USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 653 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 TYR OH : rot -53:sc= 0.345 USER MOD Set 1.2: A 49 ASN :FLIP amide:sc= 1.34 F(o=0.85,f=1.7) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 143:sc= 0.911 (180deg=0.154) USER MOD Single : A 4 TYR OH : rot -141:sc= 0.127 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot -155:sc= 1.26 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= -0.695 F(o=-2.8,f=-0.69) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 HIS :FLIP no HD1:sc= -2.55! C(o=-3.1!,f=-2.6!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 100:sc= 0.0383 USER MOD Single : A 33 SER OG : rot 44:sc= 1.85 USER MOD Single : A 44 SER OG : rot 180:sc= 0.0196 USER MOD Single : A 45 SER OG : rot -130:sc= -0.106 USER MOD Single : A 47 HIS : no HD1:sc= 0.176 K(o=0.18,f=-2.7!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0174) USER MOD Single : A 54 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00511) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 172:sc= 1.01 USER MOD Single : A 62 LYS NZ :NH3+ 163:sc= -0.688 (180deg=-1.17) USER MOD Single : A 74 THR OG1 : rot 32:sc= 0.25 USER MOD Single : A 76 SER OG : rot 64:sc= 0.289 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 281.445 120.994 404.990 1.00 0.00 N ATOM 2 CA MET A 0 282.144 122.151 404.502 1.00 0.00 C ATOM 3 C MET A 0 283.624 121.847 404.673 1.00 0.00 C ATOM 4 O MET A 0 284.339 122.483 405.449 1.00 0.00 O ATOM 5 CB MET A 0 281.685 123.504 405.147 1.00 0.00 C ATOM 6 CG MET A 0 280.166 123.821 405.022 1.00 0.00 C ATOM 7 SD MET A 0 279.111 122.915 406.207 1.00 0.00 S ATOM 8 CE MET A 0 277.511 123.328 405.454 1.00 0.00 C ATOM 0 H1 MET A 0 280.578 121.293 405.481 1.00 0.00 H new ATOM 0 H2 MET A 0 281.195 120.377 404.191 1.00 0.00 H new ATOM 0 H3 MET A 0 282.055 120.473 405.652 1.00 0.00 H new ATOM 0 HA MET A 0 281.908 122.324 403.452 1.00 0.00 H new ATOM 0 HB2 MET A 0 281.951 123.492 406.204 1.00 0.00 H new ATOM 0 HB3 MET A 0 282.248 124.316 404.686 1.00 0.00 H new ATOM 0 HG2 MET A 0 280.017 124.891 405.165 1.00 0.00 H new ATOM 0 HG3 MET A 0 279.840 123.586 404.009 1.00 0.00 H new ATOM 0 HE1 MET A 0 276.708 122.867 406.030 1.00 0.00 H new ATOM 0 HE2 MET A 0 277.379 124.410 405.450 1.00 0.00 H new ATOM 0 HE3 MET A 0 277.484 122.955 404.430 1.00 0.00 H new ATOM 18 N GLY A 1 284.109 120.818 403.910 1.00 0.00 N ATOM 19 CA GLY A 1 285.485 120.290 403.881 1.00 0.00 C ATOM 20 C GLY A 1 286.430 121.105 403.027 1.00 0.00 C ATOM 21 O GLY A 1 287.590 121.323 403.367 1.00 0.00 O ATOM 0 H GLY A 1 283.501 120.314 403.264 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.871 120.251 404.899 1.00 0.00 H new ATOM 0 HA3 GLY A 1 285.464 119.266 403.509 1.00 0.00 H new ATOM 25 N ILE A 2 285.905 121.655 401.900 1.00 0.00 N ATOM 26 CA ILE A 2 286.582 122.660 401.088 1.00 0.00 C ATOM 27 C ILE A 2 285.756 123.900 401.385 1.00 0.00 C ATOM 28 O ILE A 2 284.524 123.843 401.449 1.00 0.00 O ATOM 29 CB ILE A 2 286.598 122.545 399.555 1.00 0.00 C ATOM 30 CG1 ILE A 2 287.065 121.237 398.901 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.543 123.653 399.024 1.00 0.00 C ATOM 32 CD1 ILE A 2 286.093 120.084 399.006 1.00 0.00 C ATOM 0 H ILE A 2 284.986 121.398 401.539 1.00 0.00 H new ATOM 0 HA ILE A 2 287.639 122.604 401.348 1.00 0.00 H new ATOM 0 HB ILE A 2 285.544 122.618 399.288 1.00 0.00 H new ATOM 0 HG12 ILE A 2 287.266 121.428 397.847 1.00 0.00 H new ATOM 0 HG13 ILE A 2 288.009 120.938 399.356 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.583 123.606 397.936 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.168 124.629 399.332 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.543 123.504 399.431 1.00 0.00 H new ATOM 0 HD11 ILE A 2 286.514 119.207 398.514 1.00 0.00 H new ATOM 0 HD12 ILE A 2 285.909 119.858 400.056 1.00 0.00 H new ATOM 0 HD13 ILE A 2 285.154 120.355 398.523 1.00 0.00 H new ATOM 44 N ASP A 3 286.417 125.063 401.524 1.00 0.00 N ATOM 45 CA ASP A 3 285.793 126.288 401.937 1.00 0.00 C ATOM 46 C ASP A 3 284.991 127.037 400.887 1.00 0.00 C ATOM 47 O ASP A 3 285.308 128.162 400.564 1.00 0.00 O ATOM 48 CB ASP A 3 287.081 127.210 402.164 1.00 0.00 C ATOM 49 CG ASP A 3 288.033 127.196 400.916 1.00 0.00 C ATOM 50 OD1 ASP A 3 288.832 126.235 400.777 1.00 0.00 O ATOM 51 OD2 ASP A 3 287.921 128.114 400.062 1.00 0.00 O1- ATOM 0 H ASP A 3 287.417 125.157 401.344 1.00 0.00 H new ATOM 0 HA ASP A 3 285.100 126.078 402.752 1.00 0.00 H new ATOM 0 HB2 ASP A 3 286.765 128.233 402.369 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.627 126.863 403.042 1.00 0.00 H new ATOM 56 N TYR A 4 283.890 126.484 400.362 1.00 0.00 N ATOM 57 CA TYR A 4 282.817 127.143 399.655 1.00 0.00 C ATOM 58 C TYR A 4 281.746 127.922 400.394 1.00 0.00 C ATOM 59 O TYR A 4 281.529 129.100 400.170 1.00 0.00 O ATOM 60 CB TYR A 4 282.380 126.448 398.372 1.00 0.00 C ATOM 61 CG TYR A 4 283.470 125.683 397.752 1.00 0.00 C ATOM 62 CD1 TYR A 4 283.536 124.314 397.877 1.00 0.00 C ATOM 63 CD2 TYR A 4 284.359 126.349 396.950 1.00 0.00 C ATOM 64 CE1 TYR A 4 284.515 123.623 397.203 1.00 0.00 C ATOM 65 CE2 TYR A 4 285.331 125.650 396.302 1.00 0.00 C ATOM 66 CZ TYR A 4 285.479 124.300 396.487 1.00 0.00 C ATOM 67 OH TYR A 4 286.507 123.610 395.811 1.00 0.00 O ATOM 0 H TYR A 4 283.727 125.480 400.434 1.00 0.00 H new ATOM 0 HA TYR A 4 283.374 128.031 399.356 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.548 125.779 398.590 1.00 0.00 H new ATOM 0 HB3 TYR A 4 282.014 127.192 397.665 1.00 0.00 H new ATOM 0 HD1 TYR A 4 282.826 123.788 398.498 1.00 0.00 H new ATOM 0 HD2 TYR A 4 284.289 127.420 396.833 1.00 0.00 H new ATOM 0 HE1 TYR A 4 284.529 122.544 397.235 1.00 0.00 H new ATOM 0 HE2 TYR A 4 285.998 126.169 395.630 1.00 0.00 H new ATOM 0 HH TYR A 4 287.350 124.101 395.909 1.00 0.00 H new ATOM 77 N SER A 5 280.935 127.184 401.217 1.00 0.00 N ATOM 78 CA SER A 5 279.573 127.514 401.697 1.00 0.00 C ATOM 79 C SER A 5 279.328 128.828 402.445 1.00 0.00 C ATOM 80 O SER A 5 278.478 129.600 402.014 1.00 0.00 O ATOM 81 CB SER A 5 278.979 126.315 402.498 1.00 0.00 C ATOM 82 OG SER A 5 279.013 125.104 401.728 1.00 0.00 O ATOM 0 H SER A 5 281.247 126.284 401.581 1.00 0.00 H new ATOM 0 HA SER A 5 279.049 127.699 400.759 1.00 0.00 H new ATOM 0 HB2 SER A 5 279.542 126.177 403.421 1.00 0.00 H new ATOM 0 HB3 SER A 5 277.951 126.539 402.782 1.00 0.00 H new ATOM 0 HG SER A 5 278.636 124.370 402.256 1.00 0.00 H new ATOM 88 N GLY A 6 280.169 129.205 403.453 1.00 0.00 N ATOM 89 CA GLY A 6 280.407 130.515 404.067 1.00 0.00 C ATOM 90 C GLY A 6 280.833 131.565 403.069 1.00 0.00 C ATOM 91 O GLY A 6 280.446 132.715 403.090 1.00 0.00 O ATOM 0 H GLY A 6 280.759 128.501 403.896 1.00 0.00 H new ATOM 0 HA2 GLY A 6 279.497 130.846 404.568 1.00 0.00 H new ATOM 0 HA3 GLY A 6 281.176 130.417 404.833 1.00 0.00 H new ATOM 95 N LEU A 7 281.638 131.209 402.048 1.00 0.00 N ATOM 96 CA LEU A 7 282.080 132.144 401.024 1.00 0.00 C ATOM 97 C LEU A 7 280.959 132.465 400.006 1.00 0.00 C ATOM 98 O LEU A 7 280.783 133.617 399.609 1.00 0.00 O ATOM 99 CB LEU A 7 283.424 131.713 400.399 1.00 0.00 C ATOM 100 CG LEU A 7 284.621 131.518 401.387 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.409 130.481 402.512 1.00 0.00 C ATOM 102 CD2 LEU A 7 285.781 130.972 400.585 1.00 0.00 C ATOM 0 H LEU A 7 281.994 130.262 401.921 1.00 0.00 H new ATOM 0 HA LEU A 7 282.290 133.100 401.504 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.267 130.776 399.864 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.711 132.459 399.658 1.00 0.00 H new ATOM 0 HG LEU A 7 284.766 132.493 401.853 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.303 130.431 403.134 1.00 0.00 H new ATOM 0 HD12 LEU A 7 283.557 130.777 403.124 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.217 129.502 402.073 1.00 0.00 H new ATOM 0 HD21 LEU A 7 286.638 130.822 401.241 1.00 0.00 H new ATOM 0 HD22 LEU A 7 285.497 130.020 400.136 1.00 0.00 H new ATOM 0 HD23 LEU A 7 286.045 131.680 399.799 1.00 0.00 H new ATOM 114 N ARG A 8 280.111 131.453 399.638 1.00 0.00 N ATOM 115 CA ARG A 8 278.899 131.640 398.830 1.00 0.00 C ATOM 116 C ARG A 8 277.763 132.383 399.516 1.00 0.00 C ATOM 117 O ARG A 8 277.079 133.206 398.912 1.00 0.00 O ATOM 118 CB ARG A 8 278.334 130.331 398.150 1.00 0.00 C ATOM 119 CG ARG A 8 279.270 129.096 398.068 1.00 0.00 C ATOM 120 CD ARG A 8 278.783 128.003 397.087 1.00 0.00 C ATOM 121 NE ARG A 8 279.666 126.741 397.048 1.00 0.00 N ATOM 122 CZ ARG A 8 279.265 125.605 397.692 1.00 0.00 C ATOM 123 NH1 ARG A 8 278.438 125.660 398.770 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.782 124.416 397.263 1.00 0.00 N ATOM 0 H ARG A 8 280.268 130.481 399.906 1.00 0.00 H new ATOM 0 HA ARG A 8 279.285 132.286 398.041 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.435 130.034 398.690 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.027 130.586 397.136 1.00 0.00 H new ATOM 0 HG2 ARG A 8 280.264 129.425 397.765 1.00 0.00 H new ATOM 0 HG3 ARG A 8 279.368 128.660 399.062 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.768 127.713 397.360 1.00 0.00 H new ATOM 0 HD3 ARG A 8 278.734 128.428 396.084 1.00 0.00 H new ATOM 0 HE ARG A 8 280.551 126.754 396.541 1.00 0.00 H new ATOM 0 HH11 ARG A 8 278.105 126.561 399.112 1.00 0.00 H new ATOM 0 HH12 ARG A 8 278.150 124.800 399.237 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.444 124.398 396.487 1.00 0.00 H new ATOM 0 HH22 ARG A 8 279.507 123.546 397.719 1.00 0.00 H new ATOM 138 N THR A 9 277.556 132.087 400.817 1.00 0.00 N ATOM 139 CA THR A 9 276.526 132.689 401.656 1.00 0.00 C ATOM 140 C THR A 9 276.898 134.055 402.249 1.00 0.00 C ATOM 141 O THR A 9 276.024 134.891 402.470 1.00 0.00 O ATOM 142 CB THR A 9 276.022 131.622 402.606 1.00 0.00 C ATOM 143 OG1 THR A 9 274.668 131.804 402.981 1.00 0.00 O ATOM 144 CG2 THR A 9 276.897 131.423 403.856 1.00 0.00 C ATOM 0 H THR A 9 278.123 131.402 401.316 1.00 0.00 H new ATOM 0 HA THR A 9 275.675 133.003 401.051 1.00 0.00 H new ATOM 0 HB THR A 9 276.093 130.706 402.020 1.00 0.00 H new ATOM 0 HG1 THR A 9 274.506 131.369 403.844 1.00 0.00 H new ATOM 0 HG21 THR A 9 276.465 130.642 404.482 1.00 0.00 H new ATOM 0 HG22 THR A 9 277.903 131.131 403.553 1.00 0.00 H new ATOM 0 HG23 THR A 9 276.944 132.355 404.419 1.00 0.00 H new ATOM 152 N ILE A 10 278.218 134.336 402.475 1.00 0.00 N ATOM 153 CA ILE A 10 278.747 135.626 402.934 1.00 0.00 C ATOM 154 C ILE A 10 279.200 136.524 401.748 1.00 0.00 C ATOM 155 O ILE A 10 279.051 137.741 401.860 1.00 0.00 O ATOM 156 CB ILE A 10 279.822 135.503 404.068 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.341 134.515 405.171 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.159 136.860 404.719 1.00 0.00 C ATOM 159 CD1 ILE A 10 280.340 133.911 406.163 1.00 0.00 C ATOM 0 H ILE A 10 278.950 133.640 402.334 1.00 0.00 H new ATOM 0 HA ILE A 10 277.912 136.140 403.410 1.00 0.00 H new ATOM 0 HB ILE A 10 280.728 135.125 403.593 1.00 0.00 H new ATOM 0 HG12 ILE A 10 278.579 135.031 405.755 1.00 0.00 H new ATOM 0 HG13 ILE A 10 278.847 133.685 404.666 1.00 0.00 H new ATOM 0 HG21 ILE A 10 280.908 136.714 405.497 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.549 137.540 403.962 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.257 137.286 405.159 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.814 133.249 406.852 1.00 0.00 H new ATOM 0 HD12 ILE A 10 281.095 133.343 405.619 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.823 134.710 406.725 1.00 0.00 H new ATOM 171 N PHE A 11 279.773 136.033 400.588 1.00 0.00 N ATOM 172 CA PHE A 11 280.297 136.961 399.557 1.00 0.00 C ATOM 173 C PHE A 11 279.516 136.908 398.248 1.00 0.00 C ATOM 174 O PHE A 11 279.603 137.818 397.421 1.00 0.00 O ATOM 175 CB PHE A 11 281.837 136.817 399.326 1.00 0.00 C ATOM 176 CG PHE A 11 282.526 136.801 400.673 1.00 0.00 C ATOM 177 CD1 PHE A 11 282.626 137.922 401.480 1.00 0.00 C ATOM 178 CD2 PHE A 11 282.927 135.591 401.190 1.00 0.00 C ATOM 179 CE1 PHE A 11 283.115 137.810 402.768 1.00 0.00 C ATOM 180 CE2 PHE A 11 283.325 135.453 402.503 1.00 0.00 C ATOM 181 CZ PHE A 11 283.484 136.579 403.279 1.00 0.00 C ATOM 0 H PHE A 11 279.873 135.042 400.366 1.00 0.00 H new ATOM 0 HA PHE A 11 280.139 137.958 399.968 1.00 0.00 H new ATOM 0 HB2 PHE A 11 282.054 135.899 398.779 1.00 0.00 H new ATOM 0 HB3 PHE A 11 282.208 137.644 398.721 1.00 0.00 H new ATOM 0 HD1 PHE A 11 282.321 138.887 401.102 1.00 0.00 H new ATOM 0 HD2 PHE A 11 282.930 134.723 400.548 1.00 0.00 H new ATOM 0 HE1 PHE A 11 283.210 138.693 403.382 1.00 0.00 H new ATOM 0 HE2 PHE A 11 283.510 134.473 402.918 1.00 0.00 H new ATOM 0 HZ PHE A 11 283.892 136.502 404.276 1.00 0.00 H new ATOM 191 N GLY A 12 278.677 135.856 398.049 1.00 0.00 N ATOM 192 CA GLY A 12 277.736 135.733 396.938 1.00 0.00 C ATOM 193 C GLY A 12 278.291 135.142 395.666 1.00 0.00 C ATOM 194 O GLY A 12 278.327 133.923 395.492 1.00 0.00 O ATOM 0 H GLY A 12 278.648 135.057 398.682 1.00 0.00 H new ATOM 0 HA2 GLY A 12 276.897 135.119 397.265 1.00 0.00 H new ATOM 0 HA3 GLY A 12 277.339 136.723 396.713 1.00 0.00 H new ATOM 198 N GLU A 13 278.723 136.022 394.724 1.00 0.00 N ATOM 199 CA GLU A 13 279.155 135.730 393.357 1.00 0.00 C ATOM 200 C GLU A 13 280.461 134.966 393.140 1.00 0.00 C ATOM 201 O GLU A 13 280.513 134.044 392.330 1.00 0.00 O ATOM 202 CB GLU A 13 279.174 137.061 392.551 1.00 0.00 C ATOM 203 CG GLU A 13 279.311 136.909 391.021 1.00 0.00 C ATOM 204 CD GLU A 13 279.190 138.280 390.356 1.00 0.00 C ATOM 205 OE1 GLU A 13 280.065 139.146 390.623 1.00 0.00 O ATOM 206 OE2 GLU A 13 278.225 138.477 389.571 1.00 0.00 O1- ATOM 0 H GLU A 13 278.777 137.020 394.928 1.00 0.00 H new ATOM 0 HA GLU A 13 278.416 135.012 393.002 1.00 0.00 H new ATOM 0 HB2 GLU A 13 278.255 137.607 392.764 1.00 0.00 H new ATOM 0 HB3 GLU A 13 280.000 137.673 392.913 1.00 0.00 H new ATOM 0 HG2 GLU A 13 280.272 136.458 390.775 1.00 0.00 H new ATOM 0 HG3 GLU A 13 278.539 136.240 390.641 1.00 0.00 H new ATOM 213 N LYS A 14 281.561 135.336 393.833 1.00 0.00 N ATOM 214 CA LYS A 14 282.851 134.694 393.652 1.00 0.00 C ATOM 215 C LYS A 14 283.519 134.596 395.003 1.00 0.00 C ATOM 216 O LYS A 14 283.066 135.152 396.004 1.00 0.00 O ATOM 217 CB LYS A 14 283.743 135.445 392.609 1.00 0.00 C ATOM 218 CG LYS A 14 284.794 134.575 391.880 1.00 0.00 C ATOM 219 CD LYS A 14 286.260 134.962 392.154 1.00 0.00 C ATOM 220 CE LYS A 14 286.661 136.310 391.538 1.00 0.00 C ATOM 221 NZ LYS A 14 288.087 136.617 391.800 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.564 136.085 394.526 1.00 0.00 H new ATOM 0 HA LYS A 14 282.706 133.695 393.241 1.00 0.00 H new ATOM 0 HB2 LYS A 14 283.093 135.900 391.862 1.00 0.00 H new ATOM 0 HB3 LYS A 14 284.261 136.258 393.118 1.00 0.00 H new ATOM 0 HG2 LYS A 14 284.648 133.535 392.171 1.00 0.00 H new ATOM 0 HG3 LYS A 14 284.612 134.635 390.807 1.00 0.00 H new ATOM 0 HD2 LYS A 14 286.422 135.001 393.231 1.00 0.00 H new ATOM 0 HD3 LYS A 14 286.913 134.183 391.761 1.00 0.00 H new ATOM 0 HE2 LYS A 14 286.483 136.289 390.463 1.00 0.00 H new ATOM 0 HE3 LYS A 14 286.035 137.101 391.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 288.329 137.533 391.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 288.250 136.660 392.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 288.684 135.873 391.386 1.00 0.00 H new ATOM 235 N LEU A 15 284.646 133.863 395.036 1.00 0.00 N ATOM 236 CA LEU A 15 285.469 133.595 396.187 1.00 0.00 C ATOM 237 C LEU A 15 286.446 134.740 396.529 1.00 0.00 C ATOM 238 O LEU A 15 287.082 135.279 395.619 1.00 0.00 O ATOM 239 CB LEU A 15 286.309 132.347 395.843 1.00 0.00 C ATOM 240 CG LEU A 15 285.572 131.017 395.961 1.00 0.00 C ATOM 241 CD1 LEU A 15 286.315 129.917 395.214 1.00 0.00 C ATOM 242 CD2 LEU A 15 285.519 130.633 397.430 1.00 0.00 C ATOM 0 H LEU A 15 285.014 133.421 394.194 1.00 0.00 H new ATOM 0 HA LEU A 15 284.816 133.467 397.050 1.00 0.00 H new ATOM 0 HB2 LEU A 15 286.681 132.449 394.824 1.00 0.00 H new ATOM 0 HB3 LEU A 15 287.179 132.322 396.499 1.00 0.00 H new ATOM 0 HG LEU A 15 284.574 131.127 395.536 1.00 0.00 H new ATOM 0 HD11 LEU A 15 285.770 128.978 395.313 1.00 0.00 H new ATOM 0 HD12 LEU A 15 286.393 130.182 394.160 1.00 0.00 H new ATOM 0 HD13 LEU A 15 287.314 129.803 395.634 1.00 0.00 H new ATOM 0 HD21 LEU A 15 284.995 129.683 397.539 1.00 0.00 H new ATOM 0 HD22 LEU A 15 286.533 130.535 397.817 1.00 0.00 H new ATOM 0 HD23 LEU A 15 284.990 131.405 397.989 1.00 0.00 H new ATOM 254 N PRO A 16 286.651 135.100 397.805 1.00 0.00 N ATOM 255 CA PRO A 16 287.570 136.150 398.210 1.00 0.00 C ATOM 256 C PRO A 16 289.054 135.787 398.151 1.00 0.00 C ATOM 257 O PRO A 16 289.455 134.645 397.915 1.00 0.00 O ATOM 258 CB PRO A 16 287.179 136.380 399.676 1.00 0.00 C ATOM 259 CG PRO A 16 286.736 135.001 400.170 1.00 0.00 C ATOM 260 CD PRO A 16 285.960 134.518 398.955 1.00 0.00 C ATOM 0 HA PRO A 16 287.482 137.004 397.538 1.00 0.00 H new ATOM 0 HB2 PRO A 16 288.020 136.760 400.257 1.00 0.00 H new ATOM 0 HB3 PRO A 16 286.375 137.111 399.763 1.00 0.00 H new ATOM 0 HG2 PRO A 16 287.580 134.354 400.409 1.00 0.00 H new ATOM 0 HG3 PRO A 16 286.115 135.059 401.064 1.00 0.00 H new ATOM 0 HD2 PRO A 16 285.951 133.429 398.900 1.00 0.00 H new ATOM 0 HD3 PRO A 16 284.921 134.843 398.996 1.00 0.00 H new ATOM 268 N GLU A 17 289.839 136.845 398.438 1.00 0.00 N ATOM 269 CA GLU A 17 291.269 136.912 398.522 1.00 0.00 C ATOM 270 C GLU A 17 291.709 136.715 399.965 1.00 0.00 C ATOM 271 O GLU A 17 290.967 136.930 400.932 1.00 0.00 O ATOM 272 CB GLU A 17 291.773 138.291 398.013 1.00 0.00 C ATOM 273 CG GLU A 17 291.190 138.772 396.667 1.00 0.00 C ATOM 274 CD GLU A 17 291.206 137.672 395.607 1.00 0.00 C ATOM 275 OE1 GLU A 17 292.330 137.213 395.271 1.00 0.00 O ATOM 276 OE2 GLU A 17 290.112 137.288 395.115 1.00 0.00 O1- ATOM 0 H GLU A 17 289.421 137.755 398.633 1.00 0.00 H new ATOM 0 HA GLU A 17 291.694 136.125 397.899 1.00 0.00 H new ATOM 0 HB2 GLU A 17 291.548 139.040 398.772 1.00 0.00 H new ATOM 0 HB3 GLU A 17 292.858 138.247 397.921 1.00 0.00 H new ATOM 0 HG2 GLU A 17 290.166 139.114 396.818 1.00 0.00 H new ATOM 0 HG3 GLU A 17 291.763 139.628 396.309 1.00 0.00 H new ATOM 283 N SER A 18 292.985 136.328 400.139 1.00 0.00 N ATOM 284 CA SER A 18 293.659 136.002 401.381 1.00 0.00 C ATOM 285 C SER A 18 293.664 136.984 402.543 1.00 0.00 C ATOM 286 O SER A 18 293.783 136.523 403.674 1.00 0.00 O ATOM 287 CB SER A 18 295.076 135.470 401.119 1.00 0.00 C ATOM 288 OG SER A 18 295.820 136.341 400.261 1.00 0.00 O ATOM 0 H SER A 18 293.612 136.231 399.340 1.00 0.00 H new ATOM 0 HA SER A 18 292.985 135.236 401.766 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.603 135.356 402.067 1.00 0.00 H new ATOM 0 HB3 SER A 18 295.015 134.480 400.667 1.00 0.00 H new ATOM 0 HG SER A 18 296.716 135.972 400.118 1.00 0.00 H new ATOM 294 N HIS A 19 293.481 138.329 402.317 1.00 0.00 N ATOM 295 CA HIS A 19 293.352 139.389 403.338 1.00 0.00 C ATOM 296 C HIS A 19 292.138 139.178 404.246 1.00 0.00 C ATOM 297 O HIS A 19 292.263 139.170 405.464 1.00 0.00 O ATOM 298 CB HIS A 19 293.341 140.841 402.735 1.00 0.00 C ATOM 299 CG HIS A 19 292.219 141.185 401.766 1.00 0.00 C ATOM 300 ND1 HIS A 19 291.515 140.374 400.935 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 291.715 142.454 401.540 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 290.581 141.085 400.217 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 290.729 142.325 400.612 1.00 0.00 N flip ATOM 0 H HIS A 19 293.419 138.703 401.370 1.00 0.00 H new ATOM 0 HA HIS A 19 294.252 139.303 403.946 1.00 0.00 H new ATOM 0 HB2 HIS A 19 293.302 141.550 403.562 1.00 0.00 H new ATOM 0 HB3 HIS A 19 294.290 141.001 402.223 1.00 0.00 H new ATOM 0 HD2 HIS A 19 292.042 143.370 402.010 1.00 0.00 H new ATOM 0 HE1 HIS A 19 289.880 140.705 399.488 1.00 0.00 H new ATOM 0 HE2 HIS A 19 290.170 143.104 400.264 1.00 0.00 H new ATOM 311 N ILE A 20 290.940 138.885 403.657 1.00 0.00 N ATOM 312 CA ILE A 20 289.786 138.336 404.380 1.00 0.00 C ATOM 313 C ILE A 20 289.892 136.851 404.635 1.00 0.00 C ATOM 314 O ILE A 20 289.498 136.362 405.693 1.00 0.00 O ATOM 315 CB ILE A 20 288.386 138.695 403.823 1.00 0.00 C ATOM 316 CG1 ILE A 20 287.656 137.550 403.061 1.00 0.00 C ATOM 317 CG2 ILE A 20 288.488 139.956 402.937 1.00 0.00 C ATOM 318 CD1 ILE A 20 286.372 137.979 402.376 1.00 0.00 C ATOM 0 H ILE A 20 290.763 139.029 402.663 1.00 0.00 H new ATOM 0 HA ILE A 20 289.853 138.862 405.332 1.00 0.00 H new ATOM 0 HB ILE A 20 287.763 138.882 404.698 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.333 137.137 402.313 1.00 0.00 H new ATOM 0 HG13 ILE A 20 287.429 136.748 403.763 1.00 0.00 H new ATOM 0 HG21 ILE A 20 287.502 140.207 402.546 1.00 0.00 H new ATOM 0 HG22 ILE A 20 288.865 140.788 403.531 1.00 0.00 H new ATOM 0 HG23 ILE A 20 289.169 139.764 402.108 1.00 0.00 H new ATOM 0 HD11 ILE A 20 285.927 137.123 401.869 1.00 0.00 H new ATOM 0 HD12 ILE A 20 285.674 138.364 403.120 1.00 0.00 H new ATOM 0 HD13 ILE A 20 286.592 138.759 401.647 1.00 0.00 H new ATOM 330 N PHE A 21 290.360 136.069 403.610 1.00 0.00 N ATOM 331 CA PHE A 21 290.251 134.616 403.592 1.00 0.00 C ATOM 332 C PHE A 21 291.153 133.906 404.637 1.00 0.00 C ATOM 333 O PHE A 21 290.626 133.129 405.432 1.00 0.00 O ATOM 334 CB PHE A 21 290.064 134.132 402.103 1.00 0.00 C ATOM 335 CG PHE A 21 289.660 132.714 401.779 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.821 132.255 400.476 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.189 131.815 402.715 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.988 130.903 400.286 1.00 0.00 C ATOM 339 CE2 PHE A 21 289.134 130.468 402.445 1.00 0.00 C ATOM 340 CZ PHE A 21 289.691 130.011 401.284 1.00 0.00 C ATOM 0 H PHE A 21 290.820 136.453 402.784 1.00 0.00 H new ATOM 0 HA PHE A 21 289.336 134.220 404.033 1.00 0.00 H new ATOM 0 HB2 PHE A 21 289.319 134.785 401.649 1.00 0.00 H new ATOM 0 HB3 PHE A 21 291.007 134.318 401.589 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.815 132.939 399.640 1.00 0.00 H new ATOM 0 HD2 PHE A 21 288.858 132.177 403.677 1.00 0.00 H new ATOM 0 HE1 PHE A 21 290.358 130.539 399.339 1.00 0.00 H new ATOM 0 HE2 PHE A 21 288.661 129.786 403.136 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.895 128.958 401.154 1.00 0.00 H new ATOM 350 N PHE A 22 292.498 134.192 404.761 1.00 0.00 N ATOM 351 CA PHE A 22 293.353 133.687 405.865 1.00 0.00 C ATOM 352 C PHE A 22 293.096 134.469 407.207 1.00 0.00 C ATOM 353 O PHE A 22 293.601 134.034 408.239 1.00 0.00 O ATOM 354 CB PHE A 22 294.943 133.547 405.625 1.00 0.00 C ATOM 355 CG PHE A 22 295.513 132.448 404.680 1.00 0.00 C ATOM 356 CD1 PHE A 22 296.138 132.849 403.506 1.00 0.00 C ATOM 357 CD2 PHE A 22 295.650 131.075 404.954 1.00 0.00 C ATOM 358 CE1 PHE A 22 296.587 131.957 402.546 1.00 0.00 C ATOM 359 CE2 PHE A 22 296.018 130.172 403.980 1.00 0.00 C ATOM 360 CZ PHE A 22 296.411 130.604 402.741 1.00 0.00 C ATOM 0 H PHE A 22 293.002 134.777 404.095 1.00 0.00 H new ATOM 0 HA PHE A 22 293.014 132.653 405.920 1.00 0.00 H new ATOM 0 HB2 PHE A 22 295.296 134.507 405.249 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.403 133.399 406.602 1.00 0.00 H new ATOM 0 HD1 PHE A 22 296.281 133.906 403.334 1.00 0.00 H new ATOM 0 HD2 PHE A 22 295.461 130.718 405.956 1.00 0.00 H new ATOM 0 HE1 PHE A 22 297.071 132.319 401.651 1.00 0.00 H new ATOM 0 HE2 PHE A 22 295.996 129.114 404.196 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.579 129.902 401.937 1.00 0.00 H new ATOM 370 N ALA A 23 292.361 135.645 407.271 1.00 0.00 N ATOM 371 CA ALA A 23 292.141 136.378 408.536 1.00 0.00 C ATOM 372 C ALA A 23 290.723 136.498 409.148 1.00 0.00 C ATOM 373 O ALA A 23 290.602 136.739 410.347 1.00 0.00 O ATOM 374 CB ALA A 23 292.743 137.797 408.404 1.00 0.00 C ATOM 0 H ALA A 23 291.926 136.081 406.458 1.00 0.00 H new ATOM 0 HA ALA A 23 292.637 135.723 409.253 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.586 138.347 409.332 1.00 0.00 H new ATOM 0 HB2 ALA A 23 293.812 137.722 408.203 1.00 0.00 H new ATOM 0 HB3 ALA A 23 292.256 138.324 407.584 1.00 0.00 H new ATOM 380 N THR A 24 289.604 136.346 408.380 1.00 0.00 N ATOM 381 CA THR A 24 288.216 136.552 408.865 1.00 0.00 C ATOM 382 C THR A 24 287.486 135.220 408.902 1.00 0.00 C ATOM 383 O THR A 24 287.457 134.503 407.903 1.00 0.00 O ATOM 384 CB THR A 24 287.402 137.499 407.954 1.00 0.00 C ATOM 385 OG1 THR A 24 288.106 138.714 407.740 1.00 0.00 O ATOM 386 CG2 THR A 24 286.028 137.898 408.547 1.00 0.00 C ATOM 0 H THR A 24 289.647 136.074 407.398 1.00 0.00 H new ATOM 0 HA THR A 24 288.296 136.999 409.856 1.00 0.00 H new ATOM 0 HB THR A 24 287.250 136.938 407.032 1.00 0.00 H new ATOM 0 HG1 THR A 24 287.577 139.301 407.160 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.512 138.563 407.854 1.00 0.00 H new ATOM 0 HG22 THR A 24 285.427 137.003 408.706 1.00 0.00 H new ATOM 0 HG23 THR A 24 286.177 138.409 409.498 1.00 0.00 H new ATOM 394 N VAL A 25 286.799 134.820 410.026 1.00 0.00 N ATOM 395 CA VAL A 25 286.090 133.520 410.193 1.00 0.00 C ATOM 396 C VAL A 25 284.930 133.236 409.277 1.00 0.00 C ATOM 397 O VAL A 25 284.500 132.093 409.162 1.00 0.00 O ATOM 398 CB VAL A 25 285.777 133.014 411.621 1.00 0.00 C ATOM 399 CG1 VAL A 25 286.648 133.748 412.660 1.00 0.00 C ATOM 400 CG2 VAL A 25 284.268 133.004 412.019 1.00 0.00 C ATOM 0 H VAL A 25 286.727 135.413 410.853 1.00 0.00 H new ATOM 0 HA VAL A 25 286.931 132.917 409.851 1.00 0.00 H new ATOM 0 HB VAL A 25 286.042 131.957 411.613 1.00 0.00 H new ATOM 0 HG11 VAL A 25 286.413 133.378 413.658 1.00 0.00 H new ATOM 0 HG12 VAL A 25 287.701 133.567 412.445 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.446 134.818 412.613 1.00 0.00 H new ATOM 0 HG21 VAL A 25 284.163 132.632 413.038 1.00 0.00 H new ATOM 0 HG22 VAL A 25 283.869 134.017 411.960 1.00 0.00 H new ATOM 0 HG23 VAL A 25 283.716 132.356 411.338 1.00 0.00 H new ATOM 410 N ALA A 26 284.474 134.253 408.482 1.00 0.00 N ATOM 411 CA ALA A 26 283.493 134.153 407.405 1.00 0.00 C ATOM 412 C ALA A 26 283.920 133.121 406.368 1.00 0.00 C ATOM 413 O ALA A 26 283.128 132.309 405.906 1.00 0.00 O ATOM 414 CB ALA A 26 283.238 135.511 406.708 1.00 0.00 C ATOM 0 H ALA A 26 284.813 135.208 408.599 1.00 0.00 H new ATOM 0 HA ALA A 26 282.560 133.835 407.871 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.501 135.381 405.916 1.00 0.00 H new ATOM 0 HB2 ALA A 26 282.864 136.230 407.437 1.00 0.00 H new ATOM 0 HB3 ALA A 26 284.170 135.881 406.280 1.00 0.00 H new ATOM 420 N ALA A 27 285.240 133.100 406.087 1.00 0.00 N ATOM 421 CA ALA A 27 285.858 132.087 405.280 1.00 0.00 C ATOM 422 C ALA A 27 286.763 131.121 406.049 1.00 0.00 C ATOM 423 O ALA A 27 286.935 129.979 405.630 1.00 0.00 O ATOM 424 CB ALA A 27 286.491 132.821 404.098 1.00 0.00 C ATOM 0 H ALA A 27 285.893 133.805 406.429 1.00 0.00 H new ATOM 0 HA ALA A 27 285.121 131.376 404.906 1.00 0.00 H new ATOM 0 HB1 ALA A 27 286.980 132.101 403.442 1.00 0.00 H new ATOM 0 HB2 ALA A 27 285.717 133.351 403.542 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.227 133.536 404.466 1.00 0.00 H new ATOM 430 N HIS A 28 287.335 131.556 407.210 1.00 0.00 N ATOM 431 CA HIS A 28 288.265 130.818 408.087 1.00 0.00 C ATOM 432 C HIS A 28 287.691 129.657 408.886 1.00 0.00 C ATOM 433 O HIS A 28 288.433 128.808 409.371 1.00 0.00 O ATOM 434 CB HIS A 28 288.985 131.745 409.096 1.00 0.00 C ATOM 435 CG HIS A 28 290.445 131.487 409.276 1.00 0.00 C ATOM 436 ND1 HIS A 28 291.180 130.342 409.321 1.00 0.00 N flip ATOM 437 CD2 HIS A 28 291.318 132.508 409.558 1.00 0.00 C flip ATOM 438 CE1 HIS A 28 292.494 130.635 409.637 1.00 0.00 C flip ATOM 439 NE2 HIS A 28 292.532 131.945 409.763 1.00 0.00 N flip ATOM 0 H HIS A 28 287.140 132.490 407.571 1.00 0.00 H new ATOM 0 HA HIS A 28 288.949 130.394 407.352 1.00 0.00 H new ATOM 0 HB2 HIS A 28 288.853 132.777 408.772 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.495 131.649 410.065 1.00 0.00 H new ATOM 0 HD2 HIS A 28 291.081 133.561 409.607 1.00 0.00 H new ATOM 0 HE1 HIS A 28 293.312 129.940 409.755 1.00 0.00 H new ATOM 0 HE2 HIS A 28 293.375 132.473 409.988 1.00 0.00 H new ATOM 447 N LYS A 29 286.339 129.595 409.056 1.00 0.00 N ATOM 448 CA LYS A 29 285.585 128.555 409.754 1.00 0.00 C ATOM 449 C LYS A 29 285.640 127.177 409.088 1.00 0.00 C ATOM 450 O LYS A 29 285.251 126.173 409.673 1.00 0.00 O ATOM 451 CB LYS A 29 284.105 129.013 409.959 1.00 0.00 C ATOM 452 CG LYS A 29 283.214 128.988 408.690 1.00 0.00 C ATOM 453 CD LYS A 29 282.132 130.074 408.541 1.00 0.00 C ATOM 454 CE LYS A 29 281.451 130.519 409.836 1.00 0.00 C ATOM 455 NZ LYS A 29 280.561 131.678 409.587 1.00 0.00 N1+ ATOM 0 H LYS A 29 285.727 130.320 408.681 1.00 0.00 H new ATOM 0 HA LYS A 29 286.074 128.426 410.720 1.00 0.00 H new ATOM 0 HB2 LYS A 29 283.647 128.375 410.715 1.00 0.00 H new ATOM 0 HB3 LYS A 29 284.109 130.027 410.358 1.00 0.00 H new ATOM 0 HG2 LYS A 29 283.869 129.049 407.821 1.00 0.00 H new ATOM 0 HG3 LYS A 29 282.720 128.017 408.649 1.00 0.00 H new ATOM 0 HD2 LYS A 29 282.584 130.948 408.072 1.00 0.00 H new ATOM 0 HD3 LYS A 29 281.366 129.706 407.858 1.00 0.00 H new ATOM 0 HE2 LYS A 29 280.874 129.693 410.252 1.00 0.00 H new ATOM 0 HE3 LYS A 29 282.205 130.785 410.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 280.108 131.965 410.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 281.120 132.471 409.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 279.830 131.412 408.897 1.00 0.00 H new ATOM 469 N TYR A 30 286.142 127.114 407.820 1.00 0.00 N ATOM 470 CA TYR A 30 286.302 125.864 407.076 1.00 0.00 C ATOM 471 C TYR A 30 287.774 125.556 406.846 1.00 0.00 C ATOM 472 O TYR A 30 288.384 124.693 407.474 1.00 0.00 O ATOM 473 CB TYR A 30 285.583 125.889 405.697 1.00 0.00 C ATOM 474 CG TYR A 30 284.159 126.345 405.776 1.00 0.00 C ATOM 475 CD1 TYR A 30 283.284 126.028 406.798 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.690 127.110 404.736 1.00 0.00 C ATOM 477 CE1 TYR A 30 281.982 126.482 406.763 1.00 0.00 C ATOM 478 CE2 TYR A 30 282.372 127.414 404.597 1.00 0.00 C ATOM 479 CZ TYR A 30 281.505 127.127 405.646 1.00 0.00 C ATOM 480 OH TYR A 30 280.133 127.441 405.652 1.00 0.00 O ATOM 0 H TYR A 30 286.442 127.939 407.300 1.00 0.00 H new ATOM 0 HA TYR A 30 285.843 125.089 407.690 1.00 0.00 H new ATOM 0 HB2 TYR A 30 286.130 126.547 405.022 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.613 124.890 405.262 1.00 0.00 H new ATOM 0 HD1 TYR A 30 283.621 125.423 407.627 1.00 0.00 H new ATOM 0 HD2 TYR A 30 284.392 127.482 404.004 1.00 0.00 H new ATOM 0 HE1 TYR A 30 281.336 126.331 407.615 1.00 0.00 H new ATOM 0 HE2 TYR A 30 282.005 127.870 403.689 1.00 0.00 H new ATOM 0 HH TYR A 30 280.014 128.383 405.894 1.00 0.00 H new ATOM 490 N VAL A 31 288.395 126.300 405.901 1.00 0.00 N ATOM 491 CA VAL A 31 289.787 126.216 405.517 1.00 0.00 C ATOM 492 C VAL A 31 290.134 127.651 405.354 1.00 0.00 C ATOM 493 O VAL A 31 289.247 128.396 404.959 1.00 0.00 O ATOM 494 CB VAL A 31 290.120 125.508 404.179 1.00 0.00 C ATOM 495 CG1 VAL A 31 289.019 124.518 403.742 1.00 0.00 C ATOM 496 CG2 VAL A 31 290.737 126.337 402.999 1.00 0.00 C ATOM 0 H VAL A 31 287.892 127.009 405.367 1.00 0.00 H new ATOM 0 HA VAL A 31 290.324 125.623 406.257 1.00 0.00 H new ATOM 0 HB VAL A 31 291.005 124.939 404.464 1.00 0.00 H new ATOM 0 HG11 VAL A 31 289.303 124.050 402.799 1.00 0.00 H new ATOM 0 HG12 VAL A 31 288.896 123.750 404.506 1.00 0.00 H new ATOM 0 HG13 VAL A 31 288.079 125.054 403.612 1.00 0.00 H new ATOM 0 HG21 VAL A 31 290.905 125.683 402.144 1.00 0.00 H new ATOM 0 HG22 VAL A 31 290.050 127.135 402.716 1.00 0.00 H new ATOM 0 HG23 VAL A 31 291.685 126.771 403.316 1.00 0.00 H new ATOM 506 N PRO A 32 291.340 128.109 405.599 1.00 0.00 N ATOM 507 CA PRO A 32 291.659 129.505 405.422 1.00 0.00 C ATOM 508 C PRO A 32 292.018 129.988 404.018 1.00 0.00 C ATOM 509 O PRO A 32 291.689 131.126 403.748 1.00 0.00 O ATOM 510 CB PRO A 32 292.874 129.633 406.342 1.00 0.00 C ATOM 511 CG PRO A 32 293.571 128.266 406.374 1.00 0.00 C ATOM 512 CD PRO A 32 292.402 127.313 406.222 1.00 0.00 C ATOM 0 HA PRO A 32 290.784 130.120 405.633 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.554 130.402 405.975 1.00 0.00 H new ATOM 0 HB3 PRO A 32 292.567 129.931 407.344 1.00 0.00 H new ATOM 0 HG2 PRO A 32 294.294 128.157 405.565 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.110 128.105 407.307 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.669 126.457 405.602 1.00 0.00 H new ATOM 0 HD3 PRO A 32 292.085 126.920 407.188 1.00 0.00 H new ATOM 520 N SER A 33 292.725 129.257 403.129 1.00 0.00 N ATOM 521 CA SER A 33 293.168 129.814 401.843 1.00 0.00 C ATOM 522 C SER A 33 293.911 128.774 401.011 1.00 0.00 C ATOM 523 O SER A 33 293.971 127.587 401.370 1.00 0.00 O ATOM 524 CB SER A 33 293.603 131.334 401.702 1.00 0.00 C ATOM 525 OG SER A 33 292.677 132.135 400.991 1.00 0.00 O ATOM 0 H SER A 33 292.997 128.286 403.282 1.00 0.00 H new ATOM 0 HA SER A 33 292.221 130.027 401.347 1.00 0.00 H new ATOM 0 HB2 SER A 33 293.742 131.755 402.698 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.569 131.380 401.199 1.00 0.00 H new ATOM 0 HG SER A 33 291.768 131.931 401.294 1.00 0.00 H new ATOM 531 N TYR A 34 294.439 129.199 399.812 1.00 0.00 N ATOM 532 CA TYR A 34 295.147 128.541 398.685 1.00 0.00 C ATOM 533 C TYR A 34 296.253 127.539 399.047 1.00 0.00 C ATOM 534 O TYR A 34 296.574 126.626 398.290 1.00 0.00 O ATOM 535 CB TYR A 34 295.691 129.626 397.692 1.00 0.00 C ATOM 536 CG TYR A 34 294.675 130.724 397.399 1.00 0.00 C ATOM 537 CD1 TYR A 34 293.743 130.640 396.365 1.00 0.00 C ATOM 538 CD2 TYR A 34 294.696 131.887 398.153 1.00 0.00 C ATOM 539 CE1 TYR A 34 292.839 131.669 396.121 1.00 0.00 C ATOM 540 CE2 TYR A 34 293.804 132.908 397.910 1.00 0.00 C ATOM 541 CZ TYR A 34 292.873 132.807 396.907 1.00 0.00 C ATOM 542 OH TYR A 34 292.019 133.916 396.696 1.00 0.00 O ATOM 0 H TYR A 34 294.352 130.191 399.593 1.00 0.00 H new ATOM 0 HA TYR A 34 294.385 127.918 398.218 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.593 130.074 398.110 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.978 129.145 396.757 1.00 0.00 H new ATOM 0 HD1 TYR A 34 293.723 129.759 395.741 1.00 0.00 H new ATOM 0 HD2 TYR A 34 295.424 131.994 398.944 1.00 0.00 H new ATOM 0 HE1 TYR A 34 292.116 131.580 395.324 1.00 0.00 H new ATOM 0 HE2 TYR A 34 293.838 133.800 398.517 1.00 0.00 H new ATOM 0 HH TYR A 34 292.091 134.211 395.764 1.00 0.00 H new ATOM 552 N ALA A 35 296.761 127.664 400.294 1.00 0.00 N ATOM 553 CA ALA A 35 297.704 126.832 401.009 1.00 0.00 C ATOM 554 C ALA A 35 297.132 125.517 401.487 1.00 0.00 C ATOM 555 O ALA A 35 297.715 124.464 401.254 1.00 0.00 O ATOM 556 CB ALA A 35 298.177 127.630 402.257 1.00 0.00 C ATOM 0 H ALA A 35 296.473 128.451 400.876 1.00 0.00 H new ATOM 0 HA ALA A 35 298.510 126.590 400.316 1.00 0.00 H new ATOM 0 HB1 ALA A 35 298.892 127.032 402.822 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.653 128.557 401.937 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.319 127.862 402.888 1.00 0.00 H new ATOM 562 N PHE A 36 295.911 125.563 402.107 1.00 0.00 N ATOM 563 CA PHE A 36 295.088 124.421 402.483 1.00 0.00 C ATOM 564 C PHE A 36 294.462 123.880 401.211 1.00 0.00 C ATOM 565 O PHE A 36 294.522 122.683 400.925 1.00 0.00 O ATOM 566 CB PHE A 36 293.997 124.779 403.556 1.00 0.00 C ATOM 567 CG PHE A 36 293.045 123.588 403.868 1.00 0.00 C ATOM 568 CD1 PHE A 36 293.227 122.812 404.993 1.00 0.00 C ATOM 569 CD2 PHE A 36 292.006 123.205 403.004 1.00 0.00 C ATOM 570 CE1 PHE A 36 292.390 121.744 405.263 1.00 0.00 C ATOM 571 CE2 PHE A 36 291.162 122.140 403.255 1.00 0.00 C ATOM 572 CZ PHE A 36 291.349 121.421 404.412 1.00 0.00 C ATOM 0 H PHE A 36 295.475 126.450 402.359 1.00 0.00 H new ATOM 0 HA PHE A 36 295.713 123.666 402.960 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.489 125.096 404.476 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.409 125.625 403.201 1.00 0.00 H new ATOM 0 HD1 PHE A 36 294.034 123.041 405.673 1.00 0.00 H new ATOM 0 HD2 PHE A 36 291.859 123.772 402.097 1.00 0.00 H new ATOM 0 HE1 PHE A 36 292.552 121.153 406.152 1.00 0.00 H new ATOM 0 HE2 PHE A 36 290.377 121.879 402.561 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.684 120.606 404.656 1.00 0.00 H new ATOM 582 N LEU A 37 293.826 124.781 400.392 1.00 0.00 N ATOM 583 CA LEU A 37 293.189 124.327 399.146 1.00 0.00 C ATOM 584 C LEU A 37 294.103 123.700 398.098 1.00 0.00 C ATOM 585 O LEU A 37 293.639 122.794 397.409 1.00 0.00 O ATOM 586 CB LEU A 37 292.101 125.234 398.507 1.00 0.00 C ATOM 587 CG LEU A 37 292.329 126.730 398.539 1.00 0.00 C ATOM 588 CD1 LEU A 37 292.431 127.287 397.111 1.00 0.00 C ATOM 589 CD2 LEU A 37 291.307 127.516 399.355 1.00 0.00 C ATOM 0 H LEU A 37 293.751 125.781 400.577 1.00 0.00 H new ATOM 0 HA LEU A 37 292.620 123.503 399.576 1.00 0.00 H new ATOM 0 HB2 LEU A 37 291.983 124.934 397.466 1.00 0.00 H new ATOM 0 HB3 LEU A 37 291.155 125.027 399.007 1.00 0.00 H new ATOM 0 HG LEU A 37 293.276 126.869 399.061 1.00 0.00 H new ATOM 0 HD11 LEU A 37 292.595 128.364 397.151 1.00 0.00 H new ATOM 0 HD12 LEU A 37 293.265 126.812 396.594 1.00 0.00 H new ATOM 0 HD13 LEU A 37 291.506 127.081 396.573 1.00 0.00 H new ATOM 0 HD21 LEU A 37 291.552 128.578 399.320 1.00 0.00 H new ATOM 0 HD22 LEU A 37 290.312 127.359 398.940 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.326 127.174 400.390 1.00 0.00 H new ATOM 601 N ARG A 38 295.423 124.062 397.964 1.00 0.00 N ATOM 602 CA ARG A 38 296.274 123.328 397.018 1.00 0.00 C ATOM 603 C ARG A 38 296.657 121.915 397.439 1.00 0.00 C ATOM 604 O ARG A 38 296.476 120.992 396.649 1.00 0.00 O ATOM 605 CB ARG A 38 297.551 124.138 396.686 1.00 0.00 C ATOM 606 CG ARG A 38 298.433 123.555 395.566 1.00 0.00 C ATOM 607 CD ARG A 38 299.517 124.536 395.098 1.00 0.00 C ATOM 608 NE ARG A 38 300.162 123.959 393.866 1.00 0.00 N ATOM 609 CZ ARG A 38 300.804 124.720 392.925 1.00 0.00 C ATOM 610 NH1 ARG A 38 300.939 126.068 393.088 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 301.306 124.118 391.807 1.00 0.00 N ATOM 0 H ARG A 38 295.881 124.816 398.476 1.00 0.00 H new ATOM 0 HA ARG A 38 295.650 123.208 396.132 1.00 0.00 H new ATOM 0 HB2 ARG A 38 297.256 125.149 396.404 1.00 0.00 H new ATOM 0 HB3 ARG A 38 298.152 124.223 397.591 1.00 0.00 H new ATOM 0 HG2 ARG A 38 298.906 122.639 395.920 1.00 0.00 H new ATOM 0 HG3 ARG A 38 297.804 123.282 394.718 1.00 0.00 H new ATOM 0 HD2 ARG A 38 299.081 125.511 394.879 1.00 0.00 H new ATOM 0 HD3 ARG A 38 300.259 124.687 395.882 1.00 0.00 H new ATOM 0 HE ARG A 38 300.119 122.950 393.725 1.00 0.00 H new ATOM 0 HH11 ARG A 38 300.559 126.522 393.919 1.00 0.00 H new ATOM 0 HH12 ARG A 38 301.420 126.622 392.379 1.00 0.00 H new ATOM 0 HH21 ARG A 38 301.201 123.112 391.679 1.00 0.00 H new ATOM 0 HH22 ARG A 38 301.786 124.675 391.100 1.00 0.00 H new ATOM 625 N ARG A 39 297.134 121.708 398.704 1.00 0.00 N ATOM 626 CA ARG A 39 297.422 120.386 399.274 1.00 0.00 C ATOM 627 C ARG A 39 296.193 119.512 399.548 1.00 0.00 C ATOM 628 O ARG A 39 296.258 118.294 399.395 1.00 0.00 O ATOM 629 CB ARG A 39 298.526 120.335 400.382 1.00 0.00 C ATOM 630 CG ARG A 39 298.121 120.228 401.870 1.00 0.00 C ATOM 631 CD ARG A 39 297.536 121.509 402.465 1.00 0.00 C ATOM 632 NE ARG A 39 297.081 121.210 403.871 1.00 0.00 N ATOM 633 CZ ARG A 39 297.179 122.084 404.923 1.00 0.00 C ATOM 634 NH1 ARG A 39 297.726 123.323 404.764 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 296.714 121.705 406.150 1.00 0.00 N ATOM 0 H ARG A 39 297.326 122.473 399.350 1.00 0.00 H new ATOM 0 HA ARG A 39 297.912 119.887 398.438 1.00 0.00 H new ATOM 0 HB2 ARG A 39 299.170 119.485 400.159 1.00 0.00 H new ATOM 0 HB3 ARG A 39 299.135 121.233 400.275 1.00 0.00 H new ATOM 0 HG2 ARG A 39 297.390 119.427 401.977 1.00 0.00 H new ATOM 0 HG3 ARG A 39 298.997 119.940 402.451 1.00 0.00 H new ATOM 0 HD2 ARG A 39 298.283 122.303 402.468 1.00 0.00 H new ATOM 0 HD3 ARG A 39 296.699 121.861 401.861 1.00 0.00 H new ATOM 0 HE ARG A 39 296.672 120.293 404.052 1.00 0.00 H new ATOM 0 HH11 ARG A 39 298.071 123.614 403.850 1.00 0.00 H new ATOM 0 HH12 ARG A 39 297.790 123.958 405.559 1.00 0.00 H new ATOM 0 HH21 ARG A 39 296.300 120.781 406.275 1.00 0.00 H new ATOM 0 HH22 ARG A 39 296.781 122.346 406.941 1.00 0.00 H new ATOM 649 N GLU A 40 295.026 120.110 399.952 1.00 0.00 N ATOM 650 CA GLU A 40 293.796 119.364 400.181 1.00 0.00 C ATOM 651 C GLU A 40 292.919 119.141 398.944 1.00 0.00 C ATOM 652 O GLU A 40 292.232 118.121 398.891 1.00 0.00 O ATOM 653 CB GLU A 40 292.974 119.936 401.367 1.00 0.00 C ATOM 654 CG GLU A 40 291.955 118.940 401.974 1.00 0.00 C ATOM 655 CD GLU A 40 292.674 117.754 402.620 1.00 0.00 C ATOM 656 OE1 GLU A 40 293.447 117.985 403.588 1.00 0.00 O ATOM 657 OE2 GLU A 40 292.456 116.602 402.157 1.00 0.00 O1- ATOM 0 H GLU A 40 294.938 121.112 400.119 1.00 0.00 H new ATOM 0 HA GLU A 40 294.145 118.368 400.452 1.00 0.00 H new ATOM 0 HB2 GLU A 40 293.662 120.256 402.150 1.00 0.00 H new ATOM 0 HB3 GLU A 40 292.440 120.824 401.029 1.00 0.00 H new ATOM 0 HG2 GLU A 40 291.342 119.448 402.718 1.00 0.00 H new ATOM 0 HG3 GLU A 40 291.281 118.582 401.196 1.00 0.00 H new ATOM 664 N LEU A 41 292.885 120.031 397.886 1.00 0.00 N ATOM 665 CA LEU A 41 291.976 119.733 396.771 1.00 0.00 C ATOM 666 C LEU A 41 292.722 119.057 395.624 1.00 0.00 C ATOM 667 O LEU A 41 292.117 118.521 394.698 1.00 0.00 O ATOM 668 CB LEU A 41 291.260 121.063 396.389 1.00 0.00 C ATOM 669 CG LEU A 41 289.916 121.018 395.611 1.00 0.00 C ATOM 670 CD1 LEU A 41 290.097 120.929 394.091 1.00 0.00 C ATOM 671 CD2 LEU A 41 288.925 119.964 396.120 1.00 0.00 C ATOM 0 H LEU A 41 293.437 120.885 397.803 1.00 0.00 H new ATOM 0 HA LEU A 41 291.211 119.009 397.052 1.00 0.00 H new ATOM 0 HB2 LEU A 41 291.083 121.615 397.312 1.00 0.00 H new ATOM 0 HB3 LEU A 41 291.960 121.651 395.796 1.00 0.00 H new ATOM 0 HG LEU A 41 289.461 121.985 395.825 1.00 0.00 H new ATOM 0 HD11 LEU A 41 289.120 120.901 393.609 1.00 0.00 H new ATOM 0 HD12 LEU A 41 290.650 121.800 393.739 1.00 0.00 H new ATOM 0 HD13 LEU A 41 290.650 120.023 393.843 1.00 0.00 H new ATOM 0 HD21 LEU A 41 288.015 120.001 395.521 1.00 0.00 H new ATOM 0 HD22 LEU A 41 289.373 118.974 396.038 1.00 0.00 H new ATOM 0 HD23 LEU A 41 288.682 120.167 397.163 1.00 0.00 H new ATOM 683 N GLY A 42 294.091 119.008 395.710 1.00 0.00 N ATOM 684 CA GLY A 42 295.003 118.347 394.760 1.00 0.00 C ATOM 685 C GLY A 42 295.123 119.086 393.451 1.00 0.00 C ATOM 686 O GLY A 42 295.240 118.504 392.374 1.00 0.00 O ATOM 0 H GLY A 42 294.593 119.451 396.480 1.00 0.00 H new ATOM 0 HA2 GLY A 42 295.990 118.259 395.213 1.00 0.00 H new ATOM 0 HA3 GLY A 42 294.648 117.334 394.569 1.00 0.00 H new ATOM 690 N LEU A 43 294.997 120.433 393.521 1.00 0.00 N ATOM 691 CA LEU A 43 294.837 121.243 392.328 1.00 0.00 C ATOM 692 C LEU A 43 296.132 121.834 391.772 1.00 0.00 C ATOM 693 O LEU A 43 296.921 122.483 392.452 1.00 0.00 O ATOM 694 CB LEU A 43 293.776 122.321 392.695 1.00 0.00 C ATOM 695 CG LEU A 43 293.085 123.070 391.537 1.00 0.00 C ATOM 696 CD1 LEU A 43 292.521 122.143 390.446 1.00 0.00 C ATOM 697 CD2 LEU A 43 291.954 123.972 392.072 1.00 0.00 C ATOM 0 H LEU A 43 295.005 120.962 394.393 1.00 0.00 H new ATOM 0 HA LEU A 43 294.507 120.619 391.497 1.00 0.00 H new ATOM 0 HB2 LEU A 43 293.002 121.840 393.293 1.00 0.00 H new ATOM 0 HB3 LEU A 43 294.257 123.062 393.334 1.00 0.00 H new ATOM 0 HG LEU A 43 293.865 123.672 391.072 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.051 122.743 389.667 1.00 0.00 H new ATOM 0 HD12 LEU A 43 293.331 121.556 390.013 1.00 0.00 H new ATOM 0 HD13 LEU A 43 291.781 121.473 390.884 1.00 0.00 H new ATOM 0 HD21 LEU A 43 291.479 124.492 391.240 1.00 0.00 H new ATOM 0 HD22 LEU A 43 291.214 123.360 392.588 1.00 0.00 H new ATOM 0 HD23 LEU A 43 292.369 124.702 392.767 1.00 0.00 H new ATOM 709 N SER A 44 296.321 121.663 390.436 1.00 0.00 N ATOM 710 CA SER A 44 297.435 122.133 389.609 1.00 0.00 C ATOM 711 C SER A 44 297.098 123.456 388.926 1.00 0.00 C ATOM 712 O SER A 44 297.957 124.137 388.371 1.00 0.00 O ATOM 713 CB SER A 44 297.837 121.050 388.568 1.00 0.00 C ATOM 714 OG SER A 44 296.677 120.503 387.934 1.00 0.00 O ATOM 0 H SER A 44 295.637 121.151 389.878 1.00 0.00 H new ATOM 0 HA SER A 44 298.289 122.311 390.262 1.00 0.00 H new ATOM 0 HB2 SER A 44 298.496 121.487 387.818 1.00 0.00 H new ATOM 0 HB3 SER A 44 298.397 120.255 389.060 1.00 0.00 H new ATOM 0 HG SER A 44 296.950 119.825 387.281 1.00 0.00 H new ATOM 720 N SER A 45 295.794 123.856 389.032 1.00 0.00 N ATOM 721 CA SER A 45 295.171 125.142 388.662 1.00 0.00 C ATOM 722 C SER A 45 295.531 126.245 389.650 1.00 0.00 C ATOM 723 O SER A 45 295.295 127.424 389.413 1.00 0.00 O ATOM 724 CB SER A 45 293.615 125.039 388.522 1.00 0.00 C ATOM 725 OG SER A 45 293.291 124.115 387.484 1.00 0.00 O ATOM 0 H SER A 45 295.097 123.217 389.416 1.00 0.00 H new ATOM 0 HA SER A 45 295.576 125.400 387.684 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.175 124.713 389.464 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.194 126.019 388.296 1.00 0.00 H new ATOM 0 HG SER A 45 292.645 124.524 386.872 1.00 0.00 H new ATOM 731 N ALA A 46 296.156 125.860 390.798 1.00 0.00 N ATOM 732 CA ALA A 46 296.560 126.653 391.952 1.00 0.00 C ATOM 733 C ALA A 46 297.715 127.642 391.770 1.00 0.00 C ATOM 734 O ALA A 46 298.144 128.291 392.719 1.00 0.00 O ATOM 735 CB ALA A 46 296.812 125.690 393.121 1.00 0.00 C ATOM 0 H ALA A 46 296.407 124.881 390.933 1.00 0.00 H new ATOM 0 HA ALA A 46 295.730 127.333 392.145 1.00 0.00 H new ATOM 0 HB1 ALA A 46 297.117 126.257 394.001 1.00 0.00 H new ATOM 0 HB2 ALA A 46 295.898 125.140 393.343 1.00 0.00 H new ATOM 0 HB3 ALA A 46 297.601 124.988 392.851 1.00 0.00 H new ATOM 741 N HIS A 47 298.214 127.761 390.511 1.00 0.00 N ATOM 742 CA HIS A 47 299.274 128.660 390.062 1.00 0.00 C ATOM 743 C HIS A 47 298.756 130.011 389.523 1.00 0.00 C ATOM 744 O HIS A 47 299.538 130.910 389.219 1.00 0.00 O ATOM 745 CB HIS A 47 300.173 127.943 389.004 1.00 0.00 C ATOM 746 CG HIS A 47 301.639 127.908 389.376 1.00 0.00 C ATOM 747 ND1 HIS A 47 302.211 126.979 390.221 1.00 0.00 N ATOM 748 CD2 HIS A 47 302.655 128.734 389.002 1.00 0.00 C ATOM 749 CE1 HIS A 47 303.529 127.281 390.313 1.00 0.00 C ATOM 750 NE2 HIS A 47 303.844 128.338 389.592 1.00 0.00 N ATOM 0 H HIS A 47 297.854 127.190 389.746 1.00 0.00 H new ATOM 0 HA HIS A 47 299.869 128.904 390.942 1.00 0.00 H new ATOM 0 HB2 HIS A 47 299.817 126.922 388.870 1.00 0.00 H new ATOM 0 HB3 HIS A 47 300.063 128.448 388.044 1.00 0.00 H new ATOM 0 HD2 HIS A 47 302.549 129.579 388.338 1.00 0.00 H new ATOM 0 HE1 HIS A 47 304.237 126.722 390.907 1.00 0.00 H new ATOM 0 HE2 HIS A 47 304.762 128.770 389.491 1.00 0.00 H new ATOM 758 N THR A 48 297.418 130.189 389.351 1.00 0.00 N ATOM 759 CA THR A 48 296.823 131.435 388.852 1.00 0.00 C ATOM 760 C THR A 48 295.522 131.609 389.605 1.00 0.00 C ATOM 761 O THR A 48 294.720 130.676 389.680 1.00 0.00 O ATOM 762 CB THR A 48 296.551 131.423 387.338 1.00 0.00 C ATOM 763 OG1 THR A 48 297.758 131.315 386.597 1.00 0.00 O ATOM 764 CG2 THR A 48 295.891 132.721 386.836 1.00 0.00 C ATOM 0 H THR A 48 296.731 129.464 389.558 1.00 0.00 H new ATOM 0 HA THR A 48 297.522 132.256 389.014 1.00 0.00 H new ATOM 0 HB THR A 48 295.891 130.569 387.187 1.00 0.00 H new ATOM 0 HG1 THR A 48 297.554 131.308 385.639 1.00 0.00 H new ATOM 0 HG21 THR A 48 295.724 132.652 385.761 1.00 0.00 H new ATOM 0 HG22 THR A 48 294.937 132.863 387.343 1.00 0.00 H new ATOM 0 HG23 THR A 48 296.544 133.567 387.048 1.00 0.00 H new ATOM 772 N ASN A 49 295.217 132.824 390.175 1.00 0.00 N ATOM 773 CA ASN A 49 294.000 133.064 390.970 1.00 0.00 C ATOM 774 C ASN A 49 292.688 132.958 390.210 1.00 0.00 C ATOM 775 O ASN A 49 291.706 132.446 390.731 1.00 0.00 O ATOM 776 CB ASN A 49 294.030 134.349 391.852 1.00 0.00 C ATOM 777 CG ASN A 49 293.503 133.991 393.249 1.00 0.00 C ATOM 778 OD1 ASN A 49 292.421 134.631 393.761 1.00 0.00 O flip ATOM 779 ND2 ASN A 49 294.116 133.098 393.835 1.00 0.00 N flip ATOM 0 H ASN A 49 295.815 133.646 390.086 1.00 0.00 H new ATOM 0 HA ASN A 49 294.026 132.213 391.651 1.00 0.00 H new ATOM 0 HB2 ASN A 49 295.045 134.740 391.918 1.00 0.00 H new ATOM 0 HB3 ASN A 49 293.416 135.131 391.404 1.00 0.00 H new ATOM 0 HD21 ASN A 49 294.923 132.658 393.392 1.00 0.00 H new ATOM 0 HD22 ASN A 49 293.817 132.799 394.763 1.00 0.00 H new ATOM 786 N ARG A 50 292.686 133.340 388.905 1.00 0.00 N ATOM 787 CA ARG A 50 291.536 133.186 388.024 1.00 0.00 C ATOM 788 C ARG A 50 291.262 131.741 387.609 1.00 0.00 C ATOM 789 O ARG A 50 290.104 131.358 387.538 1.00 0.00 O ATOM 790 CB ARG A 50 291.610 134.133 386.799 1.00 0.00 C ATOM 791 CG ARG A 50 291.779 135.617 387.193 1.00 0.00 C ATOM 792 CD ARG A 50 290.618 136.165 388.045 1.00 0.00 C ATOM 793 NE ARG A 50 290.916 137.591 388.438 1.00 0.00 N ATOM 794 CZ ARG A 50 291.362 137.975 389.676 1.00 0.00 C ATOM 795 NH1 ARG A 50 291.560 137.064 390.673 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 291.610 139.296 389.916 1.00 0.00 N ATOM 0 H ARG A 50 293.494 133.764 388.449 1.00 0.00 H new ATOM 0 HA ARG A 50 290.675 133.486 388.622 1.00 0.00 H new ATOM 0 HB2 ARG A 50 292.445 133.834 386.165 1.00 0.00 H new ATOM 0 HB3 ARG A 50 290.703 134.021 386.205 1.00 0.00 H new ATOM 0 HG2 ARG A 50 292.711 135.734 387.746 1.00 0.00 H new ATOM 0 HG3 ARG A 50 291.869 136.217 386.287 1.00 0.00 H new ATOM 0 HD2 ARG A 50 289.686 136.118 387.482 1.00 0.00 H new ATOM 0 HD3 ARG A 50 290.484 135.551 388.936 1.00 0.00 H new ATOM 0 HE ARG A 50 290.776 138.318 387.736 1.00 0.00 H new ATOM 0 HH11 ARG A 50 291.376 136.075 390.504 1.00 0.00 H new ATOM 0 HH12 ARG A 50 291.892 137.372 391.587 1.00 0.00 H new ATOM 0 HH21 ARG A 50 291.463 139.985 389.178 1.00 0.00 H new ATOM 0 HH22 ARG A 50 291.942 139.594 390.833 1.00 0.00 H new ATOM 810 N LYS A 51 292.306 130.891 387.363 1.00 0.00 N ATOM 811 CA LYS A 51 292.203 129.451 387.057 1.00 0.00 C ATOM 812 C LYS A 51 291.827 128.568 388.249 1.00 0.00 C ATOM 813 O LYS A 51 290.948 127.690 388.184 1.00 0.00 O ATOM 814 CB LYS A 51 293.458 128.903 386.338 1.00 0.00 C ATOM 815 CG LYS A 51 293.766 129.696 385.052 1.00 0.00 C ATOM 816 CD LYS A 51 294.840 129.038 384.172 1.00 0.00 C ATOM 817 CE LYS A 51 295.223 129.874 382.941 1.00 0.00 C ATOM 818 NZ LYS A 51 294.070 130.061 382.031 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.273 131.215 387.376 1.00 0.00 H new ATOM 0 HA LYS A 51 291.362 129.392 386.367 1.00 0.00 H new ATOM 0 HB2 LYS A 51 294.314 128.952 387.011 1.00 0.00 H new ATOM 0 HB3 LYS A 51 293.307 127.852 386.091 1.00 0.00 H new ATOM 0 HG2 LYS A 51 292.849 129.805 384.473 1.00 0.00 H new ATOM 0 HG3 LYS A 51 294.093 130.700 385.323 1.00 0.00 H new ATOM 0 HD2 LYS A 51 295.732 128.861 384.773 1.00 0.00 H new ATOM 0 HD3 LYS A 51 294.480 128.064 383.842 1.00 0.00 H new ATOM 0 HE2 LYS A 51 295.596 130.847 383.262 1.00 0.00 H new ATOM 0 HE3 LYS A 51 296.035 129.383 382.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 294.376 130.586 381.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 293.699 129.132 381.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 293.325 130.596 382.520 1.00 0.00 H new ATOM 832 N VAL A 52 292.482 128.829 389.438 1.00 0.00 N ATOM 833 CA VAL A 52 292.220 128.144 390.719 1.00 0.00 C ATOM 834 C VAL A 52 290.835 128.423 391.191 1.00 0.00 C ATOM 835 O VAL A 52 290.104 127.472 391.458 1.00 0.00 O ATOM 836 CB VAL A 52 293.234 128.370 391.873 1.00 0.00 C ATOM 837 CG1 VAL A 52 293.160 129.739 392.596 1.00 0.00 C ATOM 838 CG2 VAL A 52 293.164 127.226 392.917 1.00 0.00 C ATOM 0 H VAL A 52 293.214 129.536 389.511 1.00 0.00 H new ATOM 0 HA VAL A 52 292.351 127.092 390.465 1.00 0.00 H new ATOM 0 HB VAL A 52 294.196 128.370 391.361 1.00 0.00 H new ATOM 0 HG11 VAL A 52 293.916 129.777 393.380 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.340 130.540 391.879 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.172 129.864 393.038 1.00 0.00 H new ATOM 0 HG21 VAL A 52 293.886 127.414 393.712 1.00 0.00 H new ATOM 0 HG22 VAL A 52 292.161 127.181 393.341 1.00 0.00 H new ATOM 0 HG23 VAL A 52 293.396 126.277 392.433 1.00 0.00 H new ATOM 848 N TRP A 53 290.425 129.740 391.175 1.00 0.00 N ATOM 849 CA TRP A 53 289.091 130.223 391.499 1.00 0.00 C ATOM 850 C TRP A 53 288.039 129.731 390.560 1.00 0.00 C ATOM 851 O TRP A 53 286.987 129.387 391.035 1.00 0.00 O ATOM 852 CB TRP A 53 288.984 131.720 391.843 1.00 0.00 C ATOM 853 CG TRP A 53 289.435 132.161 393.224 1.00 0.00 C ATOM 854 CD1 TRP A 53 289.158 133.404 393.707 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.710 131.335 394.381 1.00 0.00 C ATOM 856 NE1 TRP A 53 289.168 133.396 395.075 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.512 132.133 395.502 1.00 0.00 C ATOM 858 CE3 TRP A 53 290.033 130.012 394.527 1.00 0.00 C ATOM 859 CZ2 TRP A 53 289.549 131.597 396.758 1.00 0.00 C ATOM 860 CZ3 TRP A 53 290.041 129.478 395.784 1.00 0.00 C ATOM 861 CH2 TRP A 53 289.728 130.236 396.877 1.00 0.00 C ATOM 0 H TRP A 53 291.061 130.497 390.923 1.00 0.00 H new ATOM 0 HA TRP A 53 288.873 129.749 392.456 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.565 132.276 391.107 1.00 0.00 H new ATOM 0 HB3 TRP A 53 287.943 132.019 391.719 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.959 134.273 393.097 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.956 134.192 395.677 1.00 0.00 H new ATOM 0 HE3 TRP A 53 290.276 129.405 393.668 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.441 132.222 397.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 290.299 128.438 395.917 1.00 0.00 H new ATOM 0 HH2 TRP A 53 289.620 129.764 397.842 1.00 0.00 H new ATOM 872 N LYS A 54 288.322 129.545 389.257 1.00 0.00 N ATOM 873 CA LYS A 54 287.472 128.865 388.264 1.00 0.00 C ATOM 874 C LYS A 54 287.270 127.372 388.512 1.00 0.00 C ATOM 875 O LYS A 54 286.132 126.924 388.443 1.00 0.00 O ATOM 876 CB LYS A 54 288.160 129.034 386.890 1.00 0.00 C ATOM 877 CG LYS A 54 288.177 127.894 385.853 1.00 0.00 C ATOM 878 CD LYS A 54 288.811 128.370 384.542 1.00 0.00 C ATOM 879 CE LYS A 54 289.160 127.229 383.576 1.00 0.00 C ATOM 880 NZ LYS A 54 287.957 126.455 383.191 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.194 129.882 388.849 1.00 0.00 H new ATOM 0 HA LYS A 54 286.482 129.318 388.322 1.00 0.00 H new ATOM 0 HB2 LYS A 54 287.697 129.895 386.407 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.199 129.299 387.086 1.00 0.00 H new ATOM 0 HG2 LYS A 54 288.736 127.045 386.247 1.00 0.00 H new ATOM 0 HG3 LYS A 54 287.160 127.548 385.667 1.00 0.00 H new ATOM 0 HD2 LYS A 54 288.126 129.058 384.046 1.00 0.00 H new ATOM 0 HD3 LYS A 54 289.717 128.932 384.770 1.00 0.00 H new ATOM 0 HE2 LYS A 54 289.631 127.639 382.683 1.00 0.00 H new ATOM 0 HE3 LYS A 54 289.887 126.565 384.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 288.224 125.714 382.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 287.541 126.016 384.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 287.260 127.091 382.753 1.00 0.00 H new ATOM 894 N LYS A 55 288.311 126.535 388.851 1.00 0.00 N ATOM 895 CA LYS A 55 288.066 125.111 389.212 1.00 0.00 C ATOM 896 C LYS A 55 287.367 124.979 390.575 1.00 0.00 C ATOM 897 O LYS A 55 286.465 124.165 390.822 1.00 0.00 O ATOM 898 CB LYS A 55 289.351 124.257 389.188 1.00 0.00 C ATOM 899 CG LYS A 55 289.946 124.079 387.785 1.00 0.00 C ATOM 900 CD LYS A 55 289.041 123.260 386.857 1.00 0.00 C ATOM 901 CE LYS A 55 289.763 122.871 385.564 1.00 0.00 C ATOM 902 NZ LYS A 55 288.835 122.225 384.607 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.290 126.819 388.879 1.00 0.00 H new ATOM 0 HA LYS A 55 287.401 124.722 388.441 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.097 124.721 389.833 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.132 123.275 389.608 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.121 125.059 387.342 1.00 0.00 H new ATOM 0 HG3 LYS A 55 290.916 123.588 387.866 1.00 0.00 H new ATOM 0 HD2 LYS A 55 288.709 122.360 387.374 1.00 0.00 H new ATOM 0 HD3 LYS A 55 288.148 123.837 386.616 1.00 0.00 H new ATOM 0 HE2 LYS A 55 290.201 123.759 385.107 1.00 0.00 H new ATOM 0 HE3 LYS A 55 290.584 122.192 385.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 289.351 121.972 383.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 288.437 121.366 385.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 288.065 122.883 384.372 1.00 0.00 H new ATOM 916 N PHE A 56 287.707 125.950 391.458 1.00 0.00 N ATOM 917 CA PHE A 56 287.023 126.158 392.753 1.00 0.00 C ATOM 918 C PHE A 56 285.548 126.583 392.602 1.00 0.00 C ATOM 919 O PHE A 56 284.631 125.972 393.146 1.00 0.00 O ATOM 920 CB PHE A 56 287.813 127.146 393.642 1.00 0.00 C ATOM 921 CG PHE A 56 288.606 126.390 394.650 1.00 0.00 C ATOM 922 CD1 PHE A 56 288.374 126.624 395.985 1.00 0.00 C ATOM 923 CD2 PHE A 56 289.487 125.394 394.281 1.00 0.00 C ATOM 924 CE1 PHE A 56 288.888 125.790 396.936 1.00 0.00 C ATOM 925 CE2 PHE A 56 290.019 124.557 395.237 1.00 0.00 C ATOM 926 CZ PHE A 56 289.660 124.712 396.559 1.00 0.00 C ATOM 0 H PHE A 56 288.465 126.611 391.289 1.00 0.00 H new ATOM 0 HA PHE A 56 287.002 125.189 393.252 1.00 0.00 H new ATOM 0 HB2 PHE A 56 288.475 127.755 393.026 1.00 0.00 H new ATOM 0 HB3 PHE A 56 287.126 127.829 394.143 1.00 0.00 H new ATOM 0 HD1 PHE A 56 287.780 127.475 396.284 1.00 0.00 H new ATOM 0 HD2 PHE A 56 289.759 125.271 393.243 1.00 0.00 H new ATOM 0 HE1 PHE A 56 288.690 125.975 397.982 1.00 0.00 H new ATOM 0 HE2 PHE A 56 290.715 123.782 394.952 1.00 0.00 H new ATOM 0 HZ PHE A 56 289.982 123.992 397.296 1.00 0.00 H new ATOM 936 N VAL A 57 285.282 127.600 391.747 1.00 0.00 N ATOM 937 CA VAL A 57 283.989 128.054 391.227 1.00 0.00 C ATOM 938 C VAL A 57 283.175 127.004 390.448 1.00 0.00 C ATOM 939 O VAL A 57 281.952 126.955 390.540 1.00 0.00 O ATOM 940 CB VAL A 57 283.617 129.552 391.266 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.473 130.004 392.766 1.00 0.00 C ATOM 942 CG2 VAL A 57 284.488 130.546 390.468 1.00 0.00 C ATOM 0 H VAL A 57 286.043 128.169 391.376 1.00 0.00 H new ATOM 0 HA VAL A 57 283.267 128.190 392.032 1.00 0.00 H new ATOM 0 HB VAL A 57 282.674 129.604 390.722 1.00 0.00 H new ATOM 0 HG11 VAL A 57 283.210 131.061 392.804 1.00 0.00 H new ATOM 0 HG12 VAL A 57 282.691 129.418 393.249 1.00 0.00 H new ATOM 0 HG13 VAL A 57 284.418 129.846 393.286 1.00 0.00 H new ATOM 0 HG21 VAL A 57 284.098 131.556 390.597 1.00 0.00 H new ATOM 0 HG22 VAL A 57 285.514 130.504 390.832 1.00 0.00 H new ATOM 0 HG23 VAL A 57 284.467 130.281 389.411 1.00 0.00 H new ATOM 952 N GLU A 58 283.874 126.063 389.749 1.00 0.00 N ATOM 953 CA GLU A 58 283.344 124.787 389.235 1.00 0.00 C ATOM 954 C GLU A 58 282.877 123.831 390.382 1.00 0.00 C ATOM 955 O GLU A 58 281.784 123.276 390.289 1.00 0.00 O ATOM 956 CB GLU A 58 284.342 124.094 388.265 1.00 0.00 C ATOM 957 CG GLU A 58 283.736 122.965 387.411 1.00 0.00 C ATOM 958 CD GLU A 58 284.809 122.423 386.466 1.00 0.00 C ATOM 959 OE1 GLU A 58 284.637 122.563 385.226 1.00 0.00 O ATOM 960 OE2 GLU A 58 285.815 121.857 386.975 1.00 0.00 O1- ATOM 0 H GLU A 58 284.861 126.188 389.525 1.00 0.00 H new ATOM 0 HA GLU A 58 282.454 125.029 388.655 1.00 0.00 H new ATOM 0 HB2 GLU A 58 284.762 124.848 387.599 1.00 0.00 H new ATOM 0 HB3 GLU A 58 285.168 123.686 388.847 1.00 0.00 H new ATOM 0 HG2 GLU A 58 283.362 122.167 388.053 1.00 0.00 H new ATOM 0 HG3 GLU A 58 282.886 123.340 386.840 1.00 0.00 H new ATOM 967 N ALA A 59 283.642 123.695 391.535 1.00 0.00 N ATOM 968 CA ALA A 59 283.192 122.991 392.782 1.00 0.00 C ATOM 969 C ALA A 59 281.966 123.592 393.459 1.00 0.00 C ATOM 970 O ALA A 59 281.119 122.906 394.007 1.00 0.00 O ATOM 971 CB ALA A 59 284.150 123.072 394.008 1.00 0.00 C ATOM 0 H ALA A 59 284.585 124.075 391.612 1.00 0.00 H new ATOM 0 HA ALA A 59 283.072 121.998 392.348 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.716 122.526 394.846 1.00 0.00 H new ATOM 0 HB2 ALA A 59 285.112 122.631 393.748 1.00 0.00 H new ATOM 0 HB3 ALA A 59 284.293 124.115 394.290 1.00 0.00 H new ATOM 977 N TYR A 60 281.927 124.951 393.468 1.00 0.00 N ATOM 978 CA TYR A 60 281.021 125.898 394.128 1.00 0.00 C ATOM 979 C TYR A 60 279.499 125.640 393.881 1.00 0.00 C ATOM 980 O TYR A 60 278.613 126.151 394.547 1.00 0.00 O ATOM 981 CB TYR A 60 281.436 127.335 393.724 1.00 0.00 C ATOM 982 CG TYR A 60 281.006 128.559 394.511 1.00 0.00 C ATOM 983 CD1 TYR A 60 281.831 129.094 395.495 1.00 0.00 C ATOM 984 CD2 TYR A 60 279.948 129.332 394.060 1.00 0.00 C ATOM 985 CE1 TYR A 60 281.655 130.379 395.971 1.00 0.00 C ATOM 986 CE2 TYR A 60 279.733 130.603 394.565 1.00 0.00 C ATOM 987 CZ TYR A 60 280.599 131.133 395.497 1.00 0.00 C ATOM 988 OH TYR A 60 280.430 132.452 395.951 1.00 0.00 O ATOM 0 H TYR A 60 282.630 125.465 392.937 1.00 0.00 H new ATOM 0 HA TYR A 60 281.130 125.753 395.203 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.526 127.349 393.696 1.00 0.00 H new ATOM 0 HB3 TYR A 60 281.089 127.484 392.701 1.00 0.00 H new ATOM 0 HD1 TYR A 60 282.630 128.489 395.897 1.00 0.00 H new ATOM 0 HD2 TYR A 60 279.283 128.938 393.305 1.00 0.00 H new ATOM 0 HE1 TYR A 60 282.334 130.789 396.704 1.00 0.00 H new ATOM 0 HE2 TYR A 60 278.885 131.180 394.228 1.00 0.00 H new ATOM 0 HH TYR A 60 279.725 132.890 395.429 1.00 0.00 H new ATOM 998 N GLY A 61 279.183 124.778 392.897 1.00 0.00 N ATOM 999 CA GLY A 61 277.880 124.159 392.661 1.00 0.00 C ATOM 1000 C GLY A 61 277.626 122.801 393.330 1.00 0.00 C ATOM 1001 O GLY A 61 276.596 122.202 393.038 1.00 0.00 O ATOM 0 H GLY A 61 279.876 124.482 392.209 1.00 0.00 H new ATOM 0 HA2 GLY A 61 277.109 124.852 392.997 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.752 124.037 391.585 1.00 0.00 H new ATOM 1005 N LYS A 62 278.528 122.250 394.210 1.00 0.00 N ATOM 1006 CA LYS A 62 278.387 120.937 394.867 1.00 0.00 C ATOM 1007 C LYS A 62 277.880 120.921 396.319 1.00 0.00 C ATOM 1008 O LYS A 62 276.916 120.222 396.600 1.00 0.00 O ATOM 1009 CB LYS A 62 279.629 120.005 394.622 1.00 0.00 C ATOM 1010 CG LYS A 62 280.644 119.699 395.756 1.00 0.00 C ATOM 1011 CD LYS A 62 281.509 120.885 396.210 1.00 0.00 C ATOM 1012 CE LYS A 62 281.825 120.888 397.704 1.00 0.00 C ATOM 1013 NZ LYS A 62 282.793 119.833 398.052 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.387 122.732 394.476 1.00 0.00 H new ATOM 0 HA LYS A 62 277.537 120.499 394.343 1.00 0.00 H new ATOM 0 HB2 LYS A 62 279.243 119.047 394.274 1.00 0.00 H new ATOM 0 HB3 LYS A 62 280.195 120.440 393.798 1.00 0.00 H new ATOM 0 HG2 LYS A 62 280.095 119.322 396.619 1.00 0.00 H new ATOM 0 HG3 LYS A 62 281.304 118.898 395.423 1.00 0.00 H new ATOM 0 HD2 LYS A 62 282.445 120.874 395.651 1.00 0.00 H new ATOM 0 HD3 LYS A 62 280.997 121.813 395.956 1.00 0.00 H new ATOM 0 HE2 LYS A 62 282.226 121.860 397.990 1.00 0.00 H new ATOM 0 HE3 LYS A 62 280.906 120.742 398.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 283.203 120.033 398.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 282.310 118.912 398.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 283.550 119.808 397.340 1.00 0.00 H new ATOM 1027 N ALA A 63 278.465 121.681 397.301 1.00 0.00 N ATOM 1028 CA ALA A 63 278.039 121.714 398.724 1.00 0.00 C ATOM 1029 C ALA A 63 276.781 122.546 398.958 1.00 0.00 C ATOM 1030 O ALA A 63 276.098 122.414 399.973 1.00 0.00 O ATOM 1031 CB ALA A 63 279.153 122.169 399.718 1.00 0.00 C ATOM 0 H ALA A 63 279.258 122.294 397.112 1.00 0.00 H new ATOM 0 HA ALA A 63 277.813 120.670 398.939 1.00 0.00 H new ATOM 0 HB1 ALA A 63 278.758 122.165 400.734 1.00 0.00 H new ATOM 0 HB2 ALA A 63 279.999 121.484 399.655 1.00 0.00 H new ATOM 0 HB3 ALA A 63 279.481 123.176 399.461 1.00 0.00 H new ATOM 1037 N ILE A 64 276.441 123.415 397.974 1.00 0.00 N ATOM 1038 CA ILE A 64 275.239 124.257 397.929 1.00 0.00 C ATOM 1039 C ILE A 64 274.005 123.462 397.453 1.00 0.00 C ATOM 1040 O ILE A 64 274.102 122.781 396.431 1.00 0.00 O ATOM 1041 CB ILE A 64 275.425 125.526 397.062 1.00 0.00 C ATOM 1042 CG1 ILE A 64 274.254 126.537 397.203 1.00 0.00 C ATOM 1043 CG2 ILE A 64 275.749 125.202 395.586 1.00 0.00 C ATOM 1044 CD1 ILE A 64 274.578 127.943 396.671 1.00 0.00 C ATOM 0 H ILE A 64 277.033 123.548 397.154 1.00 0.00 H new ATOM 0 HA ILE A 64 275.069 124.586 398.954 1.00 0.00 H new ATOM 0 HB ILE A 64 276.305 126.027 397.465 1.00 0.00 H new ATOM 0 HG12 ILE A 64 273.386 126.149 396.671 1.00 0.00 H new ATOM 0 HG13 ILE A 64 273.976 126.612 398.254 1.00 0.00 H new ATOM 0 HG21 ILE A 64 275.868 126.130 395.027 1.00 0.00 H new ATOM 0 HG22 ILE A 64 276.673 124.626 395.534 1.00 0.00 H new ATOM 0 HG23 ILE A 64 274.934 124.621 395.154 1.00 0.00 H new ATOM 0 HD11 ILE A 64 273.712 128.591 396.804 1.00 0.00 H new ATOM 0 HD12 ILE A 64 275.426 128.353 397.220 1.00 0.00 H new ATOM 0 HD13 ILE A 64 274.826 127.883 395.611 1.00 0.00 H new ATOM 1056 N PRO A 65 272.835 123.454 398.146 1.00 0.00 N ATOM 1057 CA PRO A 65 271.597 122.833 397.665 1.00 0.00 C ATOM 1058 C PRO A 65 270.845 123.768 396.672 1.00 0.00 C ATOM 1059 O PRO A 65 271.002 124.988 396.787 1.00 0.00 O ATOM 1060 CB PRO A 65 270.800 122.631 398.973 1.00 0.00 C ATOM 1061 CG PRO A 65 271.199 123.816 399.859 1.00 0.00 C ATOM 1062 CD PRO A 65 272.658 124.070 399.465 1.00 0.00 C ATOM 0 HA PRO A 65 271.757 121.909 397.109 1.00 0.00 H new ATOM 0 HB2 PRO A 65 269.726 122.621 398.785 1.00 0.00 H new ATOM 0 HB3 PRO A 65 271.050 121.681 399.446 1.00 0.00 H new ATOM 0 HG2 PRO A 65 270.573 124.688 399.671 1.00 0.00 H new ATOM 0 HG3 PRO A 65 271.103 123.577 400.918 1.00 0.00 H new ATOM 0 HD2 PRO A 65 272.872 125.138 399.428 1.00 0.00 H new ATOM 0 HD3 PRO A 65 273.340 123.633 400.194 1.00 0.00 H new ATOM 1070 N PRO A 66 269.994 123.284 395.730 1.00 0.00 N ATOM 1071 CA PRO A 66 269.283 124.094 394.725 1.00 0.00 C ATOM 1072 C PRO A 66 267.985 124.715 395.287 1.00 0.00 C ATOM 1073 O PRO A 66 266.889 124.333 394.878 1.00 0.00 O ATOM 1074 CB PRO A 66 269.020 123.056 393.614 1.00 0.00 C ATOM 1075 CG PRO A 66 268.779 121.744 394.369 1.00 0.00 C ATOM 1076 CD PRO A 66 269.741 121.852 395.555 1.00 0.00 C ATOM 0 HA PRO A 66 269.843 124.963 394.380 1.00 0.00 H new ATOM 0 HB2 PRO A 66 268.156 123.331 393.009 1.00 0.00 H new ATOM 0 HB3 PRO A 66 269.870 122.975 392.937 1.00 0.00 H new ATOM 0 HG2 PRO A 66 267.743 121.650 394.696 1.00 0.00 H new ATOM 0 HG3 PRO A 66 268.998 120.875 393.749 1.00 0.00 H new ATOM 0 HD2 PRO A 66 269.304 121.419 396.455 1.00 0.00 H new ATOM 0 HD3 PRO A 66 270.667 121.312 395.359 1.00 0.00 H new ATOM 1084 N ALA A 67 268.118 125.678 396.221 1.00 0.00 N ATOM 1085 CA ALA A 67 267.073 126.386 396.933 1.00 0.00 C ATOM 1086 C ALA A 67 267.886 127.434 397.699 1.00 0.00 C ATOM 1087 O ALA A 67 269.027 127.620 397.267 1.00 0.00 O ATOM 1088 CB ALA A 67 266.277 125.401 397.839 1.00 0.00 C ATOM 0 H ALA A 67 269.043 125.996 396.510 1.00 0.00 H new ATOM 0 HA ALA A 67 266.299 126.842 396.316 1.00 0.00 H new ATOM 0 HB1 ALA A 67 265.495 125.945 398.369 1.00 0.00 H new ATOM 0 HB2 ALA A 67 265.825 124.624 397.222 1.00 0.00 H new ATOM 0 HB3 ALA A 67 266.953 124.943 398.561 1.00 0.00 H new ATOM 1094 N PRO A 68 267.505 128.186 398.763 1.00 0.00 N ATOM 1095 CA PRO A 68 268.406 129.111 399.480 1.00 0.00 C ATOM 1096 C PRO A 68 269.581 128.411 400.236 1.00 0.00 C ATOM 1097 O PRO A 68 269.369 127.299 400.727 1.00 0.00 O ATOM 1098 CB PRO A 68 267.459 129.853 400.457 1.00 0.00 C ATOM 1099 CG PRO A 68 266.065 129.700 399.842 1.00 0.00 C ATOM 1100 CD PRO A 68 266.133 128.298 399.246 1.00 0.00 C ATOM 0 HA PRO A 68 268.925 129.770 398.784 1.00 0.00 H new ATOM 0 HB2 PRO A 68 267.501 129.418 401.456 1.00 0.00 H new ATOM 0 HB3 PRO A 68 267.735 130.903 400.555 1.00 0.00 H new ATOM 0 HG2 PRO A 68 265.277 129.787 400.590 1.00 0.00 H new ATOM 0 HG3 PRO A 68 265.869 130.457 399.083 1.00 0.00 H new ATOM 0 HD2 PRO A 68 265.909 127.536 399.992 1.00 0.00 H new ATOM 0 HD3 PRO A 68 265.413 128.173 398.437 1.00 0.00 H new ATOM 1108 N PRO A 69 270.806 128.973 400.356 1.00 0.00 N ATOM 1109 CA PRO A 69 271.937 128.358 401.060 1.00 0.00 C ATOM 1110 C PRO A 69 271.856 128.529 402.591 1.00 0.00 C ATOM 1111 O PRO A 69 270.934 129.157 403.113 1.00 0.00 O ATOM 1112 CB PRO A 69 273.136 129.111 400.449 1.00 0.00 C ATOM 1113 CG PRO A 69 272.611 130.528 400.207 1.00 0.00 C ATOM 1114 CD PRO A 69 271.159 130.277 399.786 1.00 0.00 C ATOM 0 HA PRO A 69 271.986 127.276 400.936 1.00 0.00 H new ATOM 0 HB2 PRO A 69 273.990 129.114 401.126 1.00 0.00 H new ATOM 0 HB3 PRO A 69 273.466 128.645 399.520 1.00 0.00 H new ATOM 0 HG2 PRO A 69 272.673 131.142 401.105 1.00 0.00 H new ATOM 0 HG3 PRO A 69 273.176 131.043 399.430 1.00 0.00 H new ATOM 0 HD2 PRO A 69 270.501 131.061 400.161 1.00 0.00 H new ATOM 0 HD3 PRO A 69 271.061 130.270 398.700 1.00 0.00 H new ATOM 1122 N ALA A 70 272.839 127.963 403.339 1.00 0.00 N ATOM 1123 CA ALA A 70 272.951 127.969 404.793 1.00 0.00 C ATOM 1124 C ALA A 70 273.584 129.268 405.334 1.00 0.00 C ATOM 1125 O ALA A 70 274.394 129.856 404.623 1.00 0.00 O ATOM 1126 CB ALA A 70 273.786 126.738 405.210 1.00 0.00 C ATOM 0 H ALA A 70 273.614 127.464 402.901 1.00 0.00 H new ATOM 0 HA ALA A 70 271.951 127.922 405.224 1.00 0.00 H new ATOM 0 HB1 ALA A 70 273.886 126.717 406.295 1.00 0.00 H new ATOM 0 HB2 ALA A 70 273.287 125.829 404.874 1.00 0.00 H new ATOM 0 HB3 ALA A 70 274.775 126.798 404.755 1.00 0.00 H new ATOM 1132 N PRO A 71 273.257 129.770 406.542 1.00 0.00 N ATOM 1133 CA PRO A 71 273.704 131.076 407.044 1.00 0.00 C ATOM 1134 C PRO A 71 275.100 131.046 407.721 1.00 0.00 C ATOM 1135 O PRO A 71 275.726 129.984 407.785 1.00 0.00 O ATOM 1136 CB PRO A 71 272.573 131.401 408.055 1.00 0.00 C ATOM 1137 CG PRO A 71 272.171 130.050 408.642 1.00 0.00 C ATOM 1138 CD PRO A 71 272.275 129.135 407.426 1.00 0.00 C ATOM 0 HA PRO A 71 273.845 131.815 406.255 1.00 0.00 H new ATOM 0 HB2 PRO A 71 272.921 132.082 408.832 1.00 0.00 H new ATOM 0 HB3 PRO A 71 271.729 131.885 407.562 1.00 0.00 H new ATOM 0 HG2 PRO A 71 272.839 129.739 409.445 1.00 0.00 H new ATOM 0 HG3 PRO A 71 271.162 130.068 409.055 1.00 0.00 H new ATOM 0 HD2 PRO A 71 272.596 128.134 407.714 1.00 0.00 H new ATOM 0 HD3 PRO A 71 271.310 129.030 406.930 1.00 0.00 H new ATOM 1146 N PRO A 72 275.652 132.195 408.176 1.00 0.00 N ATOM 1147 CA PRO A 72 276.886 132.255 408.949 1.00 0.00 C ATOM 1148 C PRO A 72 276.630 132.039 410.458 1.00 0.00 C ATOM 1149 O PRO A 72 275.698 132.598 411.036 1.00 0.00 O ATOM 1150 CB PRO A 72 277.430 133.655 408.612 1.00 0.00 C ATOM 1151 CG PRO A 72 276.203 134.521 408.294 1.00 0.00 C ATOM 1152 CD PRO A 72 275.126 133.525 407.872 1.00 0.00 C ATOM 0 HA PRO A 72 277.598 131.467 408.704 1.00 0.00 H new ATOM 0 HB2 PRO A 72 277.992 134.067 409.450 1.00 0.00 H new ATOM 0 HB3 PRO A 72 278.110 133.615 407.761 1.00 0.00 H new ATOM 0 HG2 PRO A 72 275.890 135.099 409.164 1.00 0.00 H new ATOM 0 HG3 PRO A 72 276.417 135.234 407.498 1.00 0.00 H new ATOM 0 HD2 PRO A 72 274.196 133.707 408.410 1.00 0.00 H new ATOM 0 HD3 PRO A 72 274.903 133.621 406.809 1.00 0.00 H new ATOM 1160 N LEU A 73 277.489 131.223 411.114 1.00 0.00 N ATOM 1161 CA LEU A 73 277.446 130.928 412.541 1.00 0.00 C ATOM 1162 C LEU A 73 278.854 131.102 413.097 1.00 0.00 C ATOM 1163 O LEU A 73 279.812 130.506 412.607 1.00 0.00 O ATOM 1164 CB LEU A 73 276.900 129.495 412.824 1.00 0.00 C ATOM 1165 CG LEU A 73 276.763 129.068 414.319 1.00 0.00 C ATOM 1166 CD1 LEU A 73 275.871 130.008 415.156 1.00 0.00 C ATOM 1167 CD2 LEU A 73 276.246 127.620 414.456 1.00 0.00 C ATOM 0 H LEU A 73 278.251 130.743 410.636 1.00 0.00 H new ATOM 0 HA LEU A 73 276.758 131.615 413.034 1.00 0.00 H new ATOM 0 HB2 LEU A 73 275.919 129.408 412.356 1.00 0.00 H new ATOM 0 HB3 LEU A 73 277.555 128.779 412.327 1.00 0.00 H new ATOM 0 HG LEU A 73 277.775 129.136 414.719 1.00 0.00 H new ATOM 0 HD11 LEU A 73 275.824 129.646 416.183 1.00 0.00 H new ATOM 0 HD12 LEU A 73 276.291 131.014 415.144 1.00 0.00 H new ATOM 0 HD13 LEU A 73 274.867 130.029 414.733 1.00 0.00 H new ATOM 0 HD21 LEU A 73 276.165 127.361 415.512 1.00 0.00 H new ATOM 0 HD22 LEU A 73 275.266 127.537 413.985 1.00 0.00 H new ATOM 0 HD23 LEU A 73 276.942 126.938 413.968 1.00 0.00 H new ATOM 1179 N THR A 74 278.988 131.939 414.154 1.00 0.00 N ATOM 1180 CA THR A 74 280.229 132.231 414.867 1.00 0.00 C ATOM 1181 C THR A 74 280.162 131.569 416.242 1.00 0.00 C ATOM 1182 O THR A 74 279.234 130.823 416.568 1.00 0.00 O ATOM 1183 CB THR A 74 280.503 133.752 414.941 1.00 0.00 C ATOM 1184 OG1 THR A 74 281.807 134.085 415.420 1.00 0.00 O ATOM 1185 CG2 THR A 74 279.460 134.508 415.790 1.00 0.00 C ATOM 0 H THR A 74 278.191 132.445 414.540 1.00 0.00 H new ATOM 0 HA THR A 74 281.077 131.817 414.322 1.00 0.00 H new ATOM 0 HB THR A 74 280.429 134.074 413.902 1.00 0.00 H new ATOM 0 HG1 THR A 74 282.443 133.390 415.148 1.00 0.00 H new ATOM 0 HG21 THR A 74 279.704 135.570 415.805 1.00 0.00 H new ATOM 0 HG22 THR A 74 278.469 134.370 415.357 1.00 0.00 H new ATOM 0 HG23 THR A 74 279.469 134.119 416.808 1.00 0.00 H new ATOM 1193 N LEU A 75 281.163 131.876 417.111 1.00 0.00 N ATOM 1194 CA LEU A 75 281.365 131.422 418.479 1.00 0.00 C ATOM 1195 C LEU A 75 280.346 132.106 419.369 1.00 0.00 C ATOM 1196 O LEU A 75 280.459 133.279 419.707 1.00 0.00 O ATOM 1197 CB LEU A 75 282.808 131.729 418.984 1.00 0.00 C ATOM 1198 CG LEU A 75 283.923 130.787 418.459 1.00 0.00 C ATOM 1199 CD1 LEU A 75 283.749 129.345 418.970 1.00 0.00 C ATOM 1200 CD2 LEU A 75 284.112 130.792 416.930 1.00 0.00 C ATOM 0 H LEU A 75 281.910 132.509 416.826 1.00 0.00 H new ATOM 0 HA LEU A 75 281.236 130.340 418.512 1.00 0.00 H new ATOM 0 HB2 LEU A 75 283.061 132.751 418.703 1.00 0.00 H new ATOM 0 HB3 LEU A 75 282.808 131.688 420.073 1.00 0.00 H new ATOM 0 HG LEU A 75 284.838 131.208 418.875 1.00 0.00 H new ATOM 0 HD11 LEU A 75 284.552 128.721 418.578 1.00 0.00 H new ATOM 0 HD12 LEU A 75 283.784 129.338 420.059 1.00 0.00 H new ATOM 0 HD13 LEU A 75 282.788 128.954 418.635 1.00 0.00 H new ATOM 0 HD21 LEU A 75 284.913 130.103 416.660 1.00 0.00 H new ATOM 0 HD22 LEU A 75 283.186 130.479 416.448 1.00 0.00 H new ATOM 0 HD23 LEU A 75 284.371 131.798 416.599 1.00 0.00 H new ATOM 1212 N SER A 76 279.277 131.365 419.714 1.00 0.00 N ATOM 1213 CA SER A 76 278.119 131.857 420.439 1.00 0.00 C ATOM 1214 C SER A 76 278.025 131.234 421.831 1.00 0.00 C ATOM 1215 O SER A 76 279.035 130.864 422.426 1.00 0.00 O ATOM 1216 CB SER A 76 276.845 131.527 419.610 1.00 0.00 C ATOM 1217 OG SER A 76 276.946 131.960 418.248 1.00 0.00 O ATOM 0 H SER A 76 279.205 130.374 419.482 1.00 0.00 H new ATOM 0 HA SER A 76 278.212 132.934 420.575 1.00 0.00 H new ATOM 0 HB2 SER A 76 276.669 130.451 419.633 1.00 0.00 H new ATOM 0 HB3 SER A 76 275.981 132.001 420.075 1.00 0.00 H new ATOM 0 HG SER A 76 277.666 131.468 417.801 1.00 0.00 H new ATOM 1223 N LYS A 77 276.782 131.104 422.390 1.00 0.00 N ATOM 1224 CA LYS A 77 276.402 130.478 423.669 1.00 0.00 C ATOM 1225 C LYS A 77 276.918 131.144 424.944 1.00 0.00 C ATOM 1226 O LYS A 77 276.198 131.857 425.636 1.00 0.00 O ATOM 1227 CB LYS A 77 276.677 128.943 423.693 1.00 0.00 C ATOM 1228 CG LYS A 77 275.969 128.183 422.556 1.00 0.00 C ATOM 1229 CD LYS A 77 276.212 126.665 422.586 1.00 0.00 C ATOM 1230 CE LYS A 77 277.668 126.265 422.296 1.00 0.00 C ATOM 1231 NZ LYS A 77 277.820 124.792 422.277 1.00 0.00 N1+ ATOM 0 H LYS A 77 275.962 131.469 421.906 1.00 0.00 H new ATOM 0 HA LYS A 77 275.326 130.650 423.694 1.00 0.00 H new ATOM 0 HB2 LYS A 77 277.751 128.772 423.622 1.00 0.00 H new ATOM 0 HB3 LYS A 77 276.352 128.537 424.651 1.00 0.00 H new ATOM 0 HG2 LYS A 77 274.897 128.372 422.616 1.00 0.00 H new ATOM 0 HG3 LYS A 77 276.309 128.578 421.599 1.00 0.00 H new ATOM 0 HD2 LYS A 77 275.927 126.280 423.565 1.00 0.00 H new ATOM 0 HD3 LYS A 77 275.561 126.187 421.854 1.00 0.00 H new ATOM 0 HE2 LYS A 77 277.978 126.679 421.336 1.00 0.00 H new ATOM 0 HE3 LYS A 77 278.324 126.692 423.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 278.811 124.548 422.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 277.545 124.403 423.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 277.210 124.390 421.537 1.00 0.00 H new ATOM 1245 N LEU A 78 278.215 130.901 425.257 1.00 0.00 N ATOM 1246 CA LEU A 78 278.974 131.433 426.377 1.00 0.00 C ATOM 1247 C LEU A 78 279.839 132.611 425.937 1.00 0.00 C ATOM 1248 O LEU A 78 280.354 133.362 426.760 1.00 0.00 O ATOM 1249 CB LEU A 78 279.814 130.330 427.091 1.00 0.00 C ATOM 1250 CG LEU A 78 280.949 129.614 426.305 1.00 0.00 C ATOM 1251 CD1 LEU A 78 281.838 128.852 427.301 1.00 0.00 C ATOM 1252 CD2 LEU A 78 280.463 128.632 425.221 1.00 0.00 C ATOM 0 H LEU A 78 278.784 130.281 424.681 1.00 0.00 H new ATOM 0 HA LEU A 78 278.260 131.802 427.113 1.00 0.00 H new ATOM 0 HB2 LEU A 78 280.262 130.780 427.977 1.00 0.00 H new ATOM 0 HB3 LEU A 78 279.121 129.563 427.439 1.00 0.00 H new ATOM 0 HG LEU A 78 281.494 130.399 425.780 1.00 0.00 H new ATOM 0 HD11 LEU A 78 282.638 128.346 426.761 1.00 0.00 H new ATOM 0 HD12 LEU A 78 282.270 129.554 428.014 1.00 0.00 H new ATOM 0 HD13 LEU A 78 281.238 128.115 427.835 1.00 0.00 H new ATOM 0 HD21 LEU A 78 281.323 128.181 424.726 1.00 0.00 H new ATOM 0 HD22 LEU A 78 279.859 127.851 425.682 1.00 0.00 H new ATOM 0 HD23 LEU A 78 279.863 129.169 424.487 1.00 0.00 H new ATOM 1264 N GLU A 79 279.998 132.774 424.592 1.00 0.00 N ATOM 1265 CA GLU A 79 280.744 133.821 423.908 1.00 0.00 C ATOM 1266 C GLU A 79 279.798 134.911 423.389 1.00 0.00 C ATOM 1267 O GLU A 79 279.368 135.774 424.147 1.00 0.00 O ATOM 1268 CB GLU A 79 281.576 133.158 422.776 1.00 0.00 C ATOM 1269 CG GLU A 79 282.627 134.062 422.095 1.00 0.00 C ATOM 1270 CD GLU A 79 283.625 134.598 423.123 1.00 0.00 C ATOM 1271 OE1 GLU A 79 283.690 135.845 423.292 1.00 0.00 O ATOM 1272 OE2 GLU A 79 284.337 133.767 423.749 1.00 0.00 O1- ATOM 0 H GLU A 79 279.572 132.124 423.932 1.00 0.00 H new ATOM 0 HA GLU A 79 281.427 134.321 424.595 1.00 0.00 H new ATOM 0 HB2 GLU A 79 282.086 132.287 423.188 1.00 0.00 H new ATOM 0 HB3 GLU A 79 280.889 132.793 422.012 1.00 0.00 H new ATOM 0 HG2 GLU A 79 283.156 133.498 421.327 1.00 0.00 H new ATOM 0 HG3 GLU A 79 282.130 134.893 421.595 1.00 0.00 H new ATOM 1279 N HIS A 80 279.424 134.900 422.077 1.00 0.00 N ATOM 1280 CA HIS A 80 278.514 135.859 421.450 1.00 0.00 C ATOM 1281 C HIS A 80 277.067 135.377 421.493 1.00 0.00 C ATOM 1282 O HIS A 80 276.574 134.777 420.536 1.00 0.00 O ATOM 1283 CB HIS A 80 278.974 136.206 419.999 1.00 0.00 C ATOM 1284 CG HIS A 80 278.234 137.338 419.316 1.00 0.00 C ATOM 1285 ND1 HIS A 80 276.996 137.189 418.730 1.00 0.00 N ATOM 1286 CD2 HIS A 80 278.562 138.651 419.152 1.00 0.00 C ATOM 1287 CE1 HIS A 80 276.630 138.408 418.257 1.00 0.00 C ATOM 1288 NE2 HIS A 80 277.549 139.325 418.487 1.00 0.00 N ATOM 0 H HIS A 80 279.766 134.197 421.422 1.00 0.00 H new ATOM 0 HA HIS A 80 278.553 136.780 422.031 1.00 0.00 H new ATOM 0 HB2 HIS A 80 280.034 136.457 420.026 1.00 0.00 H new ATOM 0 HB3 HIS A 80 278.874 135.311 419.385 1.00 0.00 H new ATOM 0 HD2 HIS A 80 279.482 139.103 419.492 1.00 0.00 H new ATOM 0 HE1 HIS A 80 275.696 138.604 417.752 1.00 0.00 H new ATOM 0 HE2 HIS A 80 277.521 140.312 418.232 1.00 0.00 H new TER 1296 HIS A 80