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 54 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0058) USER MOD Set 1.2: A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 44 SER OG : rot -173:sc= -0.692 USER MOD Set 2.2: A 47 HIS : no HE2:sc= 0.0576 K(o=-0.63,f=-1.4!) USER MOD Set 3.1: A 34 TYR OH : rot 100:sc= 1.82 USER MOD Set 3.2: A 49 ASN : amide:sc= 0.44 X(o=2.3,f=2.4) USER MOD Set 4.1: A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 30 TYR OH : rot 110:sc= 0 USER MOD Single : A 0 MET N :NH3+ -176:sc= -0.206 (180deg=-0.256) USER MOD Single : A 4 TYR OH : rot 52:sc= 1.25 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot -25:sc= 0.0428 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 HIS :FLIP no HD1:sc= -1.65 F(o=-2.8!,f=-1.7) USER MOD Single : A 24 THR OG1 : rot -170:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= -2.59 X(o=-2.6,f=-2.4!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 64:sc= 1.92 USER MOD Single : A 45 SER OG : rot 180:sc= 0.0586 USER MOD Single : A 48 THR OG1 : rot 180:sc=-0.00114 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot -2:sc= 0.908 USER MOD Single : A 62 LYS NZ :NH3+ -122:sc= 0.0418 (180deg=-0.593) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 56:sc= 0.0632 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= 1.01 K(o=1,f=-5.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 281.723 122.204 403.710 1.00 0.00 N ATOM 2 CA MET A 0 282.439 122.912 404.737 1.00 0.00 C ATOM 3 C MET A 0 283.765 122.220 404.984 1.00 0.00 C ATOM 4 O MET A 0 284.568 122.674 405.796 1.00 0.00 O ATOM 5 CB MET A 0 281.647 123.150 406.061 1.00 0.00 C ATOM 6 CG MET A 0 280.187 123.614 405.862 1.00 0.00 C ATOM 7 SD MET A 0 279.335 123.932 407.436 1.00 0.00 S ATOM 8 CE MET A 0 277.700 124.179 406.692 1.00 0.00 C ATOM 0 H1 MET A 0 280.843 122.712 403.488 1.00 0.00 H new ATOM 0 H2 MET A 0 282.313 122.142 402.855 1.00 0.00 H new ATOM 0 H3 MET A 0 281.495 121.246 404.043 1.00 0.00 H new ATOM 0 HA MET A 0 282.604 123.921 404.360 1.00 0.00 H new ATOM 0 HB2 MET A 0 281.645 122.226 406.639 1.00 0.00 H new ATOM 0 HB3 MET A 0 282.174 123.897 406.655 1.00 0.00 H new ATOM 0 HG2 MET A 0 280.177 124.521 405.258 1.00 0.00 H new ATOM 0 HG3 MET A 0 279.641 122.853 405.304 1.00 0.00 H new ATOM 0 HE1 MET A 0 276.973 124.396 407.475 1.00 0.00 H new ATOM 0 HE2 MET A 0 277.741 125.014 405.993 1.00 0.00 H new ATOM 0 HE3 MET A 0 277.402 123.275 406.161 1.00 0.00 H new ATOM 18 N GLY A 1 284.053 121.120 404.229 1.00 0.00 N ATOM 19 CA GLY A 1 285.328 120.381 404.183 1.00 0.00 C ATOM 20 C GLY A 1 286.322 121.065 403.268 1.00 0.00 C ATOM 21 O GLY A 1 287.517 121.154 403.542 1.00 0.00 O ATOM 0 H GLY A 1 283.356 120.712 403.606 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.745 120.306 405.187 1.00 0.00 H new ATOM 0 HA3 GLY A 1 285.150 119.363 403.836 1.00 0.00 H new ATOM 25 N ILE A 2 285.799 121.653 402.164 1.00 0.00 N ATOM 26 CA ILE A 2 286.515 122.552 401.271 1.00 0.00 C ATOM 27 C ILE A 2 285.768 123.861 401.432 1.00 0.00 C ATOM 28 O ILE A 2 284.534 123.896 401.387 1.00 0.00 O ATOM 29 CB ILE A 2 286.511 122.239 399.774 1.00 0.00 C ATOM 30 CG1 ILE A 2 286.816 120.755 399.470 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.496 123.245 399.112 1.00 0.00 C ATOM 32 CD1 ILE A 2 287.444 120.512 398.091 1.00 0.00 C ATOM 0 H ILE A 2 284.833 121.499 401.875 1.00 0.00 H new ATOM 0 HA ILE A 2 287.568 122.508 401.547 1.00 0.00 H new ATOM 0 HB ILE A 2 285.516 122.369 399.348 1.00 0.00 H new ATOM 0 HG12 ILE A 2 287.489 120.370 400.236 1.00 0.00 H new ATOM 0 HG13 ILE A 2 285.891 120.183 399.541 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.532 123.065 398.038 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.156 124.264 399.298 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.491 123.112 399.536 1.00 0.00 H new ATOM 0 HD11 ILE A 2 287.626 119.446 397.957 1.00 0.00 H new ATOM 0 HD12 ILE A 2 286.765 120.864 397.315 1.00 0.00 H new ATOM 0 HD13 ILE A 2 288.388 121.053 398.020 1.00 0.00 H new ATOM 44 N ASP A 3 286.486 124.997 401.594 1.00 0.00 N ATOM 45 CA ASP A 3 285.852 126.264 401.873 1.00 0.00 C ATOM 46 C ASP A 3 285.224 127.007 400.691 1.00 0.00 C ATOM 47 O ASP A 3 285.673 128.092 400.340 1.00 0.00 O ATOM 48 CB ASP A 3 286.919 127.195 402.544 1.00 0.00 C ATOM 49 CG ASP A 3 286.340 128.352 403.356 1.00 0.00 C ATOM 50 OD1 ASP A 3 287.126 129.262 403.690 1.00 0.00 O ATOM 51 OD2 ASP A 3 285.112 128.385 403.617 1.00 0.00 O1- ATOM 0 H ASP A 3 287.503 125.040 401.532 1.00 0.00 H new ATOM 0 HA ASP A 3 285.004 126.023 402.514 1.00 0.00 H new ATOM 0 HB2 ASP A 3 287.549 126.591 403.197 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.565 127.603 401.767 1.00 0.00 H new ATOM 56 N TYR A 4 284.122 126.463 400.110 1.00 0.00 N ATOM 57 CA TYR A 4 283.077 127.116 399.334 1.00 0.00 C ATOM 58 C TYR A 4 282.058 127.919 400.126 1.00 0.00 C ATOM 59 O TYR A 4 281.881 129.119 399.929 1.00 0.00 O ATOM 60 CB TYR A 4 282.491 126.323 398.147 1.00 0.00 C ATOM 61 CG TYR A 4 283.562 125.516 397.570 1.00 0.00 C ATOM 62 CD1 TYR A 4 284.402 126.172 396.729 1.00 0.00 C ATOM 63 CD2 TYR A 4 283.713 124.162 397.802 1.00 0.00 C ATOM 64 CE1 TYR A 4 285.377 125.473 396.108 1.00 0.00 C ATOM 65 CE2 TYR A 4 284.747 123.483 397.192 1.00 0.00 C ATOM 66 CZ TYR A 4 285.622 124.150 396.367 1.00 0.00 C ATOM 67 OH TYR A 4 286.586 123.439 395.622 1.00 0.00 O ATOM 0 H TYR A 4 283.942 125.462 400.191 1.00 0.00 H new ATOM 0 HA TYR A 4 283.665 127.883 398.831 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.672 125.686 398.482 1.00 0.00 H new ATOM 0 HB3 TYR A 4 282.081 127.003 397.400 1.00 0.00 H new ATOM 0 HD1 TYR A 4 284.293 127.233 396.560 1.00 0.00 H new ATOM 0 HD2 TYR A 4 283.028 123.641 398.454 1.00 0.00 H new ATOM 0 HE1 TYR A 4 285.990 125.979 395.376 1.00 0.00 H new ATOM 0 HE2 TYR A 4 284.870 122.424 397.363 1.00 0.00 H new ATOM 0 HH TYR A 4 287.433 123.931 395.630 1.00 0.00 H new ATOM 77 N SER A 5 281.282 127.211 401.020 1.00 0.00 N ATOM 78 CA SER A 5 280.022 127.676 401.636 1.00 0.00 C ATOM 79 C SER A 5 279.979 128.979 402.435 1.00 0.00 C ATOM 80 O SER A 5 279.122 129.788 402.123 1.00 0.00 O ATOM 81 CB SER A 5 279.133 126.563 402.289 1.00 0.00 C ATOM 82 OG SER A 5 279.135 125.374 401.498 1.00 0.00 O ATOM 0 H SER A 5 281.541 126.274 401.329 1.00 0.00 H new ATOM 0 HA SER A 5 279.560 127.986 400.699 1.00 0.00 H new ATOM 0 HB2 SER A 5 279.502 126.339 403.290 1.00 0.00 H new ATOM 0 HB3 SER A 5 278.112 126.928 402.401 1.00 0.00 H new ATOM 0 HG SER A 5 278.574 124.694 401.927 1.00 0.00 H new ATOM 88 N GLY A 6 280.898 129.347 403.397 1.00 0.00 N ATOM 89 CA GLY A 6 281.002 130.663 404.036 1.00 0.00 C ATOM 90 C GLY A 6 281.268 131.817 403.095 1.00 0.00 C ATOM 91 O GLY A 6 280.842 132.937 403.289 1.00 0.00 O ATOM 0 H GLY A 6 281.600 128.693 403.743 1.00 0.00 H new ATOM 0 HA2 GLY A 6 280.076 130.861 404.576 1.00 0.00 H new ATOM 0 HA3 GLY A 6 281.801 130.627 404.777 1.00 0.00 H new ATOM 95 N LEU A 7 281.956 131.555 401.972 1.00 0.00 N ATOM 96 CA LEU A 7 282.313 132.446 400.874 1.00 0.00 C ATOM 97 C LEU A 7 281.076 132.678 400.003 1.00 0.00 C ATOM 98 O LEU A 7 280.733 133.824 399.731 1.00 0.00 O ATOM 99 CB LEU A 7 283.631 132.049 400.127 1.00 0.00 C ATOM 100 CG LEU A 7 284.820 131.726 401.091 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.531 130.405 401.746 1.00 0.00 C ATOM 102 CD2 LEU A 7 286.227 131.397 400.596 1.00 0.00 C ATOM 0 H LEU A 7 282.309 130.614 401.801 1.00 0.00 H new ATOM 0 HA LEU A 7 282.601 133.418 401.274 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.436 131.180 399.499 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.922 132.863 399.463 1.00 0.00 H new ATOM 0 HG LEU A 7 284.853 132.673 401.629 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.344 130.151 402.426 1.00 0.00 H new ATOM 0 HD12 LEU A 7 283.598 130.472 402.305 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.442 129.632 400.983 1.00 0.00 H new ATOM 0 HD21 LEU A 7 286.878 131.209 401.450 1.00 0.00 H new ATOM 0 HD22 LEU A 7 286.192 130.509 399.964 1.00 0.00 H new ATOM 0 HD23 LEU A 7 286.616 132.237 400.020 1.00 0.00 H new ATOM 114 N ARG A 8 280.293 131.599 399.647 1.00 0.00 N ATOM 115 CA ARG A 8 278.947 131.746 399.035 1.00 0.00 C ATOM 116 C ARG A 8 277.851 132.294 399.925 1.00 0.00 C ATOM 117 O ARG A 8 277.046 133.109 399.480 1.00 0.00 O ATOM 118 CB ARG A 8 278.384 130.548 398.176 1.00 0.00 C ATOM 119 CG ARG A 8 278.964 129.139 398.407 1.00 0.00 C ATOM 120 CD ARG A 8 278.842 128.253 397.142 1.00 0.00 C ATOM 121 NE ARG A 8 279.652 126.952 397.173 1.00 0.00 N ATOM 122 CZ ARG A 8 279.087 125.849 397.744 1.00 0.00 C ATOM 123 NH1 ARG A 8 278.022 125.959 398.584 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.605 124.633 397.417 1.00 0.00 N ATOM 0 H ARG A 8 280.582 130.630 399.778 1.00 0.00 H new ATOM 0 HA ARG A 8 279.221 132.524 398.322 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.309 130.495 398.346 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.529 130.797 397.125 1.00 0.00 H new ATOM 0 HG2 ARG A 8 280.012 129.220 398.695 1.00 0.00 H new ATOM 0 HG3 ARG A 8 278.442 128.662 399.237 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.791 128.004 396.993 1.00 0.00 H new ATOM 0 HD3 ARG A 8 279.157 128.837 396.277 1.00 0.00 H new ATOM 0 HE ARG A 8 280.591 126.912 396.776 1.00 0.00 H new ATOM 0 HH11 ARG A 8 277.633 126.878 398.796 1.00 0.00 H new ATOM 0 HH12 ARG A 8 277.613 125.123 399.001 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.388 124.570 396.766 1.00 0.00 H new ATOM 0 HH22 ARG A 8 279.210 123.785 397.823 1.00 0.00 H new ATOM 138 N THR A 9 277.788 131.870 401.203 1.00 0.00 N ATOM 139 CA THR A 9 276.783 132.301 402.167 1.00 0.00 C ATOM 140 C THR A 9 277.049 133.634 402.862 1.00 0.00 C ATOM 141 O THR A 9 276.093 134.278 403.285 1.00 0.00 O ATOM 142 CB THR A 9 276.301 131.126 403.005 1.00 0.00 C ATOM 143 OG1 THR A 9 274.914 131.201 403.296 1.00 0.00 O ATOM 144 CG2 THR A 9 277.056 130.847 404.315 1.00 0.00 C ATOM 0 H THR A 9 278.455 131.203 401.592 1.00 0.00 H new ATOM 0 HA THR A 9 275.900 132.615 401.610 1.00 0.00 H new ATOM 0 HB THR A 9 276.522 130.287 402.345 1.00 0.00 H new ATOM 0 HG1 THR A 9 274.623 132.136 403.263 1.00 0.00 H new ATOM 0 HG21 THR A 9 276.612 129.986 404.814 1.00 0.00 H new ATOM 0 HG22 THR A 9 278.103 130.639 404.094 1.00 0.00 H new ATOM 0 HG23 THR A 9 276.989 131.718 404.966 1.00 0.00 H new ATOM 152 N ILE A 10 278.321 134.120 402.943 1.00 0.00 N ATOM 153 CA ILE A 10 278.650 135.472 403.398 1.00 0.00 C ATOM 154 C ILE A 10 278.906 136.408 402.180 1.00 0.00 C ATOM 155 O ILE A 10 278.564 137.587 402.270 1.00 0.00 O ATOM 156 CB ILE A 10 279.803 135.529 404.446 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.480 134.862 405.821 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.201 136.978 404.839 1.00 0.00 C ATOM 159 CD1 ILE A 10 279.637 133.344 405.997 1.00 0.00 C ATOM 0 H ILE A 10 279.140 133.568 402.689 1.00 0.00 H new ATOM 0 HA ILE A 10 277.778 135.839 403.938 1.00 0.00 H new ATOM 0 HB ILE A 10 280.592 134.992 403.919 1.00 0.00 H new ATOM 0 HG12 ILE A 10 280.111 135.342 406.569 1.00 0.00 H new ATOM 0 HG13 ILE A 10 278.448 135.111 406.067 1.00 0.00 H new ATOM 0 HG21 ILE A 10 281.008 136.948 405.571 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.535 137.517 403.952 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.339 137.488 405.270 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.368 133.066 407.016 1.00 0.00 H new ATOM 0 HD12 ILE A 10 278.983 132.827 405.295 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.672 133.061 405.805 1.00 0.00 H new ATOM 171 N PHE A 11 279.537 136.001 401.019 1.00 0.00 N ATOM 172 CA PHE A 11 279.931 136.980 399.979 1.00 0.00 C ATOM 173 C PHE A 11 279.103 136.883 398.699 1.00 0.00 C ATOM 174 O PHE A 11 279.008 137.841 397.930 1.00 0.00 O ATOM 175 CB PHE A 11 281.463 136.939 399.645 1.00 0.00 C ATOM 176 CG PHE A 11 282.321 136.849 400.894 1.00 0.00 C ATOM 177 CD1 PHE A 11 282.233 137.742 401.949 1.00 0.00 C ATOM 178 CD2 PHE A 11 283.222 135.812 401.014 1.00 0.00 C ATOM 179 CE1 PHE A 11 282.969 137.546 403.109 1.00 0.00 C ATOM 180 CE2 PHE A 11 283.970 135.614 402.157 1.00 0.00 C ATOM 181 CZ PHE A 11 283.835 136.478 403.219 1.00 0.00 C ATOM 0 H PHE A 11 279.769 135.032 400.801 1.00 0.00 H new ATOM 0 HA PHE A 11 279.713 137.948 400.429 1.00 0.00 H new ATOM 0 HB2 PHE A 11 281.670 136.084 399.002 1.00 0.00 H new ATOM 0 HB3 PHE A 11 281.735 137.833 399.084 1.00 0.00 H new ATOM 0 HD1 PHE A 11 281.584 138.601 401.868 1.00 0.00 H new ATOM 0 HD2 PHE A 11 283.347 135.131 400.185 1.00 0.00 H new ATOM 0 HE1 PHE A 11 282.863 138.236 403.933 1.00 0.00 H new ATOM 0 HE2 PHE A 11 284.659 134.784 402.217 1.00 0.00 H new ATOM 0 HZ PHE A 11 284.399 136.322 404.127 1.00 0.00 H new ATOM 191 N GLY A 12 278.448 135.721 398.451 1.00 0.00 N ATOM 192 CA GLY A 12 277.522 135.520 397.332 1.00 0.00 C ATOM 193 C GLY A 12 278.111 134.979 396.046 1.00 0.00 C ATOM 194 O GLY A 12 278.190 133.767 395.857 1.00 0.00 O ATOM 0 H GLY A 12 278.557 134.893 399.036 1.00 0.00 H new ATOM 0 HA2 GLY A 12 276.737 134.838 397.659 1.00 0.00 H new ATOM 0 HA3 GLY A 12 277.044 136.474 397.111 1.00 0.00 H new ATOM 198 N GLU A 13 278.511 135.872 395.104 1.00 0.00 N ATOM 199 CA GLU A 13 278.929 135.596 393.722 1.00 0.00 C ATOM 200 C GLU A 13 280.271 134.905 393.441 1.00 0.00 C ATOM 201 O GLU A 13 280.329 133.977 392.637 1.00 0.00 O ATOM 202 CB GLU A 13 278.830 136.922 392.908 1.00 0.00 C ATOM 203 CG GLU A 13 278.934 136.809 391.369 1.00 0.00 C ATOM 204 CD GLU A 13 277.830 135.908 390.814 1.00 0.00 C ATOM 205 OE1 GLU A 13 276.632 136.254 390.998 1.00 0.00 O ATOM 206 OE2 GLU A 13 278.170 134.864 390.196 1.00 0.00 O1- ATOM 0 H GLU A 13 278.549 136.870 395.314 1.00 0.00 H new ATOM 0 HA GLU A 13 278.233 134.817 393.411 1.00 0.00 H new ATOM 0 HB2 GLU A 13 277.880 137.398 393.150 1.00 0.00 H new ATOM 0 HB3 GLU A 13 279.618 137.591 393.253 1.00 0.00 H new ATOM 0 HG2 GLU A 13 278.860 137.800 390.921 1.00 0.00 H new ATOM 0 HG3 GLU A 13 279.909 136.407 391.095 1.00 0.00 H new ATOM 213 N LYS A 14 281.382 135.357 394.066 1.00 0.00 N ATOM 214 CA LYS A 14 282.717 134.807 393.878 1.00 0.00 C ATOM 215 C LYS A 14 283.353 134.828 395.248 1.00 0.00 C ATOM 216 O LYS A 14 282.960 135.612 396.111 1.00 0.00 O ATOM 217 CB LYS A 14 283.568 135.632 392.854 1.00 0.00 C ATOM 218 CG LYS A 14 284.958 135.058 392.486 1.00 0.00 C ATOM 219 CD LYS A 14 285.811 135.988 391.601 1.00 0.00 C ATOM 220 CE LYS A 14 285.236 136.215 390.197 1.00 0.00 C ATOM 221 NZ LYS A 14 286.112 137.111 389.407 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.360 136.133 394.728 1.00 0.00 H new ATOM 0 HA LYS A 14 282.665 133.802 393.460 1.00 0.00 H new ATOM 0 HB2 LYS A 14 282.989 135.737 391.936 1.00 0.00 H new ATOM 0 HB3 LYS A 14 283.710 136.634 393.258 1.00 0.00 H new ATOM 0 HG2 LYS A 14 285.506 134.846 393.404 1.00 0.00 H new ATOM 0 HG3 LYS A 14 284.821 134.108 391.969 1.00 0.00 H new ATOM 0 HD2 LYS A 14 285.915 136.952 392.100 1.00 0.00 H new ATOM 0 HD3 LYS A 14 286.812 135.567 391.509 1.00 0.00 H new ATOM 0 HE2 LYS A 14 285.129 135.259 389.684 1.00 0.00 H new ATOM 0 HE3 LYS A 14 284.239 136.649 390.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 285.703 137.250 388.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 286.193 138.030 389.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 287.056 136.683 389.317 1.00 0.00 H new ATOM 235 N LEU A 15 284.381 133.970 395.478 1.00 0.00 N ATOM 236 CA LEU A 15 285.138 133.885 396.712 1.00 0.00 C ATOM 237 C LEU A 15 286.250 134.941 396.765 1.00 0.00 C ATOM 238 O LEU A 15 286.812 135.292 395.725 1.00 0.00 O ATOM 239 CB LEU A 15 285.863 132.521 396.933 1.00 0.00 C ATOM 240 CG LEU A 15 285.174 131.249 396.434 1.00 0.00 C ATOM 241 CD1 LEU A 15 285.725 130.837 395.063 1.00 0.00 C ATOM 242 CD2 LEU A 15 285.428 130.137 397.458 1.00 0.00 C ATOM 0 H LEU A 15 284.700 133.305 394.773 1.00 0.00 H new ATOM 0 HA LEU A 15 284.378 134.030 397.480 1.00 0.00 H new ATOM 0 HB2 LEU A 15 286.840 132.581 396.453 1.00 0.00 H new ATOM 0 HB3 LEU A 15 286.040 132.407 398.003 1.00 0.00 H new ATOM 0 HG LEU A 15 284.104 131.428 396.324 1.00 0.00 H new ATOM 0 HD11 LEU A 15 285.222 129.931 394.726 1.00 0.00 H new ATOM 0 HD12 LEU A 15 285.549 131.638 394.345 1.00 0.00 H new ATOM 0 HD13 LEU A 15 286.796 130.650 395.143 1.00 0.00 H new ATOM 0 HD21 LEU A 15 284.946 129.218 397.124 1.00 0.00 H new ATOM 0 HD22 LEU A 15 286.501 129.970 397.555 1.00 0.00 H new ATOM 0 HD23 LEU A 15 285.018 130.432 398.424 1.00 0.00 H new ATOM 254 N PRO A 16 286.647 135.436 397.923 1.00 0.00 N ATOM 255 CA PRO A 16 287.719 136.395 398.067 1.00 0.00 C ATOM 256 C PRO A 16 289.158 135.934 397.867 1.00 0.00 C ATOM 257 O PRO A 16 289.507 134.769 397.667 1.00 0.00 O ATOM 258 CB PRO A 16 287.589 136.733 399.551 1.00 0.00 C ATOM 259 CG PRO A 16 287.095 135.435 400.187 1.00 0.00 C ATOM 260 CD PRO A 16 286.002 135.169 399.200 1.00 0.00 C ATOM 0 HA PRO A 16 287.598 137.163 397.303 1.00 0.00 H new ATOM 0 HB2 PRO A 16 288.544 137.046 399.974 1.00 0.00 H new ATOM 0 HB3 PRO A 16 286.886 137.550 399.714 1.00 0.00 H new ATOM 0 HG2 PRO A 16 287.853 134.652 400.214 1.00 0.00 H new ATOM 0 HG3 PRO A 16 286.734 135.564 401.207 1.00 0.00 H new ATOM 0 HD2 PRO A 16 285.641 134.143 399.264 1.00 0.00 H new ATOM 0 HD3 PRO A 16 285.143 135.820 399.363 1.00 0.00 H new ATOM 268 N GLU A 17 289.981 136.979 398.067 1.00 0.00 N ATOM 269 CA GLU A 17 291.399 137.136 398.102 1.00 0.00 C ATOM 270 C GLU A 17 291.893 136.720 399.481 1.00 0.00 C ATOM 271 O GLU A 17 291.138 136.686 400.464 1.00 0.00 O ATOM 272 CB GLU A 17 291.682 138.646 397.912 1.00 0.00 C ATOM 273 CG GLU A 17 291.155 139.289 396.603 1.00 0.00 C ATOM 274 CD GLU A 17 289.631 139.451 396.525 1.00 0.00 C ATOM 275 OE1 GLU A 17 289.056 140.101 397.439 1.00 0.00 O ATOM 276 OE2 GLU A 17 289.028 138.928 395.550 1.00 0.00 O1- ATOM 0 H GLU A 17 289.552 137.889 398.237 1.00 0.00 H new ATOM 0 HA GLU A 17 291.891 136.537 397.335 1.00 0.00 H new ATOM 0 HB2 GLU A 17 291.248 139.183 398.755 1.00 0.00 H new ATOM 0 HB3 GLU A 17 292.760 138.799 397.958 1.00 0.00 H new ATOM 0 HG2 GLU A 17 291.615 140.270 396.487 1.00 0.00 H new ATOM 0 HG3 GLU A 17 291.484 138.681 395.760 1.00 0.00 H new ATOM 283 N SER A 18 293.198 136.406 399.619 1.00 0.00 N ATOM 284 CA SER A 18 293.774 135.897 400.860 1.00 0.00 C ATOM 285 C SER A 18 293.741 136.772 402.105 1.00 0.00 C ATOM 286 O SER A 18 293.788 136.222 403.200 1.00 0.00 O ATOM 287 CB SER A 18 295.220 135.419 400.666 1.00 0.00 C ATOM 288 OG SER A 18 296.026 136.508 400.210 1.00 0.00 O ATOM 0 H SER A 18 293.876 136.502 398.863 1.00 0.00 H new ATOM 0 HA SER A 18 293.077 135.085 401.070 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.614 135.029 401.604 1.00 0.00 H new ATOM 0 HB3 SER A 18 295.251 134.603 399.944 1.00 0.00 H new ATOM 0 HG SER A 18 296.949 136.203 400.088 1.00 0.00 H new ATOM 294 N HIS A 19 293.644 138.131 401.954 1.00 0.00 N ATOM 295 CA HIS A 19 293.583 139.115 403.043 1.00 0.00 C ATOM 296 C HIS A 19 292.318 138.984 403.883 1.00 0.00 C ATOM 297 O HIS A 19 292.415 138.861 405.096 1.00 0.00 O ATOM 298 CB HIS A 19 293.767 140.585 402.549 1.00 0.00 C ATOM 299 CG HIS A 19 292.682 141.096 401.628 1.00 0.00 C ATOM 300 ND1 HIS A 19 291.501 141.700 401.941 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 292.643 140.890 400.264 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 290.715 141.841 400.812 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 291.439 141.348 399.834 1.00 0.00 N flip ATOM 0 H HIS A 19 293.606 138.568 401.033 1.00 0.00 H new ATOM 0 HA HIS A 19 294.432 138.880 403.685 1.00 0.00 H new ATOM 0 HB2 HIS A 19 293.821 141.240 403.419 1.00 0.00 H new ATOM 0 HB3 HIS A 19 294.724 140.661 402.033 1.00 0.00 H new ATOM 0 HD2 HIS A 19 293.420 140.450 399.656 1.00 0.00 H new ATOM 0 HE1 HIS A 19 289.723 142.264 400.749 1.00 0.00 H new ATOM 0 HE2 HIS A 19 291.132 141.313 398.862 1.00 0.00 H new ATOM 311 N ILE A 20 291.103 138.881 403.260 1.00 0.00 N ATOM 312 CA ILE A 20 289.898 138.430 403.977 1.00 0.00 C ATOM 313 C ILE A 20 289.826 136.916 404.166 1.00 0.00 C ATOM 314 O ILE A 20 289.288 136.450 405.172 1.00 0.00 O ATOM 315 CB ILE A 20 288.516 138.940 403.539 1.00 0.00 C ATOM 316 CG1 ILE A 20 288.026 138.415 402.191 1.00 0.00 C ATOM 317 CG2 ILE A 20 288.471 140.467 403.474 1.00 0.00 C ATOM 318 CD1 ILE A 20 286.495 138.459 402.075 1.00 0.00 C ATOM 0 H ILE A 20 290.948 139.104 402.277 1.00 0.00 H new ATOM 0 HA ILE A 20 290.085 138.944 404.920 1.00 0.00 H new ATOM 0 HB ILE A 20 287.853 138.550 404.312 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.467 139.008 401.390 1.00 0.00 H new ATOM 0 HG13 ILE A 20 288.370 137.390 402.055 1.00 0.00 H new ATOM 0 HG21 ILE A 20 287.478 140.789 403.161 1.00 0.00 H new ATOM 0 HG22 ILE A 20 288.692 140.880 404.458 1.00 0.00 H new ATOM 0 HG23 ILE A 20 289.211 140.823 402.757 1.00 0.00 H new ATOM 0 HD11 ILE A 20 286.193 138.076 401.100 1.00 0.00 H new ATOM 0 HD12 ILE A 20 286.053 137.844 402.859 1.00 0.00 H new ATOM 0 HD13 ILE A 20 286.151 139.488 402.183 1.00 0.00 H new ATOM 330 N PHE A 21 290.328 136.077 403.198 1.00 0.00 N ATOM 331 CA PHE A 21 290.166 134.620 403.304 1.00 0.00 C ATOM 332 C PHE A 21 291.047 133.993 404.422 1.00 0.00 C ATOM 333 O PHE A 21 290.510 133.277 405.263 1.00 0.00 O ATOM 334 CB PHE A 21 290.111 133.975 401.863 1.00 0.00 C ATOM 335 CG PHE A 21 289.668 132.534 401.634 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.452 131.649 402.671 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.518 132.026 400.332 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.387 130.304 402.453 1.00 0.00 C ATOM 339 CE2 PHE A 21 289.302 130.665 400.140 1.00 0.00 C ATOM 340 CZ PHE A 21 289.317 129.785 401.203 1.00 0.00 C ATOM 0 H PHE A 21 290.830 136.392 402.368 1.00 0.00 H new ATOM 0 HA PHE A 21 289.191 134.347 403.707 1.00 0.00 H new ATOM 0 HB2 PHE A 21 289.453 134.604 401.263 1.00 0.00 H new ATOM 0 HB3 PHE A 21 291.112 134.066 401.441 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.332 132.029 403.675 1.00 0.00 H new ATOM 0 HD2 PHE A 21 289.570 132.691 399.482 1.00 0.00 H new ATOM 0 HE1 PHE A 21 289.391 129.634 403.300 1.00 0.00 H new ATOM 0 HE2 PHE A 21 289.120 130.291 399.143 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.274 128.718 401.044 1.00 0.00 H new ATOM 350 N PHE A 22 292.380 134.295 404.531 1.00 0.00 N ATOM 351 CA PHE A 22 293.281 133.849 405.613 1.00 0.00 C ATOM 352 C PHE A 22 293.073 134.632 406.949 1.00 0.00 C ATOM 353 O PHE A 22 293.585 134.217 407.989 1.00 0.00 O ATOM 354 CB PHE A 22 294.826 133.817 405.229 1.00 0.00 C ATOM 355 CG PHE A 22 295.317 132.623 404.387 1.00 0.00 C ATOM 356 CD1 PHE A 22 296.133 132.812 403.275 1.00 0.00 C ATOM 357 CD2 PHE A 22 295.103 131.297 404.743 1.00 0.00 C ATOM 358 CE1 PHE A 22 296.512 131.763 402.449 1.00 0.00 C ATOM 359 CE2 PHE A 22 295.527 130.244 403.966 1.00 0.00 C ATOM 360 CZ PHE A 22 296.137 130.471 402.763 1.00 0.00 C ATOM 0 H PHE A 22 292.858 134.874 403.840 1.00 0.00 H new ATOM 0 HA PHE A 22 292.981 132.813 405.770 1.00 0.00 H new ATOM 0 HB2 PHE A 22 295.058 134.732 404.685 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.404 133.840 406.153 1.00 0.00 H new ATOM 0 HD1 PHE A 22 296.483 133.808 403.047 1.00 0.00 H new ATOM 0 HD2 PHE A 22 294.583 131.085 405.666 1.00 0.00 H new ATOM 0 HE1 PHE A 22 297.099 131.956 401.563 1.00 0.00 H new ATOM 0 HE2 PHE A 22 295.377 129.231 404.308 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.321 129.659 402.075 1.00 0.00 H new ATOM 370 N ALA A 23 292.345 135.798 406.981 1.00 0.00 N ATOM 371 CA ALA A 23 292.074 136.565 408.209 1.00 0.00 C ATOM 372 C ALA A 23 290.619 136.652 408.721 1.00 0.00 C ATOM 373 O ALA A 23 290.416 136.947 409.896 1.00 0.00 O ATOM 374 CB ALA A 23 292.655 137.994 408.100 1.00 0.00 C ATOM 0 H ALA A 23 291.937 136.217 406.145 1.00 0.00 H new ATOM 0 HA ALA A 23 292.577 135.960 408.963 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.444 138.544 409.017 1.00 0.00 H new ATOM 0 HB2 ALA A 23 293.733 137.938 407.951 1.00 0.00 H new ATOM 0 HB3 ALA A 23 292.198 138.509 407.255 1.00 0.00 H new ATOM 380 N THR A 24 289.556 136.426 407.893 1.00 0.00 N ATOM 381 CA THR A 24 288.142 136.574 408.303 1.00 0.00 C ATOM 382 C THR A 24 287.502 135.202 408.505 1.00 0.00 C ATOM 383 O THR A 24 287.469 134.379 407.590 1.00 0.00 O ATOM 384 CB THR A 24 287.294 137.369 407.288 1.00 0.00 C ATOM 385 OG1 THR A 24 287.936 138.585 406.918 1.00 0.00 O ATOM 386 CG2 THR A 24 285.925 137.792 407.851 1.00 0.00 C ATOM 0 H THR A 24 289.666 136.136 406.921 1.00 0.00 H new ATOM 0 HA THR A 24 288.157 137.136 409.237 1.00 0.00 H new ATOM 0 HB THR A 24 287.171 136.691 406.444 1.00 0.00 H new ATOM 0 HG1 THR A 24 287.314 139.140 406.402 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.375 138.347 407.091 1.00 0.00 H new ATOM 0 HG22 THR A 24 285.358 136.905 408.134 1.00 0.00 H new ATOM 0 HG23 THR A 24 286.071 138.424 408.727 1.00 0.00 H new ATOM 394 N VAL A 25 286.902 134.905 409.708 1.00 0.00 N ATOM 395 CA VAL A 25 286.242 133.638 410.122 1.00 0.00 C ATOM 396 C VAL A 25 285.040 133.244 409.298 1.00 0.00 C ATOM 397 O VAL A 25 284.712 132.068 409.216 1.00 0.00 O ATOM 398 CB VAL A 25 285.873 133.555 411.612 1.00 0.00 C ATOM 399 CG1 VAL A 25 285.525 132.109 412.056 1.00 0.00 C ATOM 400 CG2 VAL A 25 287.056 134.075 412.455 1.00 0.00 C ATOM 0 H VAL A 25 286.871 135.598 410.456 1.00 0.00 H new ATOM 0 HA VAL A 25 287.037 132.918 409.927 1.00 0.00 H new ATOM 0 HB VAL A 25 284.985 134.168 411.767 1.00 0.00 H new ATOM 0 HG11 VAL A 25 285.272 132.105 413.116 1.00 0.00 H new ATOM 0 HG12 VAL A 25 284.675 131.746 411.478 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.384 131.460 411.886 1.00 0.00 H new ATOM 0 HG21 VAL A 25 286.801 134.019 413.513 1.00 0.00 H new ATOM 0 HG22 VAL A 25 287.937 133.464 412.261 1.00 0.00 H new ATOM 0 HG23 VAL A 25 287.267 135.110 412.187 1.00 0.00 H new ATOM 410 N ALA A 26 284.459 134.217 408.530 1.00 0.00 N ATOM 411 CA ALA A 26 283.442 134.111 407.483 1.00 0.00 C ATOM 412 C ALA A 26 283.817 133.034 406.463 1.00 0.00 C ATOM 413 O ALA A 26 283.001 132.222 406.054 1.00 0.00 O ATOM 414 CB ALA A 26 283.307 135.473 406.759 1.00 0.00 C ATOM 0 H ALA A 26 284.735 135.191 408.659 1.00 0.00 H new ATOM 0 HA ALA A 26 282.495 133.836 407.948 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.550 135.397 405.978 1.00 0.00 H new ATOM 0 HB2 ALA A 26 283.013 136.239 407.477 1.00 0.00 H new ATOM 0 HB3 ALA A 26 284.263 135.744 406.312 1.00 0.00 H new ATOM 420 N ALA A 27 285.125 132.949 406.151 1.00 0.00 N ATOM 421 CA ALA A 27 285.717 131.858 405.419 1.00 0.00 C ATOM 422 C ALA A 27 286.613 130.980 406.322 1.00 0.00 C ATOM 423 O ALA A 27 286.586 129.759 406.236 1.00 0.00 O ATOM 424 CB ALA A 27 286.489 132.519 404.267 1.00 0.00 C ATOM 0 H ALA A 27 285.800 133.666 406.417 1.00 0.00 H new ATOM 0 HA ALA A 27 284.967 131.166 405.037 1.00 0.00 H new ATOM 0 HB1 ALA A 27 286.969 131.750 403.662 1.00 0.00 H new ATOM 0 HB2 ALA A 27 285.798 133.090 403.646 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.248 133.187 404.674 1.00 0.00 H new ATOM 430 N HIS A 28 287.409 131.540 407.277 1.00 0.00 N ATOM 431 CA HIS A 28 288.358 130.820 408.169 1.00 0.00 C ATOM 432 C HIS A 28 287.863 129.669 409.055 1.00 0.00 C ATOM 433 O HIS A 28 288.652 128.854 409.519 1.00 0.00 O ATOM 434 CB HIS A 28 289.140 131.782 409.088 1.00 0.00 C ATOM 435 CG HIS A 28 290.611 131.508 409.089 1.00 0.00 C ATOM 436 ND1 HIS A 28 291.533 132.508 409.249 1.00 0.00 N ATOM 437 CD2 HIS A 28 291.323 130.350 408.998 1.00 0.00 C ATOM 438 CE1 HIS A 28 292.754 131.918 409.264 1.00 0.00 C ATOM 439 NE2 HIS A 28 292.674 130.613 409.116 1.00 0.00 N ATOM 0 H HIS A 28 287.405 132.545 407.451 1.00 0.00 H new ATOM 0 HA HIS A 28 288.966 130.342 407.401 1.00 0.00 H new ATOM 0 HB2 HIS A 28 288.966 132.809 408.766 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.758 131.698 410.105 1.00 0.00 H new ATOM 0 HD1 HIS A 28 291.339 133.505 409.340 1.00 0.00 H new ATOM 0 HD2 HIS A 28 290.894 129.369 408.855 1.00 0.00 H new ATOM 0 HE1 HIS A 28 293.683 132.456 409.383 1.00 0.00 H new ATOM 447 N LYS A 29 286.527 129.582 409.295 1.00 0.00 N ATOM 448 CA LYS A 29 285.816 128.557 410.056 1.00 0.00 C ATOM 449 C LYS A 29 285.771 127.189 409.373 1.00 0.00 C ATOM 450 O LYS A 29 285.355 126.195 409.953 1.00 0.00 O ATOM 451 CB LYS A 29 284.342 129.040 410.311 1.00 0.00 C ATOM 452 CG LYS A 29 283.376 129.022 409.093 1.00 0.00 C ATOM 453 CD LYS A 29 282.379 130.183 408.892 1.00 0.00 C ATOM 454 CE LYS A 29 281.793 130.829 410.159 1.00 0.00 C ATOM 455 NZ LYS A 29 281.059 129.839 410.982 1.00 0.00 N1+ ATOM 0 H LYS A 29 285.885 130.285 408.928 1.00 0.00 H new ATOM 0 HA LYS A 29 286.371 128.425 410.985 1.00 0.00 H new ATOM 0 HB2 LYS A 29 283.911 128.417 411.095 1.00 0.00 H new ATOM 0 HB3 LYS A 29 284.381 130.058 410.698 1.00 0.00 H new ATOM 0 HG2 LYS A 29 283.988 128.958 408.193 1.00 0.00 H new ATOM 0 HG3 LYS A 29 282.796 128.101 409.150 1.00 0.00 H new ATOM 0 HD2 LYS A 29 282.878 130.962 408.315 1.00 0.00 H new ATOM 0 HD3 LYS A 29 281.551 129.817 408.285 1.00 0.00 H new ATOM 0 HE2 LYS A 29 282.596 131.270 410.749 1.00 0.00 H new ATOM 0 HE3 LYS A 29 281.121 131.640 409.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 280.677 130.307 411.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 280.278 129.436 410.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 281.707 129.078 411.270 1.00 0.00 H new ATOM 469 N TYR A 30 286.141 127.167 408.069 1.00 0.00 N ATOM 470 CA TYR A 30 286.035 126.067 407.121 1.00 0.00 C ATOM 471 C TYR A 30 287.405 125.516 406.757 1.00 0.00 C ATOM 472 O TYR A 30 287.855 124.490 407.258 1.00 0.00 O ATOM 473 CB TYR A 30 285.287 126.669 405.898 1.00 0.00 C ATOM 474 CG TYR A 30 283.791 126.482 405.941 1.00 0.00 C ATOM 475 CD1 TYR A 30 283.008 126.470 407.087 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.135 126.530 404.746 1.00 0.00 C ATOM 477 CE1 TYR A 30 281.647 126.732 407.025 1.00 0.00 C ATOM 478 CE2 TYR A 30 281.791 126.724 404.677 1.00 0.00 C ATOM 479 CZ TYR A 30 281.035 126.922 405.806 1.00 0.00 C ATOM 480 OH TYR A 30 279.675 127.302 405.685 1.00 0.00 O ATOM 0 H TYR A 30 286.553 127.992 407.633 1.00 0.00 H new ATOM 0 HA TYR A 30 285.496 125.213 407.531 1.00 0.00 H new ATOM 0 HB2 TYR A 30 285.508 127.735 405.838 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.674 126.212 404.987 1.00 0.00 H new ATOM 0 HD1 TYR A 30 283.465 126.253 408.041 1.00 0.00 H new ATOM 0 HD2 TYR A 30 283.697 126.411 403.832 1.00 0.00 H new ATOM 0 HE1 TYR A 30 281.067 126.787 407.934 1.00 0.00 H new ATOM 0 HE2 TYR A 30 281.307 126.722 403.712 1.00 0.00 H new ATOM 0 HH TYR A 30 279.621 128.224 405.357 1.00 0.00 H new ATOM 490 N VAL A 31 288.130 126.228 405.862 1.00 0.00 N ATOM 491 CA VAL A 31 289.505 125.958 405.467 1.00 0.00 C ATOM 492 C VAL A 31 290.037 127.331 405.399 1.00 0.00 C ATOM 493 O VAL A 31 289.247 128.237 405.155 1.00 0.00 O ATOM 494 CB VAL A 31 289.812 125.272 404.117 1.00 0.00 C ATOM 495 CG1 VAL A 31 288.743 124.216 403.810 1.00 0.00 C ATOM 496 CG2 VAL A 31 290.336 126.125 402.897 1.00 0.00 C ATOM 0 H VAL A 31 287.741 127.040 405.382 1.00 0.00 H new ATOM 0 HA VAL A 31 289.920 125.232 406.166 1.00 0.00 H new ATOM 0 HB VAL A 31 290.766 124.771 404.285 1.00 0.00 H new ATOM 0 HG11 VAL A 31 288.967 123.738 402.857 1.00 0.00 H new ATOM 0 HG12 VAL A 31 288.736 123.465 404.600 1.00 0.00 H new ATOM 0 HG13 VAL A 31 287.765 124.694 403.755 1.00 0.00 H new ATOM 0 HG21 VAL A 31 290.495 125.473 402.038 1.00 0.00 H new ATOM 0 HG22 VAL A 31 289.599 126.887 402.642 1.00 0.00 H new ATOM 0 HG23 VAL A 31 291.276 126.606 403.166 1.00 0.00 H new ATOM 506 N PRO A 32 291.312 127.586 405.578 1.00 0.00 N ATOM 507 CA PRO A 32 291.770 128.951 405.638 1.00 0.00 C ATOM 508 C PRO A 32 292.060 129.689 404.316 1.00 0.00 C ATOM 509 O PRO A 32 291.760 130.870 404.305 1.00 0.00 O ATOM 510 CB PRO A 32 293.040 128.717 406.478 1.00 0.00 C ATOM 511 CG PRO A 32 293.586 127.340 406.120 1.00 0.00 C ATOM 512 CD PRO A 32 292.284 126.587 406.034 1.00 0.00 C ATOM 0 HA PRO A 32 291.010 129.630 406.025 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.782 129.488 406.272 1.00 0.00 H new ATOM 0 HB3 PRO A 32 292.810 128.772 407.542 1.00 0.00 H new ATOM 0 HG2 PRO A 32 294.137 127.337 405.180 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.254 126.940 406.883 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.353 125.753 405.336 1.00 0.00 H new ATOM 0 HD3 PRO A 32 292.002 126.171 407.001 1.00 0.00 H new ATOM 520 N SER A 33 292.636 129.075 403.239 1.00 0.00 N ATOM 521 CA SER A 33 292.951 129.697 401.931 1.00 0.00 C ATOM 522 C SER A 33 293.607 128.734 400.955 1.00 0.00 C ATOM 523 O SER A 33 293.732 127.538 401.240 1.00 0.00 O ATOM 524 CB SER A 33 293.272 131.222 401.695 1.00 0.00 C ATOM 525 OG SER A 33 292.427 131.854 400.732 1.00 0.00 O ATOM 0 H SER A 33 292.902 128.091 403.268 1.00 0.00 H new ATOM 0 HA SER A 33 291.906 129.909 401.707 1.00 0.00 H new ATOM 0 HB2 SER A 33 293.183 131.752 402.643 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.308 131.318 401.372 1.00 0.00 H new ATOM 0 HG SER A 33 291.503 131.857 401.059 1.00 0.00 H new ATOM 531 N TYR A 34 294.016 129.256 399.742 1.00 0.00 N ATOM 532 CA TYR A 34 294.656 128.648 398.541 1.00 0.00 C ATOM 533 C TYR A 34 295.821 127.661 398.776 1.00 0.00 C ATOM 534 O TYR A 34 296.091 126.771 397.972 1.00 0.00 O ATOM 535 CB TYR A 34 295.143 129.775 397.554 1.00 0.00 C ATOM 536 CG TYR A 34 294.116 130.860 397.230 1.00 0.00 C ATOM 537 CD1 TYR A 34 293.342 130.843 396.073 1.00 0.00 C ATOM 538 CD2 TYR A 34 294.022 131.981 398.035 1.00 0.00 C ATOM 539 CE1 TYR A 34 292.509 131.905 395.728 1.00 0.00 C ATOM 540 CE2 TYR A 34 293.160 133.015 397.729 1.00 0.00 C ATOM 541 CZ TYR A 34 292.409 132.992 396.578 1.00 0.00 C ATOM 542 OH TYR A 34 291.599 134.109 396.258 1.00 0.00 O ATOM 0 H TYR A 34 293.878 130.253 399.577 1.00 0.00 H new ATOM 0 HA TYR A 34 293.856 128.037 398.123 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.025 130.251 397.982 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.455 129.306 396.621 1.00 0.00 H new ATOM 0 HD1 TYR A 34 293.389 129.981 395.424 1.00 0.00 H new ATOM 0 HD2 TYR A 34 294.636 132.049 398.921 1.00 0.00 H new ATOM 0 HE1 TYR A 34 291.947 131.880 394.806 1.00 0.00 H new ATOM 0 HE2 TYR A 34 293.074 133.854 398.404 1.00 0.00 H new ATOM 0 HH TYR A 34 290.751 134.048 396.745 1.00 0.00 H new ATOM 552 N ALA A 35 296.448 127.753 399.974 1.00 0.00 N ATOM 553 CA ALA A 35 297.473 126.912 400.569 1.00 0.00 C ATOM 554 C ALA A 35 296.963 125.584 401.082 1.00 0.00 C ATOM 555 O ALA A 35 297.537 124.531 400.821 1.00 0.00 O ATOM 556 CB ALA A 35 298.058 127.658 401.800 1.00 0.00 C ATOM 0 H ALA A 35 296.206 128.515 400.608 1.00 0.00 H new ATOM 0 HA ALA A 35 298.200 126.715 399.781 1.00 0.00 H new ATOM 0 HB1 ALA A 35 298.831 127.045 402.264 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.491 128.606 401.479 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.264 127.848 402.522 1.00 0.00 H new ATOM 562 N PHE A 36 295.793 125.618 401.793 1.00 0.00 N ATOM 563 CA PHE A 36 295.033 124.471 402.261 1.00 0.00 C ATOM 564 C PHE A 36 294.332 123.886 401.042 1.00 0.00 C ATOM 565 O PHE A 36 294.406 122.687 400.771 1.00 0.00 O ATOM 566 CB PHE A 36 294.009 124.874 403.388 1.00 0.00 C ATOM 567 CG PHE A 36 293.113 123.692 403.826 1.00 0.00 C ATOM 568 CD1 PHE A 36 292.067 123.246 403.019 1.00 0.00 C ATOM 569 CD2 PHE A 36 293.332 122.993 405.000 1.00 0.00 C ATOM 570 CE1 PHE A 36 291.274 122.174 403.347 1.00 0.00 C ATOM 571 CE2 PHE A 36 292.522 121.922 405.354 1.00 0.00 C ATOM 572 CZ PHE A 36 291.487 121.516 404.533 1.00 0.00 C ATOM 0 H PHE A 36 295.355 126.501 402.055 1.00 0.00 H new ATOM 0 HA PHE A 36 295.691 123.731 402.717 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.555 125.251 404.253 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.380 125.688 403.028 1.00 0.00 H new ATOM 0 HD1 PHE A 36 291.872 123.768 402.094 1.00 0.00 H new ATOM 0 HD2 PHE A 36 294.144 123.284 405.650 1.00 0.00 H new ATOM 0 HE1 PHE A 36 290.490 121.851 402.678 1.00 0.00 H new ATOM 0 HE2 PHE A 36 292.703 121.400 406.282 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.853 120.691 404.821 1.00 0.00 H new ATOM 582 N LEU A 37 293.622 124.762 400.258 1.00 0.00 N ATOM 583 CA LEU A 37 292.918 124.301 399.045 1.00 0.00 C ATOM 584 C LEU A 37 293.793 123.690 397.943 1.00 0.00 C ATOM 585 O LEU A 37 293.353 122.713 397.351 1.00 0.00 O ATOM 586 CB LEU A 37 291.749 125.178 398.504 1.00 0.00 C ATOM 587 CG LEU A 37 291.948 126.683 398.533 1.00 0.00 C ATOM 588 CD1 LEU A 37 291.935 127.276 397.119 1.00 0.00 C ATOM 589 CD2 LEU A 37 290.983 127.496 399.388 1.00 0.00 C ATOM 0 H LEU A 37 293.532 125.760 400.449 1.00 0.00 H new ATOM 0 HA LEU A 37 292.389 123.452 399.479 1.00 0.00 H new ATOM 0 HB2 LEU A 37 291.552 124.882 397.474 1.00 0.00 H new ATOM 0 HB3 LEU A 37 290.854 124.943 399.080 1.00 0.00 H new ATOM 0 HG LEU A 37 292.923 126.773 399.013 1.00 0.00 H new ATOM 0 HD11 LEU A 37 292.080 128.355 397.176 1.00 0.00 H new ATOM 0 HD12 LEU A 37 292.738 126.832 396.531 1.00 0.00 H new ATOM 0 HD13 LEU A 37 290.977 127.063 396.644 1.00 0.00 H new ATOM 0 HD21 LEU A 37 291.238 128.554 399.319 1.00 0.00 H new ATOM 0 HD22 LEU A 37 289.964 127.344 399.031 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.056 127.173 400.426 1.00 0.00 H new ATOM 601 N ARG A 38 295.079 124.127 397.715 1.00 0.00 N ATOM 602 CA ARG A 38 295.958 123.408 396.774 1.00 0.00 C ATOM 603 C ARG A 38 296.349 121.986 397.197 1.00 0.00 C ATOM 604 O ARG A 38 296.313 121.066 396.385 1.00 0.00 O ATOM 605 CB ARG A 38 297.233 124.237 396.484 1.00 0.00 C ATOM 606 CG ARG A 38 298.262 123.591 395.530 1.00 0.00 C ATOM 607 CD ARG A 38 299.164 124.653 394.892 1.00 0.00 C ATOM 608 NE ARG A 38 300.324 124.004 394.193 1.00 0.00 N ATOM 609 CZ ARG A 38 301.195 124.714 393.408 1.00 0.00 C ATOM 610 NH1 ARG A 38 300.958 126.024 393.105 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 302.315 124.104 392.923 1.00 0.00 N ATOM 0 H ARG A 38 295.500 124.943 398.159 1.00 0.00 H new ATOM 0 HA ARG A 38 295.359 123.289 395.871 1.00 0.00 H new ATOM 0 HB2 ARG A 38 296.930 125.196 396.063 1.00 0.00 H new ATOM 0 HB3 ARG A 38 297.729 124.447 397.432 1.00 0.00 H new ATOM 0 HG2 ARG A 38 298.872 122.874 396.079 1.00 0.00 H new ATOM 0 HG3 ARG A 38 297.741 123.035 394.750 1.00 0.00 H new ATOM 0 HD2 ARG A 38 298.590 125.248 394.182 1.00 0.00 H new ATOM 0 HD3 ARG A 38 299.529 125.337 395.658 1.00 0.00 H new ATOM 0 HE ARG A 38 300.469 123.001 394.306 1.00 0.00 H new ATOM 0 HH11 ARG A 38 300.123 126.488 393.464 1.00 0.00 H new ATOM 0 HH12 ARG A 38 301.616 126.539 392.520 1.00 0.00 H new ATOM 0 HH21 ARG A 38 302.500 123.126 393.145 1.00 0.00 H new ATOM 0 HH22 ARG A 38 302.967 124.626 392.338 1.00 0.00 H new ATOM 625 N ARG A 39 296.668 121.774 398.501 1.00 0.00 N ATOM 626 CA ARG A 39 296.930 120.473 399.126 1.00 0.00 C ATOM 627 C ARG A 39 295.677 119.584 399.244 1.00 0.00 C ATOM 628 O ARG A 39 295.764 118.362 399.121 1.00 0.00 O ATOM 629 CB ARG A 39 297.700 120.600 400.476 1.00 0.00 C ATOM 630 CG ARG A 39 299.231 120.797 400.324 1.00 0.00 C ATOM 631 CD ARG A 39 299.657 122.028 399.503 1.00 0.00 C ATOM 632 NE ARG A 39 301.156 122.132 399.493 1.00 0.00 N ATOM 633 CZ ARG A 39 301.824 123.124 398.825 1.00 0.00 C ATOM 634 NH1 ARG A 39 301.143 124.087 398.138 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 303.189 123.147 398.844 1.00 0.00 N ATOM 0 H ARG A 39 296.750 122.545 399.164 1.00 0.00 H new ATOM 0 HA ARG A 39 297.594 119.951 398.437 1.00 0.00 H new ATOM 0 HB2 ARG A 39 297.291 121.441 401.036 1.00 0.00 H new ATOM 0 HB3 ARG A 39 297.518 119.704 401.070 1.00 0.00 H new ATOM 0 HG2 ARG A 39 299.671 120.873 401.318 1.00 0.00 H new ATOM 0 HG3 ARG A 39 299.651 119.906 399.857 1.00 0.00 H new ATOM 0 HD2 ARG A 39 299.281 121.946 398.483 1.00 0.00 H new ATOM 0 HD3 ARG A 39 299.222 122.931 399.931 1.00 0.00 H new ATOM 0 HE ARG A 39 301.698 121.436 400.004 1.00 0.00 H new ATOM 0 HH11 ARG A 39 300.123 124.074 398.117 1.00 0.00 H new ATOM 0 HH12 ARG A 39 301.654 124.820 397.645 1.00 0.00 H new ATOM 0 HH21 ARG A 39 303.704 122.429 399.353 1.00 0.00 H new ATOM 0 HH22 ARG A 39 303.694 123.882 398.349 1.00 0.00 H new ATOM 649 N GLU A 40 294.467 120.179 399.483 1.00 0.00 N ATOM 650 CA GLU A 40 293.209 119.447 399.590 1.00 0.00 C ATOM 651 C GLU A 40 292.500 119.186 398.249 1.00 0.00 C ATOM 652 O GLU A 40 291.716 118.246 398.147 1.00 0.00 O ATOM 653 CB GLU A 40 292.284 120.097 400.660 1.00 0.00 C ATOM 654 CG GLU A 40 291.587 119.084 401.602 1.00 0.00 C ATOM 655 CD GLU A 40 290.496 118.270 400.909 1.00 0.00 C ATOM 656 OE1 GLU A 40 289.523 118.892 400.409 1.00 0.00 O ATOM 657 OE2 GLU A 40 290.618 117.016 400.876 1.00 0.00 O1- ATOM 0 H GLU A 40 294.361 121.186 399.604 1.00 0.00 H new ATOM 0 HA GLU A 40 293.467 118.445 399.934 1.00 0.00 H new ATOM 0 HB2 GLU A 40 292.874 120.788 401.262 1.00 0.00 H new ATOM 0 HB3 GLU A 40 291.521 120.688 400.153 1.00 0.00 H new ATOM 0 HG2 GLU A 40 292.334 118.404 402.011 1.00 0.00 H new ATOM 0 HG3 GLU A 40 291.151 119.621 402.444 1.00 0.00 H new ATOM 664 N LEU A 41 292.722 119.981 397.153 1.00 0.00 N ATOM 665 CA LEU A 41 292.016 119.720 395.880 1.00 0.00 C ATOM 666 C LEU A 41 292.636 118.640 394.996 1.00 0.00 C ATOM 667 O LEU A 41 292.087 118.306 393.952 1.00 0.00 O ATOM 668 CB LEU A 41 291.974 121.009 394.994 1.00 0.00 C ATOM 669 CG LEU A 41 290.579 121.627 394.788 1.00 0.00 C ATOM 670 CD1 LEU A 41 290.751 122.950 394.030 1.00 0.00 C ATOM 671 CD2 LEU A 41 289.625 120.696 394.026 1.00 0.00 C ATOM 0 H LEU A 41 293.362 120.775 397.135 1.00 0.00 H new ATOM 0 HA LEU A 41 291.032 119.383 396.207 1.00 0.00 H new ATOM 0 HB2 LEU A 41 292.622 121.760 395.446 1.00 0.00 H new ATOM 0 HB3 LEU A 41 292.395 120.771 394.017 1.00 0.00 H new ATOM 0 HG LEU A 41 290.126 121.793 395.765 1.00 0.00 H new ATOM 0 HD11 LEU A 41 289.775 123.408 393.871 1.00 0.00 H new ATOM 0 HD12 LEU A 41 291.378 123.625 394.613 1.00 0.00 H new ATOM 0 HD13 LEU A 41 291.223 122.758 393.066 1.00 0.00 H new ATOM 0 HD21 LEU A 41 288.657 121.183 393.910 1.00 0.00 H new ATOM 0 HD22 LEU A 41 290.040 120.475 393.043 1.00 0.00 H new ATOM 0 HD23 LEU A 41 289.500 119.768 394.584 1.00 0.00 H new ATOM 683 N GLY A 42 293.846 118.153 395.351 1.00 0.00 N ATOM 684 CA GLY A 42 294.691 117.219 394.606 1.00 0.00 C ATOM 685 C GLY A 42 295.375 117.757 393.358 1.00 0.00 C ATOM 686 O GLY A 42 296.295 117.127 392.847 1.00 0.00 O ATOM 0 H GLY A 42 294.281 118.428 396.232 1.00 0.00 H new ATOM 0 HA2 GLY A 42 295.461 116.845 395.281 1.00 0.00 H new ATOM 0 HA3 GLY A 42 294.079 116.365 394.316 1.00 0.00 H new ATOM 690 N LEU A 43 294.966 118.949 392.836 1.00 0.00 N ATOM 691 CA LEU A 43 295.500 119.575 391.627 1.00 0.00 C ATOM 692 C LEU A 43 296.230 120.889 391.880 1.00 0.00 C ATOM 693 O LEU A 43 295.841 121.702 392.726 1.00 0.00 O ATOM 694 CB LEU A 43 294.457 119.657 390.462 1.00 0.00 C ATOM 695 CG LEU A 43 293.640 120.953 390.219 1.00 0.00 C ATOM 696 CD1 LEU A 43 292.784 120.799 388.950 1.00 0.00 C ATOM 697 CD2 LEU A 43 292.736 121.352 391.391 1.00 0.00 C ATOM 0 H LEU A 43 294.231 119.505 393.272 1.00 0.00 H new ATOM 0 HA LEU A 43 296.275 118.893 391.278 1.00 0.00 H new ATOM 0 HB2 LEU A 43 294.991 119.437 389.538 1.00 0.00 H new ATOM 0 HB3 LEU A 43 293.740 118.850 390.616 1.00 0.00 H new ATOM 0 HG LEU A 43 294.373 121.752 390.105 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.212 121.712 388.784 1.00 0.00 H new ATOM 0 HD12 LEU A 43 293.433 120.616 388.093 1.00 0.00 H new ATOM 0 HD13 LEU A 43 292.100 119.959 389.072 1.00 0.00 H new ATOM 0 HD21 LEU A 43 292.200 122.268 391.142 1.00 0.00 H new ATOM 0 HD22 LEU A 43 292.020 120.554 391.586 1.00 0.00 H new ATOM 0 HD23 LEU A 43 293.345 121.519 392.280 1.00 0.00 H new ATOM 709 N SER A 44 297.316 121.145 391.083 1.00 0.00 N ATOM 710 CA SER A 44 298.257 122.286 391.078 1.00 0.00 C ATOM 711 C SER A 44 297.656 123.614 390.577 1.00 0.00 C ATOM 712 O SER A 44 298.138 124.263 389.649 1.00 0.00 O ATOM 713 CB SER A 44 299.523 121.891 390.243 1.00 0.00 C ATOM 714 OG SER A 44 300.713 122.568 390.651 1.00 0.00 O ATOM 0 H SER A 44 297.569 120.478 390.355 1.00 0.00 H new ATOM 0 HA SER A 44 298.522 122.483 392.117 1.00 0.00 H new ATOM 0 HB2 SER A 44 299.681 120.816 390.325 1.00 0.00 H new ATOM 0 HB3 SER A 44 299.335 122.106 389.191 1.00 0.00 H new ATOM 0 HG SER A 44 301.438 122.362 390.024 1.00 0.00 H new ATOM 720 N SER A 45 296.533 123.993 391.230 1.00 0.00 N ATOM 721 CA SER A 45 295.612 125.099 390.991 1.00 0.00 C ATOM 722 C SER A 45 296.095 126.509 391.345 1.00 0.00 C ATOM 723 O SER A 45 295.743 127.446 390.627 1.00 0.00 O ATOM 724 CB SER A 45 294.201 124.843 391.651 1.00 0.00 C ATOM 725 OG SER A 45 294.293 124.137 392.896 1.00 0.00 O ATOM 0 H SER A 45 296.224 123.453 392.038 1.00 0.00 H new ATOM 0 HA SER A 45 295.541 125.099 389.903 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.703 125.798 391.816 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.579 124.274 390.960 1.00 0.00 H new ATOM 0 HG SER A 45 293.395 124.005 393.264 1.00 0.00 H new ATOM 731 N ALA A 46 296.872 126.716 392.457 1.00 0.00 N ATOM 732 CA ALA A 46 297.244 128.020 393.045 1.00 0.00 C ATOM 733 C ALA A 46 298.221 128.926 392.282 1.00 0.00 C ATOM 734 O ALA A 46 298.572 130.009 392.743 1.00 0.00 O ATOM 735 CB ALA A 46 297.694 127.883 394.520 1.00 0.00 C ATOM 0 H ALA A 46 297.267 125.935 392.981 1.00 0.00 H new ATOM 0 HA ALA A 46 296.297 128.554 392.964 1.00 0.00 H new ATOM 0 HB1 ALA A 46 297.958 128.865 394.913 1.00 0.00 H new ATOM 0 HB2 ALA A 46 296.880 127.463 395.111 1.00 0.00 H new ATOM 0 HB3 ALA A 46 298.561 127.225 394.576 1.00 0.00 H new ATOM 741 N HIS A 47 298.631 128.511 391.058 1.00 0.00 N ATOM 742 CA HIS A 47 299.456 129.246 390.106 1.00 0.00 C ATOM 743 C HIS A 47 298.794 130.501 389.528 1.00 0.00 C ATOM 744 O HIS A 47 299.458 131.450 389.121 1.00 0.00 O ATOM 745 CB HIS A 47 299.806 128.327 388.905 1.00 0.00 C ATOM 746 CG HIS A 47 300.783 127.256 389.264 1.00 0.00 C ATOM 747 ND1 HIS A 47 300.478 125.925 389.454 1.00 0.00 N ATOM 748 CD2 HIS A 47 302.132 127.358 389.414 1.00 0.00 C ATOM 749 CE1 HIS A 47 301.654 125.294 389.704 1.00 0.00 C ATOM 750 NE2 HIS A 47 302.680 126.122 389.688 1.00 0.00 N ATOM 0 H HIS A 47 298.370 127.592 390.700 1.00 0.00 H new ATOM 0 HA HIS A 47 300.333 129.560 390.672 1.00 0.00 H new ATOM 0 HB2 HIS A 47 298.893 127.868 388.526 1.00 0.00 H new ATOM 0 HB3 HIS A 47 300.217 128.932 388.097 1.00 0.00 H new ATOM 0 HD1 HIS A 47 299.552 125.499 389.415 1.00 0.00 H new ATOM 0 HD2 HIS A 47 302.694 128.277 389.330 1.00 0.00 H new ATOM 0 HE1 HIS A 47 301.739 124.234 389.894 1.00 0.00 H new ATOM 758 N THR A 48 297.449 130.506 389.406 1.00 0.00 N ATOM 759 CA THR A 48 296.719 131.627 388.832 1.00 0.00 C ATOM 760 C THR A 48 295.378 131.695 389.521 1.00 0.00 C ATOM 761 O THR A 48 294.638 130.703 389.548 1.00 0.00 O ATOM 762 CB THR A 48 296.566 131.492 387.317 1.00 0.00 C ATOM 763 OG1 THR A 48 297.837 131.320 386.703 1.00 0.00 O ATOM 764 CG2 THR A 48 295.930 132.750 386.697 1.00 0.00 C ATOM 0 H THR A 48 296.854 129.733 389.704 1.00 0.00 H new ATOM 0 HA THR A 48 297.273 132.552 388.991 1.00 0.00 H new ATOM 0 HB THR A 48 295.925 130.627 387.144 1.00 0.00 H new ATOM 0 HG1 THR A 48 297.723 131.233 385.734 1.00 0.00 H new ATOM 0 HG21 THR A 48 295.837 132.617 385.619 1.00 0.00 H new ATOM 0 HG22 THR A 48 294.942 132.909 387.129 1.00 0.00 H new ATOM 0 HG23 THR A 48 296.560 133.615 386.903 1.00 0.00 H new ATOM 772 N ASN A 49 294.979 132.897 390.073 1.00 0.00 N ATOM 773 CA ASN A 49 293.715 133.090 390.810 1.00 0.00 C ATOM 774 C ASN A 49 292.469 132.840 389.993 1.00 0.00 C ATOM 775 O ASN A 49 291.494 132.322 390.516 1.00 0.00 O ATOM 776 CB ASN A 49 293.571 134.437 391.585 1.00 0.00 C ATOM 777 CG ASN A 49 293.080 134.162 393.017 1.00 0.00 C ATOM 778 OD1 ASN A 49 293.931 133.762 393.810 1.00 0.00 O ATOM 779 ND2 ASN A 49 291.771 134.327 393.348 1.00 0.00 N ATOM 0 H ASN A 49 295.540 133.746 390.007 1.00 0.00 H new ATOM 0 HA ASN A 49 293.799 132.306 391.562 1.00 0.00 H new ATOM 0 HB2 ASN A 49 294.529 134.956 391.612 1.00 0.00 H new ATOM 0 HB3 ASN A 49 292.868 135.091 391.069 1.00 0.00 H new ATOM 0 HD21 ASN A 49 291.454 134.116 394.294 1.00 0.00 H new ATOM 0 HD22 ASN A 49 291.107 134.662 392.650 1.00 0.00 H new ATOM 786 N ARG A 50 292.519 133.135 388.669 1.00 0.00 N ATOM 787 CA ARG A 50 291.463 132.834 387.714 1.00 0.00 C ATOM 788 C ARG A 50 291.340 131.356 387.350 1.00 0.00 C ATOM 789 O ARG A 50 290.232 130.889 387.133 1.00 0.00 O ATOM 790 CB ARG A 50 291.485 133.788 386.496 1.00 0.00 C ATOM 791 CG ARG A 50 291.531 135.278 386.916 1.00 0.00 C ATOM 792 CD ARG A 50 290.481 135.703 387.970 1.00 0.00 C ATOM 793 NE ARG A 50 289.090 135.380 387.485 1.00 0.00 N ATOM 794 CZ ARG A 50 288.354 136.188 386.657 1.00 0.00 C ATOM 795 NH1 ARG A 50 288.836 137.391 386.231 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 287.114 135.780 386.256 1.00 0.00 N ATOM 0 H ARG A 50 293.321 133.600 388.243 1.00 0.00 H new ATOM 0 HA ARG A 50 290.529 133.039 388.237 1.00 0.00 H new ATOM 0 HB2 ARG A 50 292.352 133.561 385.875 1.00 0.00 H new ATOM 0 HB3 ARG A 50 290.600 133.613 385.884 1.00 0.00 H new ATOM 0 HG2 ARG A 50 292.524 135.497 387.308 1.00 0.00 H new ATOM 0 HG3 ARG A 50 291.397 135.893 386.026 1.00 0.00 H new ATOM 0 HD2 ARG A 50 290.673 135.189 388.912 1.00 0.00 H new ATOM 0 HD3 ARG A 50 290.566 136.772 388.167 1.00 0.00 H new ATOM 0 HE ARG A 50 288.669 134.503 387.793 1.00 0.00 H new ATOM 0 HH11 ARG A 50 289.760 137.704 386.528 1.00 0.00 H new ATOM 0 HH12 ARG A 50 288.272 137.977 385.615 1.00 0.00 H new ATOM 0 HH21 ARG A 50 286.745 134.883 386.572 1.00 0.00 H new ATOM 0 HH22 ARG A 50 286.557 136.372 385.640 1.00 0.00 H new ATOM 810 N LYS A 51 292.458 130.568 387.291 1.00 0.00 N ATOM 811 CA LYS A 51 292.458 129.112 387.060 1.00 0.00 C ATOM 812 C LYS A 51 291.974 128.315 388.270 1.00 0.00 C ATOM 813 O LYS A 51 291.047 127.488 388.184 1.00 0.00 O ATOM 814 CB LYS A 51 293.845 128.621 386.573 1.00 0.00 C ATOM 815 CG LYS A 51 293.946 127.151 386.101 1.00 0.00 C ATOM 816 CD LYS A 51 293.002 126.785 384.943 1.00 0.00 C ATOM 817 CE LYS A 51 293.286 125.389 384.372 1.00 0.00 C ATOM 818 NZ LYS A 51 292.335 125.056 383.285 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.397 130.949 387.407 1.00 0.00 H new ATOM 0 HA LYS A 51 291.735 128.925 386.266 1.00 0.00 H new ATOM 0 HB2 LYS A 51 294.162 129.263 385.751 1.00 0.00 H new ATOM 0 HB3 LYS A 51 294.559 128.766 387.384 1.00 0.00 H new ATOM 0 HG2 LYS A 51 294.972 126.952 385.793 1.00 0.00 H new ATOM 0 HG3 LYS A 51 293.734 126.496 386.946 1.00 0.00 H new ATOM 0 HD2 LYS A 51 291.970 126.828 385.292 1.00 0.00 H new ATOM 0 HD3 LYS A 51 293.101 127.526 384.150 1.00 0.00 H new ATOM 0 HE2 LYS A 51 294.307 125.348 383.992 1.00 0.00 H new ATOM 0 HE3 LYS A 51 293.212 124.646 385.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 292.548 124.107 382.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 291.364 125.073 383.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 292.425 125.754 382.519 1.00 0.00 H new ATOM 832 N VAL A 52 292.513 128.659 389.500 1.00 0.00 N ATOM 833 CA VAL A 52 292.024 128.088 390.774 1.00 0.00 C ATOM 834 C VAL A 52 290.631 128.515 391.057 1.00 0.00 C ATOM 835 O VAL A 52 289.812 127.637 391.293 1.00 0.00 O ATOM 836 CB VAL A 52 292.833 128.251 392.083 1.00 0.00 C ATOM 837 CG1 VAL A 52 292.996 129.703 392.589 1.00 0.00 C ATOM 838 CG2 VAL A 52 292.273 127.316 393.209 1.00 0.00 C ATOM 0 H VAL A 52 293.278 129.324 389.612 1.00 0.00 H new ATOM 0 HA VAL A 52 292.140 127.031 390.536 1.00 0.00 H new ATOM 0 HB VAL A 52 293.845 127.941 391.822 1.00 0.00 H new ATOM 0 HG11 VAL A 52 293.578 129.704 393.511 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.512 130.296 391.834 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.013 130.134 392.780 1.00 0.00 H new ATOM 0 HG21 VAL A 52 292.859 127.450 394.118 1.00 0.00 H new ATOM 0 HG22 VAL A 52 291.232 127.569 393.408 1.00 0.00 H new ATOM 0 HG23 VAL A 52 292.338 126.277 392.885 1.00 0.00 H new ATOM 848 N TRP A 53 290.287 129.841 390.938 1.00 0.00 N ATOM 849 CA TRP A 53 288.917 130.330 391.103 1.00 0.00 C ATOM 850 C TRP A 53 287.963 129.753 390.089 1.00 0.00 C ATOM 851 O TRP A 53 286.892 129.375 390.485 1.00 0.00 O ATOM 852 CB TRP A 53 288.705 131.817 391.470 1.00 0.00 C ATOM 853 CG TRP A 53 288.903 132.257 392.913 1.00 0.00 C ATOM 854 CD1 TRP A 53 288.457 133.453 393.391 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.283 131.486 394.079 1.00 0.00 C ATOM 856 NE1 TRP A 53 288.519 133.475 394.753 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.047 132.284 395.193 1.00 0.00 C ATOM 858 CE3 TRP A 53 289.751 130.215 394.240 1.00 0.00 C ATOM 859 CZ2 TRP A 53 289.299 131.826 396.456 1.00 0.00 C ATOM 860 CZ3 TRP A 53 290.068 129.785 395.497 1.00 0.00 C ATOM 861 CH2 TRP A 53 289.859 130.575 396.596 1.00 0.00 C ATOM 0 H TRP A 53 290.962 130.576 390.727 1.00 0.00 H new ATOM 0 HA TRP A 53 288.627 129.902 392.062 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.380 132.408 390.850 1.00 0.00 H new ATOM 0 HB3 TRP A 53 287.689 132.086 391.181 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.104 134.269 392.777 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.222 134.248 395.348 1.00 0.00 H new ATOM 0 HE3 TRP A 53 289.869 129.561 393.389 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.065 132.429 397.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 290.493 128.801 395.627 1.00 0.00 H new ATOM 0 HH2 TRP A 53 290.134 130.216 397.577 1.00 0.00 H new ATOM 872 N LYS A 54 288.334 129.469 388.824 1.00 0.00 N ATOM 873 CA LYS A 54 287.516 128.625 387.928 1.00 0.00 C ATOM 874 C LYS A 54 287.320 127.175 388.403 1.00 0.00 C ATOM 875 O LYS A 54 286.185 126.721 388.405 1.00 0.00 O ATOM 876 CB LYS A 54 288.298 128.578 386.586 1.00 0.00 C ATOM 877 CG LYS A 54 288.342 127.366 385.634 1.00 0.00 C ATOM 878 CD LYS A 54 287.022 126.994 384.966 1.00 0.00 C ATOM 879 CE LYS A 54 287.061 125.559 384.448 1.00 0.00 C ATOM 880 NZ LYS A 54 288.039 125.391 383.350 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.196 129.812 388.399 1.00 0.00 H new ATOM 0 HA LYS A 54 286.517 129.057 387.873 1.00 0.00 H new ATOM 0 HB2 LYS A 54 287.925 129.413 385.992 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.335 128.802 386.835 1.00 0.00 H new ATOM 0 HG2 LYS A 54 289.077 127.567 384.855 1.00 0.00 H new ATOM 0 HG3 LYS A 54 288.700 126.502 386.194 1.00 0.00 H new ATOM 0 HD2 LYS A 54 286.205 127.106 385.678 1.00 0.00 H new ATOM 0 HD3 LYS A 54 286.822 127.678 384.141 1.00 0.00 H new ATOM 0 HE2 LYS A 54 287.316 124.885 385.266 1.00 0.00 H new ATOM 0 HE3 LYS A 54 286.069 125.274 384.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 287.997 124.415 382.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 287.812 126.051 382.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 288.996 125.589 383.705 1.00 0.00 H new ATOM 894 N LYS A 55 288.367 126.415 388.879 1.00 0.00 N ATOM 895 CA LYS A 55 288.157 125.050 389.448 1.00 0.00 C ATOM 896 C LYS A 55 287.335 125.046 390.765 1.00 0.00 C ATOM 897 O LYS A 55 286.387 124.277 390.996 1.00 0.00 O ATOM 898 CB LYS A 55 289.499 124.291 389.639 1.00 0.00 C ATOM 899 CG LYS A 55 290.348 124.181 388.360 1.00 0.00 C ATOM 900 CD LYS A 55 289.655 123.359 387.268 1.00 0.00 C ATOM 901 CE LYS A 55 290.555 123.092 386.057 1.00 0.00 C ATOM 902 NZ LYS A 55 289.835 122.326 385.015 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.339 126.724 388.877 1.00 0.00 H new ATOM 0 HA LYS A 55 287.560 124.519 388.706 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.084 124.797 390.408 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.287 123.288 390.009 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.559 125.181 387.980 1.00 0.00 H new ATOM 0 HG3 LYS A 55 291.307 123.723 388.602 1.00 0.00 H new ATOM 0 HD2 LYS A 55 289.330 122.408 387.689 1.00 0.00 H new ATOM 0 HD3 LYS A 55 288.759 123.885 386.939 1.00 0.00 H new ATOM 0 HE2 LYS A 55 290.902 124.039 385.642 1.00 0.00 H new ATOM 0 HE3 LYS A 55 291.440 122.539 386.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 290.468 122.159 384.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 289.526 121.413 385.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 289.005 122.866 384.699 1.00 0.00 H new ATOM 916 N PHE A 56 287.650 126.069 391.600 1.00 0.00 N ATOM 917 CA PHE A 56 286.921 126.436 392.835 1.00 0.00 C ATOM 918 C PHE A 56 285.451 126.852 392.598 1.00 0.00 C ATOM 919 O PHE A 56 284.505 126.299 393.155 1.00 0.00 O ATOM 920 CB PHE A 56 287.692 127.527 393.647 1.00 0.00 C ATOM 921 CG PHE A 56 288.093 127.036 395.003 1.00 0.00 C ATOM 922 CD1 PHE A 56 288.783 125.847 395.137 1.00 0.00 C ATOM 923 CD2 PHE A 56 287.730 127.731 396.135 1.00 0.00 C ATOM 924 CE1 PHE A 56 289.002 125.302 396.382 1.00 0.00 C ATOM 925 CE2 PHE A 56 287.952 127.202 397.385 1.00 0.00 C ATOM 926 CZ PHE A 56 288.563 125.975 397.501 1.00 0.00 C ATOM 0 H PHE A 56 288.447 126.681 391.423 1.00 0.00 H new ATOM 0 HA PHE A 56 286.877 125.523 393.429 1.00 0.00 H new ATOM 0 HB2 PHE A 56 288.581 127.831 393.094 1.00 0.00 H new ATOM 0 HB3 PHE A 56 287.064 128.412 393.753 1.00 0.00 H new ATOM 0 HD1 PHE A 56 289.154 125.341 394.258 1.00 0.00 H new ATOM 0 HD2 PHE A 56 287.266 128.702 396.040 1.00 0.00 H new ATOM 0 HE1 PHE A 56 289.513 124.356 396.481 1.00 0.00 H new ATOM 0 HE2 PHE A 56 287.649 127.745 398.268 1.00 0.00 H new ATOM 0 HZ PHE A 56 288.700 125.535 398.478 1.00 0.00 H new ATOM 936 N VAL A 57 285.209 127.808 391.671 1.00 0.00 N ATOM 937 CA VAL A 57 283.919 128.231 391.116 1.00 0.00 C ATOM 938 C VAL A 57 283.118 127.155 390.368 1.00 0.00 C ATOM 939 O VAL A 57 281.892 127.108 390.453 1.00 0.00 O ATOM 940 CB VAL A 57 283.532 129.727 391.102 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.125 130.149 392.555 1.00 0.00 C ATOM 942 CG2 VAL A 57 284.531 130.771 390.587 1.00 0.00 C ATOM 0 H VAL A 57 285.978 128.341 391.265 1.00 0.00 H new ATOM 0 HA VAL A 57 283.190 128.373 391.914 1.00 0.00 H new ATOM 0 HB VAL A 57 282.736 129.750 390.357 1.00 0.00 H new ATOM 0 HG11 VAL A 57 282.848 131.203 392.564 1.00 0.00 H new ATOM 0 HG12 VAL A 57 282.277 129.549 392.884 1.00 0.00 H new ATOM 0 HG13 VAL A 57 283.966 129.989 393.229 1.00 0.00 H new ATOM 0 HG21 VAL A 57 284.086 131.764 390.653 1.00 0.00 H new ATOM 0 HG22 VAL A 57 285.436 130.738 391.193 1.00 0.00 H new ATOM 0 HG23 VAL A 57 284.782 130.554 389.549 1.00 0.00 H new ATOM 952 N GLU A 58 283.818 126.187 389.704 1.00 0.00 N ATOM 953 CA GLU A 58 283.278 124.906 389.208 1.00 0.00 C ATOM 954 C GLU A 58 282.752 124.001 390.363 1.00 0.00 C ATOM 955 O GLU A 58 281.628 123.506 390.292 1.00 0.00 O ATOM 956 CB GLU A 58 284.329 124.161 388.334 1.00 0.00 C ATOM 957 CG GLU A 58 283.809 122.964 387.514 1.00 0.00 C ATOM 958 CD GLU A 58 282.761 123.431 386.504 1.00 0.00 C ATOM 959 OE1 GLU A 58 283.122 124.243 385.610 1.00 0.00 O ATOM 960 OE2 GLU A 58 281.589 122.981 386.611 1.00 0.00 O1- ATOM 0 H GLU A 58 284.811 126.293 389.497 1.00 0.00 H new ATOM 0 HA GLU A 58 282.419 125.139 388.579 1.00 0.00 H new ATOM 0 HB2 GLU A 58 284.773 124.880 387.646 1.00 0.00 H new ATOM 0 HB3 GLU A 58 285.128 123.808 388.986 1.00 0.00 H new ATOM 0 HG2 GLU A 58 284.637 122.483 386.994 1.00 0.00 H new ATOM 0 HG3 GLU A 58 283.375 122.218 388.180 1.00 0.00 H new ATOM 967 N ALA A 59 283.517 123.860 391.507 1.00 0.00 N ATOM 968 CA ALA A 59 283.036 123.228 392.769 1.00 0.00 C ATOM 969 C ALA A 59 281.897 123.937 393.471 1.00 0.00 C ATOM 970 O ALA A 59 281.100 123.345 394.159 1.00 0.00 O ATOM 971 CB ALA A 59 284.032 123.294 393.942 1.00 0.00 C ATOM 0 H ALA A 59 284.482 124.186 391.565 1.00 0.00 H new ATOM 0 HA ALA A 59 282.807 122.240 392.369 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.597 122.810 394.816 1.00 0.00 H new ATOM 0 HB2 ALA A 59 284.954 122.783 393.666 1.00 0.00 H new ATOM 0 HB3 ALA A 59 284.251 124.336 394.175 1.00 0.00 H new ATOM 977 N TYR A 60 281.837 125.274 393.404 1.00 0.00 N ATOM 978 CA TYR A 60 280.918 126.177 394.091 1.00 0.00 C ATOM 979 C TYR A 60 279.373 125.845 393.930 1.00 0.00 C ATOM 980 O TYR A 60 278.508 126.350 394.631 1.00 0.00 O ATOM 981 CB TYR A 60 281.278 127.611 393.639 1.00 0.00 C ATOM 982 CG TYR A 60 280.940 128.799 394.502 1.00 0.00 C ATOM 983 CD1 TYR A 60 279.960 129.678 394.074 1.00 0.00 C ATOM 984 CD2 TYR A 60 281.747 129.177 395.572 1.00 0.00 C ATOM 985 CE1 TYR A 60 279.829 130.917 394.666 1.00 0.00 C ATOM 986 CE2 TYR A 60 281.572 130.386 396.227 1.00 0.00 C ATOM 987 CZ TYR A 60 280.637 131.274 395.722 1.00 0.00 C ATOM 988 OH TYR A 60 280.446 132.539 396.304 1.00 0.00 O ATOM 0 H TYR A 60 282.489 125.791 392.815 1.00 0.00 H new ATOM 0 HA TYR A 60 281.055 126.053 395.165 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.355 127.633 393.471 1.00 0.00 H new ATOM 0 HB3 TYR A 60 280.801 127.771 392.672 1.00 0.00 H new ATOM 0 HD1 TYR A 60 279.295 129.392 393.273 1.00 0.00 H new ATOM 0 HD2 TYR A 60 282.530 128.510 395.900 1.00 0.00 H new ATOM 0 HE1 TYR A 60 279.088 131.611 394.299 1.00 0.00 H new ATOM 0 HE2 TYR A 60 282.149 130.629 397.107 1.00 0.00 H new ATOM 0 HH TYR A 60 279.739 133.017 395.822 1.00 0.00 H new ATOM 998 N GLY A 61 279.029 124.943 392.965 1.00 0.00 N ATOM 999 CA GLY A 61 277.748 124.257 392.757 1.00 0.00 C ATOM 1000 C GLY A 61 277.631 122.839 393.346 1.00 0.00 C ATOM 1001 O GLY A 61 276.656 122.154 393.061 1.00 0.00 O ATOM 0 H GLY A 61 279.710 124.663 392.259 1.00 0.00 H new ATOM 0 HA2 GLY A 61 276.957 124.872 393.186 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.561 124.199 391.685 1.00 0.00 H new ATOM 1005 N LYS A 62 278.629 122.343 394.137 1.00 0.00 N ATOM 1006 CA LYS A 62 278.771 121.016 394.763 1.00 0.00 C ATOM 1007 C LYS A 62 278.207 120.897 396.185 1.00 0.00 C ATOM 1008 O LYS A 62 277.404 120.019 396.465 1.00 0.00 O ATOM 1009 CB LYS A 62 280.310 120.749 394.830 1.00 0.00 C ATOM 1010 CG LYS A 62 280.940 119.510 395.474 1.00 0.00 C ATOM 1011 CD LYS A 62 282.263 119.870 396.209 1.00 0.00 C ATOM 1012 CE LYS A 62 282.055 120.650 397.533 1.00 0.00 C ATOM 1013 NZ LYS A 62 283.265 120.586 398.386 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.429 122.932 394.368 1.00 0.00 H new ATOM 0 HA LYS A 62 278.202 120.303 394.167 1.00 0.00 H new ATOM 0 HB2 LYS A 62 280.667 120.771 393.800 1.00 0.00 H new ATOM 0 HB3 LYS A 62 280.746 121.610 395.337 1.00 0.00 H new ATOM 0 HG2 LYS A 62 280.238 119.067 396.180 1.00 0.00 H new ATOM 0 HG3 LYS A 62 281.139 118.760 394.708 1.00 0.00 H new ATOM 0 HD2 LYS A 62 282.810 118.952 396.422 1.00 0.00 H new ATOM 0 HD3 LYS A 62 282.887 120.465 395.542 1.00 0.00 H new ATOM 0 HE2 LYS A 62 281.817 121.690 397.312 1.00 0.00 H new ATOM 0 HE3 LYS A 62 281.203 120.236 398.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 283.019 120.170 399.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 283.986 119.998 397.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 283.640 121.545 398.529 1.00 0.00 H new ATOM 1027 N ALA A 63 278.595 121.784 397.143 1.00 0.00 N ATOM 1028 CA ALA A 63 278.165 121.773 398.556 1.00 0.00 C ATOM 1029 C ALA A 63 277.077 122.810 398.833 1.00 0.00 C ATOM 1030 O ALA A 63 276.963 123.394 399.915 1.00 0.00 O ATOM 1031 CB ALA A 63 279.377 121.995 399.496 1.00 0.00 C ATOM 0 H ALA A 63 279.238 122.549 396.938 1.00 0.00 H new ATOM 0 HA ALA A 63 277.737 120.791 398.756 1.00 0.00 H new ATOM 0 HB1 ALA A 63 279.040 121.984 400.533 1.00 0.00 H new ATOM 0 HB2 ALA A 63 280.107 121.200 399.343 1.00 0.00 H new ATOM 0 HB3 ALA A 63 279.838 122.958 399.275 1.00 0.00 H new ATOM 1037 N ILE A 64 276.283 123.083 397.773 1.00 0.00 N ATOM 1038 CA ILE A 64 275.180 124.031 397.673 1.00 0.00 C ATOM 1039 C ILE A 64 273.833 123.397 398.098 1.00 0.00 C ATOM 1040 O ILE A 64 273.569 122.250 397.726 1.00 0.00 O ATOM 1041 CB ILE A 64 275.146 124.576 396.232 1.00 0.00 C ATOM 1042 CG1 ILE A 64 274.321 125.873 396.043 1.00 0.00 C ATOM 1043 CG2 ILE A 64 274.689 123.504 395.215 1.00 0.00 C ATOM 1044 CD1 ILE A 64 274.976 127.118 396.653 1.00 0.00 C ATOM 0 H ILE A 64 276.422 122.592 396.890 1.00 0.00 H new ATOM 0 HA ILE A 64 275.339 124.857 398.366 1.00 0.00 H new ATOM 0 HB ILE A 64 276.183 124.845 396.032 1.00 0.00 H new ATOM 0 HG12 ILE A 64 274.165 126.041 394.977 1.00 0.00 H new ATOM 0 HG13 ILE A 64 273.337 125.735 396.491 1.00 0.00 H new ATOM 0 HG21 ILE A 64 274.680 123.933 394.213 1.00 0.00 H new ATOM 0 HG22 ILE A 64 275.378 122.660 395.242 1.00 0.00 H new ATOM 0 HG23 ILE A 64 273.686 123.163 395.472 1.00 0.00 H new ATOM 0 HD11 ILE A 64 274.339 127.986 396.480 1.00 0.00 H new ATOM 0 HD12 ILE A 64 275.107 126.972 397.725 1.00 0.00 H new ATOM 0 HD13 ILE A 64 275.948 127.283 396.188 1.00 0.00 H new ATOM 1056 N PRO A 65 272.942 124.020 398.899 1.00 0.00 N ATOM 1057 CA PRO A 65 271.628 123.462 399.221 1.00 0.00 C ATOM 1058 C PRO A 65 270.578 123.841 398.139 1.00 0.00 C ATOM 1059 O PRO A 65 270.770 124.849 397.453 1.00 0.00 O ATOM 1060 CB PRO A 65 271.329 124.133 400.574 1.00 0.00 C ATOM 1061 CG PRO A 65 271.962 125.527 400.475 1.00 0.00 C ATOM 1062 CD PRO A 65 273.174 125.307 399.561 1.00 0.00 C ATOM 0 HA PRO A 65 271.599 122.373 399.259 1.00 0.00 H new ATOM 0 HB2 PRO A 65 270.256 124.199 400.753 1.00 0.00 H new ATOM 0 HB3 PRO A 65 271.756 123.564 401.400 1.00 0.00 H new ATOM 0 HG2 PRO A 65 271.268 126.254 400.053 1.00 0.00 H new ATOM 0 HG3 PRO A 65 272.261 125.903 401.454 1.00 0.00 H new ATOM 0 HD2 PRO A 65 273.266 126.112 398.832 1.00 0.00 H new ATOM 0 HD3 PRO A 65 274.100 125.291 400.136 1.00 0.00 H new ATOM 1070 N PRO A 66 269.449 123.112 397.943 1.00 0.00 N ATOM 1071 CA PRO A 66 268.397 123.432 396.962 1.00 0.00 C ATOM 1072 C PRO A 66 267.483 124.563 397.482 1.00 0.00 C ATOM 1073 O PRO A 66 266.317 124.328 397.798 1.00 0.00 O ATOM 1074 CB PRO A 66 267.669 122.080 396.815 1.00 0.00 C ATOM 1075 CG PRO A 66 267.773 121.437 398.203 1.00 0.00 C ATOM 1076 CD PRO A 66 269.157 121.883 398.683 1.00 0.00 C ATOM 0 HA PRO A 66 268.765 123.812 396.009 1.00 0.00 H new ATOM 0 HB2 PRO A 66 266.629 122.219 396.518 1.00 0.00 H new ATOM 0 HB3 PRO A 66 268.137 121.457 396.053 1.00 0.00 H new ATOM 0 HG2 PRO A 66 266.983 121.784 398.869 1.00 0.00 H new ATOM 0 HG3 PRO A 66 267.693 120.351 398.152 1.00 0.00 H new ATOM 0 HD2 PRO A 66 269.161 122.062 399.758 1.00 0.00 H new ATOM 0 HD3 PRO A 66 269.907 121.117 398.484 1.00 0.00 H new ATOM 1084 N ALA A 67 268.043 125.789 397.587 1.00 0.00 N ATOM 1085 CA ALA A 67 267.440 126.976 398.143 1.00 0.00 C ATOM 1086 C ALA A 67 268.119 128.188 397.498 1.00 0.00 C ATOM 1087 O ALA A 67 269.195 128.019 396.920 1.00 0.00 O ATOM 1088 CB ALA A 67 267.709 126.964 399.673 1.00 0.00 C ATOM 0 H ALA A 67 268.992 125.965 397.257 1.00 0.00 H new ATOM 0 HA ALA A 67 266.367 127.017 397.958 1.00 0.00 H new ATOM 0 HB1 ALA A 67 267.266 127.850 400.127 1.00 0.00 H new ATOM 0 HB2 ALA A 67 267.266 126.070 400.113 1.00 0.00 H new ATOM 0 HB3 ALA A 67 268.784 126.963 399.853 1.00 0.00 H new ATOM 1094 N PRO A 68 267.541 129.416 397.547 1.00 0.00 N ATOM 1095 CA PRO A 68 268.153 130.657 397.050 1.00 0.00 C ATOM 1096 C PRO A 68 269.197 131.228 398.052 1.00 0.00 C ATOM 1097 O PRO A 68 269.287 130.698 399.162 1.00 0.00 O ATOM 1098 CB PRO A 68 266.916 131.574 396.909 1.00 0.00 C ATOM 1099 CG PRO A 68 266.000 131.164 398.062 1.00 0.00 C ATOM 1100 CD PRO A 68 266.214 129.652 398.127 1.00 0.00 C ATOM 0 HA PRO A 68 268.718 130.537 396.126 1.00 0.00 H new ATOM 0 HB2 PRO A 68 267.192 132.626 396.977 1.00 0.00 H new ATOM 0 HB3 PRO A 68 266.427 131.435 395.945 1.00 0.00 H new ATOM 0 HG2 PRO A 68 266.277 131.654 398.995 1.00 0.00 H new ATOM 0 HG3 PRO A 68 264.959 131.419 397.865 1.00 0.00 H new ATOM 0 HD2 PRO A 68 266.166 129.293 399.155 1.00 0.00 H new ATOM 0 HD3 PRO A 68 265.442 129.122 397.568 1.00 0.00 H new ATOM 1108 N PRO A 69 270.000 132.272 397.742 1.00 0.00 N ATOM 1109 CA PRO A 69 271.017 132.835 398.641 1.00 0.00 C ATOM 1110 C PRO A 69 270.428 133.678 399.791 1.00 0.00 C ATOM 1111 O PRO A 69 269.496 134.455 399.585 1.00 0.00 O ATOM 1112 CB PRO A 69 271.899 133.665 397.686 1.00 0.00 C ATOM 1113 CG PRO A 69 270.963 134.098 396.558 1.00 0.00 C ATOM 1114 CD PRO A 69 270.026 132.900 396.418 1.00 0.00 C ATOM 0 HA PRO A 69 271.570 132.063 399.176 1.00 0.00 H new ATOM 0 HB2 PRO A 69 272.329 134.528 398.195 1.00 0.00 H new ATOM 0 HB3 PRO A 69 272.731 133.074 397.303 1.00 0.00 H new ATOM 0 HG2 PRO A 69 270.420 135.009 396.810 1.00 0.00 H new ATOM 0 HG3 PRO A 69 271.507 134.296 395.634 1.00 0.00 H new ATOM 0 HD2 PRO A 69 269.028 133.215 396.112 1.00 0.00 H new ATOM 0 HD3 PRO A 69 270.387 132.205 395.660 1.00 0.00 H new ATOM 1122 N ALA A 70 270.993 133.511 401.009 1.00 0.00 N ATOM 1123 CA ALA A 70 270.606 134.169 402.242 1.00 0.00 C ATOM 1124 C ALA A 70 271.858 134.191 403.130 1.00 0.00 C ATOM 1125 O ALA A 70 272.789 133.433 402.827 1.00 0.00 O ATOM 1126 CB ALA A 70 269.452 133.383 402.915 1.00 0.00 C ATOM 0 H ALA A 70 271.776 132.872 401.147 1.00 0.00 H new ATOM 0 HA ALA A 70 270.244 135.182 402.068 1.00 0.00 H new ATOM 0 HB1 ALA A 70 269.164 133.881 403.841 1.00 0.00 H new ATOM 0 HB2 ALA A 70 268.596 133.346 402.242 1.00 0.00 H new ATOM 0 HB3 ALA A 70 269.783 132.368 403.136 1.00 0.00 H new ATOM 1132 N PRO A 71 271.980 135.026 404.197 1.00 0.00 N ATOM 1133 CA PRO A 71 273.146 135.066 405.089 1.00 0.00 C ATOM 1134 C PRO A 71 273.072 133.971 406.183 1.00 0.00 C ATOM 1135 O PRO A 71 272.017 133.345 406.312 1.00 0.00 O ATOM 1136 CB PRO A 71 273.034 136.487 405.684 1.00 0.00 C ATOM 1137 CG PRO A 71 271.529 136.736 405.802 1.00 0.00 C ATOM 1138 CD PRO A 71 270.968 136.018 404.569 1.00 0.00 C ATOM 0 HA PRO A 71 274.094 134.873 404.587 1.00 0.00 H new ATOM 0 HB2 PRO A 71 273.524 136.550 406.656 1.00 0.00 H new ATOM 0 HB3 PRO A 71 273.509 137.226 405.039 1.00 0.00 H new ATOM 0 HG2 PRO A 71 271.123 136.328 406.727 1.00 0.00 H new ATOM 0 HG3 PRO A 71 271.293 137.800 405.793 1.00 0.00 H new ATOM 0 HD2 PRO A 71 270.014 135.540 404.794 1.00 0.00 H new ATOM 0 HD3 PRO A 71 270.789 136.720 403.754 1.00 0.00 H new ATOM 1146 N PRO A 72 274.125 133.680 406.975 1.00 0.00 N ATOM 1147 CA PRO A 72 274.097 132.665 408.030 1.00 0.00 C ATOM 1148 C PRO A 72 273.422 133.139 409.335 1.00 0.00 C ATOM 1149 O PRO A 72 273.399 134.322 409.673 1.00 0.00 O ATOM 1150 CB PRO A 72 275.590 132.333 408.214 1.00 0.00 C ATOM 1151 CG PRO A 72 276.320 133.637 407.884 1.00 0.00 C ATOM 1152 CD PRO A 72 275.450 134.277 406.812 1.00 0.00 C ATOM 0 HA PRO A 72 273.490 131.801 407.761 1.00 0.00 H new ATOM 0 HB2 PRO A 72 275.801 132.008 409.233 1.00 0.00 H new ATOM 0 HB3 PRO A 72 275.901 131.526 407.551 1.00 0.00 H new ATOM 0 HG2 PRO A 72 276.411 134.278 408.761 1.00 0.00 H new ATOM 0 HG3 PRO A 72 277.330 133.449 407.520 1.00 0.00 H new ATOM 0 HD2 PRO A 72 275.410 135.359 406.934 1.00 0.00 H new ATOM 0 HD3 PRO A 72 275.848 134.083 405.816 1.00 0.00 H new ATOM 1160 N LEU A 73 272.858 132.177 410.103 1.00 0.00 N ATOM 1161 CA LEU A 73 272.157 132.378 411.369 1.00 0.00 C ATOM 1162 C LEU A 73 272.866 131.613 412.487 1.00 0.00 C ATOM 1163 O LEU A 73 273.477 130.574 412.240 1.00 0.00 O ATOM 1164 CB LEU A 73 270.682 131.894 411.208 1.00 0.00 C ATOM 1165 CG LEU A 73 269.712 132.093 412.410 1.00 0.00 C ATOM 1166 CD1 LEU A 73 269.591 133.561 412.863 1.00 0.00 C ATOM 1167 CD2 LEU A 73 268.307 131.534 412.104 1.00 0.00 C ATOM 0 H LEU A 73 272.888 131.194 409.832 1.00 0.00 H new ATOM 0 HA LEU A 73 272.159 133.435 411.635 1.00 0.00 H new ATOM 0 HB2 LEU A 73 270.255 132.406 410.346 1.00 0.00 H new ATOM 0 HB3 LEU A 73 270.704 130.831 410.969 1.00 0.00 H new ATOM 0 HG LEU A 73 270.157 131.531 413.231 1.00 0.00 H new ATOM 0 HD11 LEU A 73 268.900 133.627 413.703 1.00 0.00 H new ATOM 0 HD12 LEU A 73 270.570 133.929 413.169 1.00 0.00 H new ATOM 0 HD13 LEU A 73 269.217 134.167 412.038 1.00 0.00 H new ATOM 0 HD21 LEU A 73 267.658 131.691 412.965 1.00 0.00 H new ATOM 0 HD22 LEU A 73 267.891 132.049 411.238 1.00 0.00 H new ATOM 0 HD23 LEU A 73 268.378 130.467 411.892 1.00 0.00 H new ATOM 1179 N THR A 74 272.786 132.113 413.753 1.00 0.00 N ATOM 1180 CA THR A 74 273.364 131.521 414.966 1.00 0.00 C ATOM 1181 C THR A 74 272.304 130.646 415.642 1.00 0.00 C ATOM 1182 O THR A 74 271.190 131.102 415.899 1.00 0.00 O ATOM 1183 CB THR A 74 273.854 132.586 415.975 1.00 0.00 C ATOM 1184 OG1 THR A 74 274.597 133.612 415.323 1.00 0.00 O ATOM 1185 CG2 THR A 74 274.793 131.964 417.027 1.00 0.00 C ATOM 0 H THR A 74 272.290 132.982 413.950 1.00 0.00 H new ATOM 0 HA THR A 74 274.231 130.934 414.664 1.00 0.00 H new ATOM 0 HB THR A 74 272.959 132.995 416.445 1.00 0.00 H new ATOM 0 HG1 THR A 74 274.893 134.272 415.984 1.00 0.00 H new ATOM 0 HG21 THR A 74 275.122 132.736 417.723 1.00 0.00 H new ATOM 0 HG22 THR A 74 274.262 131.185 417.574 1.00 0.00 H new ATOM 0 HG23 THR A 74 275.661 131.531 416.529 1.00 0.00 H new ATOM 1193 N LEU A 75 272.604 129.360 416.004 1.00 0.00 N ATOM 1194 CA LEU A 75 271.733 128.400 416.665 1.00 0.00 C ATOM 1195 C LEU A 75 271.756 128.602 418.176 1.00 0.00 C ATOM 1196 O LEU A 75 272.130 127.754 418.979 1.00 0.00 O ATOM 1197 CB LEU A 75 272.057 126.929 416.261 1.00 0.00 C ATOM 1198 CG LEU A 75 273.526 126.448 416.434 1.00 0.00 C ATOM 1199 CD1 LEU A 75 273.601 124.965 416.857 1.00 0.00 C ATOM 1200 CD2 LEU A 75 274.388 126.657 415.172 1.00 0.00 C ATOM 0 H LEU A 75 273.526 128.965 415.819 1.00 0.00 H new ATOM 0 HA LEU A 75 270.716 128.587 416.321 1.00 0.00 H new ATOM 0 HB2 LEU A 75 271.415 126.270 416.846 1.00 0.00 H new ATOM 0 HB3 LEU A 75 271.780 126.798 415.215 1.00 0.00 H new ATOM 0 HG LEU A 75 273.934 127.073 417.228 1.00 0.00 H new ATOM 0 HD11 LEU A 75 274.645 124.670 416.967 1.00 0.00 H new ATOM 0 HD12 LEU A 75 273.084 124.831 417.807 1.00 0.00 H new ATOM 0 HD13 LEU A 75 273.127 124.345 416.096 1.00 0.00 H new ATOM 0 HD21 LEU A 75 275.401 126.301 415.360 1.00 0.00 H new ATOM 0 HD22 LEU A 75 273.956 126.101 414.340 1.00 0.00 H new ATOM 0 HD23 LEU A 75 274.417 127.718 414.923 1.00 0.00 H new ATOM 1212 N SER A 76 271.318 129.809 418.579 1.00 0.00 N ATOM 1213 CA SER A 76 271.244 130.281 419.942 1.00 0.00 C ATOM 1214 C SER A 76 269.937 131.026 420.100 1.00 0.00 C ATOM 1215 O SER A 76 269.886 132.161 420.564 1.00 0.00 O ATOM 1216 CB SER A 76 272.480 131.142 420.307 1.00 0.00 C ATOM 1217 OG SER A 76 272.602 132.322 419.502 1.00 0.00 O ATOM 0 H SER A 76 270.992 130.508 417.912 1.00 0.00 H new ATOM 0 HA SER A 76 271.262 129.445 420.642 1.00 0.00 H new ATOM 0 HB2 SER A 76 272.417 131.430 421.356 1.00 0.00 H new ATOM 0 HB3 SER A 76 273.381 130.539 420.196 1.00 0.00 H new ATOM 0 HG SER A 76 271.779 132.850 419.569 1.00 0.00 H new ATOM 1223 N LYS A 77 268.857 130.343 419.677 1.00 0.00 N ATOM 1224 CA LYS A 77 267.472 130.752 419.738 1.00 0.00 C ATOM 1225 C LYS A 77 266.806 129.408 419.893 1.00 0.00 C ATOM 1226 O LYS A 77 266.878 128.583 418.984 1.00 0.00 O ATOM 1227 CB LYS A 77 267.033 131.534 418.469 1.00 0.00 C ATOM 1228 CG LYS A 77 265.671 132.251 418.576 1.00 0.00 C ATOM 1229 CD LYS A 77 264.436 131.366 418.320 1.00 0.00 C ATOM 1230 CE LYS A 77 263.118 132.153 418.251 1.00 0.00 C ATOM 1231 NZ LYS A 77 262.811 132.806 419.545 1.00 0.00 N1+ ATOM 0 H LYS A 77 268.956 129.421 419.253 1.00 0.00 H new ATOM 0 HA LYS A 77 267.226 131.457 420.532 1.00 0.00 H new ATOM 0 HB2 LYS A 77 267.798 132.275 418.236 1.00 0.00 H new ATOM 0 HB3 LYS A 77 266.995 130.840 417.629 1.00 0.00 H new ATOM 0 HG2 LYS A 77 265.585 132.685 419.572 1.00 0.00 H new ATOM 0 HG3 LYS A 77 265.658 133.078 417.866 1.00 0.00 H new ATOM 0 HD2 LYS A 77 264.575 130.824 417.384 1.00 0.00 H new ATOM 0 HD3 LYS A 77 264.363 130.621 419.112 1.00 0.00 H new ATOM 0 HE2 LYS A 77 263.183 132.908 417.467 1.00 0.00 H new ATOM 0 HE3 LYS A 77 262.305 131.481 417.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 261.916 133.329 419.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 262.725 132.083 420.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 263.577 133.465 419.791 1.00 0.00 H new ATOM 1245 N LEU A 78 266.257 129.100 421.102 1.00 0.00 N ATOM 1246 CA LEU A 78 265.667 127.816 421.515 1.00 0.00 C ATOM 1247 C LEU A 78 266.722 126.758 421.897 1.00 0.00 C ATOM 1248 O LEU A 78 266.577 126.024 422.871 1.00 0.00 O ATOM 1249 CB LEU A 78 264.575 127.271 420.540 1.00 0.00 C ATOM 1250 CG LEU A 78 263.596 126.233 421.141 1.00 0.00 C ATOM 1251 CD1 LEU A 78 262.677 126.852 422.210 1.00 0.00 C ATOM 1252 CD2 LEU A 78 262.743 125.594 420.033 1.00 0.00 C ATOM 0 H LEU A 78 266.218 129.791 421.852 1.00 0.00 H new ATOM 0 HA LEU A 78 265.127 128.044 422.434 1.00 0.00 H new ATOM 0 HB2 LEU A 78 263.996 128.115 420.165 1.00 0.00 H new ATOM 0 HB3 LEU A 78 265.073 126.819 419.682 1.00 0.00 H new ATOM 0 HG LEU A 78 264.202 125.467 421.625 1.00 0.00 H new ATOM 0 HD11 LEU A 78 262.008 126.086 422.603 1.00 0.00 H new ATOM 0 HD12 LEU A 78 263.283 127.255 423.021 1.00 0.00 H new ATOM 0 HD13 LEU A 78 262.088 127.654 421.764 1.00 0.00 H new ATOM 0 HD21 LEU A 78 262.060 124.867 420.473 1.00 0.00 H new ATOM 0 HD22 LEU A 78 262.169 126.368 419.523 1.00 0.00 H new ATOM 0 HD23 LEU A 78 263.394 125.093 419.316 1.00 0.00 H new ATOM 1264 N GLU A 79 267.843 126.724 421.112 1.00 0.00 N ATOM 1265 CA GLU A 79 269.040 125.889 421.201 1.00 0.00 C ATOM 1266 C GLU A 79 270.091 126.406 422.187 1.00 0.00 C ATOM 1267 O GLU A 79 271.139 125.792 422.383 1.00 0.00 O ATOM 1268 CB GLU A 79 269.677 125.710 419.789 1.00 0.00 C ATOM 1269 CG GLU A 79 268.637 125.174 418.783 1.00 0.00 C ATOM 1270 CD GLU A 79 269.291 124.792 417.458 1.00 0.00 C ATOM 1271 OE1 GLU A 79 268.911 125.389 416.414 1.00 0.00 O ATOM 1272 OE2 GLU A 79 270.172 123.890 417.468 1.00 0.00 O1- ATOM 0 H GLU A 79 267.917 127.361 420.319 1.00 0.00 H new ATOM 0 HA GLU A 79 268.705 124.928 421.591 1.00 0.00 H new ATOM 0 HB2 GLU A 79 270.070 126.664 419.439 1.00 0.00 H new ATOM 0 HB3 GLU A 79 270.520 125.021 419.850 1.00 0.00 H new ATOM 0 HG2 GLU A 79 268.133 124.305 419.206 1.00 0.00 H new ATOM 0 HG3 GLU A 79 267.873 125.932 418.609 1.00 0.00 H new ATOM 1279 N HIS A 80 269.784 127.550 422.860 1.00 0.00 N ATOM 1280 CA HIS A 80 270.553 128.234 423.896 1.00 0.00 C ATOM 1281 C HIS A 80 270.443 127.553 425.264 1.00 0.00 C ATOM 1282 O HIS A 80 269.375 127.531 425.881 1.00 0.00 O ATOM 1283 CB HIS A 80 270.124 129.739 423.995 1.00 0.00 C ATOM 1284 CG HIS A 80 268.632 130.028 423.946 1.00 0.00 C ATOM 1285 ND1 HIS A 80 267.675 129.349 424.670 1.00 0.00 N ATOM 1286 CD2 HIS A 80 267.951 130.973 423.243 1.00 0.00 C ATOM 1287 CE1 HIS A 80 266.473 129.891 424.358 1.00 0.00 C ATOM 1288 NE2 HIS A 80 266.589 130.874 423.484 1.00 0.00 N ATOM 0 H HIS A 80 268.915 128.046 422.662 1.00 0.00 H new ATOM 0 HA HIS A 80 271.600 128.178 423.600 1.00 0.00 H new ATOM 0 HB2 HIS A 80 270.519 130.145 424.926 1.00 0.00 H new ATOM 0 HB3 HIS A 80 270.603 130.284 423.181 1.00 0.00 H new ATOM 0 HD1 HIS A 80 267.841 128.581 425.320 1.00 0.00 H new ATOM 0 HD2 HIS A 80 268.408 131.700 422.588 1.00 0.00 H new ATOM 0 HE1 HIS A 80 265.533 129.559 424.774 1.00 0.00 H new TER 1296 HIS A 80