USER MOD reduce.3.24.130724 H: found=0, std=0, add=994, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 988 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 Single : A 1 GLY N :NH3+ -108:sc= 0.0791 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.273 X(o=-0.27,f=-0.3) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.157 K(o=-0.16,f=-1.5) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc=-0.00222 X(o=-0.0022,f=-0.017) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 51 THR OG1 : rot 54:sc= 0.32 USER MOD Single : A 58 LYS NZ :NH3+ -135:sc= 0.219 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -0.0343 X(o=-0.034,f=-0.51) USER MOD Single : A 66 HIS : no HD1:sc=-0.00666 X(o=-0.0067,f=0) USER MOD Single : A 67 HIS : no HE2:sc= -1.04 K(o=-1,f=-3.7!) USER MOD Single : A 69 THR OG1 : rot -61:sc= -0.59 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 86:sc= 1.21 USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot 71:sc= 0.163 USER MOD Single : A 85 SER OG : rot -58:sc= 0.23 USER MOD Single : A 89 GLN : amide:sc= -0.054 X(o=-0.054,f=0) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 98 GLN : amide:sc= -0.806 K(o=-0.81,f=-3.8!) USER MOD Single : A 108 GLN : amide:sc= -1.18! C(o=-1.2!,f=-4.1!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot -90:sc= 1.03 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 75.159 -39.042 14.915 1.00 0.00 N ATOM 2 CA GLY A 1 74.656 -37.904 14.169 1.00 0.00 C ATOM 3 C GLY A 1 73.442 -37.272 14.822 1.00 0.00 C ATOM 4 O GLY A 1 73.032 -37.679 15.909 1.00 0.00 O ATOM 0 H1 GLY A 1 76.056 -38.786 15.376 1.00 0.00 H new ATOM 0 H2 GLY A 1 74.464 -39.317 15.638 1.00 0.00 H new ATOM 0 H3 GLY A 1 75.318 -39.839 14.266 1.00 0.00 H new ATOM 0 HA2 GLY A 1 75.445 -37.157 14.076 1.00 0.00 H new ATOM 0 HA3 GLY A 1 74.397 -38.222 13.159 1.00 0.00 H new ATOM 8 N SER A 2 72.868 -36.274 14.159 1.00 0.00 N ATOM 9 CA SER A 2 71.697 -35.581 14.685 1.00 0.00 C ATOM 10 C SER A 2 70.441 -36.429 14.513 1.00 0.00 C ATOM 11 O SER A 2 70.393 -37.356 13.704 1.00 0.00 O ATOM 12 CB SER A 2 71.517 -34.234 13.982 1.00 0.00 C ATOM 13 OG SER A 2 72.220 -33.207 14.659 1.00 0.00 O ATOM 0 H SER A 2 73.194 -35.927 13.257 1.00 0.00 H new ATOM 0 HA SER A 2 71.855 -35.409 15.750 1.00 0.00 H new ATOM 0 HB2 SER A 2 71.873 -34.306 12.954 1.00 0.00 H new ATOM 0 HB3 SER A 2 70.457 -33.984 13.935 1.00 0.00 H new ATOM 0 HG SER A 2 72.090 -32.357 14.189 1.00 0.00 H new ATOM 19 N PRO A 3 69.398 -36.106 15.293 1.00 0.00 N ATOM 20 CA PRO A 3 68.122 -36.825 15.246 1.00 0.00 C ATOM 21 C PRO A 3 67.359 -36.568 13.951 1.00 0.00 C ATOM 22 O PRO A 3 67.026 -35.427 13.631 1.00 0.00 O ATOM 23 CB PRO A 3 67.352 -36.259 16.441 1.00 0.00 C ATOM 24 CG PRO A 3 67.935 -34.906 16.661 1.00 0.00 C ATOM 25 CD PRO A 3 69.385 -35.013 16.279 1.00 0.00 C ATOM 0 HA PRO A 3 68.261 -37.905 15.284 1.00 0.00 H new ATOM 0 HB2 PRO A 3 66.284 -36.201 16.232 1.00 0.00 H new ATOM 0 HB3 PRO A 3 67.470 -36.889 17.323 1.00 0.00 H new ATOM 0 HG2 PRO A 3 67.426 -34.158 16.053 1.00 0.00 H new ATOM 0 HG3 PRO A 3 67.827 -34.599 17.701 1.00 0.00 H new ATOM 0 HD2 PRO A 3 69.758 -34.082 15.852 1.00 0.00 H new ATOM 0 HD3 PRO A 3 70.012 -35.242 17.141 1.00 0.00 H new ATOM 33 N PHE A 4 67.084 -37.636 13.209 1.00 0.00 N ATOM 34 CA PHE A 4 66.361 -37.526 11.948 1.00 0.00 C ATOM 35 C PHE A 4 64.902 -37.146 12.189 1.00 0.00 C ATOM 36 O PHE A 4 64.156 -37.884 12.832 1.00 0.00 O ATOM 37 CB PHE A 4 66.435 -38.844 11.176 1.00 0.00 C ATOM 38 CG PHE A 4 67.828 -39.213 10.752 1.00 0.00 C ATOM 39 CD1 PHE A 4 68.469 -38.509 9.744 1.00 0.00 C ATOM 40 CD2 PHE A 4 68.497 -40.263 11.360 1.00 0.00 C ATOM 41 CE1 PHE A 4 69.751 -38.845 9.352 1.00 0.00 C ATOM 42 CE2 PHE A 4 69.779 -40.603 10.972 1.00 0.00 C ATOM 43 CZ PHE A 4 70.406 -39.894 9.966 1.00 0.00 C ATOM 0 H PHE A 4 67.351 -38.588 13.460 1.00 0.00 H new ATOM 0 HA PHE A 4 66.830 -36.740 11.357 1.00 0.00 H new ATOM 0 HB2 PHE A 4 66.029 -39.643 11.797 1.00 0.00 H new ATOM 0 HB3 PHE A 4 65.801 -38.774 10.292 1.00 0.00 H new ATOM 0 HD1 PHE A 4 67.961 -37.689 9.260 1.00 0.00 H new ATOM 0 HD2 PHE A 4 68.011 -40.822 12.146 1.00 0.00 H new ATOM 0 HE1 PHE A 4 70.240 -38.288 8.566 1.00 0.00 H new ATOM 0 HE2 PHE A 4 70.290 -41.423 11.455 1.00 0.00 H new ATOM 0 HZ PHE A 4 71.407 -40.160 9.660 1.00 0.00 H new ATOM 53 N ALA A 5 64.504 -35.990 11.669 1.00 0.00 N ATOM 54 CA ALA A 5 63.136 -35.513 11.826 1.00 0.00 C ATOM 55 C ALA A 5 62.458 -35.334 10.472 1.00 0.00 C ATOM 56 O ALA A 5 63.123 -35.280 9.437 1.00 0.00 O ATOM 57 CB ALA A 5 63.119 -34.205 12.604 1.00 0.00 C ATOM 0 H ALA A 5 65.110 -35.366 11.135 1.00 0.00 H new ATOM 0 HA ALA A 5 62.578 -36.263 12.386 1.00 0.00 H new ATOM 0 HB1 ALA A 5 62.091 -33.860 12.714 1.00 0.00 H new ATOM 0 HB2 ALA A 5 63.556 -34.362 13.590 1.00 0.00 H new ATOM 0 HB3 ALA A 5 63.698 -33.454 12.066 1.00 0.00 H new ATOM 63 N ASP A 6 61.133 -35.242 10.486 1.00 0.00 N ATOM 64 CA ASP A 6 60.365 -35.069 9.258 1.00 0.00 C ATOM 65 C ASP A 6 60.096 -33.592 8.990 1.00 0.00 C ATOM 66 O ASP A 6 60.178 -32.748 9.883 1.00 0.00 O ATOM 67 CB ASP A 6 59.043 -35.833 9.347 1.00 0.00 C ATOM 68 CG ASP A 6 59.161 -37.255 8.834 1.00 0.00 C ATOM 69 OD1 ASP A 6 59.017 -37.458 7.611 1.00 0.00 O ATOM 70 OD2 ASP A 6 59.396 -38.165 9.657 1.00 0.00 O ATOM 0 H ASP A 6 60.568 -35.284 11.334 1.00 0.00 H new ATOM 0 HA ASP A 6 60.952 -35.469 8.431 1.00 0.00 H new ATOM 0 HB2 ASP A 6 58.706 -35.850 10.383 1.00 0.00 H new ATOM 0 HB3 ASP A 6 58.282 -35.305 8.773 1.00 0.00 H new ATOM 75 N PRO A 7 59.769 -33.269 7.730 1.00 0.00 N ATOM 76 CA PRO A 7 59.482 -31.893 7.314 1.00 0.00 C ATOM 77 C PRO A 7 58.170 -31.375 7.891 1.00 0.00 C ATOM 78 O PRO A 7 57.100 -31.910 7.604 1.00 0.00 O ATOM 79 CB PRO A 7 59.392 -31.995 5.789 1.00 0.00 C ATOM 80 CG PRO A 7 59.009 -33.410 5.526 1.00 0.00 C ATOM 81 CD PRO A 7 59.653 -34.223 6.614 1.00 0.00 C ATOM 0 HA PRO A 7 60.242 -31.194 7.664 1.00 0.00 H new ATOM 0 HB2 PRO A 7 58.651 -31.303 5.389 1.00 0.00 H new ATOM 0 HB3 PRO A 7 60.344 -31.749 5.319 1.00 0.00 H new ATOM 0 HG2 PRO A 7 57.926 -33.530 5.539 1.00 0.00 H new ATOM 0 HG3 PRO A 7 59.354 -33.731 4.543 1.00 0.00 H new ATOM 0 HD2 PRO A 7 59.044 -35.086 6.885 1.00 0.00 H new ATOM 0 HD3 PRO A 7 60.627 -34.604 6.308 1.00 0.00 H new ATOM 89 N ASN A 8 58.259 -30.329 8.707 1.00 0.00 N ATOM 90 CA ASN A 8 57.078 -29.738 9.325 1.00 0.00 C ATOM 91 C ASN A 8 56.309 -28.883 8.322 1.00 0.00 C ATOM 92 O ASN A 8 56.841 -28.504 7.278 1.00 0.00 O ATOM 93 CB ASN A 8 57.479 -28.890 10.534 1.00 0.00 C ATOM 94 CG ASN A 8 58.523 -27.847 10.187 1.00 0.00 C ATOM 95 OD1 ASN A 8 59.722 -28.076 10.346 1.00 0.00 O ATOM 96 ND2 ASN A 8 58.071 -26.693 9.710 1.00 0.00 N ATOM 0 H ASN A 8 59.137 -29.874 8.955 1.00 0.00 H new ATOM 0 HA ASN A 8 56.429 -30.548 9.658 1.00 0.00 H new ATOM 0 HB2 ASN A 8 56.595 -28.395 10.937 1.00 0.00 H new ATOM 0 HB3 ASN A 8 57.866 -29.540 11.319 1.00 0.00 H new ATOM 0 HD21 ASN A 8 58.727 -25.953 9.459 1.00 0.00 H new ATOM 0 HD22 ASN A 8 57.068 -26.547 9.595 1.00 0.00 H new ATOM 103 N SER A 9 55.056 -28.583 8.647 1.00 0.00 N ATOM 104 CA SER A 9 54.213 -27.775 7.773 1.00 0.00 C ATOM 105 C SER A 9 52.940 -27.343 8.495 1.00 0.00 C ATOM 106 O SER A 9 52.061 -28.161 8.771 1.00 0.00 O ATOM 107 CB SER A 9 53.855 -28.557 6.508 1.00 0.00 C ATOM 108 OG SER A 9 53.359 -27.695 5.499 1.00 0.00 O ATOM 0 H SER A 9 54.602 -28.887 9.508 1.00 0.00 H new ATOM 0 HA SER A 9 54.773 -26.882 7.493 1.00 0.00 H new ATOM 0 HB2 SER A 9 54.736 -29.083 6.140 1.00 0.00 H new ATOM 0 HB3 SER A 9 53.107 -29.314 6.744 1.00 0.00 H new ATOM 0 HG SER A 9 53.139 -28.219 4.700 1.00 0.00 H new ATOM 114 N LEU A 10 52.847 -26.053 8.797 1.00 0.00 N ATOM 115 CA LEU A 10 51.682 -25.510 9.487 1.00 0.00 C ATOM 116 C LEU A 10 51.059 -24.370 8.688 1.00 0.00 C ATOM 117 O LEU A 10 51.749 -23.662 7.956 1.00 0.00 O ATOM 118 CB LEU A 10 52.073 -25.017 10.881 1.00 0.00 C ATOM 119 CG LEU A 10 50.920 -24.773 11.855 1.00 0.00 C ATOM 120 CD1 LEU A 10 50.365 -26.093 12.368 1.00 0.00 C ATOM 121 CD2 LEU A 10 51.376 -23.898 13.013 1.00 0.00 C ATOM 0 H LEU A 10 53.565 -25.363 8.575 1.00 0.00 H new ATOM 0 HA LEU A 10 50.945 -26.307 9.585 1.00 0.00 H new ATOM 0 HB2 LEU A 10 52.750 -25.747 11.326 1.00 0.00 H new ATOM 0 HB3 LEU A 10 52.633 -24.088 10.772 1.00 0.00 H new ATOM 0 HG LEU A 10 50.125 -24.251 11.323 1.00 0.00 H new ATOM 0 HD11 LEU A 10 49.545 -25.899 13.060 1.00 0.00 H new ATOM 0 HD12 LEU A 10 49.999 -26.685 11.529 1.00 0.00 H new ATOM 0 HD13 LEU A 10 51.152 -26.643 12.884 1.00 0.00 H new ATOM 0 HD21 LEU A 10 50.542 -23.735 13.696 1.00 0.00 H new ATOM 0 HD22 LEU A 10 52.189 -24.392 13.544 1.00 0.00 H new ATOM 0 HD23 LEU A 10 51.724 -22.939 12.629 1.00 0.00 H new ATOM 133 N ALA A 11 49.750 -24.196 8.837 1.00 0.00 N ATOM 134 CA ALA A 11 49.034 -23.139 8.133 1.00 0.00 C ATOM 135 C ALA A 11 49.089 -21.828 8.910 1.00 0.00 C ATOM 136 O ALA A 11 48.558 -21.728 10.017 1.00 0.00 O ATOM 137 CB ALA A 11 47.590 -23.551 7.890 1.00 0.00 C ATOM 0 H ALA A 11 49.163 -24.774 9.439 1.00 0.00 H new ATOM 0 HA ALA A 11 49.522 -22.982 7.171 1.00 0.00 H new ATOM 0 HB1 ALA A 11 47.067 -22.752 7.364 1.00 0.00 H new ATOM 0 HB2 ALA A 11 47.567 -24.459 7.287 1.00 0.00 H new ATOM 0 HB3 ALA A 11 47.099 -23.738 8.845 1.00 0.00 H new ATOM 143 N LEU A 12 49.734 -20.826 8.324 1.00 0.00 N ATOM 144 CA LEU A 12 49.859 -19.519 8.962 1.00 0.00 C ATOM 145 C LEU A 12 49.233 -18.429 8.097 1.00 0.00 C ATOM 146 O LEU A 12 49.567 -18.288 6.922 1.00 0.00 O ATOM 147 CB LEU A 12 51.331 -19.196 9.223 1.00 0.00 C ATOM 148 CG LEU A 12 52.053 -20.110 10.214 1.00 0.00 C ATOM 149 CD1 LEU A 12 53.557 -20.056 9.993 1.00 0.00 C ATOM 150 CD2 LEU A 12 51.708 -19.723 11.645 1.00 0.00 C ATOM 0 H LEU A 12 50.179 -20.893 7.408 1.00 0.00 H new ATOM 0 HA LEU A 12 49.327 -19.553 9.913 1.00 0.00 H new ATOM 0 HB2 LEU A 12 51.864 -19.231 8.273 1.00 0.00 H new ATOM 0 HB3 LEU A 12 51.398 -18.171 9.589 1.00 0.00 H new ATOM 0 HG LEU A 12 51.719 -21.133 10.045 1.00 0.00 H new ATOM 0 HD11 LEU A 12 54.054 -20.713 10.707 1.00 0.00 H new ATOM 0 HD12 LEU A 12 53.788 -20.382 8.979 1.00 0.00 H new ATOM 0 HD13 LEU A 12 53.909 -19.034 10.134 1.00 0.00 H new ATOM 0 HD21 LEU A 12 52.230 -20.384 12.337 1.00 0.00 H new ATOM 0 HD22 LEU A 12 52.013 -18.693 11.827 1.00 0.00 H new ATOM 0 HD23 LEU A 12 50.633 -19.815 11.798 1.00 0.00 H new ATOM 162 N ALA A 13 48.325 -17.661 8.689 1.00 0.00 N ATOM 163 CA ALA A 13 47.656 -16.581 7.975 1.00 0.00 C ATOM 164 C ALA A 13 48.037 -15.222 8.552 1.00 0.00 C ATOM 165 O ALA A 13 47.383 -14.719 9.465 1.00 0.00 O ATOM 166 CB ALA A 13 46.147 -16.772 8.023 1.00 0.00 C ATOM 0 H ALA A 13 48.036 -17.767 9.661 1.00 0.00 H new ATOM 0 HA ALA A 13 47.983 -16.610 6.935 1.00 0.00 H new ATOM 0 HB1 ALA A 13 45.660 -15.958 7.486 1.00 0.00 H new ATOM 0 HB2 ALA A 13 45.886 -17.722 7.557 1.00 0.00 H new ATOM 0 HB3 ALA A 13 45.813 -16.773 9.061 1.00 0.00 H new ATOM 172 N ASN A 14 49.100 -14.633 8.014 1.00 0.00 N ATOM 173 CA ASN A 14 49.569 -13.332 8.477 1.00 0.00 C ATOM 174 C ASN A 14 49.555 -12.313 7.342 1.00 0.00 C ATOM 175 O ASN A 14 49.586 -12.677 6.166 1.00 0.00 O ATOM 176 CB ASN A 14 50.982 -13.451 9.053 1.00 0.00 C ATOM 177 CG ASN A 14 51.064 -14.467 10.176 1.00 0.00 C ATOM 178 OD1 ASN A 14 50.806 -15.653 9.975 1.00 0.00 O ATOM 179 ND2 ASN A 14 51.424 -14.003 11.368 1.00 0.00 N ATOM 0 H ASN A 14 49.653 -15.036 7.257 1.00 0.00 H new ATOM 0 HA ASN A 14 48.893 -12.987 9.259 1.00 0.00 H new ATOM 0 HB2 ASN A 14 51.673 -13.735 8.259 1.00 0.00 H new ATOM 0 HB3 ASN A 14 51.304 -12.478 9.423 1.00 0.00 H new ATOM 0 HD21 ASN A 14 51.496 -14.639 12.162 1.00 0.00 H new ATOM 0 HD22 ASN A 14 51.629 -13.011 11.489 1.00 0.00 H new ATOM 186 N VAL A 15 49.510 -11.034 7.702 1.00 0.00 N ATOM 187 CA VAL A 15 49.494 -9.962 6.714 1.00 0.00 C ATOM 188 C VAL A 15 50.796 -9.168 6.743 1.00 0.00 C ATOM 189 O VAL A 15 51.496 -9.113 7.755 1.00 0.00 O ATOM 190 CB VAL A 15 48.314 -9.000 6.949 1.00 0.00 C ATOM 191 CG1 VAL A 15 47.008 -9.639 6.504 1.00 0.00 C ATOM 192 CG2 VAL A 15 48.246 -8.589 8.412 1.00 0.00 C ATOM 0 H VAL A 15 49.484 -10.715 8.671 1.00 0.00 H new ATOM 0 HA VAL A 15 49.381 -10.433 5.738 1.00 0.00 H new ATOM 0 HB VAL A 15 48.473 -8.103 6.351 1.00 0.00 H new ATOM 0 HG11 VAL A 15 46.186 -8.945 6.678 1.00 0.00 H new ATOM 0 HG12 VAL A 15 47.063 -9.878 5.442 1.00 0.00 H new ATOM 0 HG13 VAL A 15 46.838 -10.553 7.073 1.00 0.00 H new ATOM 0 HG21 VAL A 15 47.407 -7.909 8.560 1.00 0.00 H new ATOM 0 HG22 VAL A 15 48.110 -9.475 9.033 1.00 0.00 H new ATOM 0 HG23 VAL A 15 49.173 -8.088 8.693 1.00 0.00 H new ATOM 202 N PRO A 16 51.130 -8.538 5.607 1.00 0.00 N ATOM 203 CA PRO A 16 52.349 -7.735 5.477 1.00 0.00 C ATOM 204 C PRO A 16 52.283 -6.445 6.288 1.00 0.00 C ATOM 205 O PRO A 16 51.865 -5.402 5.783 1.00 0.00 O ATOM 206 CB PRO A 16 52.409 -7.422 3.980 1.00 0.00 C ATOM 207 CG PRO A 16 50.995 -7.501 3.519 1.00 0.00 C ATOM 208 CD PRO A 16 50.343 -8.561 4.363 1.00 0.00 C ATOM 0 HA PRO A 16 53.226 -8.262 5.852 1.00 0.00 H new ATOM 0 HB2 PRO A 16 52.830 -6.433 3.799 1.00 0.00 H new ATOM 0 HB3 PRO A 16 53.038 -8.138 3.451 1.00 0.00 H new ATOM 0 HG2 PRO A 16 50.491 -6.542 3.639 1.00 0.00 H new ATOM 0 HG3 PRO A 16 50.943 -7.758 2.461 1.00 0.00 H new ATOM 0 HD2 PRO A 16 49.292 -8.338 4.548 1.00 0.00 H new ATOM 0 HD3 PRO A 16 50.381 -9.538 3.881 1.00 0.00 H new ATOM 216 N LEU A 17 52.698 -6.522 7.548 1.00 0.00 N ATOM 217 CA LEU A 17 52.686 -5.360 8.430 1.00 0.00 C ATOM 218 C LEU A 17 53.888 -5.377 9.368 1.00 0.00 C ATOM 219 O LEU A 17 53.922 -6.136 10.336 1.00 0.00 O ATOM 220 CB LEU A 17 51.391 -5.325 9.243 1.00 0.00 C ATOM 221 CG LEU A 17 50.216 -4.584 8.602 1.00 0.00 C ATOM 222 CD1 LEU A 17 49.493 -5.485 7.613 1.00 0.00 C ATOM 223 CD2 LEU A 17 49.256 -4.083 9.671 1.00 0.00 C ATOM 0 H LEU A 17 53.047 -7.377 7.982 1.00 0.00 H new ATOM 0 HA LEU A 17 52.743 -4.464 7.811 1.00 0.00 H new ATOM 0 HB2 LEU A 17 51.082 -6.351 9.442 1.00 0.00 H new ATOM 0 HB3 LEU A 17 51.603 -4.863 10.207 1.00 0.00 H new ATOM 0 HG LEU A 17 50.606 -3.723 8.059 1.00 0.00 H new ATOM 0 HD11 LEU A 17 48.660 -4.941 7.167 1.00 0.00 H new ATOM 0 HD12 LEU A 17 50.185 -5.795 6.830 1.00 0.00 H new ATOM 0 HD13 LEU A 17 49.115 -6.366 8.132 1.00 0.00 H new ATOM 0 HD21 LEU A 17 48.426 -3.558 9.198 1.00 0.00 H new ATOM 0 HD22 LEU A 17 48.872 -4.929 10.241 1.00 0.00 H new ATOM 0 HD23 LEU A 17 49.781 -3.402 10.341 1.00 0.00 H new ATOM 235 N SER A 18 54.873 -4.533 9.076 1.00 0.00 N ATOM 236 CA SER A 18 56.078 -4.451 9.892 1.00 0.00 C ATOM 237 C SER A 18 56.357 -3.010 10.306 1.00 0.00 C ATOM 238 O SER A 18 57.465 -2.677 10.727 1.00 0.00 O ATOM 239 CB SER A 18 57.277 -5.016 9.128 1.00 0.00 C ATOM 240 OG SER A 18 56.855 -5.802 8.027 1.00 0.00 O ATOM 0 H SER A 18 54.860 -3.896 8.279 1.00 0.00 H new ATOM 0 HA SER A 18 55.918 -5.044 10.792 1.00 0.00 H new ATOM 0 HB2 SER A 18 57.906 -4.198 8.776 1.00 0.00 H new ATOM 0 HB3 SER A 18 57.887 -5.621 9.798 1.00 0.00 H new ATOM 0 HG SER A 18 57.639 -6.150 7.554 1.00 0.00 H new ATOM 246 N ARG A 19 55.344 -2.158 10.183 1.00 0.00 N ATOM 247 CA ARG A 19 55.480 -0.752 10.542 1.00 0.00 C ATOM 248 C ARG A 19 55.156 -0.534 12.017 1.00 0.00 C ATOM 249 O ARG A 19 53.992 -0.550 12.416 1.00 0.00 O ATOM 250 CB ARG A 19 54.560 0.109 9.674 1.00 0.00 C ATOM 251 CG ARG A 19 55.019 1.552 9.547 1.00 0.00 C ATOM 252 CD ARG A 19 54.555 2.391 10.727 1.00 0.00 C ATOM 253 NE ARG A 19 53.101 2.513 10.774 1.00 0.00 N ATOM 254 CZ ARG A 19 52.455 3.278 11.648 1.00 0.00 C ATOM 255 NH1 ARG A 19 53.132 3.985 12.542 1.00 0.00 N ATOM 256 NH2 ARG A 19 51.130 3.337 11.627 1.00 0.00 N ATOM 0 H ARG A 19 54.420 -2.417 9.837 1.00 0.00 H new ATOM 0 HA ARG A 19 56.515 -0.456 10.367 1.00 0.00 H new ATOM 0 HB2 ARG A 19 54.495 -0.332 8.679 1.00 0.00 H new ATOM 0 HB3 ARG A 19 53.555 0.092 10.096 1.00 0.00 H new ATOM 0 HG2 ARG A 19 56.107 1.584 9.482 1.00 0.00 H new ATOM 0 HG3 ARG A 19 54.631 1.978 8.622 1.00 0.00 H new ATOM 0 HD2 ARG A 19 54.911 1.941 11.654 1.00 0.00 H new ATOM 0 HD3 ARG A 19 55.000 3.384 10.663 1.00 0.00 H new ATOM 0 HE ARG A 19 52.551 1.982 10.099 1.00 0.00 H new ATOM 0 HH11 ARG A 19 54.151 3.943 12.560 1.00 0.00 H new ATOM 0 HH12 ARG A 19 52.634 4.571 13.212 1.00 0.00 H new ATOM 0 HH21 ARG A 19 50.606 2.795 10.940 1.00 0.00 H new ATOM 0 HH22 ARG A 19 50.635 3.924 12.298 1.00 0.00 H new ATOM 270 N SER A 20 56.194 -0.331 12.822 1.00 0.00 N ATOM 271 CA SER A 20 56.020 -0.115 14.254 1.00 0.00 C ATOM 272 C SER A 20 56.254 1.349 14.614 1.00 0.00 C ATOM 273 O SER A 20 55.396 1.999 15.211 1.00 0.00 O ATOM 274 CB SER A 20 56.979 -1.006 15.046 1.00 0.00 C ATOM 275 OG SER A 20 57.066 -0.587 16.397 1.00 0.00 O ATOM 0 H SER A 20 57.164 -0.312 12.507 1.00 0.00 H new ATOM 0 HA SER A 20 54.994 -0.376 14.514 1.00 0.00 H new ATOM 0 HB2 SER A 20 56.638 -2.040 15.004 1.00 0.00 H new ATOM 0 HB3 SER A 20 57.968 -0.978 14.589 1.00 0.00 H new ATOM 0 HG SER A 20 57.684 -1.173 16.882 1.00 0.00 H new ATOM 281 N LYS A 21 57.423 1.863 14.246 1.00 0.00 N ATOM 282 CA LYS A 21 57.772 3.250 14.528 1.00 0.00 C ATOM 283 C LYS A 21 58.738 3.792 13.479 1.00 0.00 C ATOM 284 O LYS A 21 59.894 3.375 13.411 1.00 0.00 O ATOM 285 CB LYS A 21 58.397 3.368 15.920 1.00 0.00 C ATOM 286 CG LYS A 21 59.474 2.333 16.193 1.00 0.00 C ATOM 287 CD LYS A 21 60.008 2.444 17.611 1.00 0.00 C ATOM 288 CE LYS A 21 61.088 3.509 17.719 1.00 0.00 C ATOM 289 NZ LYS A 21 61.976 3.282 18.893 1.00 0.00 N ATOM 0 H LYS A 21 58.145 1.339 13.751 1.00 0.00 H new ATOM 0 HA LYS A 21 56.857 3.842 14.496 1.00 0.00 H new ATOM 0 HB2 LYS A 21 58.825 4.364 16.034 1.00 0.00 H new ATOM 0 HB3 LYS A 21 57.613 3.271 16.671 1.00 0.00 H new ATOM 0 HG2 LYS A 21 59.068 1.334 16.033 1.00 0.00 H new ATOM 0 HG3 LYS A 21 60.292 2.462 15.484 1.00 0.00 H new ATOM 0 HD2 LYS A 21 59.190 2.683 18.291 1.00 0.00 H new ATOM 0 HD3 LYS A 21 60.412 1.482 17.925 1.00 0.00 H new ATOM 0 HE2 LYS A 21 61.686 3.514 16.807 1.00 0.00 H new ATOM 0 HE3 LYS A 21 60.623 4.491 17.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 62.699 4.029 18.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 61.410 3.303 19.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 62.440 2.356 18.803 1.00 0.00 H new ATOM 303 N ARG A 22 58.256 4.726 12.664 1.00 0.00 N ATOM 304 CA ARG A 22 59.077 5.325 11.618 1.00 0.00 C ATOM 305 C ARG A 22 60.229 6.123 12.222 1.00 0.00 C ATOM 306 O ARG A 22 60.153 6.614 13.349 1.00 0.00 O ATOM 307 CB ARG A 22 58.225 6.232 10.729 1.00 0.00 C ATOM 308 CG ARG A 22 57.867 7.559 11.377 1.00 0.00 C ATOM 309 CD ARG A 22 58.834 8.658 10.968 1.00 0.00 C ATOM 310 NE ARG A 22 58.992 9.666 12.013 1.00 0.00 N ATOM 311 CZ ARG A 22 58.105 10.626 12.248 1.00 0.00 C ATOM 312 NH1 ARG A 22 57.002 10.709 11.516 1.00 0.00 N ATOM 313 NH2 ARG A 22 58.319 11.506 13.218 1.00 0.00 N ATOM 0 H ARG A 22 57.302 5.084 12.708 1.00 0.00 H new ATOM 0 HA ARG A 22 59.493 4.521 11.012 1.00 0.00 H new ATOM 0 HB2 ARG A 22 58.762 6.424 9.800 1.00 0.00 H new ATOM 0 HB3 ARG A 22 57.307 5.708 10.464 1.00 0.00 H new ATOM 0 HG2 ARG A 22 56.853 7.841 11.094 1.00 0.00 H new ATOM 0 HG3 ARG A 22 57.876 7.450 12.461 1.00 0.00 H new ATOM 0 HD2 ARG A 22 59.805 8.219 10.738 1.00 0.00 H new ATOM 0 HD3 ARG A 22 58.476 9.135 10.056 1.00 0.00 H new ATOM 0 HE ARG A 22 59.830 9.631 12.594 1.00 0.00 H new ATOM 0 HH11 ARG A 22 56.833 10.034 10.770 1.00 0.00 H new ATOM 0 HH12 ARG A 22 56.323 11.448 11.699 1.00 0.00 H new ATOM 0 HH21 ARG A 22 59.165 11.445 13.784 1.00 0.00 H new ATOM 0 HH22 ARG A 22 57.637 12.243 13.398 1.00 0.00 H new ATOM 327 N PRO A 23 61.322 6.256 11.457 1.00 0.00 N ATOM 328 CA PRO A 23 62.511 6.993 11.895 1.00 0.00 C ATOM 329 C PRO A 23 62.264 8.496 11.974 1.00 0.00 C ATOM 330 O PRO A 23 61.974 9.141 10.967 1.00 0.00 O ATOM 331 CB PRO A 23 63.544 6.677 10.811 1.00 0.00 C ATOM 332 CG PRO A 23 62.737 6.355 9.601 1.00 0.00 C ATOM 333 CD PRO A 23 61.482 5.696 10.104 1.00 0.00 C ATOM 0 HA PRO A 23 62.824 6.703 12.898 1.00 0.00 H new ATOM 0 HB2 PRO A 23 64.203 7.527 10.633 1.00 0.00 H new ATOM 0 HB3 PRO A 23 64.177 5.838 11.100 1.00 0.00 H new ATOM 0 HG2 PRO A 23 62.504 7.257 9.036 1.00 0.00 H new ATOM 0 HG3 PRO A 23 63.285 5.692 8.932 1.00 0.00 H new ATOM 0 HD2 PRO A 23 60.626 5.926 9.470 1.00 0.00 H new ATOM 0 HD3 PRO A 23 61.579 4.611 10.127 1.00 0.00 H new ATOM 341 N ASP A 24 62.381 9.047 13.177 1.00 0.00 N ATOM 342 CA ASP A 24 62.172 10.475 13.388 1.00 0.00 C ATOM 343 C ASP A 24 63.446 11.260 13.090 1.00 0.00 C ATOM 344 O ASP A 24 64.452 11.117 13.786 1.00 0.00 O ATOM 345 CB ASP A 24 61.718 10.739 14.824 1.00 0.00 C ATOM 346 CG ASP A 24 61.330 12.187 15.051 1.00 0.00 C ATOM 347 OD1 ASP A 24 62.197 13.068 14.876 1.00 0.00 O ATOM 348 OD2 ASP A 24 60.159 12.439 15.406 1.00 0.00 O ATOM 0 H ASP A 24 62.619 8.527 14.021 1.00 0.00 H new ATOM 0 HA ASP A 24 61.393 10.809 12.703 1.00 0.00 H new ATOM 0 HB2 ASP A 24 60.868 10.097 15.057 1.00 0.00 H new ATOM 0 HB3 ASP A 24 62.520 10.469 15.511 1.00 0.00 H new ATOM 353 N PHE A 25 63.395 12.089 12.053 1.00 0.00 N ATOM 354 CA PHE A 25 64.546 12.895 11.662 1.00 0.00 C ATOM 355 C PHE A 25 65.070 13.704 12.845 1.00 0.00 C ATOM 356 O PHE A 25 64.297 14.294 13.598 1.00 0.00 O ATOM 357 CB PHE A 25 64.171 13.834 10.513 1.00 0.00 C ATOM 358 CG PHE A 25 63.310 14.989 10.940 1.00 0.00 C ATOM 359 CD1 PHE A 25 63.883 16.165 11.396 1.00 0.00 C ATOM 360 CD2 PHE A 25 61.929 14.898 10.885 1.00 0.00 C ATOM 361 CE1 PHE A 25 63.095 17.230 11.789 1.00 0.00 C ATOM 362 CE2 PHE A 25 61.135 15.960 11.276 1.00 0.00 C ATOM 363 CZ PHE A 25 61.719 17.127 11.730 1.00 0.00 C ATOM 0 H PHE A 25 62.570 12.220 11.468 1.00 0.00 H new ATOM 0 HA PHE A 25 65.334 12.220 11.328 1.00 0.00 H new ATOM 0 HB2 PHE A 25 65.083 14.220 10.057 1.00 0.00 H new ATOM 0 HB3 PHE A 25 63.647 13.265 9.745 1.00 0.00 H new ATOM 0 HD1 PHE A 25 64.958 16.250 11.445 1.00 0.00 H new ATOM 0 HD2 PHE A 25 61.467 13.987 10.533 1.00 0.00 H new ATOM 0 HE1 PHE A 25 63.554 18.142 12.142 1.00 0.00 H new ATOM 0 HE2 PHE A 25 60.059 15.878 11.227 1.00 0.00 H new ATOM 0 HZ PHE A 25 61.101 17.957 12.038 1.00 0.00 H new ATOM 373 N GLY A 26 66.390 13.726 13.001 1.00 0.00 N ATOM 374 CA GLY A 26 66.996 14.464 14.093 1.00 0.00 C ATOM 375 C GLY A 26 68.479 14.186 14.229 1.00 0.00 C ATOM 376 O GLY A 26 68.878 13.084 14.605 1.00 0.00 O ATOM 0 H GLY A 26 67.051 13.246 12.390 1.00 0.00 H new ATOM 0 HA2 GLY A 26 66.843 15.532 13.935 1.00 0.00 H new ATOM 0 HA3 GLY A 26 66.494 14.205 15.025 1.00 0.00 H new ATOM 380 N GLN A 27 69.298 15.186 13.921 1.00 0.00 N ATOM 381 CA GLN A 27 70.747 15.042 14.008 1.00 0.00 C ATOM 382 C GLN A 27 71.384 16.294 14.601 1.00 0.00 C ATOM 383 O GLN A 27 71.218 17.395 14.076 1.00 0.00 O ATOM 384 CB GLN A 27 71.337 14.761 12.625 1.00 0.00 C ATOM 385 CG GLN A 27 72.855 14.689 12.615 1.00 0.00 C ATOM 386 CD GLN A 27 73.388 13.500 13.391 1.00 0.00 C ATOM 387 OE1 GLN A 27 72.997 12.358 13.146 1.00 0.00 O ATOM 388 NE2 GLN A 27 74.286 13.762 14.334 1.00 0.00 N ATOM 0 H GLN A 27 68.983 16.105 13.609 1.00 0.00 H new ATOM 0 HA GLN A 27 70.964 14.200 14.665 1.00 0.00 H new ATOM 0 HB2 GLN A 27 70.934 13.819 12.252 1.00 0.00 H new ATOM 0 HB3 GLN A 27 71.014 15.541 11.936 1.00 0.00 H new ATOM 0 HG2 GLN A 27 73.205 14.632 11.584 1.00 0.00 H new ATOM 0 HG3 GLN A 27 73.261 15.607 13.040 1.00 0.00 H new ATOM 0 HE21 GLN A 27 74.582 14.723 14.504 1.00 0.00 H new ATOM 0 HE22 GLN A 27 74.680 13.002 14.889 1.00 0.00 H new ATOM 397 N ARG A 28 72.113 16.118 15.699 1.00 0.00 N ATOM 398 CA ARG A 28 72.773 17.235 16.364 1.00 0.00 C ATOM 399 C ARG A 28 74.178 17.446 15.807 1.00 0.00 C ATOM 400 O ARG A 28 75.165 17.365 16.538 1.00 0.00 O ATOM 401 CB ARG A 28 72.843 16.988 17.872 1.00 0.00 C ATOM 402 CG ARG A 28 72.928 18.264 18.695 1.00 0.00 C ATOM 403 CD ARG A 28 72.370 18.062 20.095 1.00 0.00 C ATOM 404 NE ARG A 28 70.916 17.917 20.089 1.00 0.00 N ATOM 405 CZ ARG A 28 70.216 17.493 21.135 1.00 0.00 C ATOM 406 NH1 ARG A 28 70.832 17.176 22.265 1.00 0.00 N ATOM 407 NH2 ARG A 28 68.896 17.387 21.052 1.00 0.00 N ATOM 0 H ARG A 28 72.261 15.213 16.146 1.00 0.00 H new ATOM 0 HA ARG A 28 72.187 18.135 16.176 1.00 0.00 H new ATOM 0 HB2 ARG A 28 71.962 16.425 18.181 1.00 0.00 H new ATOM 0 HB3 ARG A 28 73.712 16.367 18.090 1.00 0.00 H new ATOM 0 HG2 ARG A 28 73.967 18.588 18.759 1.00 0.00 H new ATOM 0 HG3 ARG A 28 72.376 19.059 18.193 1.00 0.00 H new ATOM 0 HD2 ARG A 28 72.821 17.175 20.541 1.00 0.00 H new ATOM 0 HD3 ARG A 28 72.647 18.910 20.722 1.00 0.00 H new ATOM 0 HE ARG A 28 70.411 18.154 19.235 1.00 0.00 H new ATOM 0 HH11 ARG A 28 71.846 17.257 22.333 1.00 0.00 H new ATOM 0 HH12 ARG A 28 70.292 16.851 23.067 1.00 0.00 H new ATOM 0 HH21 ARG A 28 68.418 17.631 20.184 1.00 0.00 H new ATOM 0 HH22 ARG A 28 68.359 17.061 21.856 1.00 0.00 H new ATOM 421 N ARG A 29 74.259 17.715 14.508 1.00 0.00 N ATOM 422 CA ARG A 29 75.543 17.936 13.853 1.00 0.00 C ATOM 423 C ARG A 29 76.164 19.255 14.304 1.00 0.00 C ATOM 424 O ARG A 29 75.462 20.161 14.753 1.00 0.00 O ATOM 425 CB ARG A 29 75.370 17.935 12.333 1.00 0.00 C ATOM 426 CG ARG A 29 76.684 17.995 11.570 1.00 0.00 C ATOM 427 CD ARG A 29 76.621 17.181 10.287 1.00 0.00 C ATOM 428 NE ARG A 29 76.733 15.748 10.542 1.00 0.00 N ATOM 429 CZ ARG A 29 77.852 15.159 10.950 1.00 0.00 C ATOM 430 NH1 ARG A 29 78.949 15.877 11.148 1.00 0.00 N ATOM 431 NH2 ARG A 29 77.875 13.849 11.161 1.00 0.00 N ATOM 0 H ARG A 29 73.452 17.785 13.889 1.00 0.00 H new ATOM 0 HA ARG A 29 76.212 17.124 14.137 1.00 0.00 H new ATOM 0 HB2 ARG A 29 74.829 17.036 12.038 1.00 0.00 H new ATOM 0 HB3 ARG A 29 74.753 18.787 12.045 1.00 0.00 H new ATOM 0 HG2 ARG A 29 76.921 19.032 11.333 1.00 0.00 H new ATOM 0 HG3 ARG A 29 77.490 17.620 12.201 1.00 0.00 H new ATOM 0 HD2 ARG A 29 75.681 17.385 9.774 1.00 0.00 H new ATOM 0 HD3 ARG A 29 77.424 17.494 9.619 1.00 0.00 H new ATOM 0 HE ARG A 29 75.907 15.167 10.399 1.00 0.00 H new ATOM 0 HH11 ARG A 29 78.935 16.884 10.987 1.00 0.00 H new ATOM 0 HH12 ARG A 29 79.807 15.422 11.461 1.00 0.00 H new ATOM 0 HH21 ARG A 29 77.033 13.293 11.010 1.00 0.00 H new ATOM 0 HH22 ARG A 29 78.735 13.398 11.474 1.00 0.00 H new ATOM 445 N ILE A 30 77.483 19.354 14.181 1.00 0.00 N ATOM 446 CA ILE A 30 78.198 20.561 14.576 1.00 0.00 C ATOM 447 C ILE A 30 78.672 21.343 13.355 1.00 0.00 C ATOM 448 O ILE A 30 79.383 20.811 12.503 1.00 0.00 O ATOM 449 CB ILE A 30 79.412 20.232 15.464 1.00 0.00 C ATOM 450 CG1 ILE A 30 78.972 19.433 16.692 1.00 0.00 C ATOM 451 CG2 ILE A 30 80.124 21.510 15.883 1.00 0.00 C ATOM 452 CD1 ILE A 30 77.936 20.143 17.535 1.00 0.00 C ATOM 0 H ILE A 30 78.078 18.613 13.811 1.00 0.00 H new ATOM 0 HA ILE A 30 77.497 21.171 15.146 1.00 0.00 H new ATOM 0 HB ILE A 30 80.110 19.623 14.889 1.00 0.00 H new ATOM 0 HG12 ILE A 30 78.569 18.474 16.366 1.00 0.00 H new ATOM 0 HG13 ILE A 30 79.845 19.219 17.308 1.00 0.00 H new ATOM 0 HG21 ILE A 30 80.980 21.261 16.510 1.00 0.00 H new ATOM 0 HG22 ILE A 30 80.467 22.043 14.996 1.00 0.00 H new ATOM 0 HG23 ILE A 30 79.436 22.143 16.443 1.00 0.00 H new ATOM 0 HD11 ILE A 30 77.671 19.518 18.388 1.00 0.00 H new ATOM 0 HD12 ILE A 30 78.343 21.090 17.891 1.00 0.00 H new ATOM 0 HD13 ILE A 30 77.047 20.333 16.934 1.00 0.00 H new ATOM 464 N ARG A 31 78.274 22.609 13.280 1.00 0.00 N ATOM 465 CA ARG A 31 78.659 23.465 12.164 1.00 0.00 C ATOM 466 C ARG A 31 79.905 24.277 12.506 1.00 0.00 C ATOM 467 O ARG A 31 80.009 24.845 13.593 1.00 0.00 O ATOM 468 CB ARG A 31 77.510 24.406 11.795 1.00 0.00 C ATOM 469 CG ARG A 31 77.925 25.544 10.878 1.00 0.00 C ATOM 470 CD ARG A 31 78.451 25.026 9.549 1.00 0.00 C ATOM 471 NE ARG A 31 79.718 25.651 9.179 1.00 0.00 N ATOM 472 CZ ARG A 31 80.494 25.213 8.195 1.00 0.00 C ATOM 473 NH1 ARG A 31 80.135 24.153 7.485 1.00 0.00 N ATOM 474 NH2 ARG A 31 81.633 25.836 7.918 1.00 0.00 N ATOM 0 H ARG A 31 77.686 23.064 13.978 1.00 0.00 H new ATOM 0 HA ARG A 31 78.885 22.826 11.310 1.00 0.00 H new ATOM 0 HB2 ARG A 31 76.721 23.830 11.311 1.00 0.00 H new ATOM 0 HB3 ARG A 31 77.086 24.823 12.708 1.00 0.00 H new ATOM 0 HG2 ARG A 31 77.073 26.200 10.702 1.00 0.00 H new ATOM 0 HG3 ARG A 31 78.694 26.144 11.366 1.00 0.00 H new ATOM 0 HD2 ARG A 31 78.584 23.946 9.608 1.00 0.00 H new ATOM 0 HD3 ARG A 31 77.713 25.214 8.769 1.00 0.00 H new ATOM 0 HE ARG A 31 80.024 26.469 9.706 1.00 0.00 H new ATOM 0 HH11 ARG A 31 79.260 23.672 7.694 1.00 0.00 H new ATOM 0 HH12 ARG A 31 80.733 23.819 6.730 1.00 0.00 H new ATOM 0 HH21 ARG A 31 81.913 26.652 8.462 1.00 0.00 H new ATOM 0 HH22 ARG A 31 82.228 25.498 7.162 1.00 0.00 H new ATOM 488 N ARG A 32 80.848 24.325 11.571 1.00 0.00 N ATOM 489 CA ARG A 32 82.088 25.066 11.774 1.00 0.00 C ATOM 490 C ARG A 32 81.826 26.569 11.799 1.00 0.00 C ATOM 491 O ARG A 32 80.800 27.053 11.319 1.00 0.00 O ATOM 492 CB ARG A 32 83.093 24.731 10.670 1.00 0.00 C ATOM 493 CG ARG A 32 84.064 23.623 11.046 1.00 0.00 C ATOM 494 CD ARG A 32 85.275 23.608 10.127 1.00 0.00 C ATOM 495 NE ARG A 32 85.128 22.639 9.044 1.00 0.00 N ATOM 496 CZ ARG A 32 86.149 22.159 8.343 1.00 0.00 C ATOM 497 NH1 ARG A 32 87.386 22.556 8.611 1.00 0.00 N ATOM 498 NH2 ARG A 32 85.935 21.280 7.373 1.00 0.00 N ATOM 0 H ARG A 32 80.778 23.860 10.666 1.00 0.00 H new ATOM 0 HA ARG A 32 82.504 24.772 12.737 1.00 0.00 H new ATOM 0 HB2 ARG A 32 82.549 24.437 9.772 1.00 0.00 H new ATOM 0 HB3 ARG A 32 83.658 25.629 10.420 1.00 0.00 H new ATOM 0 HG2 ARG A 32 84.390 23.758 12.077 1.00 0.00 H new ATOM 0 HG3 ARG A 32 83.556 22.660 10.996 1.00 0.00 H new ATOM 0 HD2 ARG A 32 85.423 24.602 9.706 1.00 0.00 H new ATOM 0 HD3 ARG A 32 86.167 23.371 10.707 1.00 0.00 H new ATOM 0 HE ARG A 32 84.189 22.313 8.813 1.00 0.00 H new ATOM 0 HH11 ARG A 32 87.555 23.231 9.357 1.00 0.00 H new ATOM 0 HH12 ARG A 32 88.169 22.186 8.071 1.00 0.00 H new ATOM 0 HH21 ARG A 32 84.985 20.972 7.164 1.00 0.00 H new ATOM 0 HH22 ARG A 32 86.720 20.912 6.836 1.00 0.00 H new ATOM 512 N PRO A 33 82.773 27.325 12.372 1.00 0.00 N ATOM 513 CA PRO A 33 82.667 28.784 12.474 1.00 0.00 C ATOM 514 C PRO A 33 82.801 29.470 11.119 1.00 0.00 C ATOM 515 O PRO A 33 83.782 29.267 10.403 1.00 0.00 O ATOM 516 CB PRO A 33 83.839 29.162 13.383 1.00 0.00 C ATOM 517 CG PRO A 33 84.827 28.061 13.205 1.00 0.00 C ATOM 518 CD PRO A 33 84.021 26.815 12.965 1.00 0.00 C ATOM 0 HA PRO A 33 81.695 29.097 12.856 1.00 0.00 H new ATOM 0 HB2 PRO A 33 84.264 30.125 13.101 1.00 0.00 H new ATOM 0 HB3 PRO A 33 83.523 29.246 14.423 1.00 0.00 H new ATOM 0 HG2 PRO A 33 85.490 28.264 12.364 1.00 0.00 H new ATOM 0 HG3 PRO A 33 85.456 27.955 14.089 1.00 0.00 H new ATOM 0 HD2 PRO A 33 84.534 26.128 12.292 1.00 0.00 H new ATOM 0 HD3 PRO A 33 83.833 26.273 13.892 1.00 0.00 H new ATOM 526 N PHE A 34 81.809 30.284 10.773 1.00 0.00 N ATOM 527 CA PHE A 34 81.816 31.001 9.503 1.00 0.00 C ATOM 528 C PHE A 34 81.855 32.509 9.730 1.00 0.00 C ATOM 529 O PHE A 34 81.586 32.991 10.831 1.00 0.00 O ATOM 530 CB PHE A 34 80.583 30.629 8.677 1.00 0.00 C ATOM 531 CG PHE A 34 79.354 30.391 9.508 1.00 0.00 C ATOM 532 CD1 PHE A 34 78.921 31.342 10.417 1.00 0.00 C ATOM 533 CD2 PHE A 34 78.633 29.214 9.380 1.00 0.00 C ATOM 534 CE1 PHE A 34 77.791 31.126 11.183 1.00 0.00 C ATOM 535 CE2 PHE A 34 77.502 28.993 10.142 1.00 0.00 C ATOM 536 CZ PHE A 34 77.081 29.949 11.046 1.00 0.00 C ATOM 0 H PHE A 34 80.990 30.464 11.354 1.00 0.00 H new ATOM 0 HA PHE A 34 82.713 30.711 8.955 1.00 0.00 H new ATOM 0 HB2 PHE A 34 80.380 31.427 7.963 1.00 0.00 H new ATOM 0 HB3 PHE A 34 80.800 29.731 8.099 1.00 0.00 H new ATOM 0 HD1 PHE A 34 79.473 32.264 10.529 1.00 0.00 H new ATOM 0 HD2 PHE A 34 78.959 28.462 8.677 1.00 0.00 H new ATOM 0 HE1 PHE A 34 77.464 31.876 11.888 1.00 0.00 H new ATOM 0 HE2 PHE A 34 76.947 28.073 10.031 1.00 0.00 H new ATOM 0 HZ PHE A 34 76.199 29.777 11.644 1.00 0.00 H new ATOM 546 N THR A 35 82.192 33.251 8.679 1.00 0.00 N ATOM 547 CA THR A 35 82.268 34.704 8.763 1.00 0.00 C ATOM 548 C THR A 35 81.009 35.354 8.202 1.00 0.00 C ATOM 549 O THR A 35 80.342 34.792 7.333 1.00 0.00 O ATOM 550 CB THR A 35 83.494 35.247 8.004 1.00 0.00 C ATOM 551 OG1 THR A 35 84.629 34.407 8.242 1.00 0.00 O ATOM 552 CG2 THR A 35 83.811 36.671 8.436 1.00 0.00 C ATOM 0 H THR A 35 82.416 32.869 7.760 1.00 0.00 H new ATOM 0 HA THR A 35 82.363 34.955 9.819 1.00 0.00 H new ATOM 0 HB THR A 35 83.262 35.251 6.939 1.00 0.00 H new ATOM 0 HG1 THR A 35 85.404 34.758 7.755 1.00 0.00 H new ATOM 0 HG21 THR A 35 84.680 37.033 7.887 1.00 0.00 H new ATOM 0 HG22 THR A 35 82.956 37.314 8.227 1.00 0.00 H new ATOM 0 HG23 THR A 35 84.024 36.688 9.505 1.00 0.00 H new ATOM 560 N VAL A 36 80.687 36.542 8.703 1.00 0.00 N ATOM 561 CA VAL A 36 79.508 37.270 8.250 1.00 0.00 C ATOM 562 C VAL A 36 79.477 37.375 6.730 1.00 0.00 C ATOM 563 O VAL A 36 78.427 37.220 6.108 1.00 0.00 O ATOM 564 CB VAL A 36 79.457 38.687 8.853 1.00 0.00 C ATOM 565 CG1 VAL A 36 80.759 39.427 8.588 1.00 0.00 C ATOM 566 CG2 VAL A 36 78.271 39.460 8.296 1.00 0.00 C ATOM 0 H VAL A 36 81.227 37.021 9.424 1.00 0.00 H new ATOM 0 HA VAL A 36 78.639 36.707 8.590 1.00 0.00 H new ATOM 0 HB VAL A 36 79.330 38.600 9.932 1.00 0.00 H new ATOM 0 HG11 VAL A 36 80.704 40.426 9.021 1.00 0.00 H new ATOM 0 HG12 VAL A 36 81.587 38.880 9.040 1.00 0.00 H new ATOM 0 HG13 VAL A 36 80.920 39.506 7.513 1.00 0.00 H new ATOM 0 HG21 VAL A 36 78.250 40.459 8.732 1.00 0.00 H new ATOM 0 HG22 VAL A 36 78.365 39.539 7.213 1.00 0.00 H new ATOM 0 HG23 VAL A 36 77.347 38.937 8.543 1.00 0.00 H new ATOM 576 N ALA A 37 80.637 37.639 6.137 1.00 0.00 N ATOM 577 CA ALA A 37 80.744 37.762 4.688 1.00 0.00 C ATOM 578 C ALA A 37 80.547 36.412 4.007 1.00 0.00 C ATOM 579 O ALA A 37 79.777 36.294 3.055 1.00 0.00 O ATOM 580 CB ALA A 37 82.091 38.356 4.307 1.00 0.00 C ATOM 0 H ALA A 37 81.516 37.772 6.638 1.00 0.00 H new ATOM 0 HA ALA A 37 79.955 38.431 4.345 1.00 0.00 H new ATOM 0 HB1 ALA A 37 82.157 38.442 3.222 1.00 0.00 H new ATOM 0 HB2 ALA A 37 82.193 39.344 4.756 1.00 0.00 H new ATOM 0 HB3 ALA A 37 82.890 37.708 4.669 1.00 0.00 H new ATOM 586 N GLU A 38 81.249 35.397 4.501 1.00 0.00 N ATOM 587 CA GLU A 38 81.151 34.056 3.937 1.00 0.00 C ATOM 588 C GLU A 38 79.716 33.541 4.002 1.00 0.00 C ATOM 589 O GLU A 38 79.239 32.880 3.079 1.00 0.00 O ATOM 590 CB GLU A 38 82.082 33.096 4.682 1.00 0.00 C ATOM 591 CG GLU A 38 83.541 33.522 4.657 1.00 0.00 C ATOM 592 CD GLU A 38 84.415 32.662 5.550 1.00 0.00 C ATOM 593 OE1 GLU A 38 83.870 31.762 6.222 1.00 0.00 O ATOM 594 OE2 GLU A 38 85.642 32.889 5.576 1.00 0.00 O ATOM 0 H GLU A 38 81.891 35.478 5.290 1.00 0.00 H new ATOM 0 HA GLU A 38 81.454 34.107 2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 38 81.753 33.015 5.718 1.00 0.00 H new ATOM 0 HB3 GLU A 38 81.994 32.103 4.241 1.00 0.00 H new ATOM 0 HG2 GLU A 38 83.913 33.472 3.634 1.00 0.00 H new ATOM 0 HG3 GLU A 38 83.617 34.562 4.973 1.00 0.00 H new ATOM 601 N VAL A 39 79.032 33.849 5.099 1.00 0.00 N ATOM 602 CA VAL A 39 77.651 33.419 5.285 1.00 0.00 C ATOM 603 C VAL A 39 76.699 34.241 4.424 1.00 0.00 C ATOM 604 O VAL A 39 75.668 33.743 3.973 1.00 0.00 O ATOM 605 CB VAL A 39 77.222 33.535 6.760 1.00 0.00 C ATOM 606 CG1 VAL A 39 75.767 33.121 6.926 1.00 0.00 C ATOM 607 CG2 VAL A 39 78.129 32.695 7.646 1.00 0.00 C ATOM 0 H VAL A 39 79.412 34.395 5.873 1.00 0.00 H new ATOM 0 HA VAL A 39 77.601 32.374 4.980 1.00 0.00 H new ATOM 0 HB VAL A 39 77.316 34.576 7.068 1.00 0.00 H new ATOM 0 HG11 VAL A 39 75.481 33.209 7.974 1.00 0.00 H new ATOM 0 HG12 VAL A 39 75.133 33.769 6.321 1.00 0.00 H new ATOM 0 HG13 VAL A 39 75.643 32.088 6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 39 77.812 32.789 8.685 1.00 0.00 H new ATOM 0 HG22 VAL A 39 78.069 31.650 7.341 1.00 0.00 H new ATOM 0 HG23 VAL A 39 79.157 33.043 7.548 1.00 0.00 H new ATOM 617 N GLU A 40 77.053 35.503 4.198 1.00 0.00 N ATOM 618 CA GLU A 40 76.229 36.394 3.390 1.00 0.00 C ATOM 619 C GLU A 40 76.277 35.994 1.918 1.00 0.00 C ATOM 620 O GLU A 40 75.243 35.892 1.257 1.00 0.00 O ATOM 621 CB GLU A 40 76.694 37.842 3.552 1.00 0.00 C ATOM 622 CG GLU A 40 76.835 38.587 2.236 1.00 0.00 C ATOM 623 CD GLU A 40 77.004 40.082 2.426 1.00 0.00 C ATOM 624 OE1 GLU A 40 76.017 40.746 2.806 1.00 0.00 O ATOM 625 OE2 GLU A 40 78.122 40.588 2.195 1.00 0.00 O ATOM 0 H GLU A 40 77.904 35.930 4.563 1.00 0.00 H new ATOM 0 HA GLU A 40 75.199 36.310 3.738 1.00 0.00 H new ATOM 0 HB2 GLU A 40 75.985 38.374 4.186 1.00 0.00 H new ATOM 0 HB3 GLU A 40 77.653 37.851 4.069 1.00 0.00 H new ATOM 0 HG2 GLU A 40 77.694 38.195 1.691 1.00 0.00 H new ATOM 0 HG3 GLU A 40 75.955 38.400 1.621 1.00 0.00 H new ATOM 632 N LEU A 41 77.485 35.770 1.412 1.00 0.00 N ATOM 633 CA LEU A 41 77.670 35.382 0.018 1.00 0.00 C ATOM 634 C LEU A 41 77.149 33.969 -0.228 1.00 0.00 C ATOM 635 O LEU A 41 76.448 33.716 -1.209 1.00 0.00 O ATOM 636 CB LEU A 41 79.149 35.466 -0.363 1.00 0.00 C ATOM 637 CG LEU A 41 79.883 36.734 0.073 1.00 0.00 C ATOM 638 CD1 LEU A 41 81.277 36.396 0.580 1.00 0.00 C ATOM 639 CD2 LEU A 41 79.959 37.729 -1.076 1.00 0.00 C ATOM 0 H LEU A 41 78.350 35.850 1.946 1.00 0.00 H new ATOM 0 HA LEU A 41 77.101 36.073 -0.604 1.00 0.00 H new ATOM 0 HB2 LEU A 41 79.664 34.606 0.066 1.00 0.00 H new ATOM 0 HB3 LEU A 41 79.230 35.378 -1.446 1.00 0.00 H new ATOM 0 HG LEU A 41 79.323 37.193 0.888 1.00 0.00 H new ATOM 0 HD11 LEU A 41 81.785 37.311 0.886 1.00 0.00 H new ATOM 0 HD12 LEU A 41 81.200 35.721 1.432 1.00 0.00 H new ATOM 0 HD13 LEU A 41 81.846 35.914 -0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 41 80.485 38.625 -0.747 1.00 0.00 H new ATOM 0 HD22 LEU A 41 80.496 37.280 -1.912 1.00 0.00 H new ATOM 0 HD23 LEU A 41 78.951 37.996 -1.394 1.00 0.00 H new ATOM 651 N LEU A 42 77.494 33.053 0.670 1.00 0.00 N ATOM 652 CA LEU A 42 77.060 31.665 0.552 1.00 0.00 C ATOM 653 C LEU A 42 75.538 31.574 0.492 1.00 0.00 C ATOM 654 O LEU A 42 74.979 30.944 -0.406 1.00 0.00 O ATOM 655 CB LEU A 42 77.584 30.844 1.732 1.00 0.00 C ATOM 656 CG LEU A 42 77.072 29.407 1.830 1.00 0.00 C ATOM 657 CD1 LEU A 42 78.114 28.512 2.484 1.00 0.00 C ATOM 658 CD2 LEU A 42 75.763 29.359 2.604 1.00 0.00 C ATOM 0 H LEU A 42 78.073 33.246 1.488 1.00 0.00 H new ATOM 0 HA LEU A 42 77.468 31.260 -0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 42 78.672 30.818 1.676 1.00 0.00 H new ATOM 0 HB3 LEU A 42 77.325 31.364 2.654 1.00 0.00 H new ATOM 0 HG LEU A 42 76.888 29.038 0.821 1.00 0.00 H new ATOM 0 HD11 LEU A 42 77.732 27.493 2.545 1.00 0.00 H new ATOM 0 HD12 LEU A 42 79.027 28.522 1.889 1.00 0.00 H new ATOM 0 HD13 LEU A 42 78.331 28.879 3.487 1.00 0.00 H new ATOM 0 HD21 LEU A 42 75.413 28.328 2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 42 75.921 29.748 3.610 1.00 0.00 H new ATOM 0 HD23 LEU A 42 75.016 29.967 2.093 1.00 0.00 H new ATOM 670 N VAL A 43 74.874 32.209 1.452 1.00 0.00 N ATOM 671 CA VAL A 43 73.417 32.203 1.506 1.00 0.00 C ATOM 672 C VAL A 43 72.817 32.795 0.236 1.00 0.00 C ATOM 673 O VAL A 43 71.945 32.193 -0.390 1.00 0.00 O ATOM 674 CB VAL A 43 72.897 32.991 2.723 1.00 0.00 C ATOM 675 CG1 VAL A 43 71.408 33.270 2.582 1.00 0.00 C ATOM 676 CG2 VAL A 43 73.187 32.235 4.010 1.00 0.00 C ATOM 0 H VAL A 43 75.322 32.734 2.203 1.00 0.00 H new ATOM 0 HA VAL A 43 73.108 31.162 1.598 1.00 0.00 H new ATOM 0 HB VAL A 43 73.419 33.947 2.765 1.00 0.00 H new ATOM 0 HG11 VAL A 43 71.058 33.827 3.451 1.00 0.00 H new ATOM 0 HG12 VAL A 43 71.231 33.856 1.680 1.00 0.00 H new ATOM 0 HG13 VAL A 43 70.866 32.327 2.514 1.00 0.00 H new ATOM 0 HG21 VAL A 43 72.813 32.806 4.860 1.00 0.00 H new ATOM 0 HG22 VAL A 43 72.694 31.263 3.980 1.00 0.00 H new ATOM 0 HG23 VAL A 43 74.263 32.093 4.114 1.00 0.00 H new ATOM 686 N GLU A 44 73.291 33.979 -0.139 1.00 0.00 N ATOM 687 CA GLU A 44 72.801 34.654 -1.335 1.00 0.00 C ATOM 688 C GLU A 44 73.049 33.805 -2.579 1.00 0.00 C ATOM 689 O GLU A 44 72.353 33.940 -3.585 1.00 0.00 O ATOM 690 CB GLU A 44 73.476 36.018 -1.492 1.00 0.00 C ATOM 691 CG GLU A 44 73.128 36.724 -2.792 1.00 0.00 C ATOM 692 CD GLU A 44 73.903 38.013 -2.981 1.00 0.00 C ATOM 693 OE1 GLU A 44 75.112 37.939 -3.284 1.00 0.00 O ATOM 694 OE2 GLU A 44 73.301 39.096 -2.826 1.00 0.00 O ATOM 0 H GLU A 44 74.013 34.490 0.368 1.00 0.00 H new ATOM 0 HA GLU A 44 71.727 34.800 -1.224 1.00 0.00 H new ATOM 0 HB2 GLU A 44 73.189 36.654 -0.655 1.00 0.00 H new ATOM 0 HB3 GLU A 44 74.557 35.887 -1.437 1.00 0.00 H new ATOM 0 HG2 GLU A 44 73.331 36.056 -3.629 1.00 0.00 H new ATOM 0 HG3 GLU A 44 72.060 36.941 -2.809 1.00 0.00 H new ATOM 701 N ALA A 45 74.047 32.931 -2.502 1.00 0.00 N ATOM 702 CA ALA A 45 74.387 32.059 -3.620 1.00 0.00 C ATOM 703 C ALA A 45 73.371 30.932 -3.766 1.00 0.00 C ATOM 704 O ALA A 45 72.884 30.660 -4.864 1.00 0.00 O ATOM 705 CB ALA A 45 75.787 31.490 -3.438 1.00 0.00 C ATOM 0 H ALA A 45 74.634 32.808 -1.677 1.00 0.00 H new ATOM 0 HA ALA A 45 74.364 32.654 -4.533 1.00 0.00 H new ATOM 0 HB1 ALA A 45 76.028 30.841 -4.280 1.00 0.00 H new ATOM 0 HB2 ALA A 45 76.508 32.306 -3.391 1.00 0.00 H new ATOM 0 HB3 ALA A 45 75.829 30.915 -2.513 1.00 0.00 H new ATOM 711 N VAL A 46 73.054 30.279 -2.652 1.00 0.00 N ATOM 712 CA VAL A 46 72.094 29.181 -2.657 1.00 0.00 C ATOM 713 C VAL A 46 70.666 29.700 -2.781 1.00 0.00 C ATOM 714 O VAL A 46 69.809 29.049 -3.377 1.00 0.00 O ATOM 715 CB VAL A 46 72.211 28.329 -1.379 1.00 0.00 C ATOM 716 CG1 VAL A 46 72.124 29.208 -0.141 1.00 0.00 C ATOM 717 CG2 VAL A 46 71.134 27.254 -1.356 1.00 0.00 C ATOM 0 H VAL A 46 73.448 30.491 -1.735 1.00 0.00 H new ATOM 0 HA VAL A 46 72.327 28.560 -3.522 1.00 0.00 H new ATOM 0 HB VAL A 46 73.184 27.838 -1.378 1.00 0.00 H new ATOM 0 HG11 VAL A 46 72.209 28.588 0.752 1.00 0.00 H new ATOM 0 HG12 VAL A 46 72.934 29.937 -0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 46 71.167 29.729 -0.131 1.00 0.00 H new ATOM 0 HG21 VAL A 46 71.231 26.661 -0.446 1.00 0.00 H new ATOM 0 HG22 VAL A 46 70.151 27.724 -1.380 1.00 0.00 H new ATOM 0 HG23 VAL A 46 71.248 26.606 -2.225 1.00 0.00 H new ATOM 727 N GLU A 47 70.419 30.876 -2.213 1.00 0.00 N ATOM 728 CA GLU A 47 69.093 31.482 -2.260 1.00 0.00 C ATOM 729 C GLU A 47 68.770 31.975 -3.668 1.00 0.00 C ATOM 730 O GLU A 47 67.610 31.990 -4.081 1.00 0.00 O ATOM 731 CB GLU A 47 69.004 32.644 -1.269 1.00 0.00 C ATOM 732 CG GLU A 47 69.341 33.993 -1.880 1.00 0.00 C ATOM 733 CD GLU A 47 69.321 35.117 -0.861 1.00 0.00 C ATOM 734 OE1 GLU A 47 69.284 34.819 0.351 1.00 0.00 O ATOM 735 OE2 GLU A 47 69.344 36.294 -1.277 1.00 0.00 O ATOM 0 H GLU A 47 71.118 31.428 -1.716 1.00 0.00 H new ATOM 0 HA GLU A 47 68.364 30.721 -1.983 1.00 0.00 H new ATOM 0 HB2 GLU A 47 67.995 32.683 -0.858 1.00 0.00 H new ATOM 0 HB3 GLU A 47 69.681 32.453 -0.436 1.00 0.00 H new ATOM 0 HG2 GLU A 47 70.328 33.943 -2.341 1.00 0.00 H new ATOM 0 HG3 GLU A 47 68.629 34.216 -2.675 1.00 0.00 H new ATOM 742 N HIS A 48 69.804 32.378 -4.400 1.00 0.00 N ATOM 743 CA HIS A 48 69.631 32.871 -5.761 1.00 0.00 C ATOM 744 C HIS A 48 69.257 31.734 -6.708 1.00 0.00 C ATOM 745 O HIS A 48 68.447 31.912 -7.619 1.00 0.00 O ATOM 746 CB HIS A 48 70.910 33.554 -6.245 1.00 0.00 C ATOM 747 CG HIS A 48 70.776 34.191 -7.594 1.00 0.00 C ATOM 748 ND1 HIS A 48 71.168 33.571 -8.762 1.00 0.00 N ATOM 749 CD2 HIS A 48 70.288 35.400 -7.957 1.00 0.00 C ATOM 750 CE1 HIS A 48 70.928 34.372 -9.785 1.00 0.00 C ATOM 751 NE2 HIS A 48 70.394 35.489 -9.323 1.00 0.00 N ATOM 0 H HIS A 48 70.770 32.373 -4.073 1.00 0.00 H new ATOM 0 HA HIS A 48 68.819 33.598 -5.757 1.00 0.00 H new ATOM 0 HB2 HIS A 48 71.202 34.314 -5.521 1.00 0.00 H new ATOM 0 HB3 HIS A 48 71.714 32.819 -6.278 1.00 0.00 H new ATOM 0 HD2 HIS A 48 69.889 36.155 -7.295 1.00 0.00 H new ATOM 0 HE1 HIS A 48 71.133 34.151 -10.822 1.00 0.00 H new ATOM 0 HE2 HIS A 48 70.107 36.287 -9.889 1.00 0.00 H new ATOM 759 N LEU A 49 69.853 30.568 -6.488 1.00 0.00 N ATOM 760 CA LEU A 49 69.584 29.402 -7.322 1.00 0.00 C ATOM 761 C LEU A 49 68.603 28.456 -6.636 1.00 0.00 C ATOM 762 O LEU A 49 68.321 27.368 -7.135 1.00 0.00 O ATOM 763 CB LEU A 49 70.887 28.663 -7.636 1.00 0.00 C ATOM 764 CG LEU A 49 72.041 29.526 -8.146 1.00 0.00 C ATOM 765 CD1 LEU A 49 73.371 28.995 -7.634 1.00 0.00 C ATOM 766 CD2 LEU A 49 72.036 29.579 -9.667 1.00 0.00 C ATOM 0 H LEU A 49 70.526 30.404 -5.739 1.00 0.00 H new ATOM 0 HA LEU A 49 69.136 29.748 -8.253 1.00 0.00 H new ATOM 0 HB2 LEU A 49 71.216 28.148 -6.733 1.00 0.00 H new ATOM 0 HB3 LEU A 49 70.676 27.896 -8.381 1.00 0.00 H new ATOM 0 HG LEU A 49 71.907 30.539 -7.767 1.00 0.00 H new ATOM 0 HD11 LEU A 49 74.181 29.622 -8.007 1.00 0.00 H new ATOM 0 HD12 LEU A 49 73.373 29.010 -6.544 1.00 0.00 H new ATOM 0 HD13 LEU A 49 73.513 27.972 -7.983 1.00 0.00 H new ATOM 0 HD21 LEU A 49 72.864 30.198 -10.012 1.00 0.00 H new ATOM 0 HD22 LEU A 49 72.145 28.571 -10.067 1.00 0.00 H new ATOM 0 HD23 LEU A 49 71.095 30.007 -10.013 1.00 0.00 H new ATOM 778 N GLY A 50 68.083 28.881 -5.488 1.00 0.00 N ATOM 779 CA GLY A 50 67.138 28.062 -4.753 1.00 0.00 C ATOM 780 C GLY A 50 67.654 26.658 -4.509 1.00 0.00 C ATOM 781 O GLY A 50 68.860 26.445 -4.378 1.00 0.00 O ATOM 0 H GLY A 50 68.300 29.778 -5.054 1.00 0.00 H new ATOM 0 HA2 GLY A 50 66.918 28.536 -3.796 1.00 0.00 H new ATOM 0 HA3 GLY A 50 66.200 28.010 -5.306 1.00 0.00 H new ATOM 785 N THR A 51 66.739 25.695 -4.447 1.00 0.00 N ATOM 786 CA THR A 51 67.108 24.304 -4.214 1.00 0.00 C ATOM 787 C THR A 51 67.350 23.572 -5.529 1.00 0.00 C ATOM 788 O THR A 51 66.552 22.730 -5.938 1.00 0.00 O ATOM 789 CB THR A 51 66.019 23.560 -3.418 1.00 0.00 C ATOM 790 OG1 THR A 51 64.754 23.694 -4.076 1.00 0.00 O ATOM 791 CG2 THR A 51 65.919 24.102 -2.001 1.00 0.00 C ATOM 0 H THR A 51 65.737 25.853 -4.555 1.00 0.00 H new ATOM 0 HA THR A 51 68.030 24.314 -3.632 1.00 0.00 H new ATOM 0 HB THR A 51 66.292 22.506 -3.368 1.00 0.00 H new ATOM 0 HG1 THR A 51 64.837 23.400 -5.007 1.00 0.00 H new ATOM 0 HG21 THR A 51 65.144 23.561 -1.458 1.00 0.00 H new ATOM 0 HG22 THR A 51 66.875 23.972 -1.493 1.00 0.00 H new ATOM 0 HG23 THR A 51 65.667 25.162 -2.034 1.00 0.00 H new ATOM 799 N GLY A 52 68.458 23.899 -6.188 1.00 0.00 N ATOM 800 CA GLY A 52 68.786 23.262 -7.450 1.00 0.00 C ATOM 801 C GLY A 52 70.191 22.694 -7.465 1.00 0.00 C ATOM 802 O GLY A 52 70.491 21.745 -6.741 1.00 0.00 O ATOM 0 H GLY A 52 69.134 24.594 -5.870 1.00 0.00 H new ATOM 0 HA2 GLY A 52 68.072 22.462 -7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 52 68.682 23.987 -8.257 1.00 0.00 H new ATOM 806 N ARG A 53 71.053 23.274 -8.293 1.00 0.00 N ATOM 807 CA ARG A 53 72.433 22.818 -8.402 1.00 0.00 C ATOM 808 C ARG A 53 73.293 23.417 -7.293 1.00 0.00 C ATOM 809 O ARG A 53 73.326 24.634 -7.109 1.00 0.00 O ATOM 810 CB ARG A 53 73.011 23.192 -9.768 1.00 0.00 C ATOM 811 CG ARG A 53 72.703 22.177 -10.858 1.00 0.00 C ATOM 812 CD ARG A 53 73.461 20.877 -10.638 1.00 0.00 C ATOM 813 NE ARG A 53 73.233 19.922 -11.719 1.00 0.00 N ATOM 814 CZ ARG A 53 73.917 18.792 -11.857 1.00 0.00 C ATOM 815 NH1 ARG A 53 74.866 18.476 -10.987 1.00 0.00 N ATOM 816 NH2 ARG A 53 73.652 17.973 -12.867 1.00 0.00 N ATOM 0 H ARG A 53 70.820 24.061 -8.898 1.00 0.00 H new ATOM 0 HA ARG A 53 72.439 21.733 -8.298 1.00 0.00 H new ATOM 0 HB2 ARG A 53 72.617 24.164 -10.066 1.00 0.00 H new ATOM 0 HB3 ARG A 53 74.092 23.300 -9.679 1.00 0.00 H new ATOM 0 HG2 ARG A 53 71.632 21.976 -10.878 1.00 0.00 H new ATOM 0 HG3 ARG A 53 72.967 22.594 -11.830 1.00 0.00 H new ATOM 0 HD2 ARG A 53 74.528 21.088 -10.559 1.00 0.00 H new ATOM 0 HD3 ARG A 53 73.153 20.433 -9.691 1.00 0.00 H new ATOM 0 HE ARG A 53 72.509 20.134 -12.405 1.00 0.00 H new ATOM 0 HH11 ARG A 53 75.073 19.102 -10.208 1.00 0.00 H new ATOM 0 HH12 ARG A 53 75.389 17.607 -11.096 1.00 0.00 H new ATOM 0 HH21 ARG A 53 72.922 18.211 -13.539 1.00 0.00 H new ATOM 0 HH22 ARG A 53 74.178 17.105 -12.972 1.00 0.00 H new ATOM 830 N TRP A 54 73.986 22.555 -6.558 1.00 0.00 N ATOM 831 CA TRP A 54 74.845 23.000 -5.466 1.00 0.00 C ATOM 832 C TRP A 54 76.087 23.704 -6.003 1.00 0.00 C ATOM 833 O TRP A 54 76.466 24.770 -5.517 1.00 0.00 O ATOM 834 CB TRP A 54 75.255 21.811 -4.595 1.00 0.00 C ATOM 835 CG TRP A 54 74.100 20.944 -4.194 1.00 0.00 C ATOM 836 CD1 TRP A 54 72.959 21.341 -3.558 1.00 0.00 C ATOM 837 CD2 TRP A 54 73.977 19.532 -4.399 1.00 0.00 C ATOM 838 NE1 TRP A 54 72.133 20.261 -3.356 1.00 0.00 N ATOM 839 CE2 TRP A 54 72.735 19.140 -3.863 1.00 0.00 C ATOM 840 CE3 TRP A 54 74.794 18.561 -4.984 1.00 0.00 C ATOM 841 CZ2 TRP A 54 72.293 17.820 -3.896 1.00 0.00 C ATOM 842 CZ3 TRP A 54 74.355 17.252 -5.015 1.00 0.00 C ATOM 843 CH2 TRP A 54 73.114 16.890 -4.475 1.00 0.00 C ATOM 0 H TRP A 54 73.970 21.545 -6.698 1.00 0.00 H new ATOM 0 HA TRP A 54 74.281 23.709 -4.859 1.00 0.00 H new ATOM 0 HB2 TRP A 54 75.983 21.207 -5.136 1.00 0.00 H new ATOM 0 HB3 TRP A 54 75.752 22.181 -3.698 1.00 0.00 H new ATOM 0 HD1 TRP A 54 72.738 22.355 -3.258 1.00 0.00 H new ATOM 0 HE1 TRP A 54 71.220 20.290 -2.902 1.00 0.00 H new ATOM 0 HE3 TRP A 54 75.752 18.829 -5.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 71.337 17.540 -3.480 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 74.980 16.494 -5.464 1.00 0.00 H new ATOM 0 HH2 TRP A 54 72.799 15.858 -4.516 1.00 0.00 H new ATOM 854 N ARG A 55 76.715 23.102 -7.007 1.00 0.00 N ATOM 855 CA ARG A 55 77.915 23.672 -7.609 1.00 0.00 C ATOM 856 C ARG A 55 77.659 25.098 -8.086 1.00 0.00 C ATOM 857 O ARG A 55 78.574 25.921 -8.136 1.00 0.00 O ATOM 858 CB ARG A 55 78.384 22.807 -8.781 1.00 0.00 C ATOM 859 CG ARG A 55 77.345 22.656 -9.880 1.00 0.00 C ATOM 860 CD ARG A 55 77.490 21.327 -10.605 1.00 0.00 C ATOM 861 NE ARG A 55 78.785 21.205 -11.269 1.00 0.00 N ATOM 862 CZ ARG A 55 79.255 20.063 -11.757 1.00 0.00 C ATOM 863 NH1 ARG A 55 78.540 18.951 -11.657 1.00 0.00 N ATOM 864 NH2 ARG A 55 80.443 20.031 -12.348 1.00 0.00 N ATOM 0 H ARG A 55 76.413 22.220 -7.421 1.00 0.00 H new ATOM 0 HA ARG A 55 78.696 23.696 -6.849 1.00 0.00 H new ATOM 0 HB2 ARG A 55 79.288 23.244 -9.205 1.00 0.00 H new ATOM 0 HB3 ARG A 55 78.652 21.819 -8.408 1.00 0.00 H new ATOM 0 HG2 ARG A 55 76.346 22.730 -9.450 1.00 0.00 H new ATOM 0 HG3 ARG A 55 77.447 23.474 -10.593 1.00 0.00 H new ATOM 0 HD2 ARG A 55 77.369 20.510 -9.893 1.00 0.00 H new ATOM 0 HD3 ARG A 55 76.694 21.227 -11.342 1.00 0.00 H new ATOM 0 HE ARG A 55 79.360 22.042 -11.363 1.00 0.00 H new ATOM 0 HH11 ARG A 55 77.626 18.971 -11.204 1.00 0.00 H new ATOM 0 HH12 ARG A 55 78.904 18.075 -12.033 1.00 0.00 H new ATOM 0 HH21 ARG A 55 80.996 20.884 -12.428 1.00 0.00 H new ATOM 0 HH22 ARG A 55 80.803 19.153 -12.722 1.00 0.00 H new ATOM 878 N ASP A 56 76.409 25.384 -8.436 1.00 0.00 N ATOM 879 CA ASP A 56 76.032 26.711 -8.908 1.00 0.00 C ATOM 880 C ASP A 56 76.161 27.743 -7.792 1.00 0.00 C ATOM 881 O ASP A 56 76.614 28.865 -8.018 1.00 0.00 O ATOM 882 CB ASP A 56 74.599 26.697 -9.443 1.00 0.00 C ATOM 883 CG ASP A 56 74.453 25.838 -10.684 1.00 0.00 C ATOM 884 OD1 ASP A 56 75.382 25.057 -10.978 1.00 0.00 O ATOM 885 OD2 ASP A 56 73.409 25.947 -11.361 1.00 0.00 O ATOM 0 H ASP A 56 75.640 24.714 -8.402 1.00 0.00 H new ATOM 0 HA ASP A 56 76.711 26.989 -9.715 1.00 0.00 H new ATOM 0 HB2 ASP A 56 73.928 26.327 -8.668 1.00 0.00 H new ATOM 0 HB3 ASP A 56 74.290 27.717 -9.672 1.00 0.00 H new ATOM 890 N VAL A 57 75.759 27.355 -6.586 1.00 0.00 N ATOM 891 CA VAL A 57 75.829 28.246 -5.433 1.00 0.00 C ATOM 892 C VAL A 57 77.269 28.429 -4.967 1.00 0.00 C ATOM 893 O VAL A 57 77.621 29.457 -4.388 1.00 0.00 O ATOM 894 CB VAL A 57 74.985 27.714 -4.260 1.00 0.00 C ATOM 895 CG1 VAL A 57 73.810 26.898 -4.775 1.00 0.00 C ATOM 896 CG2 VAL A 57 75.846 26.889 -3.316 1.00 0.00 C ATOM 0 H VAL A 57 75.381 26.430 -6.382 1.00 0.00 H new ATOM 0 HA VAL A 57 75.428 29.208 -5.752 1.00 0.00 H new ATOM 0 HB VAL A 57 74.589 28.564 -3.704 1.00 0.00 H new ATOM 0 HG11 VAL A 57 73.225 26.530 -3.932 1.00 0.00 H new ATOM 0 HG12 VAL A 57 73.181 27.525 -5.407 1.00 0.00 H new ATOM 0 HG13 VAL A 57 74.180 26.053 -5.356 1.00 0.00 H new ATOM 0 HG21 VAL A 57 75.234 26.521 -2.493 1.00 0.00 H new ATOM 0 HG22 VAL A 57 76.272 26.044 -3.857 1.00 0.00 H new ATOM 0 HG23 VAL A 57 76.650 27.510 -2.921 1.00 0.00 H new ATOM 906 N LYS A 58 78.100 27.424 -5.223 1.00 0.00 N ATOM 907 CA LYS A 58 79.504 27.472 -4.832 1.00 0.00 C ATOM 908 C LYS A 58 80.277 28.461 -5.699 1.00 0.00 C ATOM 909 O LYS A 58 81.083 29.245 -5.197 1.00 0.00 O ATOM 910 CB LYS A 58 80.133 26.082 -4.941 1.00 0.00 C ATOM 911 CG LYS A 58 81.614 26.056 -4.605 1.00 0.00 C ATOM 912 CD LYS A 58 82.418 25.340 -5.678 1.00 0.00 C ATOM 913 CE LYS A 58 82.609 23.869 -5.342 1.00 0.00 C ATOM 914 NZ LYS A 58 83.825 23.305 -5.990 1.00 0.00 N ATOM 0 H LYS A 58 77.825 26.565 -5.700 1.00 0.00 H new ATOM 0 HA LYS A 58 79.555 27.807 -3.796 1.00 0.00 H new ATOM 0 HB2 LYS A 58 79.606 25.401 -4.273 1.00 0.00 H new ATOM 0 HB3 LYS A 58 79.992 25.707 -5.955 1.00 0.00 H new ATOM 0 HG2 LYS A 58 81.981 27.077 -4.495 1.00 0.00 H new ATOM 0 HG3 LYS A 58 81.762 25.559 -3.646 1.00 0.00 H new ATOM 0 HD2 LYS A 58 81.909 25.432 -6.638 1.00 0.00 H new ATOM 0 HD3 LYS A 58 83.391 25.819 -5.786 1.00 0.00 H new ATOM 0 HE2 LYS A 58 82.685 23.750 -4.261 1.00 0.00 H new ATOM 0 HE3 LYS A 58 81.732 23.306 -5.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 83.598 22.381 -6.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 84.153 23.952 -6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 84.575 23.187 -5.279 1.00 0.00 H new ATOM 928 N PHE A 59 80.024 28.421 -7.003 1.00 0.00 N ATOM 929 CA PHE A 59 80.696 29.314 -7.940 1.00 0.00 C ATOM 930 C PHE A 59 80.061 30.702 -7.918 1.00 0.00 C ATOM 931 O PHE A 59 80.760 31.715 -7.878 1.00 0.00 O ATOM 932 CB PHE A 59 80.641 28.738 -9.356 1.00 0.00 C ATOM 933 CG PHE A 59 81.905 28.041 -9.769 1.00 0.00 C ATOM 934 CD1 PHE A 59 82.339 26.908 -9.099 1.00 0.00 C ATOM 935 CD2 PHE A 59 82.660 28.518 -10.829 1.00 0.00 C ATOM 936 CE1 PHE A 59 83.502 26.266 -9.477 1.00 0.00 C ATOM 937 CE2 PHE A 59 83.825 27.879 -11.211 1.00 0.00 C ATOM 938 CZ PHE A 59 84.246 26.751 -10.535 1.00 0.00 C ATOM 0 H PHE A 59 79.359 27.780 -7.435 1.00 0.00 H new ATOM 0 HA PHE A 59 81.738 29.405 -7.633 1.00 0.00 H new ATOM 0 HB2 PHE A 59 79.810 28.036 -9.422 1.00 0.00 H new ATOM 0 HB3 PHE A 59 80.433 29.544 -10.060 1.00 0.00 H new ATOM 0 HD1 PHE A 59 81.761 26.523 -8.272 1.00 0.00 H new ATOM 0 HD2 PHE A 59 82.335 29.399 -11.363 1.00 0.00 H new ATOM 0 HE1 PHE A 59 83.830 25.385 -8.945 1.00 0.00 H new ATOM 0 HE2 PHE A 59 84.405 28.262 -12.037 1.00 0.00 H new ATOM 0 HZ PHE A 59 85.155 26.249 -10.833 1.00 0.00 H new ATOM 948 N ARG A 60 78.733 30.739 -7.946 1.00 0.00 N ATOM 949 CA ARG A 60 78.004 32.001 -7.931 1.00 0.00 C ATOM 950 C ARG A 60 78.456 32.878 -6.767 1.00 0.00 C ATOM 951 O ARG A 60 78.381 34.104 -6.834 1.00 0.00 O ATOM 952 CB ARG A 60 76.499 31.744 -7.835 1.00 0.00 C ATOM 953 CG ARG A 60 75.664 33.014 -7.814 1.00 0.00 C ATOM 954 CD ARG A 60 75.583 33.651 -9.193 1.00 0.00 C ATOM 955 NE ARG A 60 76.718 34.531 -9.457 1.00 0.00 N ATOM 956 CZ ARG A 60 76.990 35.039 -10.654 1.00 0.00 C ATOM 957 NH1 ARG A 60 76.213 34.757 -11.690 1.00 0.00 N ATOM 958 NH2 ARG A 60 78.042 35.832 -10.815 1.00 0.00 N ATOM 0 H ARG A 60 78.140 29.910 -7.979 1.00 0.00 H new ATOM 0 HA ARG A 60 78.218 32.525 -8.862 1.00 0.00 H new ATOM 0 HB2 ARG A 60 76.189 31.130 -8.680 1.00 0.00 H new ATOM 0 HB3 ARG A 60 76.294 31.170 -6.932 1.00 0.00 H new ATOM 0 HG2 ARG A 60 74.659 32.784 -7.459 1.00 0.00 H new ATOM 0 HG3 ARG A 60 76.097 33.724 -7.109 1.00 0.00 H new ATOM 0 HD2 ARG A 60 75.546 32.869 -9.952 1.00 0.00 H new ATOM 0 HD3 ARG A 60 74.657 34.219 -9.276 1.00 0.00 H new ATOM 0 HE ARG A 60 77.335 34.768 -8.680 1.00 0.00 H new ATOM 0 HH11 ARG A 60 75.403 34.148 -11.570 1.00 0.00 H new ATOM 0 HH12 ARG A 60 76.425 35.149 -12.608 1.00 0.00 H new ATOM 0 HH21 ARG A 60 78.642 36.051 -10.020 1.00 0.00 H new ATOM 0 HH22 ARG A 60 78.251 36.222 -11.734 1.00 0.00 H new ATOM 972 N ALA A 61 78.926 32.239 -5.700 1.00 0.00 N ATOM 973 CA ALA A 61 79.392 32.960 -4.522 1.00 0.00 C ATOM 974 C ALA A 61 80.909 33.116 -4.539 1.00 0.00 C ATOM 975 O ALA A 61 81.428 34.193 -4.834 1.00 0.00 O ATOM 976 CB ALA A 61 78.947 32.244 -3.255 1.00 0.00 C ATOM 0 H ALA A 61 78.994 31.224 -5.628 1.00 0.00 H new ATOM 0 HA ALA A 61 78.950 33.956 -4.537 1.00 0.00 H new ATOM 0 HB1 ALA A 61 79.302 32.793 -2.383 1.00 0.00 H new ATOM 0 HB2 ALA A 61 77.859 32.189 -3.231 1.00 0.00 H new ATOM 0 HB3 ALA A 61 79.361 31.236 -3.242 1.00 0.00 H new ATOM 982 N PHE A 62 81.614 32.036 -4.219 1.00 0.00 N ATOM 983 CA PHE A 62 83.072 32.054 -4.195 1.00 0.00 C ATOM 984 C PHE A 62 83.634 30.637 -4.256 1.00 0.00 C ATOM 985 O PHE A 62 83.603 29.904 -3.269 1.00 0.00 O ATOM 986 CB PHE A 62 83.574 32.761 -2.934 1.00 0.00 C ATOM 987 CG PHE A 62 83.886 34.215 -3.146 1.00 0.00 C ATOM 988 CD1 PHE A 62 84.912 34.601 -3.993 1.00 0.00 C ATOM 989 CD2 PHE A 62 83.152 35.196 -2.498 1.00 0.00 C ATOM 990 CE1 PHE A 62 85.202 35.938 -4.189 1.00 0.00 C ATOM 991 CE2 PHE A 62 83.437 36.535 -2.690 1.00 0.00 C ATOM 992 CZ PHE A 62 84.463 36.906 -3.538 1.00 0.00 C ATOM 0 H PHE A 62 81.199 31.137 -3.973 1.00 0.00 H new ATOM 0 HA PHE A 62 83.419 32.601 -5.072 1.00 0.00 H new ATOM 0 HB2 PHE A 62 82.821 32.670 -2.152 1.00 0.00 H new ATOM 0 HB3 PHE A 62 84.470 32.254 -2.575 1.00 0.00 H new ATOM 0 HD1 PHE A 62 85.492 33.848 -4.506 1.00 0.00 H new ATOM 0 HD2 PHE A 62 82.348 34.911 -1.835 1.00 0.00 H new ATOM 0 HE1 PHE A 62 86.006 36.225 -4.851 1.00 0.00 H new ATOM 0 HE2 PHE A 62 82.859 37.290 -2.178 1.00 0.00 H new ATOM 0 HZ PHE A 62 84.687 37.951 -3.691 1.00 0.00 H new ATOM 1002 N GLU A 63 84.148 30.260 -5.423 1.00 0.00 N ATOM 1003 CA GLU A 63 84.716 28.931 -5.613 1.00 0.00 C ATOM 1004 C GLU A 63 86.142 28.867 -5.074 1.00 0.00 C ATOM 1005 O GLU A 63 86.798 27.828 -5.145 1.00 0.00 O ATOM 1006 CB GLU A 63 84.702 28.553 -7.096 1.00 0.00 C ATOM 1007 CG GLU A 63 85.432 29.547 -7.984 1.00 0.00 C ATOM 1008 CD GLU A 63 86.063 28.892 -9.197 1.00 0.00 C ATOM 1009 OE1 GLU A 63 86.552 27.750 -9.067 1.00 0.00 O ATOM 1010 OE2 GLU A 63 86.067 29.520 -10.276 1.00 0.00 O ATOM 0 H GLU A 63 84.182 30.856 -6.250 1.00 0.00 H new ATOM 0 HA GLU A 63 84.104 28.220 -5.059 1.00 0.00 H new ATOM 0 HB2 GLU A 63 85.156 27.569 -7.216 1.00 0.00 H new ATOM 0 HB3 GLU A 63 83.668 28.470 -7.431 1.00 0.00 H new ATOM 0 HG2 GLU A 63 84.733 30.316 -8.313 1.00 0.00 H new ATOM 0 HG3 GLU A 63 86.206 30.048 -7.402 1.00 0.00 H new ATOM 1017 N ASN A 64 86.616 29.985 -4.535 1.00 0.00 N ATOM 1018 CA ASN A 64 87.965 30.057 -3.984 1.00 0.00 C ATOM 1019 C ASN A 64 87.925 30.224 -2.468 1.00 0.00 C ATOM 1020 O ASN A 64 88.732 30.955 -1.892 1.00 0.00 O ATOM 1021 CB ASN A 64 88.735 31.218 -4.617 1.00 0.00 C ATOM 1022 CG ASN A 64 90.235 30.997 -4.596 1.00 0.00 C ATOM 1023 OD1 ASN A 64 90.716 29.905 -4.898 1.00 0.00 O ATOM 1024 ND2 ASN A 64 90.981 32.035 -4.237 1.00 0.00 N ATOM 0 H ASN A 64 86.086 30.854 -4.468 1.00 0.00 H new ATOM 0 HA ASN A 64 88.476 29.122 -4.215 1.00 0.00 H new ATOM 0 HB2 ASN A 64 88.405 31.351 -5.647 1.00 0.00 H new ATOM 0 HB3 ASN A 64 88.499 32.140 -4.085 1.00 0.00 H new ATOM 0 HD21 ASN A 64 91.997 31.946 -4.203 1.00 0.00 H new ATOM 0 HD22 ASN A 64 90.539 32.922 -3.995 1.00 0.00 H new ATOM 1031 N VAL A 65 86.982 29.542 -1.828 1.00 0.00 N ATOM 1032 CA VAL A 65 86.837 29.612 -0.378 1.00 0.00 C ATOM 1033 C VAL A 65 87.514 28.426 0.300 1.00 0.00 C ATOM 1034 O VAL A 65 88.123 27.584 -0.361 1.00 0.00 O ATOM 1035 CB VAL A 65 85.355 29.650 0.037 1.00 0.00 C ATOM 1036 CG1 VAL A 65 84.726 30.980 -0.350 1.00 0.00 C ATOM 1037 CG2 VAL A 65 84.596 28.490 -0.590 1.00 0.00 C ATOM 0 H VAL A 65 86.306 28.934 -2.290 1.00 0.00 H new ATOM 0 HA VAL A 65 87.320 30.535 -0.056 1.00 0.00 H new ATOM 0 HB VAL A 65 85.297 29.549 1.121 1.00 0.00 H new ATOM 0 HG11 VAL A 65 83.678 30.988 -0.049 1.00 0.00 H new ATOM 0 HG12 VAL A 65 85.254 31.792 0.151 1.00 0.00 H new ATOM 0 HG13 VAL A 65 84.794 31.114 -1.430 1.00 0.00 H new ATOM 0 HG21 VAL A 65 83.550 28.533 -0.286 1.00 0.00 H new ATOM 0 HG22 VAL A 65 84.661 28.557 -1.676 1.00 0.00 H new ATOM 0 HG23 VAL A 65 85.032 27.548 -0.258 1.00 0.00 H new ATOM 1047 N HIS A 66 87.402 28.365 1.623 1.00 0.00 N ATOM 1048 CA HIS A 66 88.002 27.281 2.392 1.00 0.00 C ATOM 1049 C HIS A 66 87.474 25.927 1.924 1.00 0.00 C ATOM 1050 O HIS A 66 88.158 25.198 1.206 1.00 0.00 O ATOM 1051 CB HIS A 66 87.716 27.465 3.882 1.00 0.00 C ATOM 1052 CG HIS A 66 88.574 28.507 4.532 1.00 0.00 C ATOM 1053 ND1 HIS A 66 88.900 28.484 5.872 1.00 0.00 N ATOM 1054 CD2 HIS A 66 89.175 29.605 4.018 1.00 0.00 C ATOM 1055 CE1 HIS A 66 89.664 29.525 6.154 1.00 0.00 C ATOM 1056 NE2 HIS A 66 89.846 30.221 5.046 1.00 0.00 N ATOM 0 H HIS A 66 86.901 29.054 2.185 1.00 0.00 H new ATOM 0 HA HIS A 66 89.080 27.307 2.231 1.00 0.00 H new ATOM 0 HB2 HIS A 66 86.668 27.736 4.012 1.00 0.00 H new ATOM 0 HB3 HIS A 66 87.865 26.513 4.392 1.00 0.00 H new ATOM 0 HD2 HIS A 66 89.135 29.935 2.991 1.00 0.00 H new ATOM 0 HE1 HIS A 66 90.070 29.766 7.125 1.00 0.00 H new ATOM 0 HE2 HIS A 66 90.395 31.077 4.967 1.00 0.00 H new ATOM 1064 N HIS A 67 86.255 25.598 2.338 1.00 0.00 N ATOM 1065 CA HIS A 67 85.636 24.332 1.961 1.00 0.00 C ATOM 1066 C HIS A 67 85.499 24.224 0.446 1.00 0.00 C ATOM 1067 O HIS A 67 85.711 23.157 -0.132 1.00 0.00 O ATOM 1068 CB HIS A 67 84.263 24.195 2.620 1.00 0.00 C ATOM 1069 CG HIS A 67 84.314 24.195 4.117 1.00 0.00 C ATOM 1070 ND1 HIS A 67 84.483 25.341 4.865 1.00 0.00 N ATOM 1071 CD2 HIS A 67 84.216 23.179 5.006 1.00 0.00 C ATOM 1072 CE1 HIS A 67 84.489 25.030 6.149 1.00 0.00 C ATOM 1073 NE2 HIS A 67 84.328 23.724 6.261 1.00 0.00 N ATOM 0 H HIS A 67 85.676 26.190 2.934 1.00 0.00 H new ATOM 0 HA HIS A 67 86.280 23.524 2.308 1.00 0.00 H new ATOM 0 HB2 HIS A 67 83.626 25.014 2.286 1.00 0.00 H new ATOM 0 HB3 HIS A 67 83.797 23.270 2.281 1.00 0.00 H new ATOM 0 HD1 HIS A 67 84.587 26.282 4.486 1.00 0.00 H new ATOM 0 HD2 HIS A 67 84.076 22.134 4.772 1.00 0.00 H new ATOM 0 HE1 HIS A 67 84.606 25.725 6.967 1.00 0.00 H new ATOM 1081 N ARG A 68 85.142 25.334 -0.192 1.00 0.00 N ATOM 1082 CA ARG A 68 84.975 25.363 -1.640 1.00 0.00 C ATOM 1083 C ARG A 68 84.306 24.084 -2.136 1.00 0.00 C ATOM 1084 O ARG A 68 84.696 23.522 -3.160 1.00 0.00 O ATOM 1085 CB ARG A 68 86.330 25.541 -2.328 1.00 0.00 C ATOM 1086 CG ARG A 68 87.291 24.389 -2.089 1.00 0.00 C ATOM 1087 CD ARG A 68 88.419 24.383 -3.108 1.00 0.00 C ATOM 1088 NE ARG A 68 89.522 23.516 -2.701 1.00 0.00 N ATOM 1089 CZ ARG A 68 90.702 23.494 -3.309 1.00 0.00 C ATOM 1090 NH1 ARG A 68 90.933 24.286 -4.346 1.00 0.00 N ATOM 1091 NH2 ARG A 68 91.656 22.677 -2.879 1.00 0.00 N ATOM 0 H ARG A 68 84.963 26.225 0.271 1.00 0.00 H new ATOM 0 HA ARG A 68 84.334 26.209 -1.889 1.00 0.00 H new ATOM 0 HB2 ARG A 68 86.171 25.654 -3.400 1.00 0.00 H new ATOM 0 HB3 ARG A 68 86.789 26.465 -1.975 1.00 0.00 H new ATOM 0 HG2 ARG A 68 87.707 24.464 -1.084 1.00 0.00 H new ATOM 0 HG3 ARG A 68 86.749 23.445 -2.140 1.00 0.00 H new ATOM 0 HD2 ARG A 68 88.034 24.051 -4.072 1.00 0.00 H new ATOM 0 HD3 ARG A 68 88.789 25.399 -3.245 1.00 0.00 H new ATOM 0 HE ARG A 68 89.378 22.893 -1.906 1.00 0.00 H new ATOM 0 HH11 ARG A 68 90.203 24.915 -4.680 1.00 0.00 H new ATOM 0 HH12 ARG A 68 91.841 24.266 -4.811 1.00 0.00 H new ATOM 0 HH21 ARG A 68 91.483 22.066 -2.081 1.00 0.00 H new ATOM 0 HH22 ARG A 68 92.562 22.661 -3.347 1.00 0.00 H new ATOM 1105 N THR A 69 83.296 23.628 -1.402 1.00 0.00 N ATOM 1106 CA THR A 69 82.573 22.415 -1.765 1.00 0.00 C ATOM 1107 C THR A 69 81.091 22.701 -1.977 1.00 0.00 C ATOM 1108 O THR A 69 80.417 23.225 -1.090 1.00 0.00 O ATOM 1109 CB THR A 69 82.725 21.326 -0.686 1.00 0.00 C ATOM 1110 OG1 THR A 69 83.367 21.871 0.472 1.00 0.00 O ATOM 1111 CG2 THR A 69 83.533 20.150 -1.214 1.00 0.00 C ATOM 0 H THR A 69 82.960 24.081 -0.552 1.00 0.00 H new ATOM 0 HA THR A 69 83.008 22.055 -2.698 1.00 0.00 H new ATOM 0 HB THR A 69 81.730 20.971 -0.416 1.00 0.00 H new ATOM 0 HG1 THR A 69 84.262 22.190 0.230 1.00 0.00 H new ATOM 0 HG21 THR A 69 83.627 19.394 -0.435 1.00 0.00 H new ATOM 0 HG22 THR A 69 83.027 19.719 -2.078 1.00 0.00 H new ATOM 0 HG23 THR A 69 84.525 20.493 -1.508 1.00 0.00 H new ATOM 1119 N TYR A 70 80.589 22.353 -3.157 1.00 0.00 N ATOM 1120 CA TYR A 70 79.186 22.574 -3.485 1.00 0.00 C ATOM 1121 C TYR A 70 78.279 22.076 -2.365 1.00 0.00 C ATOM 1122 O TYR A 70 77.341 22.761 -1.957 1.00 0.00 O ATOM 1123 CB TYR A 70 78.831 21.870 -4.796 1.00 0.00 C ATOM 1124 CG TYR A 70 79.117 20.386 -4.783 1.00 0.00 C ATOM 1125 CD1 TYR A 70 80.389 19.901 -5.060 1.00 0.00 C ATOM 1126 CD2 TYR A 70 78.115 19.468 -4.492 1.00 0.00 C ATOM 1127 CE1 TYR A 70 80.654 18.545 -5.050 1.00 0.00 C ATOM 1128 CE2 TYR A 70 78.371 18.111 -4.479 1.00 0.00 C ATOM 1129 CZ TYR A 70 79.642 17.654 -4.758 1.00 0.00 C ATOM 1130 OH TYR A 70 79.903 16.303 -4.746 1.00 0.00 O ATOM 0 H TYR A 70 81.133 21.917 -3.902 1.00 0.00 H new ATOM 0 HA TYR A 70 79.031 23.647 -3.602 1.00 0.00 H new ATOM 0 HB2 TYR A 70 77.773 22.026 -5.007 1.00 0.00 H new ATOM 0 HB3 TYR A 70 79.390 22.332 -5.610 1.00 0.00 H new ATOM 0 HD1 TYR A 70 81.184 20.596 -5.287 1.00 0.00 H new ATOM 0 HD2 TYR A 70 77.119 19.822 -4.272 1.00 0.00 H new ATOM 0 HE1 TYR A 70 81.648 18.185 -5.270 1.00 0.00 H new ATOM 0 HE2 TYR A 70 77.580 17.411 -4.252 1.00 0.00 H new ATOM 0 HH TYR A 70 79.084 15.814 -4.521 1.00 0.00 H new ATOM 1140 N VAL A 71 78.565 20.876 -1.870 1.00 0.00 N ATOM 1141 CA VAL A 71 77.778 20.284 -0.796 1.00 0.00 C ATOM 1142 C VAL A 71 77.945 21.065 0.503 1.00 0.00 C ATOM 1143 O VAL A 71 77.009 21.184 1.293 1.00 0.00 O ATOM 1144 CB VAL A 71 78.173 18.815 -0.553 1.00 0.00 C ATOM 1145 CG1 VAL A 71 79.652 18.709 -0.212 1.00 0.00 C ATOM 1146 CG2 VAL A 71 77.319 18.208 0.549 1.00 0.00 C ATOM 0 H VAL A 71 79.337 20.295 -2.196 1.00 0.00 H new ATOM 0 HA VAL A 71 76.735 20.324 -1.110 1.00 0.00 H new ATOM 0 HB VAL A 71 77.994 18.253 -1.470 1.00 0.00 H new ATOM 0 HG11 VAL A 71 79.913 17.664 -0.044 1.00 0.00 H new ATOM 0 HG12 VAL A 71 80.245 19.102 -1.038 1.00 0.00 H new ATOM 0 HG13 VAL A 71 79.860 19.285 0.690 1.00 0.00 H new ATOM 0 HG21 VAL A 71 77.612 17.170 0.707 1.00 0.00 H new ATOM 0 HG22 VAL A 71 77.463 18.770 1.472 1.00 0.00 H new ATOM 0 HG23 VAL A 71 76.269 18.248 0.259 1.00 0.00 H new ATOM 1156 N ASP A 72 79.145 21.594 0.717 1.00 0.00 N ATOM 1157 CA ASP A 72 79.436 22.366 1.920 1.00 0.00 C ATOM 1158 C ASP A 72 78.539 23.597 2.006 1.00 0.00 C ATOM 1159 O ASP A 72 78.033 23.937 3.076 1.00 0.00 O ATOM 1160 CB ASP A 72 80.906 22.788 1.938 1.00 0.00 C ATOM 1161 CG ASP A 72 81.276 23.545 3.198 1.00 0.00 C ATOM 1162 OD1 ASP A 72 81.412 22.900 4.260 1.00 0.00 O ATOM 1163 OD2 ASP A 72 81.429 24.782 3.124 1.00 0.00 O ATOM 0 H ASP A 72 79.931 21.503 0.074 1.00 0.00 H new ATOM 0 HA ASP A 72 79.237 21.733 2.785 1.00 0.00 H new ATOM 0 HB2 ASP A 72 81.536 21.903 1.851 1.00 0.00 H new ATOM 0 HB3 ASP A 72 81.112 23.412 1.069 1.00 0.00 H new ATOM 1168 N LEU A 73 78.348 24.264 0.873 1.00 0.00 N ATOM 1169 CA LEU A 73 77.514 25.459 0.819 1.00 0.00 C ATOM 1170 C LEU A 73 76.047 25.110 1.054 1.00 0.00 C ATOM 1171 O LEU A 73 75.395 25.680 1.929 1.00 0.00 O ATOM 1172 CB LEU A 73 77.674 26.157 -0.533 1.00 0.00 C ATOM 1173 CG LEU A 73 79.012 26.856 -0.773 1.00 0.00 C ATOM 1174 CD1 LEU A 73 79.894 26.020 -1.687 1.00 0.00 C ATOM 1175 CD2 LEU A 73 78.792 28.241 -1.362 1.00 0.00 C ATOM 0 H LEU A 73 78.760 23.997 -0.021 1.00 0.00 H new ATOM 0 HA LEU A 73 77.839 26.135 1.610 1.00 0.00 H new ATOM 0 HB2 LEU A 73 77.527 25.418 -1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 73 76.878 26.895 -0.635 1.00 0.00 H new ATOM 0 HG LEU A 73 79.519 26.967 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 73 80.842 26.533 -1.847 1.00 0.00 H new ATOM 0 HD12 LEU A 73 80.080 25.050 -1.226 1.00 0.00 H new ATOM 0 HD13 LEU A 73 79.393 25.877 -2.645 1.00 0.00 H new ATOM 0 HD21 LEU A 73 79.755 28.724 -1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 73 78.264 28.153 -2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 73 78.199 28.840 -0.671 1.00 0.00 H new ATOM 1187 N LYS A 74 75.535 24.169 0.268 1.00 0.00 N ATOM 1188 CA LYS A 74 74.147 23.741 0.391 1.00 0.00 C ATOM 1189 C LYS A 74 73.838 23.300 1.818 1.00 0.00 C ATOM 1190 O LYS A 74 72.842 23.721 2.406 1.00 0.00 O ATOM 1191 CB LYS A 74 73.857 22.595 -0.581 1.00 0.00 C ATOM 1192 CG LYS A 74 72.462 22.013 -0.437 1.00 0.00 C ATOM 1193 CD LYS A 74 72.505 20.515 -0.191 1.00 0.00 C ATOM 1194 CE LYS A 74 71.106 19.919 -0.131 1.00 0.00 C ATOM 1195 NZ LYS A 74 70.515 20.028 1.231 1.00 0.00 N ATOM 0 H LYS A 74 76.061 23.688 -0.462 1.00 0.00 H new ATOM 0 HA LYS A 74 73.509 24.589 0.145 1.00 0.00 H new ATOM 0 HB2 LYS A 74 73.988 22.954 -1.602 1.00 0.00 H new ATOM 0 HB3 LYS A 74 74.590 21.803 -0.425 1.00 0.00 H new ATOM 0 HG2 LYS A 74 71.946 22.503 0.388 1.00 0.00 H new ATOM 0 HG3 LYS A 74 71.886 22.218 -1.340 1.00 0.00 H new ATOM 0 HD2 LYS A 74 73.074 20.031 -0.985 1.00 0.00 H new ATOM 0 HD3 LYS A 74 73.028 20.314 0.744 1.00 0.00 H new ATOM 0 HE2 LYS A 74 70.463 20.429 -0.848 1.00 0.00 H new ATOM 0 HE3 LYS A 74 71.145 18.871 -0.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 69.562 19.611 1.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 71.115 19.520 1.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 70.454 21.030 1.504 1.00 0.00 H new ATOM 1209 N ASP A 75 74.700 22.453 2.370 1.00 0.00 N ATOM 1210 CA ASP A 75 74.520 21.958 3.730 1.00 0.00 C ATOM 1211 C ASP A 75 74.662 23.089 4.744 1.00 0.00 C ATOM 1212 O ASP A 75 73.942 23.137 5.742 1.00 0.00 O ATOM 1213 CB ASP A 75 75.536 20.855 4.033 1.00 0.00 C ATOM 1214 CG ASP A 75 74.962 19.766 4.917 1.00 0.00 C ATOM 1215 OD1 ASP A 75 73.810 19.348 4.673 1.00 0.00 O ATOM 1216 OD2 ASP A 75 75.665 19.330 5.853 1.00 0.00 O ATOM 0 H ASP A 75 75.530 22.095 1.897 1.00 0.00 H new ATOM 0 HA ASP A 75 73.514 21.547 3.810 1.00 0.00 H new ATOM 0 HB2 ASP A 75 75.880 20.415 3.097 1.00 0.00 H new ATOM 0 HB3 ASP A 75 76.408 21.292 4.520 1.00 0.00 H new ATOM 1221 N LYS A 76 75.596 23.997 4.482 1.00 0.00 N ATOM 1222 CA LYS A 76 75.833 25.129 5.370 1.00 0.00 C ATOM 1223 C LYS A 76 74.576 25.982 5.512 1.00 0.00 C ATOM 1224 O LYS A 76 74.253 26.449 6.604 1.00 0.00 O ATOM 1225 CB LYS A 76 76.986 25.985 4.841 1.00 0.00 C ATOM 1226 CG LYS A 76 78.336 25.618 5.432 1.00 0.00 C ATOM 1227 CD LYS A 76 79.463 26.398 4.775 1.00 0.00 C ATOM 1228 CE LYS A 76 79.583 27.799 5.356 1.00 0.00 C ATOM 1229 NZ LYS A 76 80.745 28.537 4.787 1.00 0.00 N ATOM 0 H LYS A 76 76.201 23.971 3.662 1.00 0.00 H new ATOM 0 HA LYS A 76 76.099 24.739 6.353 1.00 0.00 H new ATOM 0 HB2 LYS A 76 77.034 25.885 3.757 1.00 0.00 H new ATOM 0 HB3 LYS A 76 76.778 27.033 5.055 1.00 0.00 H new ATOM 0 HG2 LYS A 76 78.331 25.817 6.504 1.00 0.00 H new ATOM 0 HG3 LYS A 76 78.511 24.549 5.307 1.00 0.00 H new ATOM 0 HD2 LYS A 76 80.404 25.865 4.911 1.00 0.00 H new ATOM 0 HD3 LYS A 76 79.285 26.462 3.702 1.00 0.00 H new ATOM 0 HE2 LYS A 76 78.667 28.355 5.157 1.00 0.00 H new ATOM 0 HE3 LYS A 76 79.688 27.735 6.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 80.793 29.487 5.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 81.622 28.020 4.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 80.633 28.620 3.756 1.00 0.00 H new ATOM 1243 N TRP A 77 73.872 26.179 4.404 1.00 0.00 N ATOM 1244 CA TRP A 77 72.650 26.975 4.406 1.00 0.00 C ATOM 1245 C TRP A 77 71.537 26.260 5.163 1.00 0.00 C ATOM 1246 O TRP A 77 70.908 26.835 6.052 1.00 0.00 O ATOM 1247 CB TRP A 77 72.204 27.266 2.972 1.00 0.00 C ATOM 1248 CG TRP A 77 70.806 27.801 2.882 1.00 0.00 C ATOM 1249 CD1 TRP A 77 70.387 29.058 3.214 1.00 0.00 C ATOM 1250 CD2 TRP A 77 69.645 27.094 2.433 1.00 0.00 C ATOM 1251 NE1 TRP A 77 69.035 29.175 2.998 1.00 0.00 N ATOM 1252 CE2 TRP A 77 68.557 27.984 2.518 1.00 0.00 C ATOM 1253 CE3 TRP A 77 69.419 25.797 1.965 1.00 0.00 C ATOM 1254 CZ2 TRP A 77 67.264 27.616 2.153 1.00 0.00 C ATOM 1255 CZ3 TRP A 77 68.136 25.433 1.604 1.00 0.00 C ATOM 1256 CH2 TRP A 77 67.072 26.340 1.699 1.00 0.00 C ATOM 0 H TRP A 77 74.126 25.799 3.492 1.00 0.00 H new ATOM 0 HA TRP A 77 72.860 27.918 4.911 1.00 0.00 H new ATOM 0 HB2 TRP A 77 72.890 27.985 2.524 1.00 0.00 H new ATOM 0 HB3 TRP A 77 72.274 26.351 2.384 1.00 0.00 H new ATOM 0 HD1 TRP A 77 71.024 29.844 3.591 1.00 0.00 H new ATOM 0 HE1 TRP A 77 68.478 30.012 3.167 1.00 0.00 H new ATOM 0 HE3 TRP A 77 70.233 25.091 1.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 66.442 28.313 2.226 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 67.950 24.432 1.242 1.00 0.00 H new ATOM 0 HH2 TRP A 77 66.081 26.025 1.408 1.00 0.00 H new ATOM 1267 N LYS A 78 71.297 25.003 4.807 1.00 0.00 N ATOM 1268 CA LYS A 78 70.260 24.208 5.453 1.00 0.00 C ATOM 1269 C LYS A 78 70.429 24.223 6.969 1.00 0.00 C ATOM 1270 O LYS A 78 69.468 24.438 7.710 1.00 0.00 O ATOM 1271 CB LYS A 78 70.299 22.767 4.940 1.00 0.00 C ATOM 1272 CG LYS A 78 69.370 21.828 5.691 1.00 0.00 C ATOM 1273 CD LYS A 78 67.919 22.259 5.563 1.00 0.00 C ATOM 1274 CE LYS A 78 66.976 21.067 5.627 1.00 0.00 C ATOM 1275 NZ LYS A 78 65.580 21.480 5.941 1.00 0.00 N ATOM 0 H LYS A 78 71.808 24.512 4.073 1.00 0.00 H new ATOM 0 HA LYS A 78 69.294 24.649 5.208 1.00 0.00 H new ATOM 0 HB2 LYS A 78 70.033 22.759 3.883 1.00 0.00 H new ATOM 0 HB3 LYS A 78 71.319 22.391 5.014 1.00 0.00 H new ATOM 0 HG2 LYS A 78 69.485 20.815 5.305 1.00 0.00 H new ATOM 0 HG3 LYS A 78 69.651 21.802 6.744 1.00 0.00 H new ATOM 0 HD2 LYS A 78 67.675 22.961 6.361 1.00 0.00 H new ATOM 0 HD3 LYS A 78 67.777 22.787 4.620 1.00 0.00 H new ATOM 0 HE2 LYS A 78 66.993 20.539 4.673 1.00 0.00 H new ATOM 0 HE3 LYS A 78 67.327 20.367 6.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 64.969 20.639 5.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 65.559 21.961 6.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 65.236 22.128 5.204 1.00 0.00 H new ATOM 1289 N THR A 79 71.656 23.994 7.426 1.00 0.00 N ATOM 1290 CA THR A 79 71.950 23.982 8.853 1.00 0.00 C ATOM 1291 C THR A 79 71.665 25.340 9.485 1.00 0.00 C ATOM 1292 O THR A 79 70.940 25.434 10.477 1.00 0.00 O ATOM 1293 CB THR A 79 73.419 23.603 9.121 1.00 0.00 C ATOM 1294 OG1 THR A 79 73.813 22.530 8.258 1.00 0.00 O ATOM 1295 CG2 THR A 79 73.616 23.192 10.572 1.00 0.00 C ATOM 0 H THR A 79 72.462 23.814 6.828 1.00 0.00 H new ATOM 0 HA THR A 79 71.300 23.231 9.303 1.00 0.00 H new ATOM 0 HB THR A 79 74.039 24.477 8.920 1.00 0.00 H new ATOM 0 HG1 THR A 79 74.110 22.894 7.398 1.00 0.00 H new ATOM 0 HG21 THR A 79 74.661 22.929 10.737 1.00 0.00 H new ATOM 0 HG22 THR A 79 73.343 24.021 11.225 1.00 0.00 H new ATOM 0 HG23 THR A 79 72.986 22.331 10.795 1.00 0.00 H new ATOM 1303 N LEU A 80 72.237 26.389 8.906 1.00 0.00 N ATOM 1304 CA LEU A 80 72.043 27.743 9.412 1.00 0.00 C ATOM 1305 C LEU A 80 70.561 28.099 9.460 1.00 0.00 C ATOM 1306 O LEU A 80 70.123 28.865 10.319 1.00 0.00 O ATOM 1307 CB LEU A 80 72.793 28.749 8.536 1.00 0.00 C ATOM 1308 CG LEU A 80 71.937 29.558 7.560 1.00 0.00 C ATOM 1309 CD1 LEU A 80 71.306 30.748 8.265 1.00 0.00 C ATOM 1310 CD2 LEU A 80 72.772 30.018 6.374 1.00 0.00 C ATOM 0 H LEU A 80 72.839 26.328 8.085 1.00 0.00 H new ATOM 0 HA LEU A 80 72.441 27.786 10.426 1.00 0.00 H new ATOM 0 HB2 LEU A 80 73.321 29.445 9.188 1.00 0.00 H new ATOM 0 HB3 LEU A 80 73.549 28.210 7.965 1.00 0.00 H new ATOM 0 HG LEU A 80 71.138 28.917 7.188 1.00 0.00 H new ATOM 0 HD11 LEU A 80 70.701 31.312 7.556 1.00 0.00 H new ATOM 0 HD12 LEU A 80 70.675 30.395 9.080 1.00 0.00 H new ATOM 0 HD13 LEU A 80 72.090 31.391 8.665 1.00 0.00 H new ATOM 0 HD21 LEU A 80 72.147 30.592 5.690 1.00 0.00 H new ATOM 0 HD22 LEU A 80 73.592 30.643 6.727 1.00 0.00 H new ATOM 0 HD23 LEU A 80 73.176 29.149 5.854 1.00 0.00 H new ATOM 1322 N VAL A 81 69.792 27.537 8.533 1.00 0.00 N ATOM 1323 CA VAL A 81 68.358 27.792 8.471 1.00 0.00 C ATOM 1324 C VAL A 81 67.642 27.205 9.683 1.00 0.00 C ATOM 1325 O VAL A 81 66.829 27.873 10.321 1.00 0.00 O ATOM 1326 CB VAL A 81 67.738 27.206 7.189 1.00 0.00 C ATOM 1327 CG1 VAL A 81 66.219 27.253 7.260 1.00 0.00 C ATOM 1328 CG2 VAL A 81 68.246 27.951 5.964 1.00 0.00 C ATOM 0 H VAL A 81 70.139 26.902 7.814 1.00 0.00 H new ATOM 0 HA VAL A 81 68.230 28.874 8.466 1.00 0.00 H new ATOM 0 HB VAL A 81 68.041 26.163 7.104 1.00 0.00 H new ATOM 0 HG11 VAL A 81 65.799 26.835 6.345 1.00 0.00 H new ATOM 0 HG12 VAL A 81 65.877 26.671 8.116 1.00 0.00 H new ATOM 0 HG13 VAL A 81 65.892 28.287 7.370 1.00 0.00 H new ATOM 0 HG21 VAL A 81 67.798 27.524 5.067 1.00 0.00 H new ATOM 0 HG22 VAL A 81 67.974 29.004 6.040 1.00 0.00 H new ATOM 0 HG23 VAL A 81 69.331 27.860 5.907 1.00 0.00 H new ATOM 1338 N HIS A 82 67.951 25.950 9.994 1.00 0.00 N ATOM 1339 CA HIS A 82 67.338 25.272 11.131 1.00 0.00 C ATOM 1340 C HIS A 82 67.647 26.005 12.433 1.00 0.00 C ATOM 1341 O HIS A 82 66.800 26.100 13.321 1.00 0.00 O ATOM 1342 CB HIS A 82 67.832 23.827 11.217 1.00 0.00 C ATOM 1343 CG HIS A 82 67.197 23.042 12.323 1.00 0.00 C ATOM 1344 ND1 HIS A 82 65.880 22.633 12.296 1.00 0.00 N ATOM 1345 CD2 HIS A 82 67.706 22.588 13.492 1.00 0.00 C ATOM 1346 CE1 HIS A 82 65.606 21.964 13.401 1.00 0.00 C ATOM 1347 NE2 HIS A 82 66.698 21.922 14.144 1.00 0.00 N ATOM 0 H HIS A 82 68.621 25.383 9.475 1.00 0.00 H new ATOM 0 HA HIS A 82 66.258 25.272 10.982 1.00 0.00 H new ATOM 0 HB2 HIS A 82 67.635 23.327 10.268 1.00 0.00 H new ATOM 0 HB3 HIS A 82 68.913 23.829 11.358 1.00 0.00 H new ATOM 0 HD2 HIS A 82 68.717 22.724 13.846 1.00 0.00 H new ATOM 0 HE1 HIS A 82 64.652 21.526 13.654 1.00 0.00 H new ATOM 0 HE2 HIS A 82 66.779 21.468 15.054 1.00 0.00 H new ATOM 1355 N THR A 83 68.867 26.523 12.539 1.00 0.00 N ATOM 1356 CA THR A 83 69.288 27.247 13.732 1.00 0.00 C ATOM 1357 C THR A 83 68.616 28.612 13.814 1.00 0.00 C ATOM 1358 O THR A 83 68.375 29.132 14.903 1.00 0.00 O ATOM 1359 CB THR A 83 70.817 27.437 13.763 1.00 0.00 C ATOM 1360 OG1 THR A 83 71.471 26.191 13.496 1.00 0.00 O ATOM 1361 CG2 THR A 83 71.268 27.973 15.113 1.00 0.00 C ATOM 0 H THR A 83 69.580 26.454 11.813 1.00 0.00 H new ATOM 0 HA THR A 83 68.986 26.645 14.589 1.00 0.00 H new ATOM 0 HB THR A 83 71.087 28.161 12.994 1.00 0.00 H new ATOM 0 HG1 THR A 83 71.345 25.951 12.554 1.00 0.00 H new ATOM 0 HG21 THR A 83 72.351 28.099 15.111 1.00 0.00 H new ATOM 0 HG22 THR A 83 70.791 28.935 15.300 1.00 0.00 H new ATOM 0 HG23 THR A 83 70.986 27.270 15.896 1.00 0.00 H new ATOM 1369 N ALA A 84 68.316 29.189 12.654 1.00 0.00 N ATOM 1370 CA ALA A 84 67.669 30.493 12.595 1.00 0.00 C ATOM 1371 C ALA A 84 66.156 30.363 12.742 1.00 0.00 C ATOM 1372 O ALA A 84 65.449 31.360 12.888 1.00 0.00 O ATOM 1373 CB ALA A 84 68.016 31.196 11.291 1.00 0.00 C ATOM 0 H ALA A 84 68.511 28.773 11.743 1.00 0.00 H new ATOM 0 HA ALA A 84 68.038 31.092 13.427 1.00 0.00 H new ATOM 0 HB1 ALA A 84 67.526 32.169 11.261 1.00 0.00 H new ATOM 0 HB2 ALA A 84 69.096 31.331 11.227 1.00 0.00 H new ATOM 0 HB3 ALA A 84 67.676 30.592 10.450 1.00 0.00 H new ATOM 1379 N SER A 85 65.667 29.128 12.701 1.00 0.00 N ATOM 1380 CA SER A 85 64.237 28.868 12.824 1.00 0.00 C ATOM 1381 C SER A 85 63.896 28.361 14.222 1.00 0.00 C ATOM 1382 O SER A 85 62.850 28.697 14.778 1.00 0.00 O ATOM 1383 CB SER A 85 63.791 27.847 11.776 1.00 0.00 C ATOM 1384 OG SER A 85 63.919 26.524 12.266 1.00 0.00 O ATOM 0 H SER A 85 66.239 28.292 12.584 1.00 0.00 H new ATOM 0 HA SER A 85 63.706 29.805 12.657 1.00 0.00 H new ATOM 0 HB2 SER A 85 62.754 28.036 11.498 1.00 0.00 H new ATOM 0 HB3 SER A 85 64.390 27.963 10.873 1.00 0.00 H new ATOM 0 HG SER A 85 64.850 26.360 12.526 1.00 0.00 H new ATOM 1390 N ILE A 86 64.786 27.551 14.784 1.00 0.00 N ATOM 1391 CA ILE A 86 64.581 26.998 16.117 1.00 0.00 C ATOM 1392 C ILE A 86 64.278 28.099 17.128 1.00 0.00 C ATOM 1393 O ILE A 86 64.355 29.285 16.811 1.00 0.00 O ATOM 1394 CB ILE A 86 65.811 26.203 16.593 1.00 0.00 C ATOM 1395 CG1 ILE A 86 67.079 27.047 16.443 1.00 0.00 C ATOM 1396 CG2 ILE A 86 65.937 24.904 15.812 1.00 0.00 C ATOM 1397 CD1 ILE A 86 68.301 26.418 17.075 1.00 0.00 C ATOM 0 H ILE A 86 65.656 27.263 14.337 1.00 0.00 H new ATOM 0 HA ILE A 86 63.727 26.324 16.051 1.00 0.00 H new ATOM 0 HB ILE A 86 65.682 25.958 17.647 1.00 0.00 H new ATOM 0 HG12 ILE A 86 67.272 27.213 15.383 1.00 0.00 H new ATOM 0 HG13 ILE A 86 66.910 28.025 16.893 1.00 0.00 H new ATOM 0 HG21 ILE A 86 66.811 24.354 16.160 1.00 0.00 H new ATOM 0 HG22 ILE A 86 65.043 24.299 15.965 1.00 0.00 H new ATOM 0 HG23 ILE A 86 66.047 25.127 14.751 1.00 0.00 H new ATOM 0 HD11 ILE A 86 69.162 27.070 16.930 1.00 0.00 H new ATOM 0 HD12 ILE A 86 68.127 26.277 18.142 1.00 0.00 H new ATOM 0 HD13 ILE A 86 68.495 25.452 16.609 1.00 0.00 H new ATOM 1409 N ALA A 87 63.936 27.697 18.348 1.00 0.00 N ATOM 1410 CA ALA A 87 63.626 28.649 19.407 1.00 0.00 C ATOM 1411 C ALA A 87 64.733 29.687 19.554 1.00 0.00 C ATOM 1412 O ALA A 87 65.866 29.488 19.114 1.00 0.00 O ATOM 1413 CB ALA A 87 63.405 27.920 20.724 1.00 0.00 C ATOM 0 H ALA A 87 63.867 26.718 18.627 1.00 0.00 H new ATOM 0 HA ALA A 87 62.709 29.171 19.135 1.00 0.00 H new ATOM 0 HB1 ALA A 87 63.174 28.643 21.506 1.00 0.00 H new ATOM 0 HB2 ALA A 87 62.574 27.222 20.619 1.00 0.00 H new ATOM 0 HB3 ALA A 87 64.308 27.371 20.992 1.00 0.00 H new ATOM 1419 N PRO A 88 64.401 30.822 20.186 1.00 0.00 N ATOM 1420 CA PRO A 88 65.354 31.914 20.405 1.00 0.00 C ATOM 1421 C PRO A 88 66.432 31.549 21.420 1.00 0.00 C ATOM 1422 O PRO A 88 67.541 32.079 21.378 1.00 0.00 O ATOM 1423 CB PRO A 88 64.477 33.049 20.941 1.00 0.00 C ATOM 1424 CG PRO A 88 63.308 32.363 21.559 1.00 0.00 C ATOM 1425 CD PRO A 88 63.070 31.127 20.736 1.00 0.00 C ATOM 0 HA PRO A 88 65.896 32.169 19.495 1.00 0.00 H new ATOM 0 HB2 PRO A 88 65.014 33.653 21.672 1.00 0.00 H new ATOM 0 HB3 PRO A 88 64.165 33.720 20.141 1.00 0.00 H new ATOM 0 HG2 PRO A 88 63.511 32.106 22.599 1.00 0.00 H new ATOM 0 HG3 PRO A 88 62.430 33.009 21.556 1.00 0.00 H new ATOM 0 HD2 PRO A 88 62.689 30.307 21.344 1.00 0.00 H new ATOM 0 HD3 PRO A 88 62.340 31.304 19.946 1.00 0.00 H new ATOM 1433 N GLN A 89 66.096 30.640 22.331 1.00 0.00 N ATOM 1434 CA GLN A 89 67.036 30.205 23.357 1.00 0.00 C ATOM 1435 C GLN A 89 68.063 29.237 22.779 1.00 0.00 C ATOM 1436 O GLN A 89 69.185 29.140 23.274 1.00 0.00 O ATOM 1437 CB GLN A 89 66.288 29.543 24.515 1.00 0.00 C ATOM 1438 CG GLN A 89 65.008 30.263 24.904 1.00 0.00 C ATOM 1439 CD GLN A 89 64.631 30.042 26.356 1.00 0.00 C ATOM 1440 OE1 GLN A 89 63.583 29.469 26.656 1.00 0.00 O ATOM 1441 NE2 GLN A 89 65.485 30.495 27.265 1.00 0.00 N ATOM 0 H GLN A 89 65.181 30.192 22.379 1.00 0.00 H new ATOM 0 HA GLN A 89 67.562 31.084 23.729 1.00 0.00 H new ATOM 0 HB2 GLN A 89 66.048 28.516 24.241 1.00 0.00 H new ATOM 0 HB3 GLN A 89 66.947 29.496 25.382 1.00 0.00 H new ATOM 0 HG2 GLN A 89 65.127 31.331 24.722 1.00 0.00 H new ATOM 0 HG3 GLN A 89 64.194 29.920 24.265 1.00 0.00 H new ATOM 0 HE21 GLN A 89 66.342 30.964 26.971 1.00 0.00 H new ATOM 0 HE22 GLN A 89 65.285 30.374 28.258 1.00 0.00 H new ATOM 1450 N GLN A 90 67.670 28.522 21.730 1.00 0.00 N ATOM 1451 CA GLN A 90 68.557 27.560 21.085 1.00 0.00 C ATOM 1452 C GLN A 90 69.396 28.233 20.004 1.00 0.00 C ATOM 1453 O GLN A 90 70.173 27.577 19.310 1.00 0.00 O ATOM 1454 CB GLN A 90 67.746 26.414 20.479 1.00 0.00 C ATOM 1455 CG GLN A 90 66.924 25.643 21.500 1.00 0.00 C ATOM 1456 CD GLN A 90 67.774 24.741 22.372 1.00 0.00 C ATOM 1457 OE1 GLN A 90 68.838 24.280 21.958 1.00 0.00 O ATOM 1458 NE2 GLN A 90 67.308 24.483 23.588 1.00 0.00 N ATOM 0 H GLN A 90 66.744 28.590 21.308 1.00 0.00 H new ATOM 0 HA GLN A 90 69.229 27.158 21.843 1.00 0.00 H new ATOM 0 HB2 GLN A 90 67.079 26.816 19.717 1.00 0.00 H new ATOM 0 HB3 GLN A 90 68.425 25.725 19.977 1.00 0.00 H new ATOM 0 HG2 GLN A 90 66.383 26.347 22.132 1.00 0.00 H new ATOM 0 HG3 GLN A 90 66.178 25.042 20.981 1.00 0.00 H new ATOM 0 HE21 GLN A 90 66.421 24.886 23.890 1.00 0.00 H new ATOM 0 HE22 GLN A 90 67.837 23.882 24.220 1.00 0.00 H new ATOM 1467 N ARG A 91 69.233 29.545 19.866 1.00 0.00 N ATOM 1468 CA ARG A 91 69.974 30.306 18.868 1.00 0.00 C ATOM 1469 C ARG A 91 71.381 30.627 19.363 1.00 0.00 C ATOM 1470 O ARG A 91 71.721 31.789 19.587 1.00 0.00 O ATOM 1471 CB ARG A 91 69.233 31.600 18.529 1.00 0.00 C ATOM 1472 CG ARG A 91 68.195 31.438 17.431 1.00 0.00 C ATOM 1473 CD ARG A 91 67.502 32.756 17.120 1.00 0.00 C ATOM 1474 NE ARG A 91 68.456 33.850 16.956 1.00 0.00 N ATOM 1475 CZ ARG A 91 68.130 35.133 17.072 1.00 0.00 C ATOM 1476 NH1 ARG A 91 66.881 35.480 17.352 1.00 0.00 N ATOM 1477 NH2 ARG A 91 69.054 36.071 16.908 1.00 0.00 N ATOM 0 H ARG A 91 68.594 30.103 20.433 1.00 0.00 H new ATOM 0 HA ARG A 91 70.055 29.696 17.969 1.00 0.00 H new ATOM 0 HB2 ARG A 91 68.743 31.974 19.428 1.00 0.00 H new ATOM 0 HB3 ARG A 91 69.958 32.354 18.223 1.00 0.00 H new ATOM 0 HG2 ARG A 91 68.674 31.056 16.529 1.00 0.00 H new ATOM 0 HG3 ARG A 91 67.454 30.699 17.736 1.00 0.00 H new ATOM 0 HD2 ARG A 91 66.912 32.650 16.210 1.00 0.00 H new ATOM 0 HD3 ARG A 91 66.807 32.999 17.924 1.00 0.00 H new ATOM 0 HE ARG A 91 69.425 33.616 16.741 1.00 0.00 H new ATOM 0 HH11 ARG A 91 66.168 34.761 17.479 1.00 0.00 H new ATOM 0 HH12 ARG A 91 66.633 36.465 17.441 1.00 0.00 H new ATOM 0 HH21 ARG A 91 70.016 35.808 16.693 1.00 0.00 H new ATOM 0 HH22 ARG A 91 68.803 37.056 16.997 1.00 0.00 H new ATOM 1491 N ARG A 92 72.194 29.590 19.533 1.00 0.00 N ATOM 1492 CA ARG A 92 73.563 29.761 20.004 1.00 0.00 C ATOM 1493 C ARG A 92 74.564 29.364 18.922 1.00 0.00 C ATOM 1494 O ARG A 92 74.709 28.186 18.599 1.00 0.00 O ATOM 1495 CB ARG A 92 73.800 28.927 21.264 1.00 0.00 C ATOM 1496 CG ARG A 92 75.057 29.316 22.025 1.00 0.00 C ATOM 1497 CD ARG A 92 75.251 28.451 23.260 1.00 0.00 C ATOM 1498 NE ARG A 92 74.193 28.657 24.245 1.00 0.00 N ATOM 1499 CZ ARG A 92 74.235 28.172 25.481 1.00 0.00 C ATOM 1500 NH1 ARG A 92 75.277 27.456 25.881 1.00 0.00 N ATOM 1501 NH2 ARG A 92 73.233 28.402 26.320 1.00 0.00 N ATOM 0 H ARG A 92 71.928 28.622 19.352 1.00 0.00 H new ATOM 0 HA ARG A 92 73.710 30.815 20.242 1.00 0.00 H new ATOM 0 HB2 ARG A 92 72.939 29.030 21.925 1.00 0.00 H new ATOM 0 HB3 ARG A 92 73.865 27.875 20.986 1.00 0.00 H new ATOM 0 HG2 ARG A 92 75.924 29.219 21.372 1.00 0.00 H new ATOM 0 HG3 ARG A 92 74.996 30.364 22.319 1.00 0.00 H new ATOM 0 HD2 ARG A 92 75.274 27.401 22.967 1.00 0.00 H new ATOM 0 HD3 ARG A 92 76.216 28.677 23.713 1.00 0.00 H new ATOM 0 HE ARG A 92 73.377 29.203 23.969 1.00 0.00 H new ATOM 0 HH11 ARG A 92 76.049 27.276 25.239 1.00 0.00 H new ATOM 0 HH12 ARG A 92 75.306 27.085 26.831 1.00 0.00 H new ATOM 0 HH21 ARG A 92 72.429 28.952 26.016 1.00 0.00 H new ATOM 0 HH22 ARG A 92 73.266 28.029 27.269 1.00 0.00 H new ATOM 1515 N GLY A 93 75.251 30.357 18.366 1.00 0.00 N ATOM 1516 CA GLY A 93 76.229 30.092 17.327 1.00 0.00 C ATOM 1517 C GLY A 93 77.017 31.328 16.942 1.00 0.00 C ATOM 1518 O GLY A 93 77.022 31.733 15.780 1.00 0.00 O ATOM 0 H GLY A 93 75.148 31.340 18.617 1.00 0.00 H new ATOM 0 HA2 GLY A 93 76.917 29.319 17.669 1.00 0.00 H new ATOM 0 HA3 GLY A 93 75.721 29.700 16.446 1.00 0.00 H new ATOM 1522 N ALA A 94 77.683 31.931 17.921 1.00 0.00 N ATOM 1523 CA ALA A 94 78.478 33.129 17.679 1.00 0.00 C ATOM 1524 C ALA A 94 77.600 34.288 17.220 1.00 0.00 C ATOM 1525 O ALA A 94 76.476 34.099 16.754 1.00 0.00 O ATOM 1526 CB ALA A 94 79.561 32.844 16.649 1.00 0.00 C ATOM 0 H ALA A 94 77.688 31.610 18.889 1.00 0.00 H new ATOM 0 HA ALA A 94 78.951 33.417 18.618 1.00 0.00 H new ATOM 0 HB1 ALA A 94 80.147 33.747 16.478 1.00 0.00 H new ATOM 0 HB2 ALA A 94 80.214 32.052 17.017 1.00 0.00 H new ATOM 0 HB3 ALA A 94 79.099 32.528 15.713 1.00 0.00 H new ATOM 1532 N PRO A 95 78.121 35.516 17.354 1.00 0.00 N ATOM 1533 CA PRO A 95 77.400 36.730 16.959 1.00 0.00 C ATOM 1534 C PRO A 95 77.255 36.850 15.446 1.00 0.00 C ATOM 1535 O PRO A 95 78.208 37.193 14.746 1.00 0.00 O ATOM 1536 CB PRO A 95 78.280 37.858 17.503 1.00 0.00 C ATOM 1537 CG PRO A 95 79.647 37.270 17.578 1.00 0.00 C ATOM 1538 CD PRO A 95 79.455 35.815 17.903 1.00 0.00 C ATOM 0 HA PRO A 95 76.381 36.743 17.345 1.00 0.00 H new ATOM 0 HB2 PRO A 95 78.259 38.728 16.847 1.00 0.00 H new ATOM 0 HB3 PRO A 95 77.937 38.190 18.483 1.00 0.00 H new ATOM 0 HG2 PRO A 95 80.177 37.392 16.633 1.00 0.00 H new ATOM 0 HG3 PRO A 95 80.243 37.766 18.344 1.00 0.00 H new ATOM 0 HD2 PRO A 95 80.226 35.196 17.445 1.00 0.00 H new ATOM 0 HD3 PRO A 95 79.497 35.634 18.977 1.00 0.00 H new ATOM 1546 N VAL A 96 76.056 36.567 14.946 1.00 0.00 N ATOM 1547 CA VAL A 96 75.786 36.645 13.516 1.00 0.00 C ATOM 1548 C VAL A 96 74.713 37.686 13.215 1.00 0.00 C ATOM 1549 O VAL A 96 73.892 38.030 14.065 1.00 0.00 O ATOM 1550 CB VAL A 96 75.336 35.283 12.954 1.00 0.00 C ATOM 1551 CG1 VAL A 96 76.533 34.364 12.759 1.00 0.00 C ATOM 1552 CG2 VAL A 96 74.306 34.643 13.872 1.00 0.00 C ATOM 0 H VAL A 96 75.256 36.282 15.511 1.00 0.00 H new ATOM 0 HA VAL A 96 76.718 36.938 13.034 1.00 0.00 H new ATOM 0 HB VAL A 96 74.871 35.446 11.982 1.00 0.00 H new ATOM 0 HG11 VAL A 96 76.196 33.407 12.361 1.00 0.00 H new ATOM 0 HG12 VAL A 96 77.233 34.821 12.059 1.00 0.00 H new ATOM 0 HG13 VAL A 96 77.029 34.205 13.716 1.00 0.00 H new ATOM 0 HG21 VAL A 96 73.999 33.682 13.460 1.00 0.00 H new ATOM 0 HG22 VAL A 96 74.743 34.492 14.859 1.00 0.00 H new ATOM 0 HG23 VAL A 96 73.437 35.296 13.955 1.00 0.00 H new ATOM 1562 N PRO A 97 74.718 38.200 11.976 1.00 0.00 N ATOM 1563 CA PRO A 97 73.751 39.208 11.534 1.00 0.00 C ATOM 1564 C PRO A 97 72.342 38.640 11.398 1.00 0.00 C ATOM 1565 O PRO A 97 72.139 37.608 10.758 1.00 0.00 O ATOM 1566 CB PRO A 97 74.288 39.639 10.167 1.00 0.00 C ATOM 1567 CG PRO A 97 75.077 38.472 9.684 1.00 0.00 C ATOM 1568 CD PRO A 97 75.669 37.836 10.912 1.00 0.00 C ATOM 0 HA PRO A 97 73.660 40.026 12.249 1.00 0.00 H new ATOM 0 HB2 PRO A 97 73.476 39.879 9.481 1.00 0.00 H new ATOM 0 HB3 PRO A 97 74.910 40.530 10.249 1.00 0.00 H new ATOM 0 HG2 PRO A 97 74.442 37.767 9.147 1.00 0.00 H new ATOM 0 HG3 PRO A 97 75.858 38.788 8.993 1.00 0.00 H new ATOM 0 HD2 PRO A 97 75.756 36.755 10.803 1.00 0.00 H new ATOM 0 HD3 PRO A 97 76.669 38.217 11.119 1.00 0.00 H new ATOM 1576 N GLN A 98 71.374 39.320 12.003 1.00 0.00 N ATOM 1577 CA GLN A 98 69.984 38.882 11.948 1.00 0.00 C ATOM 1578 C GLN A 98 69.472 38.873 10.512 1.00 0.00 C ATOM 1579 O GLN A 98 68.628 38.054 10.150 1.00 0.00 O ATOM 1580 CB GLN A 98 69.106 39.791 12.810 1.00 0.00 C ATOM 1581 CG GLN A 98 69.518 39.826 14.273 1.00 0.00 C ATOM 1582 CD GLN A 98 69.858 38.452 14.816 1.00 0.00 C ATOM 1583 OE1 GLN A 98 69.210 37.461 14.480 1.00 0.00 O ATOM 1584 NE2 GLN A 98 70.881 38.386 15.661 1.00 0.00 N ATOM 0 H GLN A 98 71.526 40.176 12.537 1.00 0.00 H new ATOM 0 HA GLN A 98 69.934 37.865 12.338 1.00 0.00 H new ATOM 0 HB2 GLN A 98 69.140 40.803 12.407 1.00 0.00 H new ATOM 0 HB3 GLN A 98 68.071 39.455 12.740 1.00 0.00 H new ATOM 0 HG2 GLN A 98 70.381 40.482 14.388 1.00 0.00 H new ATOM 0 HG3 GLN A 98 68.710 40.256 14.864 1.00 0.00 H new ATOM 0 HE21 GLN A 98 71.391 39.233 15.912 1.00 0.00 H new ATOM 0 HE22 GLN A 98 71.157 37.488 16.059 1.00 0.00 H new ATOM 1593 N GLU A 99 69.989 39.789 9.699 1.00 0.00 N ATOM 1594 CA GLU A 99 69.582 39.886 8.302 1.00 0.00 C ATOM 1595 C GLU A 99 69.823 38.568 7.572 1.00 0.00 C ATOM 1596 O GLU A 99 69.069 38.197 6.671 1.00 0.00 O ATOM 1597 CB GLU A 99 70.342 41.015 7.603 1.00 0.00 C ATOM 1598 CG GLU A 99 71.795 40.681 7.312 1.00 0.00 C ATOM 1599 CD GLU A 99 72.700 41.896 7.385 1.00 0.00 C ATOM 1600 OE1 GLU A 99 72.878 42.565 6.346 1.00 0.00 O ATOM 1601 OE2 GLU A 99 73.228 42.178 8.481 1.00 0.00 O ATOM 0 H GLU A 99 70.690 40.474 9.983 1.00 0.00 H new ATOM 0 HA GLU A 99 68.515 40.106 8.276 1.00 0.00 H new ATOM 0 HB2 GLU A 99 69.839 41.255 6.667 1.00 0.00 H new ATOM 0 HB3 GLU A 99 70.301 41.909 8.225 1.00 0.00 H new ATOM 0 HG2 GLU A 99 72.141 39.932 8.024 1.00 0.00 H new ATOM 0 HG3 GLU A 99 71.870 40.236 6.320 1.00 0.00 H new ATOM 1608 N LEU A 100 70.879 37.865 7.966 1.00 0.00 N ATOM 1609 CA LEU A 100 71.222 36.588 7.350 1.00 0.00 C ATOM 1610 C LEU A 100 70.179 35.526 7.683 1.00 0.00 C ATOM 1611 O LEU A 100 69.802 34.721 6.830 1.00 0.00 O ATOM 1612 CB LEU A 100 72.603 36.128 7.818 1.00 0.00 C ATOM 1613 CG LEU A 100 73.752 36.342 6.832 1.00 0.00 C ATOM 1614 CD1 LEU A 100 73.454 35.654 5.508 1.00 0.00 C ATOM 1615 CD2 LEU A 100 74.002 37.828 6.619 1.00 0.00 C ATOM 0 H LEU A 100 71.513 38.158 8.710 1.00 0.00 H new ATOM 0 HA LEU A 100 71.240 36.727 6.269 1.00 0.00 H new ATOM 0 HB2 LEU A 100 72.843 36.651 8.744 1.00 0.00 H new ATOM 0 HB3 LEU A 100 72.549 35.066 8.056 1.00 0.00 H new ATOM 0 HG LEU A 100 74.655 35.899 7.253 1.00 0.00 H new ATOM 0 HD11 LEU A 100 74.282 35.817 4.819 1.00 0.00 H new ATOM 0 HD12 LEU A 100 73.326 34.584 5.675 1.00 0.00 H new ATOM 0 HD13 LEU A 100 72.540 36.067 5.081 1.00 0.00 H new ATOM 0 HD21 LEU A 100 74.823 37.962 5.915 1.00 0.00 H new ATOM 0 HD22 LEU A 100 73.102 38.295 6.220 1.00 0.00 H new ATOM 0 HD23 LEU A 100 74.261 38.293 7.570 1.00 0.00 H new ATOM 1627 N LEU A 101 69.715 35.530 8.928 1.00 0.00 N ATOM 1628 CA LEU A 101 68.714 34.567 9.375 1.00 0.00 C ATOM 1629 C LEU A 101 67.333 34.930 8.838 1.00 0.00 C ATOM 1630 O LEU A 101 66.473 34.065 8.673 1.00 0.00 O ATOM 1631 CB LEU A 101 68.680 34.508 10.903 1.00 0.00 C ATOM 1632 CG LEU A 101 69.988 34.110 11.588 1.00 0.00 C ATOM 1633 CD1 LEU A 101 70.860 33.298 10.643 1.00 0.00 C ATOM 1634 CD2 LEU A 101 70.733 35.345 12.074 1.00 0.00 C ATOM 0 H LEU A 101 70.016 36.189 9.646 1.00 0.00 H new ATOM 0 HA LEU A 101 68.989 33.587 8.986 1.00 0.00 H new ATOM 0 HB2 LEU A 101 68.380 35.486 11.278 1.00 0.00 H new ATOM 0 HB3 LEU A 101 67.906 33.801 11.202 1.00 0.00 H new ATOM 0 HG LEU A 101 69.749 33.490 12.452 1.00 0.00 H new ATOM 0 HD11 LEU A 101 71.786 33.024 11.148 1.00 0.00 H new ATOM 0 HD12 LEU A 101 70.329 32.395 10.344 1.00 0.00 H new ATOM 0 HD13 LEU A 101 71.091 33.893 9.759 1.00 0.00 H new ATOM 0 HD21 LEU A 101 71.661 35.043 12.559 1.00 0.00 H new ATOM 0 HD22 LEU A 101 70.960 35.990 11.225 1.00 0.00 H new ATOM 0 HD23 LEU A 101 70.112 35.888 12.786 1.00 0.00 H new ATOM 1646 N ASP A 102 67.129 36.214 8.565 1.00 0.00 N ATOM 1647 CA ASP A 102 65.853 36.692 8.043 1.00 0.00 C ATOM 1648 C ASP A 102 65.723 36.379 6.556 1.00 0.00 C ATOM 1649 O ASP A 102 64.633 36.080 6.067 1.00 0.00 O ATOM 1650 CB ASP A 102 65.715 38.197 8.275 1.00 0.00 C ATOM 1651 CG ASP A 102 64.270 38.657 8.248 1.00 0.00 C ATOM 1652 OD1 ASP A 102 63.566 38.462 9.261 1.00 0.00 O ATOM 1653 OD2 ASP A 102 63.844 39.211 7.213 1.00 0.00 O ATOM 0 H ASP A 102 67.830 36.943 8.696 1.00 0.00 H new ATOM 0 HA ASP A 102 65.054 36.176 8.575 1.00 0.00 H new ATOM 0 HB2 ASP A 102 66.158 38.455 9.237 1.00 0.00 H new ATOM 0 HB3 ASP A 102 66.278 38.733 7.511 1.00 0.00 H new ATOM 1658 N ARG A 103 66.842 36.450 5.842 1.00 0.00 N ATOM 1659 CA ARG A 103 66.852 36.177 4.410 1.00 0.00 C ATOM 1660 C ARG A 103 66.739 34.679 4.141 1.00 0.00 C ATOM 1661 O ARG A 103 66.045 34.254 3.217 1.00 0.00 O ATOM 1662 CB ARG A 103 68.131 36.725 3.774 1.00 0.00 C ATOM 1663 CG ARG A 103 69.403 36.118 4.343 1.00 0.00 C ATOM 1664 CD ARG A 103 70.637 36.624 3.613 1.00 0.00 C ATOM 1665 NE ARG A 103 70.938 38.014 3.946 1.00 0.00 N ATOM 1666 CZ ARG A 103 71.706 38.799 3.199 1.00 0.00 C ATOM 1667 NH1 ARG A 103 72.246 38.334 2.081 1.00 0.00 N ATOM 1668 NH2 ARG A 103 71.933 40.053 3.568 1.00 0.00 N ATOM 0 H ARG A 103 67.753 36.694 6.232 1.00 0.00 H new ATOM 0 HA ARG A 103 65.990 36.675 3.965 1.00 0.00 H new ATOM 0 HB2 ARG A 103 68.100 36.542 2.700 1.00 0.00 H new ATOM 0 HB3 ARG A 103 68.161 37.806 3.912 1.00 0.00 H new ATOM 0 HG2 ARG A 103 69.481 36.361 5.403 1.00 0.00 H new ATOM 0 HG3 ARG A 103 69.354 35.032 4.268 1.00 0.00 H new ATOM 0 HD2 ARG A 103 71.491 35.997 3.868 1.00 0.00 H new ATOM 0 HD3 ARG A 103 70.485 36.534 2.538 1.00 0.00 H new ATOM 0 HE ARG A 103 70.536 38.403 4.799 1.00 0.00 H new ATOM 0 HH11 ARG A 103 72.072 37.371 1.793 1.00 0.00 H new ATOM 0 HH12 ARG A 103 72.835 38.939 1.509 1.00 0.00 H new ATOM 0 HH21 ARG A 103 71.518 40.415 4.426 1.00 0.00 H new ATOM 0 HH22 ARG A 103 72.523 40.655 2.993 1.00 0.00 H new ATOM 1682 N VAL A 104 67.427 33.884 4.954 1.00 0.00 N ATOM 1683 CA VAL A 104 67.404 32.434 4.805 1.00 0.00 C ATOM 1684 C VAL A 104 66.047 31.862 5.199 1.00 0.00 C ATOM 1685 O VAL A 104 65.544 30.934 4.565 1.00 0.00 O ATOM 1686 CB VAL A 104 68.499 31.764 5.657 1.00 0.00 C ATOM 1687 CG1 VAL A 104 69.880 32.196 5.189 1.00 0.00 C ATOM 1688 CG2 VAL A 104 68.300 32.090 7.130 1.00 0.00 C ATOM 0 H VAL A 104 68.007 34.220 5.723 1.00 0.00 H new ATOM 0 HA VAL A 104 67.593 32.221 3.753 1.00 0.00 H new ATOM 0 HB VAL A 104 68.422 30.684 5.533 1.00 0.00 H new ATOM 0 HG11 VAL A 104 70.640 31.712 5.803 1.00 0.00 H new ATOM 0 HG12 VAL A 104 70.018 31.908 4.147 1.00 0.00 H new ATOM 0 HG13 VAL A 104 69.974 33.278 5.281 1.00 0.00 H new ATOM 0 HG21 VAL A 104 69.082 31.609 7.718 1.00 0.00 H new ATOM 0 HG22 VAL A 104 68.350 33.169 7.274 1.00 0.00 H new ATOM 0 HG23 VAL A 104 67.326 31.725 7.455 1.00 0.00 H new ATOM 1698 N LEU A 105 65.459 32.422 6.251 1.00 0.00 N ATOM 1699 CA LEU A 105 64.158 31.969 6.731 1.00 0.00 C ATOM 1700 C LEU A 105 63.056 32.330 5.740 1.00 0.00 C ATOM 1701 O LEU A 105 62.274 31.474 5.327 1.00 0.00 O ATOM 1702 CB LEU A 105 63.854 32.585 8.097 1.00 0.00 C ATOM 1703 CG LEU A 105 64.259 31.754 9.314 1.00 0.00 C ATOM 1704 CD1 LEU A 105 63.208 30.696 9.613 1.00 0.00 C ATOM 1705 CD2 LEU A 105 65.619 31.108 9.090 1.00 0.00 C ATOM 0 H LEU A 105 65.862 33.190 6.787 1.00 0.00 H new ATOM 0 HA LEU A 105 64.192 30.884 6.828 1.00 0.00 H new ATOM 0 HB2 LEU A 105 64.357 33.550 8.158 1.00 0.00 H new ATOM 0 HB3 LEU A 105 62.783 32.779 8.155 1.00 0.00 H new ATOM 0 HG LEU A 105 64.331 32.418 10.175 1.00 0.00 H new ATOM 0 HD11 LEU A 105 63.514 30.115 10.483 1.00 0.00 H new ATOM 0 HD12 LEU A 105 62.253 31.180 9.818 1.00 0.00 H new ATOM 0 HD13 LEU A 105 63.103 30.035 8.753 1.00 0.00 H new ATOM 0 HD21 LEU A 105 65.891 30.520 9.967 1.00 0.00 H new ATOM 0 HD22 LEU A 105 65.573 30.457 8.217 1.00 0.00 H new ATOM 0 HD23 LEU A 105 66.367 31.883 8.926 1.00 0.00 H new ATOM 1717 N ALA A 106 63.002 33.602 5.361 1.00 0.00 N ATOM 1718 CA ALA A 106 61.999 34.076 4.415 1.00 0.00 C ATOM 1719 C ALA A 106 62.089 33.319 3.094 1.00 0.00 C ATOM 1720 O ALA A 106 61.076 32.885 2.547 1.00 0.00 O ATOM 1721 CB ALA A 106 62.158 35.571 4.181 1.00 0.00 C ATOM 0 H ALA A 106 63.641 34.323 5.695 1.00 0.00 H new ATOM 0 HA ALA A 106 61.014 33.890 4.844 1.00 0.00 H new ATOM 0 HB1 ALA A 106 61.402 35.911 3.473 1.00 0.00 H new ATOM 0 HB2 ALA A 106 62.035 36.102 5.125 1.00 0.00 H new ATOM 0 HB3 ALA A 106 63.150 35.773 3.778 1.00 0.00 H new ATOM 1727 N ALA A 107 63.308 33.166 2.588 1.00 0.00 N ATOM 1728 CA ALA A 107 63.530 32.460 1.332 1.00 0.00 C ATOM 1729 C ALA A 107 63.146 30.989 1.453 1.00 0.00 C ATOM 1730 O ALA A 107 62.616 30.398 0.513 1.00 0.00 O ATOM 1731 CB ALA A 107 64.983 32.595 0.901 1.00 0.00 C ATOM 0 H ALA A 107 64.157 33.521 3.028 1.00 0.00 H new ATOM 0 HA ALA A 107 62.893 32.913 0.572 1.00 0.00 H new ATOM 0 HB1 ALA A 107 65.135 32.063 -0.038 1.00 0.00 H new ATOM 0 HB2 ALA A 107 65.226 33.649 0.765 1.00 0.00 H new ATOM 0 HB3 ALA A 107 65.631 32.170 1.668 1.00 0.00 H new ATOM 1737 N GLN A 108 63.418 30.406 2.616 1.00 0.00 N ATOM 1738 CA GLN A 108 63.102 29.003 2.858 1.00 0.00 C ATOM 1739 C GLN A 108 61.605 28.749 2.710 1.00 0.00 C ATOM 1740 O GLN A 108 61.187 27.846 1.986 1.00 0.00 O ATOM 1741 CB GLN A 108 63.566 28.587 4.255 1.00 0.00 C ATOM 1742 CG GLN A 108 63.413 27.100 4.530 1.00 0.00 C ATOM 1743 CD GLN A 108 61.987 26.714 4.874 1.00 0.00 C ATOM 1744 OE1 GLN A 108 61.409 27.222 5.835 1.00 0.00 O ATOM 1745 NE2 GLN A 108 61.412 25.811 4.088 1.00 0.00 N ATOM 0 H GLN A 108 63.856 30.883 3.404 1.00 0.00 H new ATOM 0 HA GLN A 108 63.629 28.405 2.115 1.00 0.00 H new ATOM 0 HB2 GLN A 108 64.613 28.865 4.379 1.00 0.00 H new ATOM 0 HB3 GLN A 108 62.998 29.146 4.999 1.00 0.00 H new ATOM 0 HG2 GLN A 108 63.737 26.537 3.654 1.00 0.00 H new ATOM 0 HG3 GLN A 108 64.070 26.817 5.352 1.00 0.00 H new ATOM 0 HE21 GLN A 108 61.929 25.416 3.302 1.00 0.00 H new ATOM 0 HE22 GLN A 108 60.454 25.512 4.270 1.00 0.00 H new ATOM 1754 N ALA A 109 60.803 29.551 3.402 1.00 0.00 N ATOM 1755 CA ALA A 109 59.353 29.414 3.347 1.00 0.00 C ATOM 1756 C ALA A 109 58.820 29.770 1.963 1.00 0.00 C ATOM 1757 O ALA A 109 57.836 29.194 1.499 1.00 0.00 O ATOM 1758 CB ALA A 109 58.699 30.289 4.407 1.00 0.00 C ATOM 0 H ALA A 109 61.133 30.303 4.007 1.00 0.00 H new ATOM 0 HA ALA A 109 59.104 28.372 3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 109 57.616 30.177 4.354 1.00 0.00 H new ATOM 0 HB2 ALA A 109 59.048 29.986 5.394 1.00 0.00 H new ATOM 0 HB3 ALA A 109 58.964 31.332 4.233 1.00 0.00 H new ATOM 1764 N TYR A 110 59.475 30.723 1.309 1.00 0.00 N ATOM 1765 CA TYR A 110 59.065 31.158 -0.021 1.00 0.00 C ATOM 1766 C TYR A 110 59.331 30.069 -1.056 1.00 0.00 C ATOM 1767 O TYR A 110 58.497 29.804 -1.922 1.00 0.00 O ATOM 1768 CB TYR A 110 59.804 32.439 -0.411 1.00 0.00 C ATOM 1769 CG TYR A 110 59.057 33.703 -0.051 1.00 0.00 C ATOM 1770 CD1 TYR A 110 58.436 33.838 1.185 1.00 0.00 C ATOM 1771 CD2 TYR A 110 58.970 34.762 -0.946 1.00 0.00 C ATOM 1772 CE1 TYR A 110 57.752 34.990 1.519 1.00 0.00 C ATOM 1773 CE2 TYR A 110 58.288 35.919 -0.620 1.00 0.00 C ATOM 1774 CZ TYR A 110 57.681 36.028 0.613 1.00 0.00 C ATOM 1775 OH TYR A 110 57.000 37.178 0.941 1.00 0.00 O ATOM 0 H TYR A 110 60.292 31.209 1.678 1.00 0.00 H new ATOM 0 HA TYR A 110 57.994 31.357 0.003 1.00 0.00 H new ATOM 0 HB2 TYR A 110 60.777 32.450 0.079 1.00 0.00 H new ATOM 0 HB3 TYR A 110 59.988 32.429 -1.485 1.00 0.00 H new ATOM 0 HD1 TYR A 110 58.489 33.028 1.897 1.00 0.00 H new ATOM 0 HD2 TYR A 110 59.443 34.680 -1.913 1.00 0.00 H new ATOM 0 HE1 TYR A 110 57.275 35.078 2.484 1.00 0.00 H new ATOM 0 HE2 TYR A 110 58.231 36.733 -1.327 1.00 0.00 H new ATOM 0 HH TYR A 110 57.047 37.810 0.194 1.00 0.00 H new ATOM 1785 N TRP A 111 60.497 29.441 -0.958 1.00 0.00 N ATOM 1786 CA TRP A 111 60.873 28.379 -1.885 1.00 0.00 C ATOM 1787 C TRP A 111 60.023 27.133 -1.659 1.00 0.00 C ATOM 1788 O TRP A 111 59.932 26.268 -2.529 1.00 0.00 O ATOM 1789 CB TRP A 111 62.355 28.037 -1.726 1.00 0.00 C ATOM 1790 CG TRP A 111 63.269 29.055 -2.339 1.00 0.00 C ATOM 1791 CD1 TRP A 111 64.312 29.692 -1.730 1.00 0.00 C ATOM 1792 CD2 TRP A 111 63.219 29.553 -3.680 1.00 0.00 C ATOM 1793 NE1 TRP A 111 64.914 30.557 -2.612 1.00 0.00 N ATOM 1794 CE2 TRP A 111 64.263 30.490 -3.815 1.00 0.00 C ATOM 1795 CE3 TRP A 111 62.397 29.298 -4.781 1.00 0.00 C ATOM 1796 CZ2 TRP A 111 64.503 31.170 -5.006 1.00 0.00 C ATOM 1797 CZ3 TRP A 111 62.636 29.975 -5.962 1.00 0.00 C ATOM 1798 CH2 TRP A 111 63.682 30.901 -6.067 1.00 0.00 C ATOM 0 H TRP A 111 61.198 29.648 -0.247 1.00 0.00 H new ATOM 0 HA TRP A 111 60.697 28.736 -2.900 1.00 0.00 H new ATOM 0 HB2 TRP A 111 62.587 27.943 -0.665 1.00 0.00 H new ATOM 0 HB3 TRP A 111 62.547 27.066 -2.182 1.00 0.00 H new ATOM 0 HD1 TRP A 111 64.619 29.539 -0.706 1.00 0.00 H new ATOM 0 HE1 TRP A 111 65.716 31.152 -2.404 1.00 0.00 H new ATOM 0 HE3 TRP A 111 61.589 28.585 -4.710 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 65.309 31.884 -5.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 62.006 29.787 -6.819 1.00 0.00 H new ATOM 0 HH2 TRP A 111 63.844 31.413 -7.004 1.00 0.00 H new ATOM 1809 N SER A 112 59.404 27.049 -0.486 1.00 0.00 N ATOM 1810 CA SER A 112 58.564 25.907 -0.146 1.00 0.00 C ATOM 1811 C SER A 112 57.426 25.750 -1.149 1.00 0.00 C ATOM 1812 O SER A 112 57.334 26.498 -2.123 1.00 0.00 O ATOM 1813 CB SER A 112 57.996 26.067 1.266 1.00 0.00 C ATOM 1814 OG SER A 112 56.725 26.691 1.236 1.00 0.00 O ATOM 0 H SER A 112 59.468 27.758 0.245 1.00 0.00 H new ATOM 0 HA SER A 112 59.182 25.010 -0.182 1.00 0.00 H new ATOM 0 HB2 SER A 112 57.914 25.090 1.741 1.00 0.00 H new ATOM 0 HB3 SER A 112 58.681 26.659 1.872 1.00 0.00 H new ATOM 0 HG SER A 112 56.836 27.662 1.304 1.00 0.00 H new ATOM 1820 N VAL A 113 56.561 24.771 -0.905 1.00 0.00 N ATOM 1821 CA VAL A 113 55.427 24.516 -1.786 1.00 0.00 C ATOM 1822 C VAL A 113 54.589 23.348 -1.278 1.00 0.00 C ATOM 1823 O VAL A 113 55.040 22.202 -1.275 1.00 0.00 O ATOM 1824 CB VAL A 113 55.890 24.214 -3.223 1.00 0.00 C ATOM 1825 CG1 VAL A 113 56.974 23.147 -3.223 1.00 0.00 C ATOM 1826 CG2 VAL A 113 54.711 23.787 -4.084 1.00 0.00 C ATOM 0 H VAL A 113 56.624 24.141 -0.105 1.00 0.00 H new ATOM 0 HA VAL A 113 54.819 25.421 -1.791 1.00 0.00 H new ATOM 0 HB VAL A 113 56.311 25.125 -3.649 1.00 0.00 H new ATOM 0 HG11 VAL A 113 57.288 22.947 -4.248 1.00 0.00 H new ATOM 0 HG12 VAL A 113 57.828 23.496 -2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 113 56.583 22.232 -2.778 1.00 0.00 H new ATOM 0 HG21 VAL A 113 55.057 23.578 -5.096 1.00 0.00 H new ATOM 0 HG22 VAL A 113 54.259 22.890 -3.662 1.00 0.00 H new ATOM 0 HG23 VAL A 113 53.972 24.587 -4.111 1.00 0.00 H new ATOM 1836 N ASP A 114 53.368 23.646 -0.849 1.00 0.00 N ATOM 1837 CA ASP A 114 52.465 22.620 -0.340 1.00 0.00 C ATOM 1838 C ASP A 114 51.148 23.236 0.122 1.00 0.00 C ATOM 1839 O ASP A 114 51.114 24.373 0.593 1.00 0.00 O ATOM 1840 CB ASP A 114 53.120 21.861 0.815 1.00 0.00 C ATOM 1841 CG ASP A 114 52.804 20.378 0.786 1.00 0.00 C ATOM 1842 OD1 ASP A 114 53.051 19.739 -0.258 1.00 0.00 O ATOM 1843 OD2 ASP A 114 52.309 19.857 1.807 1.00 0.00 O ATOM 0 H ASP A 114 52.980 24.589 -0.843 1.00 0.00 H new ATOM 0 HA ASP A 114 52.255 21.922 -1.150 1.00 0.00 H new ATOM 0 HB2 ASP A 114 54.200 22.000 0.771 1.00 0.00 H new ATOM 0 HB3 ASP A 114 52.782 22.283 1.761 1.00 0.00 H new ATOM 1848 N SER A 115 50.065 22.478 -0.017 1.00 0.00 N ATOM 1849 CA SER A 115 48.744 22.951 0.381 1.00 0.00 C ATOM 1850 C SER A 115 48.764 23.473 1.815 1.00 0.00 C ATOM 1851 O SER A 115 48.098 24.457 2.138 1.00 0.00 O ATOM 1852 CB SER A 115 47.715 21.827 0.250 1.00 0.00 C ATOM 1853 OG SER A 115 46.586 22.070 1.071 1.00 0.00 O ATOM 0 H SER A 115 50.076 21.534 -0.402 1.00 0.00 H new ATOM 0 HA SER A 115 48.463 23.769 -0.282 1.00 0.00 H new ATOM 0 HB2 SER A 115 47.400 21.738 -0.790 1.00 0.00 H new ATOM 0 HB3 SER A 115 48.172 20.877 0.527 1.00 0.00 H new ATOM 0 HG SER A 115 45.943 21.338 0.968 1.00 0.00 H new ATOM 1859 N SER A 116 49.533 22.806 2.670 1.00 0.00 N ATOM 1860 CA SER A 116 49.637 23.199 4.071 1.00 0.00 C ATOM 1861 C SER A 116 50.975 23.879 4.346 1.00 0.00 C ATOM 1862 O SER A 116 51.929 23.728 3.584 1.00 0.00 O ATOM 1863 CB SER A 116 49.476 21.978 4.978 1.00 0.00 C ATOM 1864 OG SER A 116 49.275 22.367 6.326 1.00 0.00 O ATOM 0 H SER A 116 50.093 21.992 2.418 1.00 0.00 H new ATOM 0 HA SER A 116 48.838 23.909 4.285 1.00 0.00 H new ATOM 0 HB2 SER A 116 48.631 21.378 4.639 1.00 0.00 H new ATOM 0 HB3 SER A 116 50.363 21.348 4.906 1.00 0.00 H new ATOM 0 HG SER A 116 49.173 21.569 6.885 1.00 0.00 H new ATOM 1870 N GLY A 117 51.037 24.629 5.442 1.00 0.00 N ATOM 1871 CA GLY A 117 52.261 25.321 5.799 1.00 0.00 C ATOM 1872 C GLY A 117 52.512 25.320 7.294 1.00 0.00 C ATOM 1873 O GLY A 117 52.182 24.357 7.986 1.00 0.00 O ATOM 0 H GLY A 117 50.261 24.770 6.089 1.00 0.00 H new ATOM 0 HA2 GLY A 117 53.103 24.849 5.292 1.00 0.00 H new ATOM 0 HA3 GLY A 117 52.210 26.350 5.443 1.00 0.00 H new ATOM 1877 N ARG A 118 53.099 26.403 7.795 1.00 0.00 N ATOM 1878 CA ARG A 118 53.397 26.522 9.217 1.00 0.00 C ATOM 1879 C ARG A 118 52.112 26.614 10.035 1.00 0.00 C ATOM 1880 O ARG A 118 51.013 26.657 9.481 1.00 0.00 O ATOM 1881 CB ARG A 118 54.268 27.752 9.476 1.00 0.00 C ATOM 1882 CG ARG A 118 55.459 27.864 8.538 1.00 0.00 C ATOM 1883 CD ARG A 118 56.393 26.672 8.679 1.00 0.00 C ATOM 1884 NE ARG A 118 57.724 26.954 8.148 1.00 0.00 N ATOM 1885 CZ ARG A 118 58.592 27.770 8.736 1.00 0.00 C ATOM 1886 NH1 ARG A 118 58.271 28.382 9.867 1.00 0.00 N ATOM 1887 NH2 ARG A 118 59.784 27.976 8.191 1.00 0.00 N ATOM 0 H ARG A 118 53.377 27.210 7.237 1.00 0.00 H new ATOM 0 HA ARG A 118 53.941 25.629 9.525 1.00 0.00 H new ATOM 0 HB2 ARG A 118 53.655 28.648 9.379 1.00 0.00 H new ATOM 0 HB3 ARG A 118 54.628 27.722 10.504 1.00 0.00 H new ATOM 0 HG2 ARG A 118 55.108 27.932 7.508 1.00 0.00 H new ATOM 0 HG3 ARG A 118 56.005 28.783 8.750 1.00 0.00 H new ATOM 0 HD2 ARG A 118 56.473 26.397 9.731 1.00 0.00 H new ATOM 0 HD3 ARG A 118 55.968 25.815 8.156 1.00 0.00 H new ATOM 0 HE ARG A 118 58.002 26.500 7.278 1.00 0.00 H new ATOM 0 HH11 ARG A 118 57.355 28.227 10.289 1.00 0.00 H new ATOM 0 HH12 ARG A 118 58.940 29.008 10.316 1.00 0.00 H new ATOM 0 HH21 ARG A 118 60.034 27.508 7.320 1.00 0.00 H new ATOM 0 HH22 ARG A 118 60.450 28.603 8.643 1.00 0.00 H new ATOM 1901 N ILE A 119 52.259 26.643 11.356 1.00 0.00 N ATOM 1902 CA ILE A 119 51.111 26.730 12.249 1.00 0.00 C ATOM 1903 C ILE A 119 50.258 27.953 11.931 1.00 0.00 C ATOM 1904 O ILE A 119 49.061 27.981 12.219 1.00 0.00 O ATOM 1905 CB ILE A 119 51.550 26.794 13.724 1.00 0.00 C ATOM 1906 CG1 ILE A 119 52.540 27.941 13.935 1.00 0.00 C ATOM 1907 CG2 ILE A 119 52.165 25.470 14.152 1.00 0.00 C ATOM 1908 CD1 ILE A 119 52.868 28.197 15.389 1.00 0.00 C ATOM 0 H ILE A 119 53.161 26.608 11.830 1.00 0.00 H new ATOM 0 HA ILE A 119 50.520 25.828 12.092 1.00 0.00 H new ATOM 0 HB ILE A 119 50.671 26.980 14.341 1.00 0.00 H new ATOM 0 HG12 ILE A 119 53.461 27.718 13.397 1.00 0.00 H new ATOM 0 HG13 ILE A 119 52.128 28.851 13.498 1.00 0.00 H new ATOM 0 HG21 ILE A 119 52.470 25.531 15.197 1.00 0.00 H new ATOM 0 HG22 ILE A 119 51.431 24.673 14.035 1.00 0.00 H new ATOM 0 HG23 ILE A 119 53.035 25.256 13.532 1.00 0.00 H new ATOM 0 HD11 ILE A 119 53.575 29.023 15.462 1.00 0.00 H new ATOM 0 HD12 ILE A 119 51.956 28.451 15.929 1.00 0.00 H new ATOM 0 HD13 ILE A 119 53.310 27.301 15.825 1.00 0.00 H new ATOM 1920 N VAL A 120 50.881 28.963 11.332 1.00 0.00 N ATOM 1921 CA VAL A 120 50.178 30.188 10.970 1.00 0.00 C ATOM 1922 C VAL A 120 48.983 29.892 10.071 1.00 0.00 C ATOM 1923 O VAL A 120 48.728 28.740 9.718 1.00 0.00 O ATOM 1924 CB VAL A 120 51.113 31.180 10.253 1.00 0.00 C ATOM 1925 CG1 VAL A 120 52.314 31.510 11.127 1.00 0.00 C ATOM 1926 CG2 VAL A 120 51.558 30.618 8.911 1.00 0.00 C ATOM 0 H VAL A 120 51.871 28.957 11.087 1.00 0.00 H new ATOM 0 HA VAL A 120 49.827 30.637 11.899 1.00 0.00 H new ATOM 0 HB VAL A 120 50.563 32.103 10.070 1.00 0.00 H new ATOM 0 HG11 VAL A 120 52.963 32.212 10.604 1.00 0.00 H new ATOM 0 HG12 VAL A 120 51.973 31.958 12.060 1.00 0.00 H new ATOM 0 HG13 VAL A 120 52.868 30.597 11.344 1.00 0.00 H new ATOM 0 HG21 VAL A 120 52.218 31.332 8.418 1.00 0.00 H new ATOM 0 HG22 VAL A 120 52.091 29.680 9.068 1.00 0.00 H new ATOM 0 HG23 VAL A 120 50.685 30.439 8.284 1.00 0.00 H new ATOM 1936 N THR A 121 48.253 30.939 9.702 1.00 0.00 N ATOM 1937 CA THR A 121 47.084 30.792 8.845 1.00 0.00 C ATOM 1938 C THR A 121 47.177 31.704 7.627 1.00 0.00 C ATOM 1939 O THR A 121 46.419 32.666 7.499 1.00 0.00 O ATOM 1940 CB THR A 121 45.783 31.106 9.608 1.00 0.00 C ATOM 1941 OG1 THR A 121 45.805 30.474 10.893 1.00 0.00 O ATOM 1942 CG2 THR A 121 44.568 30.632 8.825 1.00 0.00 C ATOM 0 H THR A 121 48.451 31.899 9.984 1.00 0.00 H new ATOM 0 HA THR A 121 47.062 29.753 8.517 1.00 0.00 H new ATOM 0 HB THR A 121 45.714 32.186 9.735 1.00 0.00 H new ATOM 0 HG1 THR A 121 44.976 30.679 11.373 1.00 0.00 H new ATOM 0 HG21 THR A 121 43.662 30.865 9.384 1.00 0.00 H new ATOM 0 HG22 THR A 121 44.538 31.136 7.859 1.00 0.00 H new ATOM 0 HG23 THR A 121 44.632 29.555 8.670 1.00 0.00 H new ATOM 1950 N LEU A 122 48.110 31.396 6.733 1.00 0.00 N ATOM 1951 CA LEU A 122 48.302 32.188 5.523 1.00 0.00 C ATOM 1952 C LEU A 122 48.127 31.328 4.276 1.00 0.00 C ATOM 1953 O LEU A 122 47.323 31.645 3.399 1.00 0.00 O ATOM 1954 CB LEU A 122 49.692 32.828 5.524 1.00 0.00 C ATOM 1955 CG LEU A 122 50.031 33.698 4.313 1.00 0.00 C ATOM 1956 CD1 LEU A 122 49.226 34.988 4.339 1.00 0.00 C ATOM 1957 CD2 LEU A 122 51.522 33.999 4.274 1.00 0.00 C ATOM 0 H LEU A 122 48.746 30.603 6.823 1.00 0.00 H new ATOM 0 HA LEU A 122 47.547 32.974 5.509 1.00 0.00 H new ATOM 0 HB2 LEU A 122 49.789 33.437 6.423 1.00 0.00 H new ATOM 0 HB3 LEU A 122 50.436 32.034 5.596 1.00 0.00 H new ATOM 0 HG LEU A 122 49.767 33.148 3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 122 49.481 35.594 3.469 1.00 0.00 H new ATOM 0 HD12 LEU A 122 48.162 34.753 4.318 1.00 0.00 H new ATOM 0 HD13 LEU A 122 49.457 35.543 5.248 1.00 0.00 H new ATOM 0 HD21 LEU A 122 51.745 34.619 3.406 1.00 0.00 H new ATOM 0 HD22 LEU A 122 51.810 34.529 5.182 1.00 0.00 H new ATOM 0 HD23 LEU A 122 52.080 33.065 4.206 1.00 0.00 H new TER 1969 LEU A 122