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 127:sc= 1.14 USER MOD Set 1.2: A 49 ASN : amide:sc= -0.31 X(o=0.83,f=0.7) USER MOD Set 2.1: A 0 MET CE :methyl 164:sc= -0.0789 (180deg=-0.407) USER MOD Set 2.2: A 30 TYR OH : rot 4:sc= 1.01 USER MOD Single : A 0 MET N :NH3+ 154:sc= 1.12 (180deg=0.575) USER MOD Single : A 4 TYR OH : rot -139:sc= 0.372 USER MOD Single : A 5 SER OG : rot -112:sc= 0.00448 USER MOD Single : A 9 THR OG1 : rot 160:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0.164 USER MOD Single : A 19 HIS :FLIP no HD1:sc= -2.86 F(o=-4.2!,f=-2.9) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 HIS :FLIP no HD1:sc= -2.79! C(o=-3.7!,f=-2.8!) USER MOD Single : A 29 LYS NZ :NH3+ 169:sc= -1.1 (180deg=-1.51) USER MOD Single : A 33 SER OG : rot 87:sc= 1.37 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 140:sc= 0.0809 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot 8:sc= 0.485 USER MOD Single : A 51 LYS NZ :NH3+ -168:sc=-0.00127 (180deg=-0.137) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot -149:sc= 1.25 USER MOD Single : A 62 LYS NZ :NH3+ 157:sc=-0.00206 (180deg=-0.702) USER MOD Single : A 74 THR OG1 : rot -52:sc= 0.315 USER MOD Single : A 76 SER OG : rot 160:sc= 1.33 USER MOD Single : A 77 LYS NZ :NH3+ 173:sc=-0.000805 (180deg=-0.0415) USER MOD Single : A 80 HIS : no HD1:sc= -0.3 X(o=-0.3,f=-0.018) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 281.322 120.908 405.545 1.00 0.00 N ATOM 2 CA MET A 0 282.032 121.926 404.830 1.00 0.00 C ATOM 3 C MET A 0 283.507 121.766 405.136 1.00 0.00 C ATOM 4 O MET A 0 284.136 122.612 405.770 1.00 0.00 O ATOM 5 CB MET A 0 281.523 123.374 405.112 1.00 0.00 C ATOM 6 CG MET A 0 280.058 123.644 404.672 1.00 0.00 C ATOM 7 SD MET A 0 278.725 122.779 405.571 1.00 0.00 S ATOM 8 CE MET A 0 279.067 123.382 407.253 1.00 0.00 C ATOM 0 H1 MET A 0 280.348 121.226 405.726 1.00 0.00 H new ATOM 0 H2 MET A 0 281.302 120.036 404.979 1.00 0.00 H new ATOM 0 H3 MET A 0 281.799 120.723 406.450 1.00 0.00 H new ATOM 0 HA MET A 0 281.848 121.791 403.764 1.00 0.00 H new ATOM 0 HB2 MET A 0 281.610 123.574 406.180 1.00 0.00 H new ATOM 0 HB3 MET A 0 282.177 124.081 404.601 1.00 0.00 H new ATOM 0 HG2 MET A 0 279.876 124.716 404.754 1.00 0.00 H new ATOM 0 HG3 MET A 0 279.972 123.386 403.617 1.00 0.00 H new ATOM 0 HE1 MET A 0 278.202 123.195 407.889 1.00 0.00 H new ATOM 0 HE2 MET A 0 279.934 122.860 407.657 1.00 0.00 H new ATOM 0 HE3 MET A 0 279.270 124.452 407.221 1.00 0.00 H new ATOM 18 N GLY A 1 284.134 120.664 404.626 1.00 0.00 N ATOM 19 CA GLY A 1 285.577 120.377 404.744 1.00 0.00 C ATOM 20 C GLY A 1 286.449 121.155 403.777 1.00 0.00 C ATOM 21 O GLY A 1 287.671 121.234 403.902 1.00 0.00 O ATOM 0 H GLY A 1 283.629 119.942 404.112 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.897 120.598 405.762 1.00 0.00 H new ATOM 0 HA3 GLY A 1 285.738 119.311 404.583 1.00 0.00 H new ATOM 25 N ILE A 2 285.804 121.785 402.769 1.00 0.00 N ATOM 26 CA ILE A 2 286.422 122.655 401.792 1.00 0.00 C ATOM 27 C ILE A 2 285.704 123.987 401.893 1.00 0.00 C ATOM 28 O ILE A 2 284.471 124.031 401.906 1.00 0.00 O ATOM 29 CB ILE A 2 286.287 122.170 400.357 1.00 0.00 C ATOM 30 CG1 ILE A 2 286.495 120.645 400.224 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.282 123.019 399.538 1.00 0.00 C ATOM 32 CD1 ILE A 2 286.792 120.198 398.790 1.00 0.00 C ATOM 0 H ILE A 2 284.799 121.685 402.625 1.00 0.00 H new ATOM 0 HA ILE A 2 287.489 122.700 402.010 1.00 0.00 H new ATOM 0 HB ILE A 2 285.275 122.308 399.976 1.00 0.00 H new ATOM 0 HG12 ILE A 2 287.318 120.340 400.870 1.00 0.00 H new ATOM 0 HG13 ILE A 2 285.602 120.131 400.580 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.238 122.722 398.490 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.020 124.073 399.627 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.292 122.862 399.917 1.00 0.00 H new ATOM 0 HD11 ILE A 2 286.928 119.117 398.767 1.00 0.00 H new ATOM 0 HD12 ILE A 2 285.959 120.473 398.143 1.00 0.00 H new ATOM 0 HD13 ILE A 2 287.701 120.685 398.438 1.00 0.00 H new ATOM 44 N ASP A 3 286.434 125.134 401.922 1.00 0.00 N ATOM 45 CA ASP A 3 285.810 126.440 402.082 1.00 0.00 C ATOM 46 C ASP A 3 285.208 127.065 400.858 1.00 0.00 C ATOM 47 O ASP A 3 285.698 128.065 400.351 1.00 0.00 O ATOM 48 CB ASP A 3 286.824 127.439 402.702 1.00 0.00 C ATOM 49 CG ASP A 3 286.285 128.684 403.407 1.00 0.00 C ATOM 50 OD1 ASP A 3 285.089 128.740 403.780 1.00 0.00 O ATOM 51 OD2 ASP A 3 287.095 129.622 403.572 1.00 0.00 O1- ATOM 0 H ASP A 3 287.450 125.162 401.836 1.00 0.00 H new ATOM 0 HA ASP A 3 284.963 126.237 402.737 1.00 0.00 H new ATOM 0 HB2 ASP A 3 287.434 126.890 403.420 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.490 127.771 401.906 1.00 0.00 H new ATOM 56 N TYR A 4 284.102 126.486 400.360 1.00 0.00 N ATOM 57 CA TYR A 4 283.044 127.096 399.571 1.00 0.00 C ATOM 58 C TYR A 4 281.997 127.960 400.284 1.00 0.00 C ATOM 59 O TYR A 4 281.822 129.148 400.006 1.00 0.00 O ATOM 60 CB TYR A 4 282.508 126.259 398.412 1.00 0.00 C ATOM 61 CG TYR A 4 283.537 125.337 397.916 1.00 0.00 C ATOM 62 CD1 TYR A 4 283.548 123.997 398.254 1.00 0.00 C ATOM 63 CD2 TYR A 4 284.452 125.839 397.034 1.00 0.00 C ATOM 64 CE1 TYR A 4 284.486 123.165 397.693 1.00 0.00 C ATOM 65 CE2 TYR A 4 285.357 124.989 396.475 1.00 0.00 C ATOM 66 CZ TYR A 4 285.423 123.665 396.829 1.00 0.00 C ATOM 67 OH TYR A 4 286.336 122.796 396.202 1.00 0.00 O ATOM 0 H TYR A 4 283.920 125.495 400.519 1.00 0.00 H new ATOM 0 HA TYR A 4 283.635 127.876 399.091 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.634 125.695 398.738 1.00 0.00 H new ATOM 0 HB3 TYR A 4 282.181 126.914 397.605 1.00 0.00 H new ATOM 0 HD1 TYR A 4 282.824 123.607 398.954 1.00 0.00 H new ATOM 0 HD2 TYR A 4 284.457 126.890 396.785 1.00 0.00 H new ATOM 0 HE1 TYR A 4 284.484 122.112 397.934 1.00 0.00 H new ATOM 0 HE2 TYR A 4 286.043 125.368 395.732 1.00 0.00 H new ATOM 0 HH TYR A 4 287.226 123.207 396.194 1.00 0.00 H new ATOM 77 N SER A 5 281.170 127.282 401.171 1.00 0.00 N ATOM 78 CA SER A 5 279.871 127.755 401.704 1.00 0.00 C ATOM 79 C SER A 5 279.833 129.091 402.436 1.00 0.00 C ATOM 80 O SER A 5 279.026 129.930 402.053 1.00 0.00 O ATOM 81 CB SER A 5 278.988 126.686 402.443 1.00 0.00 C ATOM 82 OG SER A 5 279.124 125.372 401.890 1.00 0.00 O ATOM 0 H SER A 5 281.420 126.362 401.532 1.00 0.00 H new ATOM 0 HA SER A 5 279.399 127.955 400.742 1.00 0.00 H new ATOM 0 HB2 SER A 5 279.263 126.661 403.497 1.00 0.00 H new ATOM 0 HB3 SER A 5 277.942 126.989 402.393 1.00 0.00 H new ATOM 0 HG SER A 5 278.285 125.112 401.455 1.00 0.00 H new ATOM 88 N GLY A 6 280.753 129.424 403.403 1.00 0.00 N ATOM 89 CA GLY A 6 280.962 130.755 403.969 1.00 0.00 C ATOM 90 C GLY A 6 281.242 131.883 402.990 1.00 0.00 C ATOM 91 O GLY A 6 280.821 133.010 403.159 1.00 0.00 O ATOM 0 H GLY A 6 281.380 128.729 403.808 1.00 0.00 H new ATOM 0 HA2 GLY A 6 280.077 131.020 404.548 1.00 0.00 H new ATOM 0 HA3 GLY A 6 281.796 130.699 404.669 1.00 0.00 H new ATOM 95 N LEU A 7 281.940 131.619 401.874 1.00 0.00 N ATOM 96 CA LEU A 7 282.260 132.533 400.795 1.00 0.00 C ATOM 97 C LEU A 7 281.081 132.770 399.883 1.00 0.00 C ATOM 98 O LEU A 7 280.785 133.911 399.534 1.00 0.00 O ATOM 99 CB LEU A 7 283.619 132.226 400.129 1.00 0.00 C ATOM 100 CG LEU A 7 284.661 131.833 401.211 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.504 130.359 401.477 1.00 0.00 C ATOM 102 CD2 LEU A 7 286.158 131.932 400.968 1.00 0.00 C ATOM 0 H LEU A 7 282.318 130.688 401.701 1.00 0.00 H new ATOM 0 HA LEU A 7 282.439 133.520 401.223 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.506 131.415 399.409 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.968 133.098 399.575 1.00 0.00 H new ATOM 0 HG LEU A 7 284.426 132.574 401.974 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.223 130.047 402.235 1.00 0.00 H new ATOM 0 HD12 LEU A 7 283.493 130.159 401.832 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.682 129.802 400.557 1.00 0.00 H new ATOM 0 HD21 LEU A 7 286.694 131.606 401.860 1.00 0.00 H new ATOM 0 HD22 LEU A 7 286.433 131.296 400.127 1.00 0.00 H new ATOM 0 HD23 LEU A 7 286.423 132.965 400.743 1.00 0.00 H new ATOM 114 N ARG A 8 280.309 131.687 399.543 1.00 0.00 N ATOM 115 CA ARG A 8 279.017 131.834 398.854 1.00 0.00 C ATOM 116 C ARG A 8 277.883 132.435 399.652 1.00 0.00 C ATOM 117 O ARG A 8 277.103 133.232 399.133 1.00 0.00 O ATOM 118 CB ARG A 8 278.544 130.600 398.013 1.00 0.00 C ATOM 119 CG ARG A 8 279.378 129.308 398.160 1.00 0.00 C ATOM 120 CD ARG A 8 278.935 128.204 397.177 1.00 0.00 C ATOM 121 NE ARG A 8 279.733 126.899 397.289 1.00 0.00 N ATOM 122 CZ ARG A 8 279.189 125.852 397.985 1.00 0.00 C ATOM 123 NH1 ARG A 8 278.215 126.053 398.913 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.650 124.598 397.717 1.00 0.00 N ATOM 0 H ARG A 8 280.571 130.721 399.740 1.00 0.00 H new ATOM 0 HA ARG A 8 279.291 132.604 398.132 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.513 130.374 398.287 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.539 130.885 396.961 1.00 0.00 H new ATOM 0 HG2 ARG A 8 280.430 129.538 397.993 1.00 0.00 H new ATOM 0 HG3 ARG A 8 279.291 128.937 399.181 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.880 127.986 397.345 1.00 0.00 H new ATOM 0 HD3 ARG A 8 279.024 128.584 396.159 1.00 0.00 H new ATOM 0 HE ARG A 8 280.651 126.812 396.854 1.00 0.00 H new ATOM 0 HH11 ARG A 8 277.877 126.997 399.101 1.00 0.00 H new ATOM 0 HH12 ARG A 8 277.823 125.260 399.421 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.378 124.461 397.016 1.00 0.00 H new ATOM 0 HH22 ARG A 8 279.267 123.796 398.217 1.00 0.00 H new ATOM 138 N THR A 9 277.780 132.077 400.950 1.00 0.00 N ATOM 139 CA THR A 9 276.769 132.613 401.856 1.00 0.00 C ATOM 140 C THR A 9 277.093 133.971 402.474 1.00 0.00 C ATOM 141 O THR A 9 276.168 134.738 402.725 1.00 0.00 O ATOM 142 CB THR A 9 276.201 131.542 402.774 1.00 0.00 C ATOM 143 OG1 THR A 9 274.892 131.882 403.212 1.00 0.00 O ATOM 144 CG2 THR A 9 277.014 131.235 404.044 1.00 0.00 C ATOM 0 H THR A 9 278.405 131.403 401.391 1.00 0.00 H new ATOM 0 HA THR A 9 275.920 132.904 401.237 1.00 0.00 H new ATOM 0 HB THR A 9 276.224 130.654 402.142 1.00 0.00 H new ATOM 0 HG1 THR A 9 274.430 131.074 403.520 1.00 0.00 H new ATOM 0 HG21 THR A 9 276.511 130.457 404.618 1.00 0.00 H new ATOM 0 HG22 THR A 9 278.011 130.893 403.764 1.00 0.00 H new ATOM 0 HG23 THR A 9 277.097 132.137 404.650 1.00 0.00 H new ATOM 152 N ILE A 10 278.392 134.322 402.697 1.00 0.00 N ATOM 153 CA ILE A 10 278.813 135.630 403.191 1.00 0.00 C ATOM 154 C ILE A 10 279.285 136.577 402.042 1.00 0.00 C ATOM 155 O ILE A 10 279.094 137.784 402.190 1.00 0.00 O ATOM 156 CB ILE A 10 279.854 135.559 404.354 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.404 134.813 405.662 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.220 136.980 404.857 1.00 0.00 C ATOM 159 CD1 ILE A 10 279.651 133.311 405.868 1.00 0.00 C ATOM 0 H ILE A 10 279.171 133.685 402.531 1.00 0.00 H new ATOM 0 HA ILE A 10 277.916 136.072 403.626 1.00 0.00 H new ATOM 0 HB ILE A 10 280.668 135.006 403.886 1.00 0.00 H new ATOM 0 HG12 ILE A 10 279.880 135.327 406.497 1.00 0.00 H new ATOM 0 HG13 ILE A 10 278.330 134.971 405.761 1.00 0.00 H new ATOM 0 HG21 ILE A 10 280.946 136.904 405.666 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.649 137.557 404.038 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.322 137.480 405.221 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.259 133.008 406.839 1.00 0.00 H new ATOM 0 HD12 ILE A 10 279.148 132.748 405.082 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.722 133.110 405.830 1.00 0.00 H new ATOM 171 N PHE A 11 279.925 136.155 400.891 1.00 0.00 N ATOM 172 CA PHE A 11 280.504 137.161 399.955 1.00 0.00 C ATOM 173 C PHE A 11 279.791 137.182 398.606 1.00 0.00 C ATOM 174 O PHE A 11 279.617 138.240 397.998 1.00 0.00 O ATOM 175 CB PHE A 11 282.075 137.135 399.889 1.00 0.00 C ATOM 176 CG PHE A 11 282.638 137.246 401.292 1.00 0.00 C ATOM 177 CD1 PHE A 11 282.528 138.417 402.026 1.00 0.00 C ATOM 178 CD2 PHE A 11 283.215 136.145 401.901 1.00 0.00 C ATOM 179 CE1 PHE A 11 282.974 138.468 403.331 1.00 0.00 C ATOM 180 CE2 PHE A 11 283.637 136.175 403.217 1.00 0.00 C ATOM 181 CZ PHE A 11 283.524 137.350 403.930 1.00 0.00 C ATOM 0 H PHE A 11 280.042 135.181 400.612 1.00 0.00 H new ATOM 0 HA PHE A 11 280.297 138.140 400.386 1.00 0.00 H new ATOM 0 HB2 PHE A 11 282.415 136.212 399.420 1.00 0.00 H new ATOM 0 HB3 PHE A 11 282.438 137.958 399.273 1.00 0.00 H new ATOM 0 HD1 PHE A 11 282.091 139.295 401.574 1.00 0.00 H new ATOM 0 HD2 PHE A 11 283.339 135.236 401.331 1.00 0.00 H new ATOM 0 HE1 PHE A 11 282.893 139.389 403.889 1.00 0.00 H new ATOM 0 HE2 PHE A 11 284.049 135.291 403.680 1.00 0.00 H new ATOM 0 HZ PHE A 11 283.864 137.397 404.954 1.00 0.00 H new ATOM 191 N GLY A 12 279.246 136.012 398.186 1.00 0.00 N ATOM 192 CA GLY A 12 278.216 135.921 397.143 1.00 0.00 C ATOM 193 C GLY A 12 278.561 135.204 395.863 1.00 0.00 C ATOM 194 O GLY A 12 278.553 133.976 395.796 1.00 0.00 O ATOM 0 H GLY A 12 279.516 135.106 398.569 1.00 0.00 H new ATOM 0 HA2 GLY A 12 277.346 135.428 397.576 1.00 0.00 H new ATOM 0 HA3 GLY A 12 277.913 136.936 396.885 1.00 0.00 H new ATOM 198 N GLU A 13 278.816 135.953 394.759 1.00 0.00 N ATOM 199 CA GLU A 13 278.971 135.441 393.395 1.00 0.00 C ATOM 200 C GLU A 13 280.296 134.798 392.980 1.00 0.00 C ATOM 201 O GLU A 13 280.324 133.991 392.056 1.00 0.00 O ATOM 202 CB GLU A 13 278.577 136.552 392.379 1.00 0.00 C ATOM 203 CG GLU A 13 279.464 137.815 392.412 1.00 0.00 C ATOM 204 CD GLU A 13 278.925 138.845 391.419 1.00 0.00 C ATOM 205 OE1 GLU A 13 278.512 139.948 391.872 1.00 0.00 O ATOM 206 OE2 GLU A 13 278.923 138.545 390.196 1.00 0.00 O1- ATOM 0 H GLU A 13 278.921 136.966 394.809 1.00 0.00 H new ATOM 0 HA GLU A 13 278.296 134.585 393.386 1.00 0.00 H new ATOM 0 HB2 GLU A 13 278.608 136.131 391.374 1.00 0.00 H new ATOM 0 HB3 GLU A 13 277.545 136.847 392.569 1.00 0.00 H new ATOM 0 HG2 GLU A 13 279.478 138.236 393.417 1.00 0.00 H new ATOM 0 HG3 GLU A 13 280.493 137.556 392.161 1.00 0.00 H new ATOM 213 N LYS A 14 281.429 135.136 393.631 1.00 0.00 N ATOM 214 CA LYS A 14 282.729 134.582 393.295 1.00 0.00 C ATOM 215 C LYS A 14 283.445 134.516 394.611 1.00 0.00 C ATOM 216 O LYS A 14 282.988 135.101 395.592 1.00 0.00 O ATOM 217 CB LYS A 14 283.525 135.481 392.299 1.00 0.00 C ATOM 218 CG LYS A 14 284.603 134.748 391.478 1.00 0.00 C ATOM 219 CD LYS A 14 285.645 135.714 390.891 1.00 0.00 C ATOM 220 CE LYS A 14 286.380 135.152 389.667 1.00 0.00 C ATOM 221 NZ LYS A 14 287.152 133.935 390.006 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.453 135.802 394.403 1.00 0.00 H new ATOM 0 HA LYS A 14 282.631 133.617 392.798 1.00 0.00 H new ATOM 0 HB2 LYS A 14 282.820 135.947 391.611 1.00 0.00 H new ATOM 0 HB3 LYS A 14 284.001 136.285 392.860 1.00 0.00 H new ATOM 0 HG2 LYS A 14 285.105 134.017 392.112 1.00 0.00 H new ATOM 0 HG3 LYS A 14 284.127 134.195 390.669 1.00 0.00 H new ATOM 0 HD2 LYS A 14 285.150 136.644 390.612 1.00 0.00 H new ATOM 0 HD3 LYS A 14 286.375 135.960 391.662 1.00 0.00 H new ATOM 0 HE2 LYS A 14 285.659 134.919 388.884 1.00 0.00 H new ATOM 0 HE3 LYS A 14 287.053 135.910 389.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 287.636 133.583 389.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 287.857 134.163 390.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 286.506 133.203 390.365 1.00 0.00 H new ATOM 235 N LEU A 15 284.613 133.838 394.691 1.00 0.00 N ATOM 236 CA LEU A 15 285.402 133.742 395.910 1.00 0.00 C ATOM 237 C LEU A 15 286.241 135.010 396.165 1.00 0.00 C ATOM 238 O LEU A 15 286.814 135.564 395.224 1.00 0.00 O ATOM 239 CB LEU A 15 286.359 132.539 395.814 1.00 0.00 C ATOM 240 CG LEU A 15 285.636 131.192 395.756 1.00 0.00 C ATOM 241 CD1 LEU A 15 286.527 130.193 395.040 1.00 0.00 C ATOM 242 CD2 LEU A 15 285.271 130.671 397.152 1.00 0.00 C ATOM 0 H LEU A 15 285.025 133.344 393.899 1.00 0.00 H new ATOM 0 HA LEU A 15 284.701 133.621 396.736 1.00 0.00 H new ATOM 0 HB2 LEU A 15 286.980 132.648 394.925 1.00 0.00 H new ATOM 0 HB3 LEU A 15 287.029 132.547 396.674 1.00 0.00 H new ATOM 0 HG LEU A 15 284.700 131.326 395.213 1.00 0.00 H new ATOM 0 HD11 LEU A 15 286.024 129.227 394.991 1.00 0.00 H new ATOM 0 HD12 LEU A 15 286.732 130.547 394.030 1.00 0.00 H new ATOM 0 HD13 LEU A 15 287.465 130.087 395.585 1.00 0.00 H new ATOM 0 HD21 LEU A 15 284.760 129.713 397.061 1.00 0.00 H new ATOM 0 HD22 LEU A 15 286.179 130.543 397.741 1.00 0.00 H new ATOM 0 HD23 LEU A 15 284.615 131.387 397.647 1.00 0.00 H new ATOM 254 N PRO A 16 286.360 135.480 397.408 1.00 0.00 N ATOM 255 CA PRO A 16 287.085 136.681 397.755 1.00 0.00 C ATOM 256 C PRO A 16 288.574 136.415 397.955 1.00 0.00 C ATOM 257 O PRO A 16 289.054 135.294 397.821 1.00 0.00 O ATOM 258 CB PRO A 16 286.424 137.039 399.079 1.00 0.00 C ATOM 259 CG PRO A 16 286.246 135.682 399.769 1.00 0.00 C ATOM 260 CD PRO A 16 285.760 134.864 398.588 1.00 0.00 C ATOM 0 HA PRO A 16 287.045 137.456 396.990 1.00 0.00 H new ATOM 0 HB2 PRO A 16 287.047 137.711 399.670 1.00 0.00 H new ATOM 0 HB3 PRO A 16 285.468 137.541 398.928 1.00 0.00 H new ATOM 0 HG2 PRO A 16 287.177 135.300 400.189 1.00 0.00 H new ATOM 0 HG3 PRO A 16 285.520 135.717 400.582 1.00 0.00 H new ATOM 0 HD2 PRO A 16 286.063 133.821 398.682 1.00 0.00 H new ATOM 0 HD3 PRO A 16 284.672 134.875 398.525 1.00 0.00 H new ATOM 268 N GLU A 17 289.304 137.488 398.306 1.00 0.00 N ATOM 269 CA GLU A 17 290.734 137.544 398.496 1.00 0.00 C ATOM 270 C GLU A 17 291.246 137.111 399.875 1.00 0.00 C ATOM 271 O GLU A 17 290.550 137.219 400.878 1.00 0.00 O ATOM 272 CB GLU A 17 291.105 139.020 398.239 1.00 0.00 C ATOM 273 CG GLU A 17 292.548 139.175 397.729 1.00 0.00 C ATOM 274 CD GLU A 17 292.857 140.588 397.232 1.00 0.00 C ATOM 275 OE1 GLU A 17 291.906 141.383 397.010 1.00 0.00 O ATOM 276 OE2 GLU A 17 294.071 140.883 397.055 1.00 0.00 O1- ATOM 0 H GLU A 17 288.864 138.393 398.472 1.00 0.00 H new ATOM 0 HA GLU A 17 291.202 136.829 397.819 1.00 0.00 H new ATOM 0 HB2 GLU A 17 290.416 139.445 397.509 1.00 0.00 H new ATOM 0 HB3 GLU A 17 290.984 139.589 399.161 1.00 0.00 H new ATOM 0 HG2 GLU A 17 293.240 138.918 398.531 1.00 0.00 H new ATOM 0 HG3 GLU A 17 292.720 138.465 396.920 1.00 0.00 H new ATOM 283 N SER A 18 292.518 136.666 399.964 1.00 0.00 N ATOM 284 CA SER A 18 293.304 136.199 401.103 1.00 0.00 C ATOM 285 C SER A 18 293.461 137.066 402.335 1.00 0.00 C ATOM 286 O SER A 18 293.683 136.519 403.416 1.00 0.00 O ATOM 287 CB SER A 18 294.665 135.633 400.645 1.00 0.00 C ATOM 288 OG SER A 18 294.924 136.092 399.313 1.00 0.00 O ATOM 0 H SER A 18 293.084 136.625 399.117 1.00 0.00 H new ATOM 0 HA SER A 18 292.644 135.423 401.491 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.457 135.960 401.319 1.00 0.00 H new ATOM 0 HB3 SER A 18 294.651 134.543 400.674 1.00 0.00 H new ATOM 0 HG SER A 18 295.787 135.742 399.008 1.00 0.00 H new ATOM 294 N HIS A 19 293.296 138.425 402.220 1.00 0.00 N ATOM 295 CA HIS A 19 293.254 139.382 403.340 1.00 0.00 C ATOM 296 C HIS A 19 292.004 139.153 404.190 1.00 0.00 C ATOM 297 O HIS A 19 292.080 139.066 405.409 1.00 0.00 O ATOM 298 CB HIS A 19 293.374 140.871 402.902 1.00 0.00 C ATOM 299 CG HIS A 19 292.309 141.346 401.945 1.00 0.00 C ATOM 300 ND1 HIS A 19 291.047 141.786 402.202 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 292.419 141.317 400.572 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 290.362 142.016 401.025 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 291.220 141.726 400.078 1.00 0.00 N flip ATOM 0 H HIS A 19 293.187 138.880 401.314 1.00 0.00 H new ATOM 0 HA HIS A 19 294.140 139.186 403.944 1.00 0.00 H new ATOM 0 HB2 HIS A 19 293.346 141.499 403.793 1.00 0.00 H new ATOM 0 HB3 HIS A 19 294.349 141.019 402.438 1.00 0.00 H new ATOM 0 HD2 HIS A 19 293.288 141.026 400.000 1.00 0.00 H new ATOM 0 HE1 HIS A 19 289.344 142.359 400.910 1.00 0.00 H new ATOM 0 HE2 HIS A 19 291.012 141.799 399.082 1.00 0.00 H new ATOM 311 N ILE A 20 290.827 138.939 403.529 1.00 0.00 N ATOM 312 CA ILE A 20 289.624 138.389 404.164 1.00 0.00 C ATOM 313 C ILE A 20 289.676 136.879 404.357 1.00 0.00 C ATOM 314 O ILE A 20 289.368 136.371 405.434 1.00 0.00 O ATOM 315 CB ILE A 20 288.260 138.781 403.551 1.00 0.00 C ATOM 316 CG1 ILE A 20 287.743 137.913 402.396 1.00 0.00 C ATOM 317 CG2 ILE A 20 288.296 140.180 402.923 1.00 0.00 C ATOM 318 CD1 ILE A 20 286.305 138.279 402.064 1.00 0.00 C ATOM 0 H ILE A 20 290.702 139.149 402.539 1.00 0.00 H new ATOM 0 HA ILE A 20 289.663 138.889 405.132 1.00 0.00 H new ATOM 0 HB ILE A 20 287.613 138.675 404.422 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.373 138.052 401.517 1.00 0.00 H new ATOM 0 HG13 ILE A 20 287.804 136.859 402.668 1.00 0.00 H new ATOM 0 HG21 ILE A 20 287.318 140.416 402.504 1.00 0.00 H new ATOM 0 HG22 ILE A 20 288.551 140.915 403.686 1.00 0.00 H new ATOM 0 HG23 ILE A 20 289.045 140.204 402.132 1.00 0.00 H new ATOM 0 HD11 ILE A 20 285.951 137.655 401.243 1.00 0.00 H new ATOM 0 HD12 ILE A 20 285.677 138.117 402.940 1.00 0.00 H new ATOM 0 HD13 ILE A 20 286.255 139.328 401.771 1.00 0.00 H new ATOM 330 N PHE A 21 290.036 136.091 403.289 1.00 0.00 N ATOM 331 CA PHE A 21 289.920 134.631 403.265 1.00 0.00 C ATOM 332 C PHE A 21 290.866 133.936 404.282 1.00 0.00 C ATOM 333 O PHE A 21 290.381 133.156 405.101 1.00 0.00 O ATOM 334 CB PHE A 21 289.747 134.113 401.774 1.00 0.00 C ATOM 335 CG PHE A 21 289.498 132.655 401.436 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.313 132.279 400.101 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.366 131.660 402.384 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.051 130.951 399.786 1.00 0.00 C ATOM 339 CE2 PHE A 21 289.310 130.339 402.033 1.00 0.00 C ATOM 340 CZ PHE A 21 289.128 129.968 400.743 1.00 0.00 C ATOM 0 H PHE A 21 290.415 136.477 402.425 1.00 0.00 H new ATOM 0 HA PHE A 21 288.986 134.271 403.697 1.00 0.00 H new ATOM 0 HB2 PHE A 21 288.920 134.677 401.343 1.00 0.00 H new ATOM 0 HB3 PHE A 21 290.648 134.407 401.236 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.374 133.019 399.317 1.00 0.00 H new ATOM 0 HD2 PHE A 21 289.306 131.931 403.428 1.00 0.00 H new ATOM 0 HE1 PHE A 21 288.783 130.688 398.774 1.00 0.00 H new ATOM 0 HE2 PHE A 21 289.412 129.581 402.795 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.045 128.925 400.473 1.00 0.00 H new ATOM 350 N PHE A 22 292.201 134.243 404.348 1.00 0.00 N ATOM 351 CA PHE A 22 293.118 133.741 405.391 1.00 0.00 C ATOM 352 C PHE A 22 292.928 134.467 406.772 1.00 0.00 C ATOM 353 O PHE A 22 293.497 133.999 407.756 1.00 0.00 O ATOM 354 CB PHE A 22 294.677 133.710 405.044 1.00 0.00 C ATOM 355 CG PHE A 22 295.204 132.632 404.071 1.00 0.00 C ATOM 356 CD1 PHE A 22 295.680 133.047 402.837 1.00 0.00 C ATOM 357 CD2 PHE A 22 295.430 131.278 404.367 1.00 0.00 C ATOM 358 CE1 PHE A 22 296.154 132.166 401.882 1.00 0.00 C ATOM 359 CE2 PHE A 22 295.856 130.386 403.408 1.00 0.00 C ATOM 360 CZ PHE A 22 296.152 130.812 402.142 1.00 0.00 C ATOM 0 H PHE A 22 292.660 134.850 403.669 1.00 0.00 H new ATOM 0 HA PHE A 22 292.806 132.698 405.451 1.00 0.00 H new ATOM 0 HB2 PHE A 22 294.942 134.684 404.632 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.221 133.602 405.982 1.00 0.00 H new ATOM 0 HD1 PHE A 22 295.681 134.103 402.612 1.00 0.00 H new ATOM 0 HD2 PHE A 22 295.265 130.926 405.375 1.00 0.00 H new ATOM 0 HE1 PHE A 22 296.524 132.537 400.937 1.00 0.00 H new ATOM 0 HE2 PHE A 22 295.957 129.340 403.658 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.380 130.101 401.361 1.00 0.00 H new ATOM 370 N ALA A 23 292.197 135.636 406.926 1.00 0.00 N ATOM 371 CA ALA A 23 292.009 136.278 408.246 1.00 0.00 C ATOM 372 C ALA A 23 290.600 136.355 408.878 1.00 0.00 C ATOM 373 O ALA A 23 290.488 136.516 410.090 1.00 0.00 O ATOM 374 CB ALA A 23 292.631 137.694 408.235 1.00 0.00 C ATOM 0 H ALA A 23 291.745 136.127 406.154 1.00 0.00 H new ATOM 0 HA ALA A 23 292.518 135.570 408.899 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.489 138.161 409.210 1.00 0.00 H new ATOM 0 HB2 ALA A 23 293.697 137.622 408.019 1.00 0.00 H new ATOM 0 HB3 ALA A 23 292.146 138.299 407.469 1.00 0.00 H new ATOM 380 N THR A 24 289.484 136.258 408.102 1.00 0.00 N ATOM 381 CA THR A 24 288.095 136.463 408.564 1.00 0.00 C ATOM 382 C THR A 24 287.379 135.129 408.699 1.00 0.00 C ATOM 383 O THR A 24 287.284 134.365 407.740 1.00 0.00 O ATOM 384 CB THR A 24 287.293 137.359 407.595 1.00 0.00 C ATOM 385 OG1 THR A 24 287.925 138.623 407.431 1.00 0.00 O ATOM 386 CG2 THR A 24 285.866 137.680 408.074 1.00 0.00 C ATOM 0 H THR A 24 289.536 136.028 407.110 1.00 0.00 H new ATOM 0 HA THR A 24 288.153 136.959 409.533 1.00 0.00 H new ATOM 0 HB THR A 24 287.252 136.780 406.672 1.00 0.00 H new ATOM 0 HG1 THR A 24 287.401 139.173 406.812 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.369 138.313 407.339 1.00 0.00 H new ATOM 0 HG22 THR A 24 285.305 136.753 408.193 1.00 0.00 H new ATOM 0 HG23 THR A 24 285.912 138.202 409.030 1.00 0.00 H new ATOM 394 N VAL A 25 286.793 134.793 409.895 1.00 0.00 N ATOM 395 CA VAL A 25 286.090 133.532 410.255 1.00 0.00 C ATOM 396 C VAL A 25 284.908 133.168 409.394 1.00 0.00 C ATOM 397 O VAL A 25 284.603 131.992 409.273 1.00 0.00 O ATOM 398 CB VAL A 25 285.702 133.384 411.737 1.00 0.00 C ATOM 399 CG1 VAL A 25 285.356 131.916 412.109 1.00 0.00 C ATOM 400 CG2 VAL A 25 286.868 133.867 412.621 1.00 0.00 C ATOM 0 H VAL A 25 286.805 135.446 410.679 1.00 0.00 H new ATOM 0 HA VAL A 25 286.883 132.815 410.045 1.00 0.00 H new ATOM 0 HB VAL A 25 284.812 133.990 411.907 1.00 0.00 H new ATOM 0 HG11 VAL A 25 285.089 131.861 413.164 1.00 0.00 H new ATOM 0 HG12 VAL A 25 284.516 131.576 411.504 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.220 131.279 411.920 1.00 0.00 H new ATOM 0 HG21 VAL A 25 286.596 133.763 413.671 1.00 0.00 H new ATOM 0 HG22 VAL A 25 287.754 133.266 412.415 1.00 0.00 H new ATOM 0 HG23 VAL A 25 287.080 134.914 412.403 1.00 0.00 H new ATOM 410 N ALA A 26 284.320 134.155 408.641 1.00 0.00 N ATOM 411 CA ALA A 26 283.322 134.040 407.574 1.00 0.00 C ATOM 412 C ALA A 26 283.732 132.988 406.540 1.00 0.00 C ATOM 413 O ALA A 26 282.935 132.173 406.097 1.00 0.00 O ATOM 414 CB ALA A 26 283.177 135.399 406.848 1.00 0.00 C ATOM 0 H ALA A 26 284.570 135.131 408.797 1.00 0.00 H new ATOM 0 HA ALA A 26 282.379 133.743 408.033 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.434 135.311 406.055 1.00 0.00 H new ATOM 0 HB2 ALA A 26 282.858 136.160 407.560 1.00 0.00 H new ATOM 0 HB3 ALA A 26 284.136 135.685 406.416 1.00 0.00 H new ATOM 420 N ALA A 27 285.049 132.939 406.250 1.00 0.00 N ATOM 421 CA ALA A 27 285.665 131.886 405.488 1.00 0.00 C ATOM 422 C ALA A 27 286.552 130.987 406.375 1.00 0.00 C ATOM 423 O ALA A 27 286.532 129.767 406.250 1.00 0.00 O ATOM 424 CB ALA A 27 286.498 132.639 404.429 1.00 0.00 C ATOM 0 H ALA A 27 285.708 133.655 406.555 1.00 0.00 H new ATOM 0 HA ALA A 27 284.936 131.209 405.043 1.00 0.00 H new ATOM 0 HB1 ALA A 27 287.012 131.920 403.791 1.00 0.00 H new ATOM 0 HB2 ALA A 27 285.839 133.258 403.820 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.232 133.272 404.927 1.00 0.00 H new ATOM 430 N HIS A 28 287.333 131.534 407.360 1.00 0.00 N ATOM 431 CA HIS A 28 288.317 130.812 408.211 1.00 0.00 C ATOM 432 C HIS A 28 287.870 129.596 409.031 1.00 0.00 C ATOM 433 O HIS A 28 288.682 128.769 409.431 1.00 0.00 O ATOM 434 CB HIS A 28 289.041 131.759 409.196 1.00 0.00 C ATOM 435 CG HIS A 28 290.525 131.576 409.207 1.00 0.00 C ATOM 436 ND1 HIS A 28 291.300 130.463 409.107 1.00 0.00 N flip ATOM 437 CD2 HIS A 28 291.391 132.619 409.405 1.00 0.00 C flip ATOM 438 CE1 HIS A 28 292.632 130.792 409.259 1.00 0.00 C flip ATOM 439 NE2 HIS A 28 292.640 132.094 409.437 1.00 0.00 N flip ATOM 0 H HIS A 28 287.287 132.528 407.585 1.00 0.00 H new ATOM 0 HA HIS A 28 288.954 130.412 407.422 1.00 0.00 H new ATOM 0 HB2 HIS A 28 288.811 132.791 408.933 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.654 131.592 410.201 1.00 0.00 H new ATOM 0 HD2 HIS A 28 291.128 133.661 409.515 1.00 0.00 H new ATOM 0 HE1 HIS A 28 293.481 130.125 409.237 1.00 0.00 H new ATOM 0 HE2 HIS A 28 293.486 132.644 409.582 1.00 0.00 H new ATOM 447 N LYS A 29 286.540 129.460 409.263 1.00 0.00 N ATOM 448 CA LYS A 29 285.843 128.376 409.945 1.00 0.00 C ATOM 449 C LYS A 29 285.872 127.042 409.197 1.00 0.00 C ATOM 450 O LYS A 29 285.496 126.003 409.722 1.00 0.00 O ATOM 451 CB LYS A 29 284.348 128.815 410.160 1.00 0.00 C ATOM 452 CG LYS A 29 283.417 128.849 408.912 1.00 0.00 C ATOM 453 CD LYS A 29 282.433 130.019 408.746 1.00 0.00 C ATOM 454 CE LYS A 29 281.780 130.540 410.032 1.00 0.00 C ATOM 455 NZ LYS A 29 281.166 131.864 409.787 1.00 0.00 N1+ ATOM 0 H LYS A 29 285.885 130.175 408.945 1.00 0.00 H new ATOM 0 HA LYS A 29 286.364 128.203 410.887 1.00 0.00 H new ATOM 0 HB2 LYS A 29 283.903 128.142 410.892 1.00 0.00 H new ATOM 0 HB3 LYS A 29 284.351 129.811 410.603 1.00 0.00 H new ATOM 0 HG2 LYS A 29 284.053 128.826 408.027 1.00 0.00 H new ATOM 0 HG3 LYS A 29 282.835 127.927 408.911 1.00 0.00 H new ATOM 0 HD2 LYS A 29 282.960 130.846 408.270 1.00 0.00 H new ATOM 0 HD3 LYS A 29 281.643 129.708 408.062 1.00 0.00 H new ATOM 0 HE2 LYS A 29 281.022 129.836 410.376 1.00 0.00 H new ATOM 0 HE3 LYS A 29 282.526 130.617 410.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 280.571 132.126 410.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 281.914 132.576 409.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 280.581 131.822 408.928 1.00 0.00 H new ATOM 469 N TYR A 30 286.258 127.107 407.900 1.00 0.00 N ATOM 470 CA TYR A 30 286.159 126.063 406.897 1.00 0.00 C ATOM 471 C TYR A 30 287.498 125.564 406.344 1.00 0.00 C ATOM 472 O TYR A 30 287.821 124.386 406.455 1.00 0.00 O ATOM 473 CB TYR A 30 285.263 126.724 405.818 1.00 0.00 C ATOM 474 CG TYR A 30 283.786 126.447 405.932 1.00 0.00 C ATOM 475 CD1 TYR A 30 283.109 126.134 407.104 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.024 126.733 404.829 1.00 0.00 C ATOM 477 CE1 TYR A 30 281.737 126.297 407.201 1.00 0.00 C ATOM 478 CE2 TYR A 30 281.667 126.824 404.908 1.00 0.00 C ATOM 479 CZ TYR A 30 281.003 126.675 406.103 1.00 0.00 C ATOM 480 OH TYR A 30 279.605 126.880 406.150 1.00 0.00 O ATOM 0 H TYR A 30 286.673 127.957 407.518 1.00 0.00 H new ATOM 0 HA TYR A 30 285.749 125.140 407.308 1.00 0.00 H new ATOM 0 HB2 TYR A 30 285.415 127.803 405.857 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.601 126.390 404.837 1.00 0.00 H new ATOM 0 HD1 TYR A 30 283.661 125.758 407.953 1.00 0.00 H new ATOM 0 HD2 TYR A 30 283.510 126.890 403.877 1.00 0.00 H new ATOM 0 HE1 TYR A 30 281.241 126.126 408.145 1.00 0.00 H new ATOM 0 HE2 TYR A 30 281.099 127.018 404.010 1.00 0.00 H new ATOM 0 HH TYR A 30 279.290 126.776 407.072 1.00 0.00 H new ATOM 490 N VAL A 31 288.301 126.453 405.702 1.00 0.00 N ATOM 491 CA VAL A 31 289.622 126.242 405.091 1.00 0.00 C ATOM 492 C VAL A 31 290.144 127.638 405.065 1.00 0.00 C ATOM 493 O VAL A 31 289.332 128.530 404.843 1.00 0.00 O ATOM 494 CB VAL A 31 289.675 125.765 403.611 1.00 0.00 C ATOM 495 CG1 VAL A 31 291.020 126.020 402.867 1.00 0.00 C ATOM 496 CG2 VAL A 31 289.252 124.295 403.578 1.00 0.00 C ATOM 0 H VAL A 31 288.004 127.423 405.594 1.00 0.00 H new ATOM 0 HA VAL A 31 290.140 125.462 405.649 1.00 0.00 H new ATOM 0 HB VAL A 31 288.980 126.382 403.042 1.00 0.00 H new ATOM 0 HG11 VAL A 31 290.946 125.649 401.845 1.00 0.00 H new ATOM 0 HG12 VAL A 31 291.230 127.090 402.851 1.00 0.00 H new ATOM 0 HG13 VAL A 31 291.826 125.500 403.384 1.00 0.00 H new ATOM 0 HG21 VAL A 31 289.279 123.931 402.551 1.00 0.00 H new ATOM 0 HG22 VAL A 31 289.935 123.706 404.190 1.00 0.00 H new ATOM 0 HG23 VAL A 31 288.239 124.199 403.970 1.00 0.00 H new ATOM 506 N PRO A 32 291.395 127.976 405.297 1.00 0.00 N ATOM 507 CA PRO A 32 291.788 129.365 405.203 1.00 0.00 C ATOM 508 C PRO A 32 292.158 129.912 403.816 1.00 0.00 C ATOM 509 O PRO A 32 291.802 131.056 403.616 1.00 0.00 O ATOM 510 CB PRO A 32 292.960 129.349 406.184 1.00 0.00 C ATOM 511 CG PRO A 32 293.614 127.971 406.082 1.00 0.00 C ATOM 512 CD PRO A 32 292.394 127.089 405.902 1.00 0.00 C ATOM 0 HA PRO A 32 290.968 130.049 405.421 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.676 130.134 405.941 1.00 0.00 H new ATOM 0 HB3 PRO A 32 292.614 129.537 407.200 1.00 0.00 H new ATOM 0 HG2 PRO A 32 294.302 127.902 405.239 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.180 127.715 406.978 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.611 126.236 405.259 1.00 0.00 H new ATOM 0 HD3 PRO A 32 292.047 126.690 406.855 1.00 0.00 H new ATOM 520 N SER A 33 292.834 129.205 402.879 1.00 0.00 N ATOM 521 CA SER A 33 293.134 129.650 401.505 1.00 0.00 C ATOM 522 C SER A 33 293.921 128.603 400.733 1.00 0.00 C ATOM 523 O SER A 33 294.124 127.491 401.235 1.00 0.00 O ATOM 524 CB SER A 33 293.121 131.148 400.981 1.00 0.00 C ATOM 525 OG SER A 33 292.278 131.319 399.834 1.00 0.00 O ATOM 0 H SER A 33 293.198 128.272 403.072 1.00 0.00 H new ATOM 0 HA SER A 33 292.102 129.807 401.190 1.00 0.00 H new ATOM 0 HB2 SER A 33 292.780 131.807 401.780 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.137 131.451 400.730 1.00 0.00 H new ATOM 0 HG SER A 33 291.360 131.497 400.127 1.00 0.00 H new ATOM 531 N TYR A 34 294.360 128.907 399.461 1.00 0.00 N ATOM 532 CA TYR A 34 295.094 128.150 398.390 1.00 0.00 C ATOM 533 C TYR A 34 296.280 127.293 398.829 1.00 0.00 C ATOM 534 O TYR A 34 296.725 126.394 398.126 1.00 0.00 O ATOM 535 CB TYR A 34 295.579 129.040 397.195 1.00 0.00 C ATOM 536 CG TYR A 34 294.817 130.324 397.067 1.00 0.00 C ATOM 537 CD1 TYR A 34 295.179 131.393 397.863 1.00 0.00 C ATOM 538 CD2 TYR A 34 293.803 130.476 396.138 1.00 0.00 C ATOM 539 CE1 TYR A 34 294.483 132.575 397.772 1.00 0.00 C ATOM 540 CE2 TYR A 34 293.165 131.692 395.964 1.00 0.00 C ATOM 541 CZ TYR A 34 293.482 132.715 396.843 1.00 0.00 C ATOM 542 OH TYR A 34 292.888 133.971 396.682 1.00 0.00 O ATOM 0 H TYR A 34 294.171 129.847 399.114 1.00 0.00 H new ATOM 0 HA TYR A 34 294.301 127.472 398.075 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.638 129.265 397.324 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.484 128.475 396.268 1.00 0.00 H new ATOM 0 HD1 TYR A 34 296.004 131.301 398.553 1.00 0.00 H new ATOM 0 HD2 TYR A 34 293.504 129.630 395.537 1.00 0.00 H new ATOM 0 HE1 TYR A 34 294.724 133.395 398.432 1.00 0.00 H new ATOM 0 HE2 TYR A 34 292.446 131.838 395.172 1.00 0.00 H new ATOM 0 HH TYR A 34 292.914 134.226 395.736 1.00 0.00 H new ATOM 552 N ALA A 35 296.809 127.554 400.040 1.00 0.00 N ATOM 553 CA ALA A 35 297.817 126.806 400.760 1.00 0.00 C ATOM 554 C ALA A 35 297.328 125.455 401.267 1.00 0.00 C ATOM 555 O ALA A 35 297.925 124.423 400.993 1.00 0.00 O ATOM 556 CB ALA A 35 298.234 127.680 401.975 1.00 0.00 C ATOM 0 H ALA A 35 296.504 128.369 400.573 1.00 0.00 H new ATOM 0 HA ALA A 35 298.642 126.594 400.080 1.00 0.00 H new ATOM 0 HB1 ALA A 35 298.996 127.158 402.554 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.634 128.630 401.620 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.364 127.866 402.605 1.00 0.00 H new ATOM 562 N PHE A 36 296.145 125.450 401.944 1.00 0.00 N ATOM 563 CA PHE A 36 295.349 124.300 402.352 1.00 0.00 C ATOM 564 C PHE A 36 294.653 123.767 401.094 1.00 0.00 C ATOM 565 O PHE A 36 294.679 122.575 400.782 1.00 0.00 O ATOM 566 CB PHE A 36 294.337 124.729 403.479 1.00 0.00 C ATOM 567 CG PHE A 36 293.356 123.607 403.927 1.00 0.00 C ATOM 568 CD1 PHE A 36 293.447 123.034 405.186 1.00 0.00 C ATOM 569 CD2 PHE A 36 292.340 123.111 403.102 1.00 0.00 C ATOM 570 CE1 PHE A 36 292.572 122.033 405.585 1.00 0.00 C ATOM 571 CE2 PHE A 36 291.496 122.083 403.467 1.00 0.00 C ATOM 572 CZ PHE A 36 291.594 121.557 404.731 1.00 0.00 C ATOM 0 H PHE A 36 295.707 126.325 402.231 1.00 0.00 H new ATOM 0 HA PHE A 36 295.961 123.506 402.780 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.902 125.068 404.347 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.757 125.581 403.124 1.00 0.00 H new ATOM 0 HD1 PHE A 36 294.212 123.372 405.869 1.00 0.00 H new ATOM 0 HD2 PHE A 36 292.210 123.557 402.127 1.00 0.00 H new ATOM 0 HE1 PHE A 36 292.656 121.619 406.579 1.00 0.00 H new ATOM 0 HE2 PHE A 36 290.768 121.697 402.768 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.916 120.781 405.055 1.00 0.00 H new ATOM 582 N LEU A 37 293.996 124.693 400.327 1.00 0.00 N ATOM 583 CA LEU A 37 293.310 124.365 399.064 1.00 0.00 C ATOM 584 C LEU A 37 294.132 123.794 397.900 1.00 0.00 C ATOM 585 O LEU A 37 293.568 123.012 397.146 1.00 0.00 O ATOM 586 CB LEU A 37 291.994 125.107 398.690 1.00 0.00 C ATOM 587 CG LEU A 37 292.108 126.607 398.524 1.00 0.00 C ATOM 588 CD1 LEU A 37 292.144 127.019 397.048 1.00 0.00 C ATOM 589 CD2 LEU A 37 291.101 127.450 399.299 1.00 0.00 C ATOM 0 H LEU A 37 293.936 125.680 400.578 1.00 0.00 H new ATOM 0 HA LEU A 37 292.875 123.448 399.461 1.00 0.00 H new ATOM 0 HB2 LEU A 37 291.613 124.685 397.760 1.00 0.00 H new ATOM 0 HB3 LEU A 37 291.251 124.901 399.461 1.00 0.00 H new ATOM 0 HG LEU A 37 293.067 126.835 398.989 1.00 0.00 H new ATOM 0 HD11 LEU A 37 292.226 128.103 396.975 1.00 0.00 H new ATOM 0 HD12 LEU A 37 293.003 126.556 396.562 1.00 0.00 H new ATOM 0 HD13 LEU A 37 291.228 126.691 396.556 1.00 0.00 H new ATOM 0 HD21 LEU A 37 291.282 128.506 399.101 1.00 0.00 H new ATOM 0 HD22 LEU A 37 290.090 127.190 398.985 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.210 127.257 400.366 1.00 0.00 H new ATOM 601 N ARG A 38 295.471 124.061 397.701 1.00 0.00 N ATOM 602 CA ARG A 38 296.236 123.307 396.680 1.00 0.00 C ATOM 603 C ARG A 38 296.396 121.811 397.003 1.00 0.00 C ATOM 604 O ARG A 38 296.324 120.975 396.112 1.00 0.00 O ATOM 605 CB ARG A 38 297.606 123.934 396.323 1.00 0.00 C ATOM 606 CG ARG A 38 298.296 123.233 395.129 1.00 0.00 C ATOM 607 CD ARG A 38 299.290 124.113 394.365 1.00 0.00 C ATOM 608 NE ARG A 38 300.403 124.554 395.280 1.00 0.00 N ATOM 609 CZ ARG A 38 301.566 123.850 395.462 1.00 0.00 C ATOM 610 NH1 ARG A 38 301.791 122.675 394.806 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 302.508 124.329 396.327 1.00 0.00 N ATOM 0 H ARG A 38 296.007 124.761 398.215 1.00 0.00 H new ATOM 0 HA ARG A 38 295.608 123.385 395.792 1.00 0.00 H new ATOM 0 HB2 ARG A 38 297.467 124.989 396.087 1.00 0.00 H new ATOM 0 HB3 ARG A 38 298.260 123.886 397.194 1.00 0.00 H new ATOM 0 HG2 ARG A 38 298.819 122.350 395.495 1.00 0.00 H new ATOM 0 HG3 ARG A 38 297.530 122.885 394.436 1.00 0.00 H new ATOM 0 HD2 ARG A 38 299.701 123.561 393.520 1.00 0.00 H new ATOM 0 HD3 ARG A 38 298.777 124.984 393.957 1.00 0.00 H new ATOM 0 HE ARG A 38 300.285 125.427 395.794 1.00 0.00 H new ATOM 0 HH11 ARG A 38 301.088 122.305 394.167 1.00 0.00 H new ATOM 0 HH12 ARG A 38 302.663 122.166 394.955 1.00 0.00 H new ATOM 0 HH21 ARG A 38 302.343 125.201 396.829 1.00 0.00 H new ATOM 0 HH22 ARG A 38 303.377 123.814 396.471 1.00 0.00 H new ATOM 625 N ARG A 39 296.496 121.442 398.313 1.00 0.00 N ATOM 626 CA ARG A 39 296.390 120.071 398.819 1.00 0.00 C ATOM 627 C ARG A 39 294.961 119.518 398.691 1.00 0.00 C ATOM 628 O ARG A 39 294.752 118.427 398.161 1.00 0.00 O ATOM 629 CB ARG A 39 296.918 119.916 400.276 1.00 0.00 C ATOM 630 CG ARG A 39 298.447 120.067 400.390 1.00 0.00 C ATOM 631 CD ARG A 39 298.938 121.519 400.517 1.00 0.00 C ATOM 632 NE ARG A 39 300.436 121.576 400.366 1.00 0.00 N ATOM 633 CZ ARG A 39 301.069 121.656 399.151 1.00 0.00 C ATOM 634 NH1 ARG A 39 300.358 121.653 397.986 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 302.432 121.739 399.108 1.00 0.00 N ATOM 0 H ARG A 39 296.657 122.123 399.055 1.00 0.00 H new ATOM 0 HA ARG A 39 297.041 119.472 398.182 1.00 0.00 H new ATOM 0 HB2 ARG A 39 296.438 120.661 400.910 1.00 0.00 H new ATOM 0 HB3 ARG A 39 296.627 118.938 400.658 1.00 0.00 H new ATOM 0 HG2 ARG A 39 298.791 119.504 401.257 1.00 0.00 H new ATOM 0 HG3 ARG A 39 298.910 119.616 399.512 1.00 0.00 H new ATOM 0 HD2 ARG A 39 298.464 122.139 399.756 1.00 0.00 H new ATOM 0 HD3 ARG A 39 298.647 121.926 401.485 1.00 0.00 H new ATOM 0 HE ARG A 39 301.009 121.554 401.210 1.00 0.00 H new ATOM 0 HH11 ARG A 39 299.340 121.591 398.010 1.00 0.00 H new ATOM 0 HH12 ARG A 39 300.844 121.713 397.091 1.00 0.00 H new ATOM 0 HH21 ARG A 39 302.970 121.741 399.974 1.00 0.00 H new ATOM 0 HH22 ARG A 39 302.911 121.799 398.210 1.00 0.00 H new ATOM 649 N GLU A 40 293.932 120.301 399.134 1.00 0.00 N ATOM 650 CA GLU A 40 292.510 119.949 399.072 1.00 0.00 C ATOM 651 C GLU A 40 291.848 119.854 397.677 1.00 0.00 C ATOM 652 O GLU A 40 290.879 119.116 397.517 1.00 0.00 O ATOM 653 CB GLU A 40 291.680 120.879 400.002 1.00 0.00 C ATOM 654 CG GLU A 40 290.294 120.341 400.435 1.00 0.00 C ATOM 655 CD GLU A 40 290.375 119.175 401.429 1.00 0.00 C ATOM 656 OE1 GLU A 40 289.292 118.608 401.736 1.00 0.00 O ATOM 657 OE2 GLU A 40 291.494 118.842 401.904 1.00 0.00 O1- ATOM 0 H GLU A 40 294.091 121.217 399.553 1.00 0.00 H new ATOM 0 HA GLU A 40 292.499 118.916 399.420 1.00 0.00 H new ATOM 0 HB2 GLU A 40 292.266 121.081 400.899 1.00 0.00 H new ATOM 0 HB3 GLU A 40 291.536 121.833 399.494 1.00 0.00 H new ATOM 0 HG2 GLU A 40 289.722 121.153 400.885 1.00 0.00 H new ATOM 0 HG3 GLU A 40 289.746 120.017 399.550 1.00 0.00 H new ATOM 664 N LEU A 41 292.323 120.573 396.614 1.00 0.00 N ATOM 665 CA LEU A 41 291.702 120.489 395.285 1.00 0.00 C ATOM 666 C LEU A 41 292.169 119.303 394.447 1.00 0.00 C ATOM 667 O LEU A 41 291.668 119.053 393.358 1.00 0.00 O ATOM 668 CB LEU A 41 292.031 121.776 394.469 1.00 0.00 C ATOM 669 CG LEU A 41 290.790 122.541 393.961 1.00 0.00 C ATOM 670 CD1 LEU A 41 291.284 123.822 393.292 1.00 0.00 C ATOM 671 CD2 LEU A 41 289.863 121.771 393.009 1.00 0.00 C ATOM 0 H LEU A 41 293.123 121.204 396.666 1.00 0.00 H new ATOM 0 HA LEU A 41 290.636 120.370 395.476 1.00 0.00 H new ATOM 0 HB2 LEU A 41 292.626 122.445 395.091 1.00 0.00 H new ATOM 0 HB3 LEU A 41 292.649 121.502 393.614 1.00 0.00 H new ATOM 0 HG LEU A 41 290.164 122.730 394.833 1.00 0.00 H new ATOM 0 HD11 LEU A 41 290.432 124.390 392.920 1.00 0.00 H new ATOM 0 HD12 LEU A 41 291.832 124.423 394.017 1.00 0.00 H new ATOM 0 HD13 LEU A 41 291.942 123.568 392.461 1.00 0.00 H new ATOM 0 HD21 LEU A 41 289.028 122.409 392.720 1.00 0.00 H new ATOM 0 HD22 LEU A 41 290.419 121.476 392.119 1.00 0.00 H new ATOM 0 HD23 LEU A 41 289.483 120.881 393.511 1.00 0.00 H new ATOM 683 N GLY A 42 293.210 118.571 394.914 1.00 0.00 N ATOM 684 CA GLY A 42 293.881 117.453 394.244 1.00 0.00 C ATOM 685 C GLY A 42 294.770 117.785 393.054 1.00 0.00 C ATOM 686 O GLY A 42 295.557 116.949 392.624 1.00 0.00 O ATOM 0 H GLY A 42 293.622 118.766 395.827 1.00 0.00 H new ATOM 0 HA2 GLY A 42 294.488 116.932 394.984 1.00 0.00 H new ATOM 0 HA3 GLY A 42 293.116 116.752 393.909 1.00 0.00 H new ATOM 690 N LEU A 43 294.680 119.025 392.497 1.00 0.00 N ATOM 691 CA LEU A 43 295.441 119.513 391.356 1.00 0.00 C ATOM 692 C LEU A 43 296.243 120.759 391.690 1.00 0.00 C ATOM 693 O LEU A 43 295.895 121.522 392.596 1.00 0.00 O ATOM 694 CB LEU A 43 294.548 119.653 390.072 1.00 0.00 C ATOM 695 CG LEU A 43 293.686 120.923 389.761 1.00 0.00 C ATOM 696 CD1 LEU A 43 292.928 121.551 390.945 1.00 0.00 C ATOM 697 CD2 LEU A 43 294.442 121.988 388.943 1.00 0.00 C ATOM 0 H LEU A 43 294.039 119.729 392.863 1.00 0.00 H new ATOM 0 HA LEU A 43 296.185 118.755 391.110 1.00 0.00 H new ATOM 0 HB2 LEU A 43 295.211 119.514 389.218 1.00 0.00 H new ATOM 0 HB3 LEU A 43 293.860 118.808 390.082 1.00 0.00 H new ATOM 0 HG LEU A 43 292.897 120.509 389.133 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.370 122.421 390.599 1.00 0.00 H new ATOM 0 HD12 LEU A 43 292.237 120.820 391.364 1.00 0.00 H new ATOM 0 HD13 LEU A 43 293.640 121.857 391.711 1.00 0.00 H new ATOM 0 HD21 LEU A 43 293.787 122.841 388.763 1.00 0.00 H new ATOM 0 HD22 LEU A 43 295.321 122.316 389.497 1.00 0.00 H new ATOM 0 HD23 LEU A 43 294.753 121.561 387.989 1.00 0.00 H new ATOM 709 N SER A 44 297.332 121.031 390.901 1.00 0.00 N ATOM 710 CA SER A 44 298.271 122.170 390.951 1.00 0.00 C ATOM 711 C SER A 44 297.642 123.521 390.585 1.00 0.00 C ATOM 712 O SER A 44 298.015 124.181 389.622 1.00 0.00 O ATOM 713 CB SER A 44 299.471 121.957 389.974 1.00 0.00 C ATOM 714 OG SER A 44 300.060 120.669 390.142 1.00 0.00 O ATOM 0 H SER A 44 297.585 120.390 390.149 1.00 0.00 H new ATOM 0 HA SER A 44 298.593 122.201 391.992 1.00 0.00 H new ATOM 0 HB2 SER A 44 299.128 122.070 388.945 1.00 0.00 H new ATOM 0 HB3 SER A 44 300.223 122.727 390.146 1.00 0.00 H new ATOM 0 HG SER A 44 300.806 120.566 389.515 1.00 0.00 H new ATOM 720 N SER A 45 296.615 123.906 391.367 1.00 0.00 N ATOM 721 CA SER A 45 295.697 125.016 391.218 1.00 0.00 C ATOM 722 C SER A 45 296.238 126.412 391.492 1.00 0.00 C ATOM 723 O SER A 45 295.774 127.354 390.858 1.00 0.00 O ATOM 724 CB SER A 45 294.386 124.739 392.021 1.00 0.00 C ATOM 725 OG SER A 45 294.629 124.023 393.243 1.00 0.00 O ATOM 0 H SER A 45 296.397 123.375 392.211 1.00 0.00 H new ATOM 0 HA SER A 45 295.495 125.052 390.147 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.897 125.686 392.250 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.697 124.167 391.399 1.00 0.00 H new ATOM 0 HG SER A 45 294.060 124.386 393.954 1.00 0.00 H new ATOM 731 N ALA A 46 297.244 126.602 392.393 1.00 0.00 N ATOM 732 CA ALA A 46 297.800 127.869 392.906 1.00 0.00 C ATOM 733 C ALA A 46 298.596 128.758 391.932 1.00 0.00 C ATOM 734 O ALA A 46 299.195 129.762 392.308 1.00 0.00 O ATOM 735 CB ALA A 46 298.610 127.648 394.202 1.00 0.00 C ATOM 0 H ALA A 46 297.720 125.801 392.808 1.00 0.00 H new ATOM 0 HA ALA A 46 296.896 128.447 393.097 1.00 0.00 H new ATOM 0 HB1 ALA A 46 299.005 128.602 394.552 1.00 0.00 H new ATOM 0 HB2 ALA A 46 297.962 127.221 394.968 1.00 0.00 H new ATOM 0 HB3 ALA A 46 299.436 126.965 394.003 1.00 0.00 H new ATOM 741 N HIS A 47 298.625 128.365 390.633 1.00 0.00 N ATOM 742 CA HIS A 47 299.251 129.027 389.491 1.00 0.00 C ATOM 743 C HIS A 47 298.713 130.435 389.158 1.00 0.00 C ATOM 744 O HIS A 47 299.449 131.377 388.873 1.00 0.00 O ATOM 745 CB HIS A 47 299.066 128.099 388.260 1.00 0.00 C ATOM 746 CG HIS A 47 300.049 128.351 387.156 1.00 0.00 C ATOM 747 ND1 HIS A 47 301.328 127.843 387.157 1.00 0.00 N ATOM 748 CD2 HIS A 47 299.952 129.121 386.038 1.00 0.00 C ATOM 749 CE1 HIS A 47 301.939 128.323 386.046 1.00 0.00 C ATOM 750 NE2 HIS A 47 301.143 129.102 385.339 1.00 0.00 N ATOM 0 H HIS A 47 298.167 127.499 390.348 1.00 0.00 H new ATOM 0 HA HIS A 47 300.296 129.189 389.756 1.00 0.00 H new ATOM 0 HB2 HIS A 47 299.155 127.062 388.583 1.00 0.00 H new ATOM 0 HB3 HIS A 47 298.056 128.226 387.870 1.00 0.00 H new ATOM 0 HD2 HIS A 47 299.070 129.668 385.740 1.00 0.00 H new ATOM 0 HE1 HIS A 47 302.958 128.094 385.772 1.00 0.00 H new ATOM 0 HE2 HIS A 47 301.360 129.585 384.467 1.00 0.00 H new ATOM 758 N THR A 48 297.370 130.605 389.161 1.00 0.00 N ATOM 759 CA THR A 48 296.699 131.883 388.949 1.00 0.00 C ATOM 760 C THR A 48 295.414 131.835 389.765 1.00 0.00 C ATOM 761 O THR A 48 294.712 130.810 389.785 1.00 0.00 O ATOM 762 CB THR A 48 296.473 132.221 387.466 1.00 0.00 C ATOM 763 OG1 THR A 48 297.725 132.398 386.802 1.00 0.00 O ATOM 764 CG2 THR A 48 295.673 133.529 387.266 1.00 0.00 C ATOM 0 H THR A 48 296.721 129.834 389.315 1.00 0.00 H new ATOM 0 HA THR A 48 297.332 132.703 389.287 1.00 0.00 H new ATOM 0 HB THR A 48 295.909 131.385 387.053 1.00 0.00 H new ATOM 0 HG1 THR A 48 298.454 132.137 387.403 1.00 0.00 H new ATOM 0 HG21 THR A 48 295.544 133.717 386.200 1.00 0.00 H new ATOM 0 HG22 THR A 48 294.695 133.433 387.739 1.00 0.00 H new ATOM 0 HG23 THR A 48 296.215 134.360 387.718 1.00 0.00 H new ATOM 772 N ASN A 49 295.032 132.981 390.448 1.00 0.00 N ATOM 773 CA ASN A 49 293.835 133.165 391.303 1.00 0.00 C ATOM 774 C ASN A 49 292.542 132.803 390.597 1.00 0.00 C ATOM 775 O ASN A 49 291.757 132.020 391.108 1.00 0.00 O ATOM 776 CB ASN A 49 293.705 134.597 391.935 1.00 0.00 C ATOM 777 CG ASN A 49 292.933 134.573 393.271 1.00 0.00 C ATOM 778 OD1 ASN A 49 293.483 134.057 394.238 1.00 0.00 O ATOM 779 ND2 ASN A 49 291.683 135.097 393.364 1.00 0.00 N ATOM 0 H ASN A 49 295.594 133.831 390.400 1.00 0.00 H new ATOM 0 HA ASN A 49 293.998 132.463 392.121 1.00 0.00 H new ATOM 0 HB2 ASN A 49 294.699 135.012 392.099 1.00 0.00 H new ATOM 0 HB3 ASN A 49 293.195 135.258 391.234 1.00 0.00 H new ATOM 0 HD21 ASN A 49 291.182 135.066 394.252 1.00 0.00 H new ATOM 0 HD22 ASN A 49 291.246 135.521 392.546 1.00 0.00 H new ATOM 786 N ARG A 50 292.380 133.291 389.340 1.00 0.00 N ATOM 787 CA ARG A 50 291.286 132.990 388.426 1.00 0.00 C ATOM 788 C ARG A 50 291.211 131.531 387.962 1.00 0.00 C ATOM 789 O ARG A 50 290.113 131.032 387.781 1.00 0.00 O ATOM 790 CB ARG A 50 291.209 134.007 387.254 1.00 0.00 C ATOM 791 CG ARG A 50 291.219 135.485 387.713 1.00 0.00 C ATOM 792 CD ARG A 50 290.127 135.831 388.743 1.00 0.00 C ATOM 793 NE ARG A 50 290.310 137.256 389.196 1.00 0.00 N ATOM 794 CZ ARG A 50 289.903 137.719 390.421 1.00 0.00 C ATOM 795 NH1 ARG A 50 289.293 136.894 391.320 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 290.118 139.027 390.747 1.00 0.00 N ATOM 0 H ARG A 50 293.054 133.938 388.931 1.00 0.00 H new ATOM 0 HA ARG A 50 290.382 133.116 389.022 1.00 0.00 H new ATOM 0 HB2 ARG A 50 292.051 133.838 386.582 1.00 0.00 H new ATOM 0 HB3 ARG A 50 290.301 133.820 386.681 1.00 0.00 H new ATOM 0 HG2 ARG A 50 292.194 135.714 388.142 1.00 0.00 H new ATOM 0 HG3 ARG A 50 291.096 136.126 386.840 1.00 0.00 H new ATOM 0 HD2 ARG A 50 289.139 135.701 388.302 1.00 0.00 H new ATOM 0 HD3 ARG A 50 290.187 135.155 389.596 1.00 0.00 H new ATOM 0 HE ARG A 50 290.761 137.911 388.558 1.00 0.00 H new ATOM 0 HH11 ARG A 50 289.133 135.914 391.086 1.00 0.00 H new ATOM 0 HH12 ARG A 50 288.997 137.257 392.226 1.00 0.00 H new ATOM 0 HH21 ARG A 50 290.577 139.649 390.082 1.00 0.00 H new ATOM 0 HH22 ARG A 50 289.819 139.382 391.655 1.00 0.00 H new ATOM 810 N LYS A 51 292.353 130.801 387.785 1.00 0.00 N ATOM 811 CA LYS A 51 292.423 129.364 387.459 1.00 0.00 C ATOM 812 C LYS A 51 292.048 128.441 388.630 1.00 0.00 C ATOM 813 O LYS A 51 291.171 127.568 388.511 1.00 0.00 O ATOM 814 CB LYS A 51 293.796 128.993 386.838 1.00 0.00 C ATOM 815 CG LYS A 51 293.918 127.579 386.221 1.00 0.00 C ATOM 816 CD LYS A 51 292.929 127.296 385.078 1.00 0.00 C ATOM 817 CE LYS A 51 293.199 125.979 384.331 1.00 0.00 C ATOM 818 NZ LYS A 51 294.491 126.020 383.608 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.277 131.224 387.871 1.00 0.00 H new ATOM 0 HA LYS A 51 291.655 129.190 386.705 1.00 0.00 H new ATOM 0 HB2 LYS A 51 294.028 129.724 386.063 1.00 0.00 H new ATOM 0 HB3 LYS A 51 294.558 129.094 387.611 1.00 0.00 H new ATOM 0 HG2 LYS A 51 294.933 127.445 385.848 1.00 0.00 H new ATOM 0 HG3 LYS A 51 293.767 126.839 387.007 1.00 0.00 H new ATOM 0 HD2 LYS A 51 291.918 127.271 385.484 1.00 0.00 H new ATOM 0 HD3 LYS A 51 292.967 128.120 384.366 1.00 0.00 H new ATOM 0 HE2 LYS A 51 293.204 125.152 385.040 1.00 0.00 H new ATOM 0 HE3 LYS A 51 292.391 125.788 383.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 294.551 125.211 382.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 294.558 126.905 383.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 295.273 125.973 384.292 1.00 0.00 H new ATOM 832 N VAL A 52 292.611 128.713 389.864 1.00 0.00 N ATOM 833 CA VAL A 52 292.191 128.009 391.100 1.00 0.00 C ATOM 834 C VAL A 52 290.792 128.347 391.481 1.00 0.00 C ATOM 835 O VAL A 52 290.008 127.430 391.708 1.00 0.00 O ATOM 836 CB VAL A 52 293.041 128.143 392.380 1.00 0.00 C ATOM 837 CG1 VAL A 52 293.372 129.598 392.774 1.00 0.00 C ATOM 838 CG2 VAL A 52 292.474 127.269 393.551 1.00 0.00 C ATOM 0 H VAL A 52 293.344 129.407 390.009 1.00 0.00 H new ATOM 0 HA VAL A 52 292.329 126.979 390.770 1.00 0.00 H new ATOM 0 HB VAL A 52 294.019 127.726 392.139 1.00 0.00 H new ATOM 0 HG11 VAL A 52 293.972 129.601 393.684 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.931 130.075 391.969 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.447 130.147 392.947 1.00 0.00 H new ATOM 0 HG21 VAL A 52 293.102 127.392 394.434 1.00 0.00 H new ATOM 0 HG22 VAL A 52 291.457 127.586 393.782 1.00 0.00 H new ATOM 0 HG23 VAL A 52 292.469 126.221 393.253 1.00 0.00 H new ATOM 848 N TRP A 53 290.420 129.662 391.454 1.00 0.00 N ATOM 849 CA TRP A 53 289.067 130.139 391.687 1.00 0.00 C ATOM 850 C TRP A 53 288.043 129.609 390.733 1.00 0.00 C ATOM 851 O TRP A 53 286.970 129.299 391.184 1.00 0.00 O ATOM 852 CB TRP A 53 288.926 131.651 391.856 1.00 0.00 C ATOM 853 CG TRP A 53 289.353 132.309 393.119 1.00 0.00 C ATOM 854 CD1 TRP A 53 289.012 133.598 393.397 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.748 131.703 394.365 1.00 0.00 C ATOM 856 NE1 TRP A 53 289.165 133.843 394.727 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.678 132.709 395.319 1.00 0.00 C ATOM 858 CE3 TRP A 53 290.095 130.416 394.711 1.00 0.00 C ATOM 859 CZ2 TRP A 53 290.017 132.458 396.605 1.00 0.00 C ATOM 860 CZ3 TRP A 53 290.392 130.156 396.023 1.00 0.00 C ATOM 861 CH2 TRP A 53 290.400 131.179 396.935 1.00 0.00 C ATOM 0 H TRP A 53 291.082 130.415 391.264 1.00 0.00 H new ATOM 0 HA TRP A 53 288.848 129.703 392.662 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.483 132.119 391.044 1.00 0.00 H new ATOM 0 HB3 TRP A 53 287.875 131.896 391.704 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.671 134.319 392.669 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.939 134.716 395.204 1.00 0.00 H new ATOM 0 HE3 TRP A 53 290.132 129.633 393.968 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.988 133.239 397.350 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 290.619 129.148 396.338 1.00 0.00 H new ATOM 0 HH2 TRP A 53 290.718 130.974 397.947 1.00 0.00 H new ATOM 872 N LYS A 54 288.383 129.369 389.451 1.00 0.00 N ATOM 873 CA LYS A 54 287.586 128.624 388.469 1.00 0.00 C ATOM 874 C LYS A 54 287.451 127.145 388.794 1.00 0.00 C ATOM 875 O LYS A 54 286.337 126.646 388.741 1.00 0.00 O ATOM 876 CB LYS A 54 288.355 128.708 387.132 1.00 0.00 C ATOM 877 CG LYS A 54 288.305 127.574 386.093 1.00 0.00 C ATOM 878 CD LYS A 54 288.994 128.007 384.795 1.00 0.00 C ATOM 879 CE LYS A 54 289.150 126.857 383.795 1.00 0.00 C ATOM 880 NZ LYS A 54 289.844 127.312 382.568 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.262 129.707 389.059 1.00 0.00 H new ATOM 0 HA LYS A 54 286.585 129.056 388.451 1.00 0.00 H new ATOM 0 HB2 LYS A 54 288.013 129.612 386.628 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.405 128.860 387.382 1.00 0.00 H new ATOM 0 HG2 LYS A 54 288.793 126.685 386.492 1.00 0.00 H new ATOM 0 HG3 LYS A 54 287.269 127.304 385.889 1.00 0.00 H new ATOM 0 HD2 LYS A 54 288.418 128.809 384.333 1.00 0.00 H new ATOM 0 HD3 LYS A 54 289.977 128.415 385.029 1.00 0.00 H new ATOM 0 HE2 LYS A 54 289.712 126.044 384.255 1.00 0.00 H new ATOM 0 HE3 LYS A 54 288.169 126.460 383.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 289.938 126.515 381.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 289.294 128.072 382.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 290.789 127.669 382.816 1.00 0.00 H new ATOM 894 N LYS A 55 288.535 126.387 389.188 1.00 0.00 N ATOM 895 CA LYS A 55 288.397 124.974 389.641 1.00 0.00 C ATOM 896 C LYS A 55 287.524 124.854 390.922 1.00 0.00 C ATOM 897 O LYS A 55 286.568 124.074 391.060 1.00 0.00 O ATOM 898 CB LYS A 55 289.789 124.324 389.893 1.00 0.00 C ATOM 899 CG LYS A 55 290.706 124.270 388.656 1.00 0.00 C ATOM 900 CD LYS A 55 290.335 123.146 387.681 1.00 0.00 C ATOM 901 CE LYS A 55 291.225 123.140 386.431 1.00 0.00 C ATOM 902 NZ LYS A 55 290.855 122.036 385.518 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.494 126.735 389.197 1.00 0.00 H new ATOM 0 HA LYS A 55 287.895 124.438 388.836 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.297 124.879 390.681 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.640 123.310 390.263 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.659 125.226 388.134 1.00 0.00 H new ATOM 0 HG3 LYS A 55 291.738 124.135 388.981 1.00 0.00 H new ATOM 0 HD2 LYS A 55 290.420 122.185 388.189 1.00 0.00 H new ATOM 0 HD3 LYS A 55 289.293 123.257 387.381 1.00 0.00 H new ATOM 0 HE2 LYS A 55 291.132 124.093 385.910 1.00 0.00 H new ATOM 0 HE3 LYS A 55 292.270 123.038 386.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 291.473 122.056 384.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 290.967 121.126 386.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 289.865 122.149 385.220 1.00 0.00 H new ATOM 916 N PHE A 56 287.808 125.809 391.843 1.00 0.00 N ATOM 917 CA PHE A 56 287.039 126.063 393.074 1.00 0.00 C ATOM 918 C PHE A 56 285.568 126.508 392.823 1.00 0.00 C ATOM 919 O PHE A 56 284.612 125.992 393.394 1.00 0.00 O ATOM 920 CB PHE A 56 287.846 127.027 393.991 1.00 0.00 C ATOM 921 CG PHE A 56 288.127 126.469 395.351 1.00 0.00 C ATOM 922 CD1 PHE A 56 288.749 125.240 395.461 1.00 0.00 C ATOM 923 CD2 PHE A 56 287.772 127.144 396.502 1.00 0.00 C ATOM 924 CE1 PHE A 56 289.030 124.701 396.696 1.00 0.00 C ATOM 925 CE2 PHE A 56 288.013 126.594 397.736 1.00 0.00 C ATOM 926 CZ PHE A 56 288.675 125.393 397.830 1.00 0.00 C ATOM 0 H PHE A 56 288.604 126.439 391.741 1.00 0.00 H new ATOM 0 HA PHE A 56 286.915 125.116 393.600 1.00 0.00 H new ATOM 0 HB2 PHE A 56 288.791 127.270 393.505 1.00 0.00 H new ATOM 0 HB3 PHE A 56 287.293 127.960 394.098 1.00 0.00 H new ATOM 0 HD1 PHE A 56 289.018 124.696 394.568 1.00 0.00 H new ATOM 0 HD2 PHE A 56 287.301 128.113 396.431 1.00 0.00 H new ATOM 0 HE1 PHE A 56 289.524 123.744 396.774 1.00 0.00 H new ATOM 0 HE2 PHE A 56 287.684 127.103 398.630 1.00 0.00 H new ATOM 0 HZ PHE A 56 288.918 124.990 398.802 1.00 0.00 H new ATOM 936 N VAL A 57 285.334 127.429 391.861 1.00 0.00 N ATOM 937 CA VAL A 57 284.058 127.871 391.290 1.00 0.00 C ATOM 938 C VAL A 57 283.273 126.829 390.501 1.00 0.00 C ATOM 939 O VAL A 57 282.046 126.779 390.571 1.00 0.00 O ATOM 940 CB VAL A 57 283.700 129.362 391.272 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.691 129.851 392.766 1.00 0.00 C ATOM 942 CG2 VAL A 57 284.467 130.287 390.299 1.00 0.00 C ATOM 0 H VAL A 57 286.114 127.924 391.429 1.00 0.00 H new ATOM 0 HA VAL A 57 283.343 127.945 392.109 1.00 0.00 H new ATOM 0 HB VAL A 57 282.713 129.448 390.818 1.00 0.00 H new ATOM 0 HG11 VAL A 57 283.440 130.911 392.800 1.00 0.00 H new ATOM 0 HG12 VAL A 57 282.950 129.284 393.330 1.00 0.00 H new ATOM 0 HG13 VAL A 57 284.677 129.697 393.205 1.00 0.00 H new ATOM 0 HG21 VAL A 57 284.101 131.308 390.404 1.00 0.00 H new ATOM 0 HG22 VAL A 57 285.532 130.257 390.531 1.00 0.00 H new ATOM 0 HG23 VAL A 57 284.310 129.948 389.275 1.00 0.00 H new ATOM 952 N GLU A 58 283.990 125.889 389.826 1.00 0.00 N ATOM 953 CA GLU A 58 283.469 124.617 389.298 1.00 0.00 C ATOM 954 C GLU A 58 282.997 123.682 390.447 1.00 0.00 C ATOM 955 O GLU A 58 281.936 123.074 390.333 1.00 0.00 O ATOM 956 CB GLU A 58 284.478 123.914 388.349 1.00 0.00 C ATOM 957 CG GLU A 58 284.535 124.587 386.963 1.00 0.00 C ATOM 958 CD GLU A 58 285.633 123.951 386.112 1.00 0.00 C ATOM 959 OE1 GLU A 58 286.829 124.101 386.478 1.00 0.00 O ATOM 960 OE2 GLU A 58 285.292 123.314 385.080 1.00 0.00 O1- ATOM 0 H GLU A 58 284.984 126.011 389.632 1.00 0.00 H new ATOM 0 HA GLU A 58 282.596 124.854 388.691 1.00 0.00 H new ATOM 0 HB2 GLU A 58 285.470 123.929 388.800 1.00 0.00 H new ATOM 0 HB3 GLU A 58 284.197 122.867 388.232 1.00 0.00 H new ATOM 0 HG2 GLU A 58 283.572 124.486 386.462 1.00 0.00 H new ATOM 0 HG3 GLU A 58 284.725 125.654 387.076 1.00 0.00 H new ATOM 967 N ALA A 59 283.723 123.632 391.623 1.00 0.00 N ATOM 968 CA ALA A 59 283.253 122.963 392.865 1.00 0.00 C ATOM 969 C ALA A 59 281.995 123.518 393.502 1.00 0.00 C ATOM 970 O ALA A 59 281.159 122.788 394.003 1.00 0.00 O ATOM 971 CB ALA A 59 284.164 123.145 394.107 1.00 0.00 C ATOM 0 H ALA A 59 284.645 124.058 391.719 1.00 0.00 H new ATOM 0 HA ALA A 59 283.174 121.958 392.450 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.730 122.618 394.957 1.00 0.00 H new ATOM 0 HB2 ALA A 59 285.153 122.739 393.895 1.00 0.00 H new ATOM 0 HB3 ALA A 59 284.250 124.206 394.343 1.00 0.00 H new ATOM 977 N TYR A 60 281.935 124.877 393.573 1.00 0.00 N ATOM 978 CA TYR A 60 281.065 125.806 394.299 1.00 0.00 C ATOM 979 C TYR A 60 279.536 125.559 394.124 1.00 0.00 C ATOM 980 O TYR A 60 278.679 126.013 394.864 1.00 0.00 O ATOM 981 CB TYR A 60 281.471 127.222 393.795 1.00 0.00 C ATOM 982 CG TYR A 60 281.102 128.492 394.525 1.00 0.00 C ATOM 983 CD1 TYR A 60 281.918 129.002 395.530 1.00 0.00 C ATOM 984 CD2 TYR A 60 280.111 129.312 394.009 1.00 0.00 C ATOM 985 CE1 TYR A 60 281.766 130.294 395.987 1.00 0.00 C ATOM 986 CE2 TYR A 60 279.937 130.600 394.482 1.00 0.00 C ATOM 987 CZ TYR A 60 280.774 131.090 395.458 1.00 0.00 C ATOM 988 OH TYR A 60 280.626 132.400 395.949 1.00 0.00 O ATOM 0 H TYR A 60 282.611 125.414 393.030 1.00 0.00 H new ATOM 0 HA TYR A 60 281.210 125.671 395.371 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.558 127.220 393.708 1.00 0.00 H new ATOM 0 HB3 TYR A 60 281.071 127.318 392.786 1.00 0.00 H new ATOM 0 HD1 TYR A 60 282.685 128.374 395.960 1.00 0.00 H new ATOM 0 HD2 TYR A 60 279.466 128.940 393.227 1.00 0.00 H new ATOM 0 HE1 TYR A 60 282.420 130.679 396.755 1.00 0.00 H new ATOM 0 HE2 TYR A 60 279.146 131.220 394.086 1.00 0.00 H new ATOM 0 HH TYR A 60 279.684 132.666 395.893 1.00 0.00 H new ATOM 998 N GLY A 61 279.179 124.739 393.121 1.00 0.00 N ATOM 999 CA GLY A 61 277.864 124.127 392.929 1.00 0.00 C ATOM 1000 C GLY A 61 277.637 122.757 393.578 1.00 0.00 C ATOM 1001 O GLY A 61 276.577 122.185 393.360 1.00 0.00 O ATOM 0 H GLY A 61 279.837 124.475 392.388 1.00 0.00 H new ATOM 0 HA2 GLY A 61 277.110 124.814 393.314 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.688 124.029 391.858 1.00 0.00 H new ATOM 1005 N LYS A 62 278.592 122.171 394.371 1.00 0.00 N ATOM 1006 CA LYS A 62 278.494 120.847 395.007 1.00 0.00 C ATOM 1007 C LYS A 62 278.043 120.838 396.477 1.00 0.00 C ATOM 1008 O LYS A 62 277.077 120.167 396.817 1.00 0.00 O ATOM 1009 CB LYS A 62 279.743 119.940 394.685 1.00 0.00 C ATOM 1010 CG LYS A 62 280.781 119.540 395.767 1.00 0.00 C ATOM 1011 CD LYS A 62 281.693 120.665 396.297 1.00 0.00 C ATOM 1012 CE LYS A 62 281.802 120.675 397.824 1.00 0.00 C ATOM 1013 NZ LYS A 62 283.040 120.035 398.318 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.474 122.638 394.581 1.00 0.00 H new ATOM 0 HA LYS A 62 277.642 120.367 394.525 1.00 0.00 H new ATOM 0 HB2 LYS A 62 279.355 119.012 394.266 1.00 0.00 H new ATOM 0 HB3 LYS A 62 280.297 120.441 393.891 1.00 0.00 H new ATOM 0 HG2 LYS A 62 280.244 119.110 396.612 1.00 0.00 H new ATOM 0 HG3 LYS A 62 281.414 118.753 395.358 1.00 0.00 H new ATOM 0 HD2 LYS A 62 282.688 120.551 395.868 1.00 0.00 H new ATOM 0 HD3 LYS A 62 281.308 121.627 395.959 1.00 0.00 H new ATOM 0 HE2 LYS A 62 281.765 121.705 398.179 1.00 0.00 H new ATOM 0 HE3 LYS A 62 280.939 120.161 398.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 283.261 120.394 399.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 282.905 119.005 398.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 283.826 120.256 397.673 1.00 0.00 H new ATOM 1027 N ALA A 63 278.665 121.605 397.413 1.00 0.00 N ATOM 1028 CA ALA A 63 278.288 121.678 398.845 1.00 0.00 C ATOM 1029 C ALA A 63 277.254 122.759 399.154 1.00 0.00 C ATOM 1030 O ALA A 63 277.275 123.366 400.222 1.00 0.00 O ATOM 1031 CB ALA A 63 279.503 121.879 399.801 1.00 0.00 C ATOM 0 H ALA A 63 279.460 122.202 397.184 1.00 0.00 H new ATOM 0 HA ALA A 63 277.845 120.700 399.032 1.00 0.00 H new ATOM 0 HB1 ALA A 63 279.151 121.923 400.832 1.00 0.00 H new ATOM 0 HB2 ALA A 63 280.196 121.045 399.689 1.00 0.00 H new ATOM 0 HB3 ALA A 63 280.012 122.810 399.551 1.00 0.00 H new ATOM 1037 N ILE A 64 276.365 123.083 398.190 1.00 0.00 N ATOM 1038 CA ILE A 64 275.351 124.141 398.304 1.00 0.00 C ATOM 1039 C ILE A 64 273.934 123.679 398.757 1.00 0.00 C ATOM 1040 O ILE A 64 273.153 123.173 397.947 1.00 0.00 O ATOM 1041 CB ILE A 64 275.374 125.055 397.066 1.00 0.00 C ATOM 1042 CG1 ILE A 64 274.767 126.441 397.390 1.00 0.00 C ATOM 1043 CG2 ILE A 64 274.806 124.405 395.782 1.00 0.00 C ATOM 1044 CD1 ILE A 64 275.142 127.534 396.382 1.00 0.00 C ATOM 0 H ILE A 64 276.336 122.601 397.291 1.00 0.00 H new ATOM 0 HA ILE A 64 275.647 124.751 399.158 1.00 0.00 H new ATOM 0 HB ILE A 64 276.423 125.215 396.817 1.00 0.00 H new ATOM 0 HG12 ILE A 64 273.681 126.352 397.427 1.00 0.00 H new ATOM 0 HG13 ILE A 64 275.096 126.748 398.383 1.00 0.00 H new ATOM 0 HG21 ILE A 64 274.860 125.118 394.959 1.00 0.00 H new ATOM 0 HG22 ILE A 64 275.390 123.519 395.534 1.00 0.00 H new ATOM 0 HG23 ILE A 64 273.767 124.120 395.947 1.00 0.00 H new ATOM 0 HD11 ILE A 64 274.679 128.476 396.677 1.00 0.00 H new ATOM 0 HD12 ILE A 64 276.225 127.653 396.361 1.00 0.00 H new ATOM 0 HD13 ILE A 64 274.789 127.251 395.390 1.00 0.00 H new ATOM 1056 N PRO A 65 273.521 123.781 400.055 1.00 0.00 N ATOM 1057 CA PRO A 65 272.163 123.457 400.514 1.00 0.00 C ATOM 1058 C PRO A 65 271.224 124.695 400.449 1.00 0.00 C ATOM 1059 O PRO A 65 271.733 125.818 400.402 1.00 0.00 O ATOM 1060 CB PRO A 65 272.429 123.059 401.982 1.00 0.00 C ATOM 1061 CG PRO A 65 273.515 124.034 402.447 1.00 0.00 C ATOM 1062 CD PRO A 65 274.365 124.207 401.179 1.00 0.00 C ATOM 0 HA PRO A 65 271.668 122.694 399.914 1.00 0.00 H new ATOM 0 HB2 PRO A 65 271.528 123.149 402.588 1.00 0.00 H new ATOM 0 HB3 PRO A 65 272.763 122.024 402.059 1.00 0.00 H new ATOM 0 HG2 PRO A 65 273.094 124.980 402.786 1.00 0.00 H new ATOM 0 HG3 PRO A 65 274.097 123.629 403.275 1.00 0.00 H new ATOM 0 HD2 PRO A 65 274.678 125.244 401.059 1.00 0.00 H new ATOM 0 HD3 PRO A 65 275.272 123.605 401.234 1.00 0.00 H new ATOM 1070 N PRO A 66 269.875 124.591 400.482 1.00 0.00 N ATOM 1071 CA PRO A 66 268.954 125.736 400.430 1.00 0.00 C ATOM 1072 C PRO A 66 268.715 126.379 401.820 1.00 0.00 C ATOM 1073 O PRO A 66 267.565 126.504 402.238 1.00 0.00 O ATOM 1074 CB PRO A 66 267.686 125.079 399.848 1.00 0.00 C ATOM 1075 CG PRO A 66 267.683 123.665 400.442 1.00 0.00 C ATOM 1076 CD PRO A 66 269.171 123.309 400.487 1.00 0.00 C ATOM 0 HA PRO A 66 269.326 126.575 399.841 1.00 0.00 H new ATOM 0 HB2 PRO A 66 266.788 125.630 400.129 1.00 0.00 H new ATOM 0 HB3 PRO A 66 267.716 125.053 398.759 1.00 0.00 H new ATOM 0 HG2 PRO A 66 267.233 123.645 401.434 1.00 0.00 H new ATOM 0 HG3 PRO A 66 267.119 122.968 399.822 1.00 0.00 H new ATOM 0 HD2 PRO A 66 269.411 122.732 401.380 1.00 0.00 H new ATOM 0 HD3 PRO A 66 269.456 122.700 399.629 1.00 0.00 H new ATOM 1084 N ALA A 67 269.788 126.801 402.534 1.00 0.00 N ATOM 1085 CA ALA A 67 269.772 127.421 403.848 1.00 0.00 C ATOM 1086 C ALA A 67 271.221 127.833 404.120 1.00 0.00 C ATOM 1087 O ALA A 67 272.091 127.288 403.441 1.00 0.00 O ATOM 1088 CB ALA A 67 269.262 126.442 404.943 1.00 0.00 C ATOM 0 H ALA A 67 270.736 126.704 402.171 1.00 0.00 H new ATOM 0 HA ALA A 67 269.091 128.272 403.872 1.00 0.00 H new ATOM 0 HB1 ALA A 67 269.265 126.944 405.910 1.00 0.00 H new ATOM 0 HB2 ALA A 67 268.247 126.124 404.703 1.00 0.00 H new ATOM 0 HB3 ALA A 67 269.915 125.570 404.984 1.00 0.00 H new ATOM 1094 N PRO A 68 271.581 128.776 405.013 1.00 0.00 N ATOM 1095 CA PRO A 68 272.969 129.184 405.257 1.00 0.00 C ATOM 1096 C PRO A 68 273.696 128.289 406.305 1.00 0.00 C ATOM 1097 O PRO A 68 273.321 128.371 407.474 1.00 0.00 O ATOM 1098 CB PRO A 68 272.782 130.630 405.761 1.00 0.00 C ATOM 1099 CG PRO A 68 271.439 130.636 406.505 1.00 0.00 C ATOM 1100 CD PRO A 68 270.610 129.604 405.734 1.00 0.00 C ATOM 0 HA PRO A 68 273.604 129.094 404.376 1.00 0.00 H new ATOM 0 HB2 PRO A 68 273.598 130.924 406.422 1.00 0.00 H new ATOM 0 HB3 PRO A 68 272.774 131.337 404.931 1.00 0.00 H new ATOM 0 HG2 PRO A 68 271.557 130.357 407.552 1.00 0.00 H new ATOM 0 HG3 PRO A 68 270.973 131.621 406.488 1.00 0.00 H new ATOM 0 HD2 PRO A 68 270.007 129.000 406.412 1.00 0.00 H new ATOM 0 HD3 PRO A 68 269.921 130.091 405.044 1.00 0.00 H new ATOM 1108 N PRO A 69 274.733 127.458 406.028 1.00 0.00 N ATOM 1109 CA PRO A 69 275.431 126.633 407.033 1.00 0.00 C ATOM 1110 C PRO A 69 276.593 127.387 407.737 1.00 0.00 C ATOM 1111 O PRO A 69 277.669 126.816 407.948 1.00 0.00 O ATOM 1112 CB PRO A 69 275.909 125.453 406.170 1.00 0.00 C ATOM 1113 CG PRO A 69 276.244 126.078 404.808 1.00 0.00 C ATOM 1114 CD PRO A 69 275.258 127.245 404.681 1.00 0.00 C ATOM 0 HA PRO A 69 274.806 126.337 407.875 1.00 0.00 H new ATOM 0 HB2 PRO A 69 276.781 124.969 406.609 1.00 0.00 H new ATOM 0 HB3 PRO A 69 275.135 124.691 406.077 1.00 0.00 H new ATOM 0 HG2 PRO A 69 277.277 126.423 404.771 1.00 0.00 H new ATOM 0 HG3 PRO A 69 276.118 125.360 403.998 1.00 0.00 H new ATOM 0 HD2 PRO A 69 275.755 128.140 404.307 1.00 0.00 H new ATOM 0 HD3 PRO A 69 274.457 127.008 403.980 1.00 0.00 H new ATOM 1122 N ALA A 70 276.363 128.670 408.110 1.00 0.00 N ATOM 1123 CA ALA A 70 277.260 129.602 408.757 1.00 0.00 C ATOM 1124 C ALA A 70 276.355 130.809 409.026 1.00 0.00 C ATOM 1125 O ALA A 70 275.272 130.805 408.439 1.00 0.00 O ATOM 1126 CB ALA A 70 278.457 129.956 407.839 1.00 0.00 C ATOM 0 H ALA A 70 275.453 129.098 407.940 1.00 0.00 H new ATOM 0 HA ALA A 70 277.720 129.212 409.665 1.00 0.00 H new ATOM 0 HB1 ALA A 70 279.114 130.658 408.352 1.00 0.00 H new ATOM 0 HB2 ALA A 70 279.012 129.049 407.599 1.00 0.00 H new ATOM 0 HB3 ALA A 70 278.088 130.410 406.919 1.00 0.00 H new ATOM 1132 N PRO A 71 276.640 131.823 409.869 1.00 0.00 N ATOM 1133 CA PRO A 71 275.750 132.960 410.123 1.00 0.00 C ATOM 1134 C PRO A 71 276.091 134.182 409.225 1.00 0.00 C ATOM 1135 O PRO A 71 276.967 134.944 409.640 1.00 0.00 O ATOM 1136 CB PRO A 71 276.030 133.221 411.620 1.00 0.00 C ATOM 1137 CG PRO A 71 277.503 132.835 411.852 1.00 0.00 C ATOM 1138 CD PRO A 71 277.828 131.857 410.716 1.00 0.00 C ATOM 0 HA PRO A 71 274.700 132.773 409.896 1.00 0.00 H new ATOM 0 HB2 PRO A 71 275.857 134.267 411.872 1.00 0.00 H new ATOM 0 HB3 PRO A 71 275.368 132.627 412.250 1.00 0.00 H new ATOM 0 HG2 PRO A 71 278.152 133.710 411.820 1.00 0.00 H new ATOM 0 HG3 PRO A 71 277.642 132.370 412.828 1.00 0.00 H new ATOM 0 HD2 PRO A 71 278.701 132.188 410.153 1.00 0.00 H new ATOM 0 HD3 PRO A 71 278.058 130.866 411.107 1.00 0.00 H new ATOM 1146 N PRO A 72 275.490 134.437 408.029 1.00 0.00 N ATOM 1147 CA PRO A 72 275.809 135.552 407.134 1.00 0.00 C ATOM 1148 C PRO A 72 275.316 136.925 407.593 1.00 0.00 C ATOM 1149 O PRO A 72 274.406 137.053 408.411 1.00 0.00 O ATOM 1150 CB PRO A 72 275.126 135.152 405.805 1.00 0.00 C ATOM 1151 CG PRO A 72 273.926 134.322 406.249 1.00 0.00 C ATOM 1152 CD PRO A 72 274.530 133.542 407.402 1.00 0.00 C ATOM 0 HA PRO A 72 276.889 135.686 407.077 1.00 0.00 H new ATOM 0 HB2 PRO A 72 274.818 136.028 405.234 1.00 0.00 H new ATOM 0 HB3 PRO A 72 275.797 134.576 405.168 1.00 0.00 H new ATOM 0 HG2 PRO A 72 273.088 134.943 406.565 1.00 0.00 H new ATOM 0 HG3 PRO A 72 273.559 133.670 405.457 1.00 0.00 H new ATOM 0 HD2 PRO A 72 273.761 133.235 408.111 1.00 0.00 H new ATOM 0 HD3 PRO A 72 275.017 132.634 407.047 1.00 0.00 H new ATOM 1160 N LEU A 73 275.930 137.986 407.014 1.00 0.00 N ATOM 1161 CA LEU A 73 275.603 139.393 407.252 1.00 0.00 C ATOM 1162 C LEU A 73 274.520 139.884 406.283 1.00 0.00 C ATOM 1163 O LEU A 73 274.538 139.573 405.093 1.00 0.00 O ATOM 1164 CB LEU A 73 276.837 140.330 407.111 1.00 0.00 C ATOM 1165 CG LEU A 73 277.952 140.217 408.184 1.00 0.00 C ATOM 1166 CD1 LEU A 73 277.403 140.227 409.621 1.00 0.00 C ATOM 1167 CD2 LEU A 73 278.915 139.035 407.983 1.00 0.00 C ATOM 0 H LEU A 73 276.692 137.869 406.346 1.00 0.00 H new ATOM 0 HA LEU A 73 275.242 139.438 408.280 1.00 0.00 H new ATOM 0 HB2 LEU A 73 277.289 140.146 406.136 1.00 0.00 H new ATOM 0 HB3 LEU A 73 276.478 141.359 407.107 1.00 0.00 H new ATOM 0 HG LEU A 73 278.542 141.122 408.037 1.00 0.00 H new ATOM 0 HD11 LEU A 73 278.230 140.145 410.327 1.00 0.00 H new ATOM 0 HD12 LEU A 73 276.865 141.158 409.798 1.00 0.00 H new ATOM 0 HD13 LEU A 73 276.725 139.385 409.757 1.00 0.00 H new ATOM 0 HD21 LEU A 73 279.661 139.034 408.778 1.00 0.00 H new ATOM 0 HD22 LEU A 73 278.355 138.100 408.010 1.00 0.00 H new ATOM 0 HD23 LEU A 73 279.413 139.132 407.018 1.00 0.00 H new ATOM 1179 N THR A 74 273.545 140.666 406.808 1.00 0.00 N ATOM 1180 CA THR A 74 272.369 141.144 406.080 1.00 0.00 C ATOM 1181 C THR A 74 272.174 142.664 406.208 1.00 0.00 C ATOM 1182 O THR A 74 271.123 143.112 406.666 1.00 0.00 O ATOM 1183 CB THR A 74 271.128 140.319 406.502 1.00 0.00 C ATOM 1184 OG1 THR A 74 269.933 140.725 405.852 1.00 0.00 O ATOM 1185 CG2 THR A 74 270.875 140.345 408.025 1.00 0.00 C ATOM 0 H THR A 74 273.566 140.984 407.777 1.00 0.00 H new ATOM 0 HA THR A 74 272.525 140.983 405.013 1.00 0.00 H new ATOM 0 HB THR A 74 271.376 139.304 406.191 1.00 0.00 H new ATOM 0 HG1 THR A 74 269.816 141.692 405.957 1.00 0.00 H new ATOM 0 HG21 THR A 74 269.992 139.749 408.257 1.00 0.00 H new ATOM 0 HG22 THR A 74 271.739 139.931 408.545 1.00 0.00 H new ATOM 0 HG23 THR A 74 270.714 141.373 408.350 1.00 0.00 H new ATOM 1193 N LEU A 75 273.179 143.462 405.764 1.00 0.00 N ATOM 1194 CA LEU A 75 273.231 144.928 405.726 1.00 0.00 C ATOM 1195 C LEU A 75 274.240 145.469 406.719 1.00 0.00 C ATOM 1196 O LEU A 75 274.829 146.514 406.470 1.00 0.00 O ATOM 1197 CB LEU A 75 271.885 145.729 405.690 1.00 0.00 C ATOM 1198 CG LEU A 75 271.952 147.258 405.409 1.00 0.00 C ATOM 1199 CD1 LEU A 75 272.693 147.598 404.102 1.00 0.00 C ATOM 1200 CD2 LEU A 75 270.547 147.902 405.403 1.00 0.00 C ATOM 0 H LEU A 75 274.038 143.054 405.396 1.00 0.00 H new ATOM 0 HA LEU A 75 273.583 145.129 404.714 1.00 0.00 H new ATOM 0 HB2 LEU A 75 271.248 145.277 404.930 1.00 0.00 H new ATOM 0 HB3 LEU A 75 271.386 145.587 406.649 1.00 0.00 H new ATOM 0 HG LEU A 75 272.529 147.681 406.232 1.00 0.00 H new ATOM 0 HD11 LEU A 75 272.706 148.679 403.962 1.00 0.00 H new ATOM 0 HD12 LEU A 75 273.716 147.227 404.157 1.00 0.00 H new ATOM 0 HD13 LEU A 75 272.181 147.129 403.261 1.00 0.00 H new ATOM 0 HD21 LEU A 75 270.637 148.970 405.203 1.00 0.00 H new ATOM 0 HD22 LEU A 75 269.937 147.438 404.628 1.00 0.00 H new ATOM 0 HD23 LEU A 75 270.074 147.753 406.374 1.00 0.00 H new ATOM 1212 N SER A 76 274.563 144.763 407.842 1.00 0.00 N ATOM 1213 CA SER A 76 275.701 145.088 408.736 1.00 0.00 C ATOM 1214 C SER A 76 275.646 146.491 409.407 1.00 0.00 C ATOM 1215 O SER A 76 274.646 146.910 409.991 1.00 0.00 O ATOM 1216 CB SER A 76 277.028 144.863 407.941 1.00 0.00 C ATOM 1217 OG SER A 76 278.224 144.788 408.712 1.00 0.00 O ATOM 0 H SER A 76 274.033 143.947 408.149 1.00 0.00 H new ATOM 0 HA SER A 76 275.643 144.412 409.589 1.00 0.00 H new ATOM 0 HB2 SER A 76 276.932 143.940 407.370 1.00 0.00 H new ATOM 0 HB3 SER A 76 277.136 145.674 407.221 1.00 0.00 H new ATOM 0 HG SER A 76 278.920 144.333 408.193 1.00 0.00 H new ATOM 1223 N LYS A 77 276.735 147.271 409.201 1.00 0.00 N ATOM 1224 CA LYS A 77 276.861 148.691 409.499 1.00 0.00 C ATOM 1225 C LYS A 77 277.410 149.368 408.229 1.00 0.00 C ATOM 1226 O LYS A 77 278.042 150.421 408.263 1.00 0.00 O ATOM 1227 CB LYS A 77 277.753 148.927 410.753 1.00 0.00 C ATOM 1228 CG LYS A 77 277.612 150.326 411.380 1.00 0.00 C ATOM 1229 CD LYS A 77 278.391 150.503 412.698 1.00 0.00 C ATOM 1230 CE LYS A 77 279.921 150.420 412.565 1.00 0.00 C ATOM 1231 NZ LYS A 77 280.447 151.473 411.665 1.00 0.00 N1+ ATOM 0 H LYS A 77 277.591 146.889 408.798 1.00 0.00 H new ATOM 0 HA LYS A 77 275.897 149.130 409.755 1.00 0.00 H new ATOM 0 HB2 LYS A 77 277.506 148.178 411.506 1.00 0.00 H new ATOM 0 HB3 LYS A 77 278.796 148.769 410.477 1.00 0.00 H new ATOM 0 HG2 LYS A 77 277.957 151.071 410.663 1.00 0.00 H new ATOM 0 HG3 LYS A 77 276.556 150.526 411.564 1.00 0.00 H new ATOM 0 HD2 LYS A 77 278.131 151.470 413.129 1.00 0.00 H new ATOM 0 HD3 LYS A 77 278.061 149.740 413.403 1.00 0.00 H new ATOM 0 HE2 LYS A 77 280.379 150.520 413.549 1.00 0.00 H new ATOM 0 HE3 LYS A 77 280.201 149.439 412.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 281.487 151.464 411.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 280.123 151.293 410.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 280.101 152.402 411.979 1.00 0.00 H new ATOM 1245 N LEU A 78 277.176 148.724 407.054 1.00 0.00 N ATOM 1246 CA LEU A 78 277.629 149.143 405.730 1.00 0.00 C ATOM 1247 C LEU A 78 276.962 148.201 404.738 1.00 0.00 C ATOM 1248 O LEU A 78 276.062 148.596 404.005 1.00 0.00 O ATOM 1249 CB LEU A 78 279.182 149.161 405.567 1.00 0.00 C ATOM 1250 CG LEU A 78 279.727 149.745 404.241 1.00 0.00 C ATOM 1251 CD1 LEU A 78 279.388 151.237 404.079 1.00 0.00 C ATOM 1252 CD2 LEU A 78 281.248 149.527 404.167 1.00 0.00 C ATOM 0 H LEU A 78 276.639 147.858 407.020 1.00 0.00 H new ATOM 0 HA LEU A 78 277.344 150.180 405.556 1.00 0.00 H new ATOM 0 HB2 LEU A 78 279.606 149.733 406.392 1.00 0.00 H new ATOM 0 HB3 LEU A 78 279.548 148.139 405.667 1.00 0.00 H new ATOM 0 HG LEU A 78 279.241 149.219 403.420 1.00 0.00 H new ATOM 0 HD11 LEU A 78 279.791 151.601 403.134 1.00 0.00 H new ATOM 0 HD12 LEU A 78 278.306 151.367 404.086 1.00 0.00 H new ATOM 0 HD13 LEU A 78 279.826 151.801 404.902 1.00 0.00 H new ATOM 0 HD21 LEU A 78 281.630 149.939 403.233 1.00 0.00 H new ATOM 0 HD22 LEU A 78 281.729 150.028 405.007 1.00 0.00 H new ATOM 0 HD23 LEU A 78 281.465 148.460 404.208 1.00 0.00 H new ATOM 1264 N GLU A 79 277.356 146.901 404.748 1.00 0.00 N ATOM 1265 CA GLU A 79 276.676 145.854 403.988 1.00 0.00 C ATOM 1266 C GLU A 79 276.985 144.491 404.581 1.00 0.00 C ATOM 1267 O GLU A 79 276.097 143.688 404.852 1.00 0.00 O ATOM 1268 CB GLU A 79 276.866 145.887 402.454 1.00 0.00 C ATOM 1269 CG GLU A 79 275.556 145.656 401.661 1.00 0.00 C ATOM 1270 CD GLU A 79 275.095 144.200 401.741 1.00 0.00 C ATOM 1271 OE1 GLU A 79 275.852 143.311 401.264 1.00 0.00 O ATOM 1272 OE2 GLU A 79 273.980 143.956 402.276 1.00 0.00 O1- ATOM 0 H GLU A 79 278.154 146.564 405.286 1.00 0.00 H new ATOM 0 HA GLU A 79 275.613 146.069 404.098 1.00 0.00 H new ATOM 0 HB2 GLU A 79 277.288 146.851 402.169 1.00 0.00 H new ATOM 0 HB3 GLU A 79 277.592 145.125 402.170 1.00 0.00 H new ATOM 0 HG2 GLU A 79 274.774 146.307 402.052 1.00 0.00 H new ATOM 0 HG3 GLU A 79 275.709 145.932 400.618 1.00 0.00 H new ATOM 1279 N HIS A 80 278.274 144.188 404.846 1.00 0.00 N ATOM 1280 CA HIS A 80 278.651 142.910 405.434 1.00 0.00 C ATOM 1281 C HIS A 80 280.010 143.018 406.082 1.00 0.00 C ATOM 1282 O HIS A 80 280.115 143.517 407.206 1.00 0.00 O ATOM 1283 CB HIS A 80 278.637 141.767 404.368 1.00 0.00 C ATOM 1284 CG HIS A 80 279.173 142.189 403.020 1.00 0.00 C ATOM 1285 ND1 HIS A 80 278.689 141.696 401.829 1.00 0.00 N ATOM 1286 CD2 HIS A 80 280.101 143.124 402.679 1.00 0.00 C ATOM 1287 CE1 HIS A 80 279.331 142.356 400.836 1.00 0.00 C ATOM 1288 NE2 HIS A 80 280.189 143.235 401.309 1.00 0.00 N ATOM 0 H HIS A 80 279.057 144.814 404.659 1.00 0.00 H new ATOM 0 HA HIS A 80 277.915 142.657 406.197 1.00 0.00 H new ATOM 0 HB2 HIS A 80 279.228 140.929 404.738 1.00 0.00 H new ATOM 0 HB3 HIS A 80 277.615 141.407 404.247 1.00 0.00 H new ATOM 0 HD2 HIS A 80 280.686 143.698 403.383 1.00 0.00 H new ATOM 0 HE1 HIS A 80 279.160 142.182 399.784 1.00 0.00 H new ATOM 0 HE2 HIS A 80 280.790 143.863 400.776 1.00 0.00 H new TER 1296 HIS A 80