM 1028 CA ALA A 63 277.871 121.576 398.521 1.00 0.00 C ATOM 1029 C ALA A 63 276.786 122.611 398.820 1.00 0.00 C ATOM 1030 O ALA A 63 276.585 123.032 399.958 1.00 0.00 O ATOM 1031 CB ALA A 63 279.044 121.755 399.533 1.00 0.00 C ATOM 0 H ALA A 63 278.775 122.496 396.862 1.00 0.00 H new ATOM 0 HA ALA A 63 277.473 120.571 398.659 1.00 0.00 H new ATOM 0 HB1 ALA A 63 278.657 121.705 400.551 1.00 0.00 H new ATOM 0 HB2 ALA A 63 279.777 120.962 399.384 1.00 0.00 H new ATOM 0 HB3 ALA A 63 279.518 122.723 399.373 1.00 0.00 H new ATOM 1037 N ILE A 64 276.069 123.069 397.765 1.00 0.00 N ATOM 1038 CA ILE A 64 275.000 124.061 397.849 1.00 0.00 C ATOM 1039 C ILE A 64 273.622 123.381 397.950 1.00 0.00 C ATOM 1040 O ILE A 64 273.331 122.502 397.135 1.00 0.00 O ATOM 1041 CB ILE A 64 275.080 125.097 396.708 1.00 0.00 C ATOM 1042 CG1 ILE A 64 274.459 126.449 397.139 1.00 0.00 C ATOM 1043 CG2 ILE A 64 274.503 124.595 395.360 1.00 0.00 C ATOM 1044 CD1 ILE A 64 274.737 127.599 396.163 1.00 0.00 C ATOM 0 H ILE A 64 276.232 122.742 396.813 1.00 0.00 H new ATOM 0 HA ILE A 64 275.140 124.627 398.770 1.00 0.00 H new ATOM 0 HB ILE A 64 276.142 125.254 396.518 1.00 0.00 H new ATOM 0 HG12 ILE A 64 273.381 126.326 397.243 1.00 0.00 H new ATOM 0 HG13 ILE A 64 274.845 126.718 398.122 1.00 0.00 H new ATOM 0 HG21 ILE A 64 274.596 125.380 394.610 1.00 0.00 H new ATOM 0 HG22 ILE A 64 275.055 123.714 395.034 1.00 0.00 H new ATOM 0 HG23 ILE A 64 273.452 124.338 395.488 1.00 0.00 H new ATOM 0 HD11 ILE A 64 274.270 128.512 396.533 1.00 0.00 H new ATOM 0 HD12 ILE A 64 275.813 127.751 396.077 1.00 0.00 H new ATOM 0 HD13 ILE A 64 274.326 127.353 395.184 1.00 0.00 H new ATOM 1056 N PRO A 65 272.747 123.662 398.941 1.00 0.00 N ATOM 1057 CA PRO A 65 271.381 123.139 398.981 1.00 0.00 C ATOM 1058 C PRO A 65 270.460 123.981 398.055 1.00 0.00 C ATOM 1059 O PRO A 65 270.435 125.199 398.244 1.00 0.00 O ATOM 1060 CB PRO A 65 271.004 123.283 400.471 1.00 0.00 C ATOM 1061 CG PRO A 65 271.797 124.498 400.972 1.00 0.00 C ATOM 1062 CD PRO A 65 273.065 124.483 400.111 1.00 0.00 C ATOM 0 HA PRO A 65 271.281 122.113 398.627 1.00 0.00 H new ATOM 0 HB2 PRO A 65 269.932 123.435 400.593 1.00 0.00 H new ATOM 0 HB3 PRO A 65 271.264 122.385 401.031 1.00 0.00 H new ATOM 0 HG2 PRO A 65 271.236 125.424 400.843 1.00 0.00 H new ATOM 0 HG3 PRO A 65 272.032 124.413 402.033 1.00 0.00 H new ATOM 0 HD2 PRO A 65 273.347 125.493 399.814 1.00 0.00 H new ATOM 0 HD3 PRO A 65 273.907 124.066 400.663 1.00 0.00 H new ATOM 1070 N PRO A 66 269.692 123.476 397.064 1.00 0.00 N ATOM 1071 CA PRO A 66 268.820 124.281 396.186 1.00 0.00 C ATOM 1072 C PRO A 66 267.491 124.671 396.875 1.00 0.00 C ATOM 1073 O PRO A 66 266.414 124.311 396.399 1.00 0.00 O ATOM 1074 CB PRO A 66 268.628 123.342 394.976 1.00 0.00 C ATOM 1075 CG PRO A 66 268.667 121.933 395.574 1.00 0.00 C ATOM 1076 CD PRO A 66 269.707 122.064 396.688 1.00 0.00 C ATOM 0 HA PRO A 66 269.241 125.248 395.911 1.00 0.00 H new ATOM 0 HB2 PRO A 66 267.681 123.533 394.472 1.00 0.00 H new ATOM 0 HB3 PRO A 66 269.417 123.481 394.236 1.00 0.00 H new ATOM 0 HG2 PRO A 66 267.694 121.632 395.963 1.00 0.00 H new ATOM 0 HG3 PRO A 66 268.959 121.188 394.834 1.00 0.00 H new ATOM 0 HD2 PRO A 66 269.456 121.428 397.537 1.00 0.00 H new ATOM 0 HD3 PRO A 66 270.695 121.759 396.342 1.00 0.00 H new ATOM 1084 N ALA A 67 267.571 125.409 398.009 1.00 0.00 N ATOM 1085 CA ALA A 67 266.471 125.824 398.851 1.00 0.00 C ATOM 1086 C ALA A 67 267.038 126.910 399.770 1.00 0.00 C ATOM 1087 O ALA A 67 268.263 127.045 399.800 1.00 0.00 O ATOM 1088 CB ALA A 67 265.964 124.600 399.667 1.00 0.00 C ATOM 0 H ALA A 67 268.468 125.740 398.364 1.00 0.00 H new ATOM 0 HA ALA A 67 265.625 126.207 398.281 1.00 0.00 H new ATOM 0 HB1 ALA A 67 265.134 124.906 400.304 1.00 0.00 H new ATOM 0 HB2 ALA A 67 265.628 123.821 398.983 1.00 0.00 H new ATOM 0 HB3 ALA A 67 266.774 124.215 400.286 1.00 0.00 H new ATOM 1094 N PRO A 68 266.272 127.703 400.553 1.00 0.00 N ATOM 1095 CA PRO A 68 266.805 128.770 401.416 1.00 0.00 C ATOM 1096 C PRO A 68 267.423 128.395 402.800 1.00 0.00 C ATOM 1097 O PRO A 68 267.739 129.399 403.445 1.00 0.00 O ATOM 1098 CB PRO A 68 265.571 129.683 401.589 1.00 0.00 C ATOM 1099 CG PRO A 68 264.384 128.720 401.582 1.00 0.00 C ATOM 1100 CD PRO A 68 264.806 127.692 400.532 1.00 0.00 C ATOM 0 HA PRO A 68 267.686 129.201 400.941 1.00 0.00 H new ATOM 0 HB2 PRO A 68 265.621 130.246 402.521 1.00 0.00 H new ATOM 0 HB3 PRO A 68 265.498 130.410 400.780 1.00 0.00 H new ATOM 0 HG2 PRO A 68 264.226 128.263 402.559 1.00 0.00 H new ATOM 0 HG3 PRO A 68 263.455 129.221 401.310 1.00 0.00 H new ATOM 0 HD2 PRO A 68 264.416 126.702 400.770 1.00 0.00 H new ATOM 0 HD3 PRO A 68 264.424 127.956 399.546 1.00 0.00 H new ATOM 1108 N PRO A 69 267.692 127.198 403.414 1.00 0.00 N ATOM 1109 CA PRO A 69 268.248 127.111 404.770 1.00 0.00 C ATOM 1110 C PRO A 69 269.790 127.171 404.792 1.00 0.00 C ATOM 1111 O PRO A 69 270.426 126.333 405.425 1.00 0.00 O ATOM 1112 CB PRO A 69 267.699 125.754 405.255 1.00 0.00 C ATOM 1113 CG PRO A 69 267.721 124.874 404.005 1.00 0.00 C ATOM 1114 CD PRO A 69 267.404 125.867 402.884 1.00 0.00 C ATOM 0 HA PRO A 69 267.965 127.949 405.407 1.00 0.00 H new ATOM 0 HB2 PRO A 69 268.317 125.335 406.049 1.00 0.00 H new ATOM 0 HB3 PRO A 69 266.690 125.852 405.655 1.00 0.00 H new ATOM 0 HG2 PRO A 69 268.692 124.399 403.862 1.00 0.00 H new ATOM 0 HG3 PRO A 69 266.981 124.076 404.059 1.00 0.00 H new ATOM 0 HD2 PRO A 69 268.010 125.662 402.001 1.00 0.00 H new ATOM 0 HD3 PRO A 69 266.360 125.788 402.580 1.00 0.00 H new ATOM 1122 N ALA A 70 270.426 128.179 404.157 1.00 0.00 N ATOM 1123 CA ALA A 70 271.873 128.348 404.201 1.00 0.00 C ATOM 1124 C ALA A 70 272.349 129.793 404.427 1.00 0.00 C ATOM 1125 O ALA A 70 273.304 130.161 403.745 1.00 0.00 O ATOM 1126 CB ALA A 70 272.501 127.767 402.909 1.00 0.00 C ATOM 0 H ALA A 70 269.943 128.889 403.606 1.00 0.00 H new ATOM 0 HA ALA A 70 272.213 127.799 405.079 1.00 0.00 H new ATOM 0 HB1 ALA A 70 273.583 127.893 402.942 1.00 0.00 H new ATOM 0 HB2 ALA A 70 272.262 126.706 402.833 1.00 0.00 H new ATOM 0 HB3 ALA A 70 272.101 128.292 402.042 1.00 0.00 H new ATOM 1132 N PRO A 71 271.824 130.686 405.307 1.00 0.00 N ATOM 1133 CA PRO A 71 272.362 132.037 405.525 1.00 0.00 C ATOM 1134 C PRO A 71 273.502 132.043 406.579 1.00 0.00 C ATOM 1135 O PRO A 71 273.748 131.000 407.192 1.00 0.00 O ATOM 1136 CB PRO A 71 271.108 132.762 406.065 1.00 0.00 C ATOM 1137 CG PRO A 71 270.419 131.722 406.950 1.00 0.00 C ATOM 1138 CD PRO A 71 270.678 130.422 406.188 1.00 0.00 C ATOM 0 HA PRO A 71 272.808 132.487 404.638 1.00 0.00 H new ATOM 0 HB2 PRO A 71 271.378 133.652 406.634 1.00 0.00 H new ATOM 0 HB3 PRO A 71 270.457 133.087 405.254 1.00 0.00 H new ATOM 0 HG2 PRO A 71 270.844 131.697 407.954 1.00 0.00 H new ATOM 0 HG3 PRO A 71 269.353 131.923 407.060 1.00 0.00 H new ATOM 0 HD2 PRO A 71 270.895 129.604 406.875 1.00 0.00 H new ATOM 0 HD3 PRO A 71 269.802 130.128 405.610 1.00 0.00 H new ATOM 1146 N PRO A 72 274.240 133.146 406.828 1.00 0.00 N ATOM 1147 CA PRO A 72 275.216 133.257 407.916 1.00 0.00 C ATOM 1148 C PRO A 72 274.547 133.585 409.278 1.00 0.00 C ATOM 1149 O PRO A 72 273.514 134.250 409.347 1.00 0.00 O ATOM 1150 CB PRO A 72 276.120 134.403 407.421 1.00 0.00 C ATOM 1151 CG PRO A 72 275.176 135.331 406.648 1.00 0.00 C ATOM 1152 CD PRO A 72 274.165 134.372 406.028 1.00 0.00 C ATOM 0 HA PRO A 72 275.754 132.330 408.112 1.00 0.00 H new ATOM 0 HB2 PRO A 72 276.593 134.923 408.254 1.00 0.00 H new ATOM 0 HB3 PRO A 72 276.920 134.029 406.782 1.00 0.00 H new ATOM 0 HG2 PRO A 72 274.693 136.052 407.307 1.00 0.00 H new ATOM 0 HG3 PRO A 72 275.708 135.901 405.886 1.00 0.00 H new ATOM 0 HD2 PRO A 72 273.160 134.794 406.051 1.00 0.00 H new ATOM 0 HD3 PRO A 72 274.404 134.173 404.983 1.00 0.00 H new ATOM 1160 N LEU A 73 275.149 133.128 410.405 1.00 0.00 N ATOM 1161 CA LEU A 73 274.689 133.372 411.769 1.00 0.00 C ATOM 1162 C LEU A 73 275.723 134.264 412.450 1.00 0.00 C ATOM 1163 O LEU A 73 276.902 133.926 412.526 1.00 0.00 O ATOM 1164 CB LEU A 73 274.519 132.062 412.604 1.00 0.00 C ATOM 1165 CG LEU A 73 273.392 131.084 412.159 1.00 0.00 C ATOM 1166 CD1 LEU A 73 272.015 131.762 412.041 1.00 0.00 C ATOM 1167 CD2 LEU A 73 273.708 130.269 410.886 1.00 0.00 C ATOM 0 H LEU A 73 275.996 132.561 410.373 1.00 0.00 H new ATOM 0 HA LEU A 73 273.706 133.840 411.717 1.00 0.00 H new ATOM 0 HB2 LEU A 73 275.465 131.521 412.583 1.00 0.00 H new ATOM 0 HB3 LEU A 73 274.335 132.342 413.641 1.00 0.00 H new ATOM 0 HG LEU A 73 273.347 130.365 412.977 1.00 0.00 H new ATOM 0 HD11 LEU A 73 271.273 131.027 411.727 1.00 0.00 H new ATOM 0 HD12 LEU A 73 271.729 132.176 413.008 1.00 0.00 H new ATOM 0 HD13 LEU A 73 272.066 132.563 411.304 1.00 0.00 H new ATOM 0 HD21 LEU A 73 272.866 129.616 410.654 1.00 0.00 H new ATOM 0 HD22 LEU A 73 273.881 130.949 410.052 1.00 0.00 H new ATOM 0 HD23 LEU A 73 274.600 129.665 411.053 1.00 0.00 H new ATOM 1179 N THR A 74 275.333 135.457 412.952 1.00 0.00 N ATOM 1180 CA THR A 74 276.265 136.366 413.635 1.00 0.00 C ATOM 1181 C THR A 74 275.449 137.365 414.422 1.00 0.00 C ATOM 1182 O THR A 74 275.657 137.567 415.617 1.00 0.00 O ATOM 1183 CB THR A 74 277.272 137.121 412.734 1.00 0.00 C ATOM 1184 OG1 THR A 74 278.075 136.223 411.979 1.00 0.00 O ATOM 1185 CG2 THR A 74 278.274 137.965 413.545 1.00 0.00 C ATOM 0 H THR A 74 274.377 135.808 412.894 1.00 0.00 H new ATOM 0 HA THR A 74 276.890 135.732 414.263 1.00 0.00 H new ATOM 0 HB THR A 74 276.650 137.751 412.098 1.00 0.00 H new ATOM 0 HG1 THR A 74 278.002 135.322 412.357 1.00 0.00 H new ATOM 0 HG21 THR A 74 278.957 138.473 412.864 1.00 0.00 H new ATOM 0 HG22 THR A 74 277.733 138.705 414.135 1.00 0.00 H new ATOM 0 HG23 THR A 74 278.842 137.315 414.211 1.00 0.00 H new ATOM 1193 N LEU A 75 274.484 138.049 413.752 1.00 0.00 N ATOM 1194 CA LEU A 75 273.667 139.103 414.330 1.00 0.00 C ATOM 1195 C LEU A 75 272.375 138.549 414.926 1.00 0.00 C ATOM 1196 O LEU A 75 271.276 138.706 414.394 1.00 0.00 O ATOM 1197 CB LEU A 75 273.391 140.213 413.274 1.00 0.00 C ATOM 1198 CG LEU A 75 274.653 140.715 412.518 1.00 0.00 C ATOM 1199 CD1 LEU A 75 274.298 141.758 411.441 1.00 0.00 C ATOM 1200 CD2 LEU A 75 275.758 141.267 413.444 1.00 0.00 C ATOM 0 H LEU A 75 274.262 137.864 412.774 1.00 0.00 H new ATOM 0 HA LEU A 75 274.221 139.553 415.154 1.00 0.00 H new ATOM 0 HB2 LEU A 75 272.674 139.833 412.546 1.00 0.00 H new ATOM 0 HB3 LEU A 75 272.921 141.061 413.772 1.00 0.00 H new ATOM 0 HG LEU A 75 275.060 139.827 412.035 1.00 0.00 H new ATOM 0 HD11 LEU A 75 275.207 142.083 410.936 1.00 0.00 H new ATOM 0 HD12 LEU A 75 273.618 141.313 410.714 1.00 0.00 H new ATOM 0 HD13 LEU A 75 273.817 142.616 411.910 1.00 0.00 H new ATOM 0 HD21 LEU A 75 276.605 141.597 412.843 1.00 0.00 H new ATOM 0 HD22 LEU A 75 275.367 142.110 414.014 1.00 0.00 H new ATOM 0 HD23 LEU A 75 276.083 140.484 414.130 1.00 0.00 H new ATOM 1212 N SER A 76 272.468 137.892 416.113 1.00 0.00 N ATOM 1213 CA SER A 76 271.393 137.244 416.887 1.00 0.00 C ATOM 1214 C SER A 76 270.510 138.236 417.654 1.00 0.00 C ATOM 1215 O SER A 76 270.290 138.155 418.854 1.00 0.00 O ATOM 1216 CB SER A 76 272.062 136.140 417.771 1.00 0.00 C ATOM 1217 OG SER A 76 271.205 135.318 418.573 1.00 0.00 O ATOM 0 H SER A 76 273.368 137.799 416.583 1.00 0.00 H new ATOM 0 HA SER A 76 270.673 136.772 416.218 1.00 0.00 H new ATOM 0 HB2 SER A 76 272.635 135.486 417.114 1.00 0.00 H new ATOM 0 HB3 SER A 76 272.775 136.629 418.435 1.00 0.00 H new ATOM 0 HG SER A 76 270.270 135.495 418.339 1.00 0.00 H new ATOM 1223 N LYS A 77 269.962 139.192 416.881 1.00 0.00 N ATOM 1224 CA LYS A 77 269.032 140.243 417.257 1.00 0.00 C ATOM 1225 C LYS A 77 268.281 140.562 415.977 1.00 0.00 C ATOM 1226 O LYS A 77 267.058 140.535 415.918 1.00 0.00 O ATOM 1227 CB LYS A 77 269.702 141.538 417.816 1.00 0.00 C ATOM 1228 CG LYS A 77 270.263 141.402 419.244 1.00 0.00 C ATOM 1229 CD LYS A 77 270.858 142.716 419.774 1.00 0.00 C ATOM 1230 CE LYS A 77 271.405 142.583 421.201 1.00 0.00 C ATOM 1231 NZ LYS A 77 271.963 143.871 421.679 1.00 0.00 N1+ ATOM 0 H LYS A 77 270.188 139.242 415.888 1.00 0.00 H new ATOM 0 HA LYS A 77 268.401 139.896 418.075 1.00 0.00 H new ATOM 0 HB2 LYS A 77 270.512 141.830 417.148 1.00 0.00 H new ATOM 0 HB3 LYS A 77 268.970 142.346 417.802 1.00 0.00 H new ATOM 0 HG2 LYS A 77 269.468 141.072 419.913 1.00 0.00 H new ATOM 0 HG3 LYS A 77 271.031 140.629 419.256 1.00 0.00 H new ATOM 0 HD2 LYS A 77 271.659 143.041 419.111 1.00 0.00 H new ATOM 0 HD3 LYS A 77 270.092 143.492 419.753 1.00 0.00 H new ATOM 0 HE2 LYS A 77 270.609 142.257 421.870 1.00 0.00 H new ATOM 0 HE3 LYS A 77 272.178 141.815 421.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 272.326 143.754 422.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 272.738 144.168 421.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 271.217 144.596 421.675 1.00 0.00 H new ATOM 1245 N LEU A 78 269.052 140.860 414.898 1.00 0.00 N ATOM 1246 CA LEU A 78 268.625 141.192 413.540 1.00 0.00 C ATOM 1247 C LEU A 78 268.237 139.951 412.721 1.00 0.00 C ATOM 1248 O LEU A 78 267.227 139.941 412.021 1.00 0.00 O ATOM 1249 CB LEU A 78 269.788 142.001 412.883 1.00 0.00 C ATOM 1250 CG LEU A 78 269.488 142.898 411.654 1.00 0.00 C ATOM 1251 CD1 LEU A 78 270.652 143.891 411.472 1.00 0.00 C ATOM 1252 CD2 LEU A 78 269.281 142.136 410.334 1.00 0.00 C ATOM 0 H LEU A 78 270.069 140.871 414.977 1.00 0.00 H new ATOM 0 HA LEU A 78 267.715 141.791 413.569 1.00 0.00 H new ATOM 0 HB2 LEU A 78 270.222 142.637 413.655 1.00 0.00 H new ATOM 0 HB3 LEU A 78 270.558 141.288 412.588 1.00 0.00 H new ATOM 0 HG LEU A 78 268.542 143.397 411.867 1.00 0.00 H new ATOM 0 HD11 LEU A 78 270.455 144.529 410.611 1.00 0.00 H new ATOM 0 HD12 LEU A 78 270.747 144.508 412.366 1.00 0.00 H new ATOM 0 HD13 LEU A 78 271.579 143.340 411.311 1.00 0.00 H new ATOM 0 HD21 LEU A 78 269.077 142.846 409.532 1.00 0.00 H new ATOM 0 HD22 LEU A 78 270.181 141.569 410.096 1.00 0.00 H new ATOM 0 HD23 LEU A 78 268.438 141.453 410.437 1.00 0.00 H new ATOM 1264 N GLU A 79 269.067 138.878 412.802 1.00 0.00 N ATOM 1265 CA GLU A 79 268.948 137.597 412.116 1.00 0.00 C ATOM 1266 C GLU A 79 268.299 136.491 412.945 1.00 0.00 C ATOM 1267 O GLU A 79 267.542 135.681 412.420 1.00 0.00 O ATOM 1268 CB GLU A 79 270.357 137.089 411.682 1.00 0.00 C ATOM 1269 CG GLU A 79 271.040 138.046 410.685 1.00 0.00 C ATOM 1270 CD GLU A 79 272.347 137.434 410.183 1.00 0.00 C ATOM 1271 OE1 GLU A 79 272.464 137.217 408.948 1.00 0.00 O ATOM 1272 OE2 GLU A 79 273.246 137.176 411.027 1.00 0.00 O1- ATOM 0 H GLU A 79 269.894 138.905 413.398 1.00 0.00 H new ATOM 0 HA GLU A 79 268.298 137.796 411.264 1.00 0.00 H new ATOM 0 HB2 GLU A 79 270.988 136.975 412.564 1.00 0.00 H new ATOM 0 HB3 GLU A 79 270.262 136.102 411.229 1.00 0.00 H new ATOM 0 HG2 GLU A 79 270.375 138.243 409.844 1.00 0.00 H new ATOM 0 HG3 GLU A 79 271.239 139.004 411.166 1.00 0.00 H new ATOM 1279 N HIS A 80 268.625 136.393 414.263 1.00 0.00 N ATOM 1280 CA HIS A 80 268.134 135.302 415.104 1.00 0.00 C ATOM 1281 C HIS A 80 268.066 135.657 416.570 1.00 0.00 C ATOM 1282 O HIS A 80 268.899 135.227 417.369 1.00 0.00 O ATOM 1283 CB HIS A 80 268.863 133.933 414.860 1.00 0.00 C ATOM 1284 CG HIS A 80 270.366 133.877 415.053 1.00 0.00 C ATOM 1285 ND1 HIS A 80 271.275 134.675 414.391 1.00 0.00 N ATOM 1286 CD2 HIS A 80 271.114 132.989 415.766 1.00 0.00 C ATOM 1287 CE1 HIS A 80 272.512 134.236 414.732 1.00 0.00 C ATOM 1288 NE2 HIS A 80 272.465 133.214 415.555 1.00 0.00 N ATOM 0 H HIS A 80 269.223 137.060 414.750 1.00 0.00 H new ATOM 0 HA HIS A 80 267.105 135.153 414.776 1.00 0.00 H new ATOM 0 HB2 HIS A 80 268.414 133.194 415.524 1.00 0.00 H new ATOM 0 HB3 HIS A 80 268.646 133.618 413.839 1.00 0.00 H new ATOM 0 HD2 HIS A 80 270.711 132.218 416.406 1.00 0.00 H new ATOM 0 HE1 HIS A 80 273.429 134.676 414.369 1.00 0.00 H new ATOM 0 HE2 HIS A 80 273.251 132.699 415.952 1.00 0.00 H new TER 1296 HIS A 80