USER MOD reduce.3.24.130724 H: found=0, std=0, add=818, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 816 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 ASN : amide:sc= -1.75! C(o=-1.7!,f=-3.6!) USER MOD Set 1.2: A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -54:sc= 0.0216 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 18 ASN : amide:sc= -1.2! C(o=-1.2!,f=-1.9!) USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 THR OG1 : rot -83:sc= 0.953 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.0905 K(o=-0.09,f=-1.9!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 54 THR OG1 : rot 160:sc= -1.59 USER MOD Single : A 57 SER OG : rot -45:sc= 0.0124 USER MOD Single : A 61 TYR OH : rot 39:sc= -4.67! USER MOD Single : A 64 HIS : no HD1:sc= -0.0267 K(o=-0.027,f=-1.5) USER MOD Single : A 69 HIS : no HD1:sc= -0.941 K(o=-0.94,f=-0.38) USER MOD Single : A 70 THR OG1 : rot 72:sc= 0.237 USER MOD Single : A 72 TYR OH : rot -90:sc= -0.327 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -2.26 K(o=-2.3,f=-0.029) USER MOD Single : A 85 THR OG1 : rot 69:sc= -1.68 USER MOD Single : A 86 SER OG : rot 13:sc= 0.172 USER MOD Single : A 89 SER OG : rot 73:sc= 1.12 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 126:sc= 1.26 USER MOD Single : A 105 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0755) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.883 -7.564 15.922 1.00 0.00 N ATOM 2 CA GLY A 1 -10.386 -8.904 16.155 1.00 0.00 C ATOM 3 C GLY A 1 -9.285 -9.884 16.511 1.00 0.00 C ATOM 4 O GLY A 1 -8.385 -9.561 17.286 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.674 -6.933 15.682 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.411 -7.216 16.781 1.00 0.00 H new ATOM 0 H3 GLY A 1 -9.203 -7.580 15.135 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.120 -8.878 16.961 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.905 -9.254 15.263 1.00 0.00 H new ATOM 8 N SER A 2 -9.357 -11.084 15.945 1.00 0.00 N ATOM 9 CA SER A 2 -8.363 -12.117 16.212 1.00 0.00 C ATOM 10 C SER A 2 -7.077 -11.844 15.437 1.00 0.00 C ATOM 11 O SER A 2 -7.048 -11.007 14.535 1.00 0.00 O ATOM 12 CB SER A 2 -8.913 -13.495 15.840 1.00 0.00 C ATOM 13 OG SER A 2 -9.880 -13.928 16.781 1.00 0.00 O ATOM 0 H SER A 2 -10.094 -11.365 15.298 1.00 0.00 H new ATOM 0 HA SER A 2 -8.136 -12.101 17.278 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.360 -13.456 14.846 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.097 -14.216 15.794 1.00 0.00 H new ATOM 0 HG SER A 2 -10.218 -14.810 16.520 1.00 0.00 H new ATOM 19 N SER A 3 -6.014 -12.557 15.796 1.00 0.00 N ATOM 20 CA SER A 3 -4.724 -12.392 15.138 1.00 0.00 C ATOM 21 C SER A 3 -4.796 -12.836 13.680 1.00 0.00 C ATOM 22 O SER A 3 -4.369 -12.116 12.779 1.00 0.00 O ATOM 23 CB SER A 3 -3.646 -13.190 15.873 1.00 0.00 C ATOM 24 OG SER A 3 -3.330 -12.593 17.120 1.00 0.00 O ATOM 0 H SER A 3 -6.021 -13.255 16.540 1.00 0.00 H new ATOM 0 HA SER A 3 -4.464 -11.334 15.165 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.991 -14.212 16.032 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.749 -13.249 15.257 1.00 0.00 H new ATOM 0 HG SER A 3 -2.640 -13.123 17.571 1.00 0.00 H new ATOM 30 N GLY A 4 -5.342 -14.027 13.458 1.00 0.00 N ATOM 31 CA GLY A 4 -5.461 -14.548 12.108 1.00 0.00 C ATOM 32 C GLY A 4 -5.493 -16.063 12.072 1.00 0.00 C ATOM 33 O GLY A 4 -6.328 -16.689 12.726 1.00 0.00 O ATOM 0 H GLY A 4 -5.704 -14.641 14.188 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.370 -14.157 11.650 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.623 -14.191 11.509 1.00 0.00 H new ATOM 37 N SER A 5 -4.583 -16.654 11.305 1.00 0.00 N ATOM 38 CA SER A 5 -4.514 -18.106 11.182 1.00 0.00 C ATOM 39 C SER A 5 -3.135 -18.620 11.586 1.00 0.00 C ATOM 40 O SER A 5 -2.234 -17.839 11.891 1.00 0.00 O ATOM 41 CB SER A 5 -4.829 -18.533 9.747 1.00 0.00 C ATOM 42 OG SER A 5 -3.881 -18.003 8.837 1.00 0.00 O ATOM 0 H SER A 5 -3.883 -16.151 10.759 1.00 0.00 H new ATOM 0 HA SER A 5 -5.256 -18.539 11.853 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.833 -19.621 9.681 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.828 -18.194 9.474 1.00 0.00 H new ATOM 0 HG SER A 5 -4.104 -18.292 7.927 1.00 0.00 H new ATOM 48 N SER A 6 -2.979 -19.940 11.585 1.00 0.00 N ATOM 49 CA SER A 6 -1.712 -20.560 11.954 1.00 0.00 C ATOM 50 C SER A 6 -0.822 -20.748 10.730 1.00 0.00 C ATOM 51 O SER A 6 -0.168 -21.780 10.576 1.00 0.00 O ATOM 52 CB SER A 6 -1.959 -21.910 12.632 1.00 0.00 C ATOM 53 OG SER A 6 -0.837 -22.309 13.400 1.00 0.00 O ATOM 0 H SER A 6 -3.714 -20.601 11.333 1.00 0.00 H new ATOM 0 HA SER A 6 -1.202 -19.898 12.654 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.837 -21.843 13.274 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.174 -22.666 11.877 1.00 0.00 H new ATOM 0 HG SER A 6 -0.035 -22.302 12.836 1.00 0.00 H new ATOM 59 N GLY A 7 -0.800 -19.742 9.860 1.00 0.00 N ATOM 60 CA GLY A 7 0.012 -19.816 8.661 1.00 0.00 C ATOM 61 C GLY A 7 -0.824 -19.902 7.399 1.00 0.00 C ATOM 62 O GLY A 7 -1.129 -20.987 6.904 1.00 0.00 O ATOM 0 H GLY A 7 -1.331 -18.877 9.965 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.656 -18.938 8.607 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.665 -20.687 8.721 1.00 0.00 H new ATOM 66 N PRO A 8 -1.208 -18.736 6.859 1.00 0.00 N ATOM 67 CA PRO A 8 -2.020 -18.658 5.641 1.00 0.00 C ATOM 68 C PRO A 8 -1.246 -19.089 4.400 1.00 0.00 C ATOM 69 O PRO A 8 -0.188 -19.711 4.502 1.00 0.00 O ATOM 70 CB PRO A 8 -2.386 -17.174 5.553 1.00 0.00 C ATOM 71 CG PRO A 8 -1.301 -16.472 6.294 1.00 0.00 C ATOM 72 CD PRO A 8 -0.880 -17.405 7.396 1.00 0.00 C ATOM 0 HA PRO A 8 -2.883 -19.323 5.683 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.438 -16.840 4.517 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.361 -16.979 6.000 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.463 -16.243 5.635 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.655 -15.524 6.699 1.00 0.00 H new ATOM 0 HD2 PRO A 8 0.183 -17.312 7.617 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -1.417 -17.202 8.322 1.00 0.00 H new ATOM 80 N ASP A 9 -1.780 -18.756 3.230 1.00 0.00 N ATOM 81 CA ASP A 9 -1.139 -19.108 1.969 1.00 0.00 C ATOM 82 C ASP A 9 -0.820 -17.858 1.153 1.00 0.00 C ATOM 83 O ASP A 9 -0.013 -17.899 0.226 1.00 0.00 O ATOM 84 CB ASP A 9 -2.035 -20.045 1.159 1.00 0.00 C ATOM 85 CG ASP A 9 -2.619 -21.160 2.004 1.00 0.00 C ATOM 86 OD1 ASP A 9 -1.885 -21.707 2.853 1.00 0.00 O ATOM 87 OD2 ASP A 9 -3.811 -21.487 1.816 1.00 0.00 O ATOM 0 H ASP A 9 -2.656 -18.243 3.129 1.00 0.00 H new ATOM 0 HA ASP A 9 -0.204 -19.620 2.197 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -2.845 -19.470 0.710 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -1.459 -20.477 0.341 1.00 0.00 H new ATOM 92 N GLY A 10 -1.463 -16.748 1.505 1.00 0.00 N ATOM 93 CA GLY A 10 -1.236 -15.503 0.795 1.00 0.00 C ATOM 94 C GLY A 10 -0.238 -14.607 1.501 1.00 0.00 C ATOM 95 O GLY A 10 0.427 -15.013 2.456 1.00 0.00 O ATOM 0 H GLY A 10 -2.137 -16.689 2.269 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.876 -15.722 -0.210 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.182 -14.973 0.686 1.00 0.00 H new ATOM 99 N PRO A 11 -0.121 -13.357 1.029 1.00 0.00 N ATOM 100 CA PRO A 11 0.802 -12.376 1.606 1.00 0.00 C ATOM 101 C PRO A 11 0.365 -11.915 2.993 1.00 0.00 C ATOM 102 O PRO A 11 -0.817 -11.673 3.236 1.00 0.00 O ATOM 103 CB PRO A 11 0.746 -11.210 0.614 1.00 0.00 C ATOM 104 CG PRO A 11 -0.586 -11.332 -0.039 1.00 0.00 C ATOM 105 CD PRO A 11 -0.882 -12.806 -0.105 1.00 0.00 C ATOM 0 HA PRO A 11 1.801 -12.789 1.745 1.00 0.00 H new ATOM 0 HB2 PRO A 11 0.851 -10.252 1.123 1.00 0.00 H new ATOM 0 HB3 PRO A 11 1.552 -11.273 -0.117 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -1.350 -10.806 0.533 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -0.574 -10.891 -1.036 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -1.949 -13.006 -0.008 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -0.561 -13.238 -1.053 1.00 0.00 H new ATOM 113 N THR A 12 1.329 -11.797 3.902 1.00 0.00 N ATOM 114 CA THR A 12 1.044 -11.366 5.265 1.00 0.00 C ATOM 115 C THR A 12 2.065 -10.339 5.742 1.00 0.00 C ATOM 116 O THR A 12 3.135 -10.195 5.151 1.00 0.00 O ATOM 117 CB THR A 12 1.037 -12.558 6.241 1.00 0.00 C ATOM 118 OG1 THR A 12 2.321 -13.193 6.247 1.00 0.00 O ATOM 119 CG2 THR A 12 -0.032 -13.568 5.853 1.00 0.00 C ATOM 0 H THR A 12 2.313 -11.994 3.719 1.00 0.00 H new ATOM 0 HA THR A 12 0.054 -10.911 5.252 1.00 0.00 H new ATOM 0 HB THR A 12 0.813 -12.181 7.239 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.309 -13.949 6.871 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.018 -14.401 6.556 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.011 -13.089 5.877 1.00 0.00 H new ATOM 0 HG23 THR A 12 0.166 -13.939 4.847 1.00 0.00 H new ATOM 127 N GLN A 13 1.728 -9.630 6.814 1.00 0.00 N ATOM 128 CA GLN A 13 2.617 -8.616 7.369 1.00 0.00 C ATOM 129 C GLN A 13 2.885 -7.512 6.352 1.00 0.00 C ATOM 130 O GLN A 13 3.992 -6.977 6.279 1.00 0.00 O ATOM 131 CB GLN A 13 3.937 -9.252 7.810 1.00 0.00 C ATOM 132 CG GLN A 13 3.759 -10.426 8.759 1.00 0.00 C ATOM 133 CD GLN A 13 3.526 -9.988 10.192 1.00 0.00 C ATOM 134 OE1 GLN A 13 2.493 -9.401 10.513 1.00 0.00 O ATOM 135 NE2 GLN A 13 4.488 -10.273 11.062 1.00 0.00 N ATOM 0 H GLN A 13 0.846 -9.739 7.315 1.00 0.00 H new ATOM 0 HA GLN A 13 2.127 -8.174 8.237 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.482 -9.588 6.928 1.00 0.00 H new ATOM 0 HB3 GLN A 13 4.552 -8.494 8.295 1.00 0.00 H new ATOM 0 HG2 GLN A 13 2.916 -11.032 8.427 1.00 0.00 H new ATOM 0 HG3 GLN A 13 4.644 -11.060 8.716 1.00 0.00 H new ATOM 0 HE21 GLN A 13 5.328 -10.761 10.752 1.00 0.00 H new ATOM 0 HE22 GLN A 13 4.387 -10.004 12.041 1.00 0.00 H new ATOM 144 N LEU A 14 1.867 -7.173 5.570 1.00 0.00 N ATOM 145 CA LEU A 14 1.992 -6.133 4.557 1.00 0.00 C ATOM 146 C LEU A 14 2.358 -4.794 5.193 1.00 0.00 C ATOM 147 O LEU A 14 1.541 -4.178 5.878 1.00 0.00 O ATOM 148 CB LEU A 14 0.686 -5.997 3.772 1.00 0.00 C ATOM 149 CG LEU A 14 0.784 -5.279 2.425 1.00 0.00 C ATOM 150 CD1 LEU A 14 1.237 -6.243 1.339 1.00 0.00 C ATOM 151 CD2 LEU A 14 -0.551 -4.649 2.058 1.00 0.00 C ATOM 0 H LEU A 14 0.944 -7.604 5.619 1.00 0.00 H new ATOM 0 HA LEU A 14 2.791 -6.421 3.874 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.283 -6.995 3.601 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.034 -5.465 4.393 1.00 0.00 H new ATOM 0 HG LEU A 14 1.526 -4.485 2.511 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.301 -5.715 0.388 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.216 -6.647 1.596 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.519 -7.059 1.254 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.462 -4.143 1.097 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.313 -5.425 1.990 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.835 -3.927 2.824 1.00 0.00 H new ATOM 163 N ARG A 15 3.588 -4.351 4.960 1.00 0.00 N ATOM 164 CA ARG A 15 4.061 -3.086 5.509 1.00 0.00 C ATOM 165 C ARG A 15 4.432 -2.114 4.394 1.00 0.00 C ATOM 166 O ARG A 15 4.801 -2.526 3.294 1.00 0.00 O ATOM 167 CB ARG A 15 5.269 -3.320 6.419 1.00 0.00 C ATOM 168 CG ARG A 15 5.387 -2.308 7.546 1.00 0.00 C ATOM 169 CD ARG A 15 6.422 -2.737 8.575 1.00 0.00 C ATOM 170 NE ARG A 15 6.587 -1.745 9.632 1.00 0.00 N ATOM 171 CZ ARG A 15 7.666 -1.666 10.405 1.00 0.00 C ATOM 172 NH1 ARG A 15 8.670 -2.516 10.236 1.00 0.00 N ATOM 173 NH2 ARG A 15 7.743 -0.734 11.346 1.00 0.00 N ATOM 0 H ARG A 15 4.276 -4.849 4.395 1.00 0.00 H new ATOM 0 HA ARG A 15 3.253 -2.648 6.095 1.00 0.00 H new ATOM 0 HB2 ARG A 15 5.203 -4.321 6.846 1.00 0.00 H new ATOM 0 HB3 ARG A 15 6.178 -3.289 5.818 1.00 0.00 H new ATOM 0 HG2 ARG A 15 5.661 -1.336 7.136 1.00 0.00 H new ATOM 0 HG3 ARG A 15 4.418 -2.188 8.031 1.00 0.00 H new ATOM 0 HD2 ARG A 15 6.123 -3.689 9.015 1.00 0.00 H new ATOM 0 HD3 ARG A 15 7.379 -2.901 8.080 1.00 0.00 H new ATOM 0 HE ARG A 15 5.833 -1.075 9.786 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.615 -3.232 9.512 1.00 0.00 H new ATOM 0 HH12 ARG A 15 9.497 -2.453 10.830 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.974 -0.077 11.477 1.00 0.00 H new ATOM 0 HH22 ARG A 15 8.571 -0.675 11.938 1.00 0.00 H new ATOM 187 N ALA A 16 4.332 -0.821 4.685 1.00 0.00 N ATOM 188 CA ALA A 16 4.659 0.210 3.707 1.00 0.00 C ATOM 189 C ALA A 16 6.027 0.821 3.990 1.00 0.00 C ATOM 190 O ALA A 16 6.219 1.496 5.003 1.00 0.00 O ATOM 191 CB ALA A 16 3.587 1.290 3.701 1.00 0.00 C ATOM 0 H ALA A 16 4.027 -0.462 5.590 1.00 0.00 H new ATOM 0 HA ALA A 16 4.695 -0.256 2.722 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.844 2.053 2.966 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.625 0.847 3.443 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.523 1.745 4.690 1.00 0.00 H new ATOM 197 N LEU A 17 6.974 0.581 3.091 1.00 0.00 N ATOM 198 CA LEU A 17 8.326 1.108 3.244 1.00 0.00 C ATOM 199 C LEU A 17 8.355 2.614 3.001 1.00 0.00 C ATOM 200 O LEU A 17 7.368 3.199 2.556 1.00 0.00 O ATOM 201 CB LEU A 17 9.281 0.406 2.278 1.00 0.00 C ATOM 202 CG LEU A 17 8.952 0.543 0.790 1.00 0.00 C ATOM 203 CD1 LEU A 17 9.238 1.957 0.309 1.00 0.00 C ATOM 204 CD2 LEU A 17 9.742 -0.469 -0.026 1.00 0.00 C ATOM 0 H LEU A 17 6.831 0.025 2.248 1.00 0.00 H new ATOM 0 HA LEU A 17 8.649 0.918 4.267 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.285 0.795 2.445 1.00 0.00 H new ATOM 0 HB3 LEU A 17 9.304 -0.655 2.528 1.00 0.00 H new ATOM 0 HG LEU A 17 7.890 0.341 0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 17 8.998 2.036 -0.751 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.628 2.663 0.873 1.00 0.00 H new ATOM 0 HD13 LEU A 17 10.293 2.187 0.461 1.00 0.00 H new ATOM 0 HD21 LEU A 17 9.495 -0.357 -1.082 1.00 0.00 H new ATOM 0 HD22 LEU A 17 10.809 -0.299 0.117 1.00 0.00 H new ATOM 0 HD23 LEU A 17 9.488 -1.477 0.301 1.00 0.00 H new ATOM 216 N ASN A 18 9.493 3.234 3.294 1.00 0.00 N ATOM 217 CA ASN A 18 9.651 4.672 3.106 1.00 0.00 C ATOM 218 C ASN A 18 9.712 5.022 1.622 1.00 0.00 C ATOM 219 O ASN A 18 10.639 4.623 0.917 1.00 0.00 O ATOM 220 CB ASN A 18 10.917 5.163 3.810 1.00 0.00 C ATOM 221 CG ASN A 18 12.145 5.067 2.926 1.00 0.00 C ATOM 222 OD1 ASN A 18 12.436 5.976 2.147 1.00 0.00 O ATOM 223 ND2 ASN A 18 12.872 3.962 3.042 1.00 0.00 N ATOM 0 H ASN A 18 10.320 2.764 3.663 1.00 0.00 H new ATOM 0 HA ASN A 18 8.785 5.169 3.543 1.00 0.00 H new ATOM 0 HB2 ASN A 18 10.778 6.198 4.122 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.077 4.576 4.714 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.709 3.840 2.472 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.593 3.235 3.701 1.00 0.00 H new ATOM 230 N LEU A 19 8.719 5.772 1.156 1.00 0.00 N ATOM 231 CA LEU A 19 8.659 6.177 -0.244 1.00 0.00 C ATOM 232 C LEU A 19 9.787 7.149 -0.578 1.00 0.00 C ATOM 233 O LEU A 19 9.825 8.271 -0.075 1.00 0.00 O ATOM 234 CB LEU A 19 7.307 6.824 -0.551 1.00 0.00 C ATOM 235 CG LEU A 19 6.090 6.182 0.117 1.00 0.00 C ATOM 236 CD1 LEU A 19 4.807 6.841 -0.368 1.00 0.00 C ATOM 237 CD2 LEU A 19 6.059 4.686 -0.156 1.00 0.00 C ATOM 0 H LEU A 19 7.945 6.112 1.727 1.00 0.00 H new ATOM 0 HA LEU A 19 8.777 5.285 -0.860 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.351 7.871 -0.251 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.155 6.808 -1.630 1.00 0.00 H new ATOM 0 HG LEU A 19 6.168 6.333 1.194 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.951 6.372 0.117 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.827 7.902 -0.121 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.722 6.721 -1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.186 4.246 0.327 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.004 4.513 -1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.964 4.225 0.240 1.00 0.00 H new ATOM 249 N THR A 20 10.707 6.709 -1.432 1.00 0.00 N ATOM 250 CA THR A 20 11.835 7.539 -1.834 1.00 0.00 C ATOM 251 C THR A 20 11.361 8.823 -2.505 1.00 0.00 C ATOM 252 O THR A 20 11.398 9.897 -1.903 1.00 0.00 O ATOM 253 CB THR A 20 12.770 6.785 -2.800 1.00 0.00 C ATOM 254 OG1 THR A 20 13.391 7.709 -3.700 1.00 0.00 O ATOM 255 CG2 THR A 20 12.002 5.737 -3.590 1.00 0.00 C ATOM 0 H THR A 20 10.692 5.782 -1.858 1.00 0.00 H new ATOM 0 HA THR A 20 12.384 7.788 -0.926 1.00 0.00 H new ATOM 0 HB THR A 20 13.536 6.282 -2.211 1.00 0.00 H new ATOM 0 HG1 THR A 20 13.985 7.223 -4.310 1.00 0.00 H new ATOM 0 HG21 THR A 20 12.683 5.218 -4.265 1.00 0.00 H new ATOM 0 HG22 THR A 20 11.555 5.019 -2.903 1.00 0.00 H new ATOM 0 HG23 THR A 20 11.216 6.222 -4.170 1.00 0.00 H new ATOM 263 N GLU A 21 10.917 8.707 -3.752 1.00 0.00 N ATOM 264 CA GLU A 21 10.436 9.861 -4.502 1.00 0.00 C ATOM 265 C GLU A 21 8.922 9.802 -4.681 1.00 0.00 C ATOM 266 O GLU A 21 8.424 9.345 -5.709 1.00 0.00 O ATOM 267 CB GLU A 21 11.120 9.929 -5.869 1.00 0.00 C ATOM 268 CG GLU A 21 10.926 11.258 -6.580 1.00 0.00 C ATOM 269 CD GLU A 21 11.606 11.299 -7.935 1.00 0.00 C ATOM 270 OE1 GLU A 21 11.325 10.409 -8.766 1.00 0.00 O ATOM 271 OE2 GLU A 21 12.418 12.219 -8.165 1.00 0.00 O ATOM 0 H GLU A 21 10.880 7.826 -4.264 1.00 0.00 H new ATOM 0 HA GLU A 21 10.682 10.759 -3.935 1.00 0.00 H new ATOM 0 HB2 GLU A 21 12.187 9.747 -5.742 1.00 0.00 H new ATOM 0 HB3 GLU A 21 10.733 9.129 -6.500 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.860 11.446 -6.707 1.00 0.00 H new ATOM 0 HG3 GLU A 21 11.319 12.061 -5.956 1.00 0.00 H new ATOM 278 N GLY A 22 8.193 10.267 -3.670 1.00 0.00 N ATOM 279 CA GLY A 22 6.744 10.257 -3.734 1.00 0.00 C ATOM 280 C GLY A 22 6.204 9.041 -4.460 1.00 0.00 C ATOM 281 O GLY A 22 5.160 9.109 -5.110 1.00 0.00 O ATOM 0 H GLY A 22 8.581 10.650 -2.808 1.00 0.00 H new ATOM 0 HA2 GLY A 22 6.339 10.282 -2.723 1.00 0.00 H new ATOM 0 HA3 GLY A 22 6.399 11.160 -4.238 1.00 0.00 H new ATOM 285 N PHE A 23 6.916 7.925 -4.353 1.00 0.00 N ATOM 286 CA PHE A 23 6.505 6.688 -5.007 1.00 0.00 C ATOM 287 C PHE A 23 6.008 5.671 -3.984 1.00 0.00 C ATOM 288 O PHE A 23 6.794 5.105 -3.225 1.00 0.00 O ATOM 289 CB PHE A 23 7.666 6.098 -5.808 1.00 0.00 C ATOM 290 CG PHE A 23 7.227 5.309 -7.008 1.00 0.00 C ATOM 291 CD1 PHE A 23 6.264 5.809 -7.869 1.00 0.00 C ATOM 292 CD2 PHE A 23 7.778 4.066 -7.276 1.00 0.00 C ATOM 293 CE1 PHE A 23 5.858 5.086 -8.974 1.00 0.00 C ATOM 294 CE2 PHE A 23 7.376 3.338 -8.379 1.00 0.00 C ATOM 295 CZ PHE A 23 6.415 3.848 -9.229 1.00 0.00 C ATOM 0 H PHE A 23 7.782 7.851 -3.819 1.00 0.00 H new ATOM 0 HA PHE A 23 5.686 6.922 -5.688 1.00 0.00 H new ATOM 0 HB2 PHE A 23 8.320 6.907 -6.134 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.256 5.454 -5.156 1.00 0.00 H new ATOM 0 HD1 PHE A 23 5.825 6.776 -7.674 1.00 0.00 H new ATOM 0 HD2 PHE A 23 8.530 3.662 -6.615 1.00 0.00 H new ATOM 0 HE1 PHE A 23 5.106 5.488 -9.637 1.00 0.00 H new ATOM 0 HE2 PHE A 23 7.813 2.370 -8.576 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.099 3.280 -10.092 1.00 0.00 H new ATOM 305 N ALA A 24 4.698 5.445 -3.970 1.00 0.00 N ATOM 306 CA ALA A 24 4.097 4.495 -3.042 1.00 0.00 C ATOM 307 C ALA A 24 4.167 3.073 -3.589 1.00 0.00 C ATOM 308 O ALA A 24 3.768 2.814 -4.724 1.00 0.00 O ATOM 309 CB ALA A 24 2.654 4.882 -2.753 1.00 0.00 C ATOM 0 H ALA A 24 4.033 5.907 -4.591 1.00 0.00 H new ATOM 0 HA ALA A 24 4.663 4.525 -2.111 1.00 0.00 H new ATOM 0 HB1 ALA A 24 2.217 4.164 -2.059 1.00 0.00 H new ATOM 0 HB2 ALA A 24 2.626 5.878 -2.311 1.00 0.00 H new ATOM 0 HB3 ALA A 24 2.084 4.881 -3.682 1.00 0.00 H new ATOM 315 N VAL A 25 4.677 2.155 -2.775 1.00 0.00 N ATOM 316 CA VAL A 25 4.798 0.759 -3.178 1.00 0.00 C ATOM 317 C VAL A 25 4.329 -0.176 -2.069 1.00 0.00 C ATOM 318 O VAL A 25 4.306 0.197 -0.895 1.00 0.00 O ATOM 319 CB VAL A 25 6.251 0.407 -3.550 1.00 0.00 C ATOM 320 CG1 VAL A 25 6.897 1.548 -4.321 1.00 0.00 C ATOM 321 CG2 VAL A 25 7.055 0.074 -2.302 1.00 0.00 C ATOM 0 H VAL A 25 5.013 2.353 -1.832 1.00 0.00 H new ATOM 0 HA VAL A 25 4.163 0.626 -4.054 1.00 0.00 H new ATOM 0 HB VAL A 25 6.239 -0.473 -4.193 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.923 1.281 -4.575 1.00 0.00 H new ATOM 0 HG12 VAL A 25 6.334 1.734 -5.235 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.898 2.448 -3.706 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.079 -0.172 -2.584 1.00 0.00 H new ATOM 0 HG22 VAL A 25 7.060 0.934 -1.632 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.603 -0.779 -1.795 1.00 0.00 H new ATOM 331 N LEU A 26 3.955 -1.393 -2.447 1.00 0.00 N ATOM 332 CA LEU A 26 3.486 -2.383 -1.484 1.00 0.00 C ATOM 333 C LEU A 26 4.596 -3.367 -1.129 1.00 0.00 C ATOM 334 O LEU A 26 5.506 -3.605 -1.924 1.00 0.00 O ATOM 335 CB LEU A 26 2.281 -3.139 -2.047 1.00 0.00 C ATOM 336 CG LEU A 26 0.956 -2.377 -2.061 1.00 0.00 C ATOM 337 CD1 LEU A 26 -0.071 -3.104 -2.913 1.00 0.00 C ATOM 338 CD2 LEU A 26 0.436 -2.185 -0.644 1.00 0.00 C ATOM 0 H LEU A 26 3.967 -1.718 -3.414 1.00 0.00 H new ATOM 0 HA LEU A 26 3.188 -1.858 -0.577 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.513 -3.443 -3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 26 2.146 -4.051 -1.466 1.00 0.00 H new ATOM 0 HG LEU A 26 1.130 -1.394 -2.500 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.007 -2.546 -2.910 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.298 -3.188 -3.935 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.242 -4.101 -2.506 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.508 -1.641 -0.673 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.279 -3.158 -0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 26 1.164 -1.618 -0.063 1.00 0.00 H new ATOM 350 N HIS A 27 4.516 -3.935 0.069 1.00 0.00 N ATOM 351 CA HIS A 27 5.512 -4.895 0.529 1.00 0.00 C ATOM 352 C HIS A 27 4.856 -6.028 1.311 1.00 0.00 C ATOM 353 O HIS A 27 4.231 -5.800 2.348 1.00 0.00 O ATOM 354 CB HIS A 27 6.559 -4.199 1.400 1.00 0.00 C ATOM 355 CG HIS A 27 7.913 -4.832 1.332 1.00 0.00 C ATOM 356 ND1 HIS A 27 8.389 -5.696 2.296 1.00 0.00 N ATOM 357 CD2 HIS A 27 8.895 -4.726 0.407 1.00 0.00 C ATOM 358 CE1 HIS A 27 9.606 -6.093 1.967 1.00 0.00 C ATOM 359 NE2 HIS A 27 9.936 -5.518 0.824 1.00 0.00 N ATOM 0 H HIS A 27 3.771 -3.747 0.740 1.00 0.00 H new ATOM 0 HA HIS A 27 6.002 -5.319 -0.348 1.00 0.00 H new ATOM 0 HB2 HIS A 27 6.639 -3.156 1.093 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.218 -4.202 2.435 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.865 -4.129 -0.493 1.00 0.00 H new ATOM 0 HE1 HIS A 27 10.225 -6.771 2.535 1.00 0.00 H new ATOM 0 HE2 HIS A 27 10.821 -5.642 0.331 1.00 0.00 H new ATOM 368 N TRP A 28 4.999 -7.249 0.808 1.00 0.00 N ATOM 369 CA TRP A 28 4.420 -8.418 1.460 1.00 0.00 C ATOM 370 C TRP A 28 5.461 -9.518 1.633 1.00 0.00 C ATOM 371 O TRP A 28 6.431 -9.593 0.878 1.00 0.00 O ATOM 372 CB TRP A 28 3.235 -8.944 0.648 1.00 0.00 C ATOM 373 CG TRP A 28 3.624 -9.463 -0.703 1.00 0.00 C ATOM 374 CD1 TRP A 28 4.439 -10.525 -0.970 1.00 0.00 C ATOM 375 CD2 TRP A 28 3.215 -8.940 -1.972 1.00 0.00 C ATOM 376 NE1 TRP A 28 4.562 -10.694 -2.328 1.00 0.00 N ATOM 377 CE2 TRP A 28 3.820 -9.735 -2.965 1.00 0.00 C ATOM 378 CE3 TRP A 28 2.394 -7.879 -2.366 1.00 0.00 C ATOM 379 CZ2 TRP A 28 3.630 -9.501 -4.324 1.00 0.00 C ATOM 380 CZ3 TRP A 28 2.207 -7.647 -3.715 1.00 0.00 C ATOM 381 CH2 TRP A 28 2.822 -8.456 -4.681 1.00 0.00 C ATOM 0 H TRP A 28 5.511 -7.455 -0.050 1.00 0.00 H new ATOM 0 HA TRP A 28 4.071 -8.116 2.448 1.00 0.00 H new ATOM 0 HB2 TRP A 28 2.745 -9.741 1.208 1.00 0.00 H new ATOM 0 HB3 TRP A 28 2.504 -8.145 0.526 1.00 0.00 H new ATOM 0 HD1 TRP A 28 4.917 -11.142 -0.223 1.00 0.00 H new ATOM 0 HE1 TRP A 28 5.116 -11.417 -2.787 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.915 -7.252 -1.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 4.103 -10.122 -5.070 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 1.577 -6.829 -4.031 1.00 0.00 H new ATOM 0 HH2 TRP A 28 2.655 -8.250 -5.728 1.00 0.00 H new ATOM 392 N LYS A 29 5.254 -10.370 2.631 1.00 0.00 N ATOM 393 CA LYS A 29 6.175 -11.468 2.903 1.00 0.00 C ATOM 394 C LYS A 29 5.700 -12.754 2.234 1.00 0.00 C ATOM 395 O LYS A 29 4.560 -13.185 2.401 1.00 0.00 O ATOM 396 CB LYS A 29 6.310 -11.686 4.412 1.00 0.00 C ATOM 397 CG LYS A 29 7.512 -12.528 4.799 1.00 0.00 C ATOM 398 CD LYS A 29 7.937 -12.267 6.235 1.00 0.00 C ATOM 399 CE LYS A 29 8.937 -11.123 6.321 1.00 0.00 C ATOM 400 NZ LYS A 29 10.339 -11.601 6.165 1.00 0.00 N ATOM 0 H LYS A 29 4.457 -10.322 3.265 1.00 0.00 H new ATOM 0 HA LYS A 29 7.149 -11.203 2.492 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.382 -10.717 4.906 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.405 -12.167 4.784 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.272 -13.584 4.676 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.342 -12.309 4.127 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.060 -12.031 6.838 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.379 -13.171 6.655 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.715 -10.388 5.547 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.830 -10.618 7.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.990 -10.793 6.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.559 -12.284 6.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.448 -12.061 5.238 1.00 0.00 H new ATOM 414 N PRO A 30 6.596 -13.383 1.458 1.00 0.00 N ATOM 415 CA PRO A 30 6.293 -14.630 0.749 1.00 0.00 C ATOM 416 C PRO A 30 6.137 -15.813 1.698 1.00 0.00 C ATOM 417 O PRO A 30 7.048 -16.159 2.451 1.00 0.00 O ATOM 418 CB PRO A 30 7.509 -14.828 -0.158 1.00 0.00 C ATOM 419 CG PRO A 30 8.614 -14.101 0.526 1.00 0.00 C ATOM 420 CD PRO A 30 7.974 -12.926 1.213 1.00 0.00 C ATOM 0 HA PRO A 30 5.348 -14.572 0.209 1.00 0.00 H new ATOM 0 HB2 PRO A 30 7.745 -15.885 -0.278 1.00 0.00 H new ATOM 0 HB3 PRO A 30 7.329 -14.427 -1.155 1.00 0.00 H new ATOM 0 HG2 PRO A 30 9.119 -14.746 1.245 1.00 0.00 H new ATOM 0 HG3 PRO A 30 9.367 -13.772 -0.190 1.00 0.00 H new ATOM 0 HD2 PRO A 30 8.486 -12.676 2.142 1.00 0.00 H new ATOM 0 HD3 PRO A 30 7.996 -12.034 0.587 1.00 0.00 H new ATOM 428 N PRO A 31 4.957 -16.450 1.664 1.00 0.00 N ATOM 429 CA PRO A 31 4.656 -17.605 2.515 1.00 0.00 C ATOM 430 C PRO A 31 5.448 -18.844 2.111 1.00 0.00 C ATOM 431 O PRO A 31 6.093 -18.865 1.064 1.00 0.00 O ATOM 432 CB PRO A 31 3.160 -17.831 2.290 1.00 0.00 C ATOM 433 CG PRO A 31 2.888 -17.257 0.942 1.00 0.00 C ATOM 434 CD PRO A 31 3.827 -16.092 0.791 1.00 0.00 C ATOM 0 HA PRO A 31 4.922 -17.424 3.557 1.00 0.00 H new ATOM 0 HB2 PRO A 31 2.910 -18.891 2.326 1.00 0.00 H new ATOM 0 HB3 PRO A 31 2.565 -17.337 3.058 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.057 -17.998 0.161 1.00 0.00 H new ATOM 0 HG3 PRO A 31 1.850 -16.935 0.857 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.144 -15.963 -0.244 1.00 0.00 H new ATOM 0 HD3 PRO A 31 3.360 -15.157 1.101 1.00 0.00 H new ATOM 442 N GLN A 32 5.394 -19.875 2.950 1.00 0.00 N ATOM 443 CA GLN A 32 6.107 -21.117 2.679 1.00 0.00 C ATOM 444 C GLN A 32 6.135 -21.414 1.183 1.00 0.00 C ATOM 445 O GLN A 32 7.195 -21.661 0.609 1.00 0.00 O ATOM 446 CB GLN A 32 5.453 -22.279 3.428 1.00 0.00 C ATOM 447 CG GLN A 32 6.059 -23.633 3.100 1.00 0.00 C ATOM 448 CD GLN A 32 5.299 -24.783 3.733 1.00 0.00 C ATOM 449 OE1 GLN A 32 5.499 -25.104 4.905 1.00 0.00 O ATOM 450 NE2 GLN A 32 4.419 -25.408 2.959 1.00 0.00 N ATOM 0 H GLN A 32 4.864 -19.874 3.822 1.00 0.00 H new ATOM 0 HA GLN A 32 7.133 -21.000 3.027 1.00 0.00 H new ATOM 0 HB2 GLN A 32 5.538 -22.103 4.500 1.00 0.00 H new ATOM 0 HB3 GLN A 32 4.389 -22.300 3.192 1.00 0.00 H new ATOM 0 HG2 GLN A 32 6.077 -23.766 2.018 1.00 0.00 H new ATOM 0 HG3 GLN A 32 7.094 -23.655 3.441 1.00 0.00 H new ATOM 0 HE21 GLN A 32 4.286 -25.108 1.993 1.00 0.00 H new ATOM 0 HE22 GLN A 32 3.876 -26.188 3.330 1.00 0.00 H new ATOM 459 N ASN A 33 4.963 -21.387 0.556 1.00 0.00 N ATOM 460 CA ASN A 33 4.854 -21.654 -0.873 1.00 0.00 C ATOM 461 C ASN A 33 4.534 -20.376 -1.642 1.00 0.00 C ATOM 462 O ASN A 33 3.517 -19.721 -1.409 1.00 0.00 O ATOM 463 CB ASN A 33 3.774 -22.705 -1.136 1.00 0.00 C ATOM 464 CG ASN A 33 3.949 -23.391 -2.477 1.00 0.00 C ATOM 465 OD1 ASN A 33 4.599 -24.431 -2.576 1.00 0.00 O ATOM 466 ND2 ASN A 33 3.367 -22.808 -3.519 1.00 0.00 N ATOM 0 H ASN A 33 4.076 -21.183 1.016 1.00 0.00 H new ATOM 0 HA ASN A 33 5.814 -22.035 -1.220 1.00 0.00 H new ATOM 0 HB2 ASN A 33 3.797 -23.452 -0.343 1.00 0.00 H new ATOM 0 HB3 ASN A 33 2.793 -22.231 -1.099 1.00 0.00 H new ATOM 0 HD21 ASN A 33 3.450 -23.223 -4.447 1.00 0.00 H new ATOM 0 HD22 ASN A 33 2.837 -21.946 -3.391 1.00 0.00 H new ATOM 473 N PRO A 34 5.419 -20.013 -2.582 1.00 0.00 N ATOM 474 CA PRO A 34 5.250 -18.812 -3.405 1.00 0.00 C ATOM 475 C PRO A 34 4.102 -18.947 -4.400 1.00 0.00 C ATOM 476 O PRO A 34 4.132 -19.802 -5.285 1.00 0.00 O ATOM 477 CB PRO A 34 6.587 -18.698 -4.143 1.00 0.00 C ATOM 478 CG PRO A 34 7.118 -20.089 -4.182 1.00 0.00 C ATOM 479 CD PRO A 34 6.651 -20.746 -2.913 1.00 0.00 C ATOM 0 HA PRO A 34 5.003 -17.937 -2.804 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.452 -18.298 -5.148 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.271 -18.028 -3.622 1.00 0.00 H new ATOM 0 HG2 PRO A 34 6.748 -20.623 -5.057 1.00 0.00 H new ATOM 0 HG3 PRO A 34 8.206 -20.090 -4.244 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.459 -21.809 -3.058 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.394 -20.662 -2.120 1.00 0.00 H new ATOM 487 N VAL A 35 3.092 -18.096 -4.249 1.00 0.00 N ATOM 488 CA VAL A 35 1.935 -18.120 -5.136 1.00 0.00 C ATOM 489 C VAL A 35 2.352 -17.920 -6.589 1.00 0.00 C ATOM 490 O VAL A 35 3.538 -17.799 -6.894 1.00 0.00 O ATOM 491 CB VAL A 35 0.912 -17.034 -4.752 1.00 0.00 C ATOM 492 CG1 VAL A 35 0.525 -17.159 -3.287 1.00 0.00 C ATOM 493 CG2 VAL A 35 1.469 -15.649 -5.049 1.00 0.00 C ATOM 0 H VAL A 35 3.052 -17.382 -3.522 1.00 0.00 H new ATOM 0 HA VAL A 35 1.472 -19.100 -5.026 1.00 0.00 H new ATOM 0 HB VAL A 35 0.014 -17.176 -5.353 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -0.198 -16.384 -3.034 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.083 -18.139 -3.110 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.413 -17.044 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.733 -14.894 -4.772 1.00 0.00 H new ATOM 0 HG22 VAL A 35 2.383 -15.494 -4.475 1.00 0.00 H new ATOM 0 HG23 VAL A 35 1.690 -15.566 -6.113 1.00 0.00 H new ATOM 503 N ASP A 36 1.367 -17.886 -7.481 1.00 0.00 N ATOM 504 CA ASP A 36 1.631 -17.699 -8.903 1.00 0.00 C ATOM 505 C ASP A 36 1.526 -16.227 -9.286 1.00 0.00 C ATOM 506 O ASP A 36 2.452 -15.656 -9.864 1.00 0.00 O ATOM 507 CB ASP A 36 0.654 -18.527 -9.738 1.00 0.00 C ATOM 508 CG ASP A 36 0.552 -18.036 -11.168 1.00 0.00 C ATOM 509 OD1 ASP A 36 1.358 -18.486 -12.009 1.00 0.00 O ATOM 510 OD2 ASP A 36 -0.332 -17.199 -11.447 1.00 0.00 O ATOM 0 H ASP A 36 0.380 -17.985 -7.244 1.00 0.00 H new ATOM 0 HA ASP A 36 2.647 -18.037 -9.106 1.00 0.00 H new ATOM 0 HB2 ASP A 36 0.973 -19.569 -9.737 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -0.332 -18.495 -9.275 1.00 0.00 H new ATOM 515 N THR A 37 0.391 -15.615 -8.961 1.00 0.00 N ATOM 516 CA THR A 37 0.163 -14.210 -9.273 1.00 0.00 C ATOM 517 C THR A 37 -0.601 -13.514 -8.152 1.00 0.00 C ATOM 518 O THR A 37 -1.587 -14.043 -7.639 1.00 0.00 O ATOM 519 CB THR A 37 -0.620 -14.047 -10.590 1.00 0.00 C ATOM 520 OG1 THR A 37 -1.744 -14.933 -10.605 1.00 0.00 O ATOM 521 CG2 THR A 37 0.273 -14.330 -11.788 1.00 0.00 C ATOM 0 H THR A 37 -0.385 -16.071 -8.481 1.00 0.00 H new ATOM 0 HA THR A 37 1.144 -13.748 -9.382 1.00 0.00 H new ATOM 0 HB THR A 37 -0.971 -13.017 -10.654 1.00 0.00 H new ATOM 0 HG1 THR A 37 -1.454 -15.825 -10.888 1.00 0.00 H new ATOM 0 HG21 THR A 37 -0.301 -14.209 -12.707 1.00 0.00 H new ATOM 0 HG22 THR A 37 1.111 -13.633 -11.790 1.00 0.00 H new ATOM 0 HG23 THR A 37 0.650 -15.351 -11.728 1.00 0.00 H new ATOM 529 N TYR A 38 -0.138 -12.327 -7.776 1.00 0.00 N ATOM 530 CA TYR A 38 -0.777 -11.560 -6.713 1.00 0.00 C ATOM 531 C TYR A 38 -1.821 -10.605 -7.283 1.00 0.00 C ATOM 532 O TYR A 38 -1.532 -9.816 -8.183 1.00 0.00 O ATOM 533 CB TYR A 38 0.270 -10.775 -5.921 1.00 0.00 C ATOM 534 CG TYR A 38 1.205 -11.653 -5.120 1.00 0.00 C ATOM 535 CD1 TYR A 38 0.794 -12.232 -3.925 1.00 0.00 C ATOM 536 CD2 TYR A 38 2.500 -11.902 -5.556 1.00 0.00 C ATOM 537 CE1 TYR A 38 1.645 -13.033 -3.189 1.00 0.00 C ATOM 538 CE2 TYR A 38 3.358 -12.703 -4.827 1.00 0.00 C ATOM 539 CZ TYR A 38 2.926 -13.266 -3.644 1.00 0.00 C ATOM 540 OH TYR A 38 3.777 -14.064 -2.915 1.00 0.00 O ATOM 0 H TYR A 38 0.677 -11.875 -8.191 1.00 0.00 H new ATOM 0 HA TYR A 38 -1.278 -12.261 -6.045 1.00 0.00 H new ATOM 0 HB2 TYR A 38 0.856 -10.168 -6.611 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -0.238 -10.087 -5.245 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -0.209 -12.052 -3.566 1.00 0.00 H new ATOM 0 HD2 TYR A 38 2.842 -11.462 -6.481 1.00 0.00 H new ATOM 0 HE1 TYR A 38 1.309 -13.474 -2.262 1.00 0.00 H new ATOM 0 HE2 TYR A 38 4.361 -12.887 -5.181 1.00 0.00 H new ATOM 0 HH TYR A 38 4.640 -14.127 -3.374 1.00 0.00 H new ATOM 550 N ASP A 39 -3.036 -10.682 -6.752 1.00 0.00 N ATOM 551 CA ASP A 39 -4.124 -9.823 -7.205 1.00 0.00 C ATOM 552 C ASP A 39 -4.246 -8.586 -6.320 1.00 0.00 C ATOM 553 O ASP A 39 -4.695 -8.671 -5.176 1.00 0.00 O ATOM 554 CB ASP A 39 -5.445 -10.596 -7.207 1.00 0.00 C ATOM 555 CG ASP A 39 -6.422 -10.069 -8.239 1.00 0.00 C ATOM 556 OD1 ASP A 39 -6.155 -10.237 -9.448 1.00 0.00 O ATOM 557 OD2 ASP A 39 -7.453 -9.488 -7.840 1.00 0.00 O ATOM 0 H ASP A 39 -3.292 -11.330 -6.007 1.00 0.00 H new ATOM 0 HA ASP A 39 -3.899 -9.499 -8.221 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -5.246 -11.649 -7.404 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -5.899 -10.537 -6.218 1.00 0.00 H new ATOM 562 N ILE A 40 -3.842 -7.440 -6.856 1.00 0.00 N ATOM 563 CA ILE A 40 -3.905 -6.187 -6.115 1.00 0.00 C ATOM 564 C ILE A 40 -5.021 -5.291 -6.643 1.00 0.00 C ATOM 565 O ILE A 40 -5.187 -5.138 -7.853 1.00 0.00 O ATOM 566 CB ILE A 40 -2.570 -5.421 -6.188 1.00 0.00 C ATOM 567 CG1 ILE A 40 -1.441 -6.263 -5.591 1.00 0.00 C ATOM 568 CG2 ILE A 40 -2.683 -4.088 -5.462 1.00 0.00 C ATOM 569 CD1 ILE A 40 -0.759 -7.161 -6.600 1.00 0.00 C ATOM 0 H ILE A 40 -3.468 -7.353 -7.801 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.110 -6.446 -5.076 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.338 -5.224 -7.235 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.699 -5.599 -5.147 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.843 -6.876 -4.784 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.732 -3.559 -5.523 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -3.464 -3.486 -5.927 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.935 -4.264 -4.416 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.030 -7.728 -6.107 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.489 -7.850 -7.026 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -0.327 -6.553 -7.395 1.00 0.00 H new ATOM 581 N GLN A 41 -5.782 -4.701 -5.727 1.00 0.00 N ATOM 582 CA GLN A 41 -6.882 -3.819 -6.101 1.00 0.00 C ATOM 583 C GLN A 41 -6.803 -2.498 -5.344 1.00 0.00 C ATOM 584 O GLN A 41 -6.913 -2.465 -4.119 1.00 0.00 O ATOM 585 CB GLN A 41 -8.224 -4.499 -5.826 1.00 0.00 C ATOM 586 CG GLN A 41 -9.420 -3.717 -6.345 1.00 0.00 C ATOM 587 CD GLN A 41 -10.656 -4.579 -6.505 1.00 0.00 C ATOM 588 OE1 GLN A 41 -10.577 -5.808 -6.482 1.00 0.00 O ATOM 589 NE2 GLN A 41 -11.808 -3.939 -6.669 1.00 0.00 N ATOM 0 H GLN A 41 -5.657 -4.817 -4.721 1.00 0.00 H new ATOM 0 HA GLN A 41 -6.800 -3.610 -7.168 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -8.221 -5.488 -6.284 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.334 -4.645 -4.751 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.639 -2.898 -5.660 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.167 -3.269 -7.306 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.828 -2.919 -6.682 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.673 -4.467 -6.782 1.00 0.00 H new ATOM 598 N VAL A 42 -6.609 -1.410 -6.082 1.00 0.00 N ATOM 599 CA VAL A 42 -6.515 -0.084 -5.481 1.00 0.00 C ATOM 600 C VAL A 42 -7.750 0.751 -5.796 1.00 0.00 C ATOM 601 O VAL A 42 -8.211 0.793 -6.937 1.00 0.00 O ATOM 602 CB VAL A 42 -5.262 0.666 -5.969 1.00 0.00 C ATOM 603 CG1 VAL A 42 -5.100 1.980 -5.220 1.00 0.00 C ATOM 604 CG2 VAL A 42 -4.024 -0.203 -5.812 1.00 0.00 C ATOM 0 H VAL A 42 -6.514 -1.420 -7.097 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.445 -0.229 -4.403 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.386 0.892 -7.028 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.209 2.496 -5.579 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.975 2.606 -5.391 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -4.999 1.781 -4.153 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -3.149 0.344 -6.162 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.893 -0.463 -4.762 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.142 -1.114 -6.400 1.00 0.00 H new ATOM 614 N THR A 43 -8.285 1.417 -4.776 1.00 0.00 N ATOM 615 CA THR A 43 -9.467 2.251 -4.943 1.00 0.00 C ATOM 616 C THR A 43 -9.428 3.455 -4.008 1.00 0.00 C ATOM 617 O THR A 43 -8.649 3.487 -3.056 1.00 0.00 O ATOM 618 CB THR A 43 -10.759 1.454 -4.680 1.00 0.00 C ATOM 619 OG1 THR A 43 -10.824 1.066 -3.303 1.00 0.00 O ATOM 620 CG2 THR A 43 -10.819 0.216 -5.563 1.00 0.00 C ATOM 0 H THR A 43 -7.917 1.394 -3.825 1.00 0.00 H new ATOM 0 HA THR A 43 -9.465 2.597 -5.977 1.00 0.00 H new ATOM 0 HB THR A 43 -11.609 2.094 -4.917 1.00 0.00 H new ATOM 0 HG1 THR A 43 -11.649 0.561 -3.144 1.00 0.00 H new ATOM 0 HG21 THR A 43 -11.740 -0.331 -5.360 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.798 0.515 -6.611 1.00 0.00 H new ATOM 0 HG23 THR A 43 -9.962 -0.424 -5.351 1.00 0.00 H new ATOM 628 N ALA A 44 -10.272 4.442 -4.287 1.00 0.00 N ATOM 629 CA ALA A 44 -10.335 5.647 -3.469 1.00 0.00 C ATOM 630 C ALA A 44 -11.661 6.374 -3.665 1.00 0.00 C ATOM 631 O ALA A 44 -12.385 6.145 -4.634 1.00 0.00 O ATOM 632 CB ALA A 44 -9.171 6.570 -3.798 1.00 0.00 C ATOM 0 H ALA A 44 -10.922 4.431 -5.073 1.00 0.00 H new ATOM 0 HA ALA A 44 -10.264 5.350 -2.423 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -9.231 7.466 -3.180 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.231 6.055 -3.600 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.216 6.852 -4.850 1.00 0.00 H new ATOM 638 N PRO A 45 -11.989 7.272 -2.723 1.00 0.00 N ATOM 639 CA PRO A 45 -13.229 8.052 -2.771 1.00 0.00 C ATOM 640 C PRO A 45 -13.223 9.084 -3.893 1.00 0.00 C ATOM 641 O PRO A 45 -12.871 10.244 -3.682 1.00 0.00 O ATOM 642 CB PRO A 45 -13.264 8.745 -1.407 1.00 0.00 C ATOM 643 CG PRO A 45 -11.838 8.825 -0.986 1.00 0.00 C ATOM 644 CD PRO A 45 -11.172 7.597 -1.541 1.00 0.00 C ATOM 0 HA PRO A 45 -14.098 7.424 -2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -13.712 9.736 -1.478 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -13.857 8.178 -0.690 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -11.368 9.731 -1.370 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -11.753 8.858 0.100 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -10.134 7.790 -1.811 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.167 6.781 -0.819 1.00 0.00 H new ATOM 652 N GLY A 46 -13.615 8.654 -5.088 1.00 0.00 N ATOM 653 CA GLY A 46 -13.648 9.554 -6.227 1.00 0.00 C ATOM 654 C GLY A 46 -12.667 9.154 -7.311 1.00 0.00 C ATOM 655 O GLY A 46 -12.960 9.279 -8.499 1.00 0.00 O ATOM 0 H GLY A 46 -13.910 7.699 -5.288 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -14.656 9.573 -6.642 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -13.422 10.567 -5.893 1.00 0.00 H new ATOM 659 N ALA A 47 -11.499 8.671 -6.901 1.00 0.00 N ATOM 660 CA ALA A 47 -10.471 8.251 -7.846 1.00 0.00 C ATOM 661 C ALA A 47 -10.902 6.999 -8.604 1.00 0.00 C ATOM 662 O ALA A 47 -11.676 6.180 -8.109 1.00 0.00 O ATOM 663 CB ALA A 47 -9.157 8.005 -7.121 1.00 0.00 C ATOM 0 H ALA A 47 -11.241 8.561 -5.920 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.328 9.052 -8.571 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -8.399 7.692 -7.839 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -8.835 8.923 -6.630 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -9.294 7.223 -6.374 1.00 0.00 H new ATOM 669 N PRO A 48 -10.391 6.847 -9.835 1.00 0.00 N ATOM 670 CA PRO A 48 -10.710 5.699 -10.687 1.00 0.00 C ATOM 671 C PRO A 48 -10.098 4.402 -10.166 1.00 0.00 C ATOM 672 O PRO A 48 -9.029 4.395 -9.555 1.00 0.00 O ATOM 673 CB PRO A 48 -10.094 6.076 -12.037 1.00 0.00 C ATOM 674 CG PRO A 48 -8.997 7.026 -11.700 1.00 0.00 C ATOM 675 CD PRO A 48 -9.464 7.785 -10.489 1.00 0.00 C ATOM 0 HA PRO A 48 -11.783 5.510 -10.730 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -9.711 5.198 -12.557 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -10.831 6.539 -12.693 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -8.069 6.493 -11.493 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -8.797 7.702 -12.531 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -8.633 8.050 -9.835 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -9.961 8.715 -10.765 1.00 0.00 H new ATOM 683 N PRO A 49 -10.788 3.279 -10.414 1.00 0.00 N ATOM 684 CA PRO A 49 -10.330 1.957 -9.978 1.00 0.00 C ATOM 685 C PRO A 49 -9.100 1.487 -10.749 1.00 0.00 C ATOM 686 O PRO A 49 -9.016 1.655 -11.967 1.00 0.00 O ATOM 687 CB PRO A 49 -11.526 1.051 -10.278 1.00 0.00 C ATOM 688 CG PRO A 49 -12.260 1.742 -11.375 1.00 0.00 C ATOM 689 CD PRO A 49 -12.069 3.215 -11.137 1.00 0.00 C ATOM 0 HA PRO A 49 -10.028 1.955 -8.931 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -11.202 0.056 -10.584 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -12.157 0.924 -9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.870 1.450 -12.350 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -13.318 1.479 -11.363 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.031 3.772 -12.073 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -12.884 3.636 -10.549 1.00 0.00 H new ATOM 697 N LEU A 50 -8.148 0.899 -10.033 1.00 0.00 N ATOM 698 CA LEU A 50 -6.923 0.403 -10.650 1.00 0.00 C ATOM 699 C LEU A 50 -6.773 -1.099 -10.435 1.00 0.00 C ATOM 700 O LEU A 50 -6.896 -1.590 -9.313 1.00 0.00 O ATOM 701 CB LEU A 50 -5.708 1.136 -10.077 1.00 0.00 C ATOM 702 CG LEU A 50 -4.403 0.339 -10.035 1.00 0.00 C ATOM 703 CD1 LEU A 50 -3.909 0.048 -11.443 1.00 0.00 C ATOM 704 CD2 LEU A 50 -3.345 1.092 -9.241 1.00 0.00 C ATOM 0 H LEU A 50 -8.201 0.754 -9.025 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.983 0.593 -11.722 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.541 2.038 -10.666 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.947 1.457 -9.063 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.595 -0.611 -9.537 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.980 -0.520 -11.393 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.660 -0.532 -11.979 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.733 0.987 -11.968 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.423 0.511 -9.221 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.156 2.057 -9.711 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.698 1.248 -8.221 1.00 0.00 H new ATOM 716 N GLN A 51 -6.506 -1.824 -11.516 1.00 0.00 N ATOM 717 CA GLN A 51 -6.338 -3.270 -11.445 1.00 0.00 C ATOM 718 C GLN A 51 -5.000 -3.693 -12.044 1.00 0.00 C ATOM 719 O GLN A 51 -4.715 -3.415 -13.208 1.00 0.00 O ATOM 720 CB GLN A 51 -7.483 -3.974 -12.175 1.00 0.00 C ATOM 721 CG GLN A 51 -7.261 -5.467 -12.359 1.00 0.00 C ATOM 722 CD GLN A 51 -8.535 -6.207 -12.715 1.00 0.00 C ATOM 723 OE1 GLN A 51 -9.311 -5.758 -13.559 1.00 0.00 O ATOM 724 NE2 GLN A 51 -8.757 -7.348 -12.073 1.00 0.00 N ATOM 0 H GLN A 51 -6.401 -1.433 -12.452 1.00 0.00 H new ATOM 0 HA GLN A 51 -6.353 -3.561 -10.395 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -8.407 -3.818 -11.619 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -7.618 -3.512 -13.153 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -6.521 -5.626 -13.144 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -6.847 -5.885 -11.441 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -8.087 -7.683 -11.381 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -9.598 -7.890 -12.272 1.00 0.00 H new ATOM 733 N ALA A 52 -4.185 -4.367 -11.241 1.00 0.00 N ATOM 734 CA ALA A 52 -2.878 -4.830 -11.692 1.00 0.00 C ATOM 735 C ALA A 52 -2.566 -6.217 -11.139 1.00 0.00 C ATOM 736 O ALA A 52 -3.275 -6.721 -10.270 1.00 0.00 O ATOM 737 CB ALA A 52 -1.797 -3.841 -11.281 1.00 0.00 C ATOM 0 H ALA A 52 -4.406 -4.605 -10.274 1.00 0.00 H new ATOM 0 HA ALA A 52 -2.899 -4.897 -12.780 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.826 -4.199 -11.624 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -2.004 -2.869 -11.729 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.785 -3.745 -10.195 1.00 0.00 H new ATOM 743 N GLU A 53 -1.502 -6.827 -11.652 1.00 0.00 N ATOM 744 CA GLU A 53 -1.099 -8.157 -11.210 1.00 0.00 C ATOM 745 C GLU A 53 0.419 -8.306 -11.251 1.00 0.00 C ATOM 746 O GLU A 53 1.119 -7.490 -11.850 1.00 0.00 O ATOM 747 CB GLU A 53 -1.752 -9.230 -12.085 1.00 0.00 C ATOM 748 CG GLU A 53 -1.884 -10.578 -11.398 1.00 0.00 C ATOM 749 CD GLU A 53 -2.958 -11.448 -12.022 1.00 0.00 C ATOM 750 OE1 GLU A 53 -2.802 -11.829 -13.201 1.00 0.00 O ATOM 751 OE2 GLU A 53 -3.954 -11.747 -11.331 1.00 0.00 O ATOM 0 H GLU A 53 -0.905 -6.422 -12.373 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.432 -8.287 -10.180 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.742 -8.887 -12.387 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.165 -9.352 -12.995 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -0.928 -11.099 -11.443 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.114 -10.423 -10.344 1.00 0.00 H new ATOM 758 N THR A 54 0.922 -9.356 -10.608 1.00 0.00 N ATOM 759 CA THR A 54 2.357 -9.613 -10.568 1.00 0.00 C ATOM 760 C THR A 54 2.645 -11.072 -10.232 1.00 0.00 C ATOM 761 O THR A 54 1.951 -11.698 -9.431 1.00 0.00 O ATOM 762 CB THR A 54 3.060 -8.712 -9.536 1.00 0.00 C ATOM 763 OG1 THR A 54 4.447 -9.056 -9.450 1.00 0.00 O ATOM 764 CG2 THR A 54 2.412 -8.850 -8.166 1.00 0.00 C ATOM 0 H THR A 54 0.357 -10.042 -10.108 1.00 0.00 H new ATOM 0 HA THR A 54 2.746 -9.388 -11.561 1.00 0.00 H new ATOM 0 HB THR A 54 2.962 -7.677 -9.864 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.946 -8.308 -9.059 1.00 0.00 H new ATOM 0 HG21 THR A 54 2.926 -8.204 -7.454 1.00 0.00 H new ATOM 0 HG22 THR A 54 1.363 -8.559 -8.229 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.482 -9.885 -7.833 1.00 0.00 H new ATOM 772 N PRO A 55 3.693 -11.627 -10.858 1.00 0.00 N ATOM 773 CA PRO A 55 4.097 -13.020 -10.640 1.00 0.00 C ATOM 774 C PRO A 55 4.684 -13.242 -9.250 1.00 0.00 C ATOM 775 O PRO A 55 5.266 -12.334 -8.659 1.00 0.00 O ATOM 776 CB PRO A 55 5.162 -13.252 -11.714 1.00 0.00 C ATOM 777 CG PRO A 55 5.711 -11.897 -12.003 1.00 0.00 C ATOM 778 CD PRO A 55 4.563 -10.940 -11.827 1.00 0.00 C ATOM 0 HA PRO A 55 3.252 -13.705 -10.704 1.00 0.00 H new ATOM 0 HB2 PRO A 55 5.941 -13.927 -11.360 1.00 0.00 H new ATOM 0 HB3 PRO A 55 4.731 -13.703 -12.608 1.00 0.00 H new ATOM 0 HG2 PRO A 55 6.529 -11.654 -11.325 1.00 0.00 H new ATOM 0 HG3 PRO A 55 6.111 -11.845 -13.016 1.00 0.00 H new ATOM 0 HD2 PRO A 55 4.899 -9.974 -11.451 1.00 0.00 H new ATOM 0 HD3 PRO A 55 4.047 -10.754 -12.769 1.00 0.00 H new ATOM 786 N GLY A 56 4.528 -14.457 -8.734 1.00 0.00 N ATOM 787 CA GLY A 56 5.049 -14.776 -7.418 1.00 0.00 C ATOM 788 C GLY A 56 6.527 -14.471 -7.290 1.00 0.00 C ATOM 789 O GLY A 56 7.065 -14.423 -6.183 1.00 0.00 O ATOM 0 H GLY A 56 4.050 -15.226 -9.204 1.00 0.00 H new ATOM 0 HA2 GLY A 56 4.498 -14.211 -6.666 1.00 0.00 H new ATOM 0 HA3 GLY A 56 4.880 -15.833 -7.210 1.00 0.00 H new ATOM 793 N SER A 57 7.189 -14.265 -8.424 1.00 0.00 N ATOM 794 CA SER A 57 8.616 -13.968 -8.434 1.00 0.00 C ATOM 795 C SER A 57 8.876 -12.534 -7.980 1.00 0.00 C ATOM 796 O SER A 57 10.011 -12.060 -8.007 1.00 0.00 O ATOM 797 CB SER A 57 9.194 -14.184 -9.834 1.00 0.00 C ATOM 798 OG SER A 57 10.583 -14.455 -9.777 1.00 0.00 O ATOM 0 H SER A 57 6.759 -14.298 -9.348 1.00 0.00 H new ATOM 0 HA SER A 57 9.108 -14.646 -7.737 1.00 0.00 H new ATOM 0 HB2 SER A 57 8.679 -15.013 -10.320 1.00 0.00 H new ATOM 0 HB3 SER A 57 9.018 -13.298 -10.444 1.00 0.00 H new ATOM 0 HG SER A 57 11.014 -13.827 -9.160 1.00 0.00 H new ATOM 804 N ALA A 58 7.815 -11.851 -7.564 1.00 0.00 N ATOM 805 CA ALA A 58 7.928 -10.473 -7.102 1.00 0.00 C ATOM 806 C ALA A 58 7.358 -10.316 -5.696 1.00 0.00 C ATOM 807 O ALA A 58 6.260 -10.790 -5.404 1.00 0.00 O ATOM 808 CB ALA A 58 7.220 -9.533 -8.067 1.00 0.00 C ATOM 0 H ALA A 58 6.868 -12.229 -7.537 1.00 0.00 H new ATOM 0 HA ALA A 58 8.986 -10.214 -7.068 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.312 -8.507 -7.710 1.00 0.00 H new ATOM 0 HB2 ALA A 58 7.674 -9.615 -9.054 1.00 0.00 H new ATOM 0 HB3 ALA A 58 6.166 -9.802 -8.129 1.00 0.00 H new ATOM 814 N VAL A 59 8.112 -9.650 -4.827 1.00 0.00 N ATOM 815 CA VAL A 59 7.682 -9.432 -3.452 1.00 0.00 C ATOM 816 C VAL A 59 7.402 -7.955 -3.191 1.00 0.00 C ATOM 817 O VAL A 59 7.550 -7.474 -2.068 1.00 0.00 O ATOM 818 CB VAL A 59 8.739 -9.928 -2.447 1.00 0.00 C ATOM 819 CG1 VAL A 59 8.834 -11.446 -2.479 1.00 0.00 C ATOM 820 CG2 VAL A 59 10.091 -9.295 -2.741 1.00 0.00 C ATOM 0 H VAL A 59 9.024 -9.252 -5.052 1.00 0.00 H new ATOM 0 HA VAL A 59 6.764 -10.003 -3.314 1.00 0.00 H new ATOM 0 HB VAL A 59 8.433 -9.628 -1.445 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.585 -11.779 -1.763 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.867 -11.877 -2.217 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.117 -11.772 -3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 59 10.826 -9.656 -2.022 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.407 -9.564 -3.749 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.010 -8.211 -2.663 1.00 0.00 H new ATOM 830 N ASP A 60 6.998 -7.243 -4.236 1.00 0.00 N ATOM 831 CA ASP A 60 6.696 -5.821 -4.121 1.00 0.00 C ATOM 832 C ASP A 60 6.032 -5.301 -5.392 1.00 0.00 C ATOM 833 O ASP A 60 6.403 -5.687 -6.501 1.00 0.00 O ATOM 834 CB ASP A 60 7.974 -5.027 -3.837 1.00 0.00 C ATOM 835 CG ASP A 60 8.883 -4.944 -5.046 1.00 0.00 C ATOM 836 OD1 ASP A 60 9.055 -5.973 -5.731 1.00 0.00 O ATOM 837 OD2 ASP A 60 9.425 -3.849 -5.307 1.00 0.00 O ATOM 0 H ASP A 60 6.872 -7.627 -5.173 1.00 0.00 H new ATOM 0 HA ASP A 60 6.003 -5.689 -3.290 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.709 -4.020 -3.515 1.00 0.00 H new ATOM 0 HB3 ASP A 60 8.513 -5.494 -3.012 1.00 0.00 H new ATOM 842 N TYR A 61 5.049 -4.423 -5.223 1.00 0.00 N ATOM 843 CA TYR A 61 4.331 -3.853 -6.357 1.00 0.00 C ATOM 844 C TYR A 61 4.194 -2.342 -6.210 1.00 0.00 C ATOM 845 O TYR A 61 3.293 -1.837 -5.540 1.00 0.00 O ATOM 846 CB TYR A 61 2.947 -4.493 -6.485 1.00 0.00 C ATOM 847 CG TYR A 61 2.399 -4.476 -7.894 1.00 0.00 C ATOM 848 CD1 TYR A 61 2.903 -5.330 -8.866 1.00 0.00 C ATOM 849 CD2 TYR A 61 1.378 -3.604 -8.253 1.00 0.00 C ATOM 850 CE1 TYR A 61 2.407 -5.317 -10.156 1.00 0.00 C ATOM 851 CE2 TYR A 61 0.874 -3.586 -9.538 1.00 0.00 C ATOM 852 CZ TYR A 61 1.391 -4.443 -10.486 1.00 0.00 C ATOM 853 OH TYR A 61 0.893 -4.428 -11.769 1.00 0.00 O ATOM 0 H TYR A 61 4.732 -4.091 -4.312 1.00 0.00 H new ATOM 0 HA TYR A 61 4.905 -4.061 -7.260 1.00 0.00 H new ATOM 0 HB2 TYR A 61 3.000 -5.525 -6.137 1.00 0.00 H new ATOM 0 HB3 TYR A 61 2.252 -3.970 -5.828 1.00 0.00 H new ATOM 0 HD1 TYR A 61 3.696 -6.016 -8.610 1.00 0.00 H new ATOM 0 HD2 TYR A 61 0.972 -2.929 -7.514 1.00 0.00 H new ATOM 0 HE1 TYR A 61 2.812 -5.986 -10.901 1.00 0.00 H new ATOM 0 HE2 TYR A 61 0.079 -2.904 -9.799 1.00 0.00 H new ATOM 0 HH TYR A 61 0.839 -5.345 -12.110 1.00 0.00 H new ATOM 863 N PRO A 62 5.107 -1.600 -6.853 1.00 0.00 N ATOM 864 CA PRO A 62 5.110 -0.135 -6.811 1.00 0.00 C ATOM 865 C PRO A 62 3.938 0.469 -7.577 1.00 0.00 C ATOM 866 O PRO A 62 3.926 0.477 -8.809 1.00 0.00 O ATOM 867 CB PRO A 62 6.435 0.237 -7.480 1.00 0.00 C ATOM 868 CG PRO A 62 6.747 -0.917 -8.369 1.00 0.00 C ATOM 869 CD PRO A 62 6.209 -2.134 -7.671 1.00 0.00 C ATOM 0 HA PRO A 62 5.010 0.244 -5.794 1.00 0.00 H new ATOM 0 HB2 PRO A 62 6.345 1.162 -8.049 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.222 0.392 -6.742 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.284 -0.792 -9.348 1.00 0.00 H new ATOM 0 HG3 PRO A 62 7.821 -1.004 -8.533 1.00 0.00 H new ATOM 0 HD2 PRO A 62 5.856 -2.881 -8.382 1.00 0.00 H new ATOM 0 HD3 PRO A 62 6.970 -2.614 -7.056 1.00 0.00 H new ATOM 877 N LEU A 63 2.954 0.976 -6.842 1.00 0.00 N ATOM 878 CA LEU A 63 1.777 1.582 -7.453 1.00 0.00 C ATOM 879 C LEU A 63 2.076 3.005 -7.916 1.00 0.00 C ATOM 880 O LEU A 63 2.566 3.830 -7.145 1.00 0.00 O ATOM 881 CB LEU A 63 0.611 1.590 -6.463 1.00 0.00 C ATOM 882 CG LEU A 63 0.204 0.231 -5.894 1.00 0.00 C ATOM 883 CD1 LEU A 63 -0.384 0.389 -4.501 1.00 0.00 C ATOM 884 CD2 LEU A 63 -0.790 -0.458 -6.819 1.00 0.00 C ATOM 0 H LEU A 63 2.948 0.979 -5.822 1.00 0.00 H new ATOM 0 HA LEU A 63 1.502 0.986 -8.323 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.871 2.246 -5.632 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -0.256 2.029 -6.957 1.00 0.00 H new ATOM 0 HG LEU A 63 1.095 -0.392 -5.821 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.668 -0.589 -4.113 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.358 0.840 -3.842 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -1.264 1.030 -4.548 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.069 -1.424 -6.399 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.680 0.163 -6.924 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.334 -0.606 -7.798 1.00 0.00 H new ATOM 896 N HIS A 64 1.776 3.286 -9.180 1.00 0.00 N ATOM 897 CA HIS A 64 2.009 4.610 -9.745 1.00 0.00 C ATOM 898 C HIS A 64 0.693 5.272 -10.143 1.00 0.00 C ATOM 899 O HIS A 64 -0.368 4.649 -10.084 1.00 0.00 O ATOM 900 CB HIS A 64 2.933 4.514 -10.960 1.00 0.00 C ATOM 901 CG HIS A 64 2.423 3.595 -12.028 1.00 0.00 C ATOM 902 ND1 HIS A 64 1.467 3.969 -12.949 1.00 0.00 N ATOM 903 CD2 HIS A 64 2.744 2.313 -12.319 1.00 0.00 C ATOM 904 CE1 HIS A 64 1.221 2.955 -13.760 1.00 0.00 C ATOM 905 NE2 HIS A 64 1.983 1.938 -13.399 1.00 0.00 N ATOM 0 H HIS A 64 1.371 2.614 -9.832 1.00 0.00 H new ATOM 0 HA HIS A 64 2.487 5.224 -8.982 1.00 0.00 H new ATOM 0 HB2 HIS A 64 3.069 5.509 -11.383 1.00 0.00 H new ATOM 0 HB3 HIS A 64 3.914 4.170 -10.634 1.00 0.00 H new ATOM 0 HD2 HIS A 64 3.464 1.699 -11.799 1.00 0.00 H new ATOM 0 HE1 HIS A 64 0.517 2.957 -14.579 1.00 0.00 H new ATOM 0 HE2 HIS A 64 2.003 1.023 -13.849 1.00 0.00 H new ATOM 914 N ASP A 65 0.770 6.534 -10.548 1.00 0.00 N ATOM 915 CA ASP A 65 -0.415 7.279 -10.957 1.00 0.00 C ATOM 916 C ASP A 65 -1.427 7.357 -9.818 1.00 0.00 C ATOM 917 O ASP A 65 -2.603 7.038 -9.994 1.00 0.00 O ATOM 918 CB ASP A 65 -1.057 6.627 -12.182 1.00 0.00 C ATOM 919 CG ASP A 65 -1.854 7.614 -13.012 1.00 0.00 C ATOM 920 OD1 ASP A 65 -2.538 8.473 -12.418 1.00 0.00 O ATOM 921 OD2 ASP A 65 -1.794 7.528 -14.257 1.00 0.00 O ATOM 0 H ASP A 65 1.640 7.063 -10.602 1.00 0.00 H new ATOM 0 HA ASP A 65 -0.106 8.292 -11.215 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.279 6.180 -12.802 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -1.711 5.817 -11.858 1.00 0.00 H new ATOM 926 N LEU A 66 -0.962 7.783 -8.649 1.00 0.00 N ATOM 927 CA LEU A 66 -1.826 7.903 -7.479 1.00 0.00 C ATOM 928 C LEU A 66 -1.892 9.348 -6.995 1.00 0.00 C ATOM 929 O LEU A 66 -0.885 9.921 -6.577 1.00 0.00 O ATOM 930 CB LEU A 66 -1.321 6.999 -6.353 1.00 0.00 C ATOM 931 CG LEU A 66 -1.235 5.507 -6.676 1.00 0.00 C ATOM 932 CD1 LEU A 66 -0.181 4.833 -5.812 1.00 0.00 C ATOM 933 CD2 LEU A 66 -2.590 4.841 -6.486 1.00 0.00 C ATOM 0 H LEU A 66 0.008 8.051 -8.486 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.830 7.590 -7.766 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.331 7.343 -6.055 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.976 7.126 -5.491 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.942 5.397 -7.720 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.135 3.772 -6.056 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.790 5.291 -5.999 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.442 4.952 -4.760 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.510 3.780 -6.720 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.913 4.961 -5.452 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.320 5.305 -7.150 1.00 0.00 H new ATOM 945 N VAL A 67 -3.084 9.932 -7.054 1.00 0.00 N ATOM 946 CA VAL A 67 -3.283 11.309 -6.620 1.00 0.00 C ATOM 947 C VAL A 67 -2.791 11.511 -5.191 1.00 0.00 C ATOM 948 O VAL A 67 -3.099 10.721 -4.298 1.00 0.00 O ATOM 949 CB VAL A 67 -4.766 11.716 -6.701 1.00 0.00 C ATOM 950 CG1 VAL A 67 -4.962 13.132 -6.184 1.00 0.00 C ATOM 951 CG2 VAL A 67 -5.275 11.586 -8.129 1.00 0.00 C ATOM 0 H VAL A 67 -3.927 9.473 -7.398 1.00 0.00 H new ATOM 0 HA VAL A 67 -2.704 11.939 -7.295 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.345 11.042 -6.069 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.016 13.401 -6.250 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.637 13.188 -5.145 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -4.373 13.824 -6.786 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -6.325 11.877 -8.169 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -4.693 12.235 -8.783 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.173 10.552 -8.459 1.00 0.00 H new ATOM 961 N LEU A 68 -2.023 12.575 -4.980 1.00 0.00 N ATOM 962 CA LEU A 68 -1.488 12.883 -3.658 1.00 0.00 C ATOM 963 C LEU A 68 -2.571 13.460 -2.752 1.00 0.00 C ATOM 964 O LEU A 68 -3.646 13.840 -3.217 1.00 0.00 O ATOM 965 CB LEU A 68 -0.325 13.871 -3.775 1.00 0.00 C ATOM 966 CG LEU A 68 0.678 13.597 -4.897 1.00 0.00 C ATOM 967 CD1 LEU A 68 0.886 12.101 -5.074 1.00 0.00 C ATOM 968 CD2 LEU A 68 0.208 14.230 -6.198 1.00 0.00 C ATOM 0 H LEU A 68 -1.757 13.239 -5.707 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.126 11.955 -3.214 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.736 14.870 -3.918 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.214 13.881 -2.828 1.00 0.00 H new ATOM 0 HG LEU A 68 1.633 14.045 -4.622 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.603 11.926 -5.876 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.268 11.675 -4.147 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.064 11.629 -5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.934 14.025 -6.985 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.759 13.812 -6.478 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.112 15.308 -6.065 1.00 0.00 H new ATOM 980 N HIS A 69 -2.279 13.523 -1.457 1.00 0.00 N ATOM 981 CA HIS A 69 -3.227 14.056 -0.485 1.00 0.00 C ATOM 982 C HIS A 69 -4.576 13.351 -0.599 1.00 0.00 C ATOM 983 O HIS A 69 -5.629 13.983 -0.509 1.00 0.00 O ATOM 984 CB HIS A 69 -3.408 15.561 -0.689 1.00 0.00 C ATOM 985 CG HIS A 69 -2.124 16.288 -0.950 1.00 0.00 C ATOM 986 ND1 HIS A 69 -2.075 17.582 -1.422 1.00 0.00 N ATOM 987 CD2 HIS A 69 -0.838 15.894 -0.801 1.00 0.00 C ATOM 988 CE1 HIS A 69 -0.813 17.954 -1.553 1.00 0.00 C ATOM 989 NE2 HIS A 69 -0.043 16.947 -1.182 1.00 0.00 N ATOM 0 H HIS A 69 -1.394 13.212 -1.056 1.00 0.00 H new ATOM 0 HA HIS A 69 -2.825 13.877 0.512 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -4.087 15.727 -1.526 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -3.883 15.985 0.196 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -0.500 14.931 -0.448 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -0.470 18.916 -1.903 1.00 0.00 H new ATOM 0 HE2 HIS A 69 0.977 16.951 -1.179 1.00 0.00 H new ATOM 998 N THR A 70 -4.536 12.037 -0.797 1.00 0.00 N ATOM 999 CA THR A 70 -5.753 11.246 -0.925 1.00 0.00 C ATOM 1000 C THR A 70 -5.561 9.846 -0.353 1.00 0.00 C ATOM 1001 O THR A 70 -4.585 9.166 -0.667 1.00 0.00 O ATOM 1002 CB THR A 70 -6.198 11.132 -2.395 1.00 0.00 C ATOM 1003 OG1 THR A 70 -6.414 12.437 -2.944 1.00 0.00 O ATOM 1004 CG2 THR A 70 -7.473 10.311 -2.512 1.00 0.00 C ATOM 0 H THR A 70 -3.673 11.498 -0.872 1.00 0.00 H new ATOM 0 HA THR A 70 -6.527 11.764 -0.359 1.00 0.00 H new ATOM 0 HB THR A 70 -5.408 10.629 -2.953 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.552 12.887 -3.067 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.768 10.244 -3.559 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.298 9.309 -2.120 1.00 0.00 H new ATOM 0 HG23 THR A 70 -8.268 10.790 -1.941 1.00 0.00 H new ATOM 1012 N ASN A 71 -6.499 9.420 0.487 1.00 0.00 N ATOM 1013 CA ASN A 71 -6.433 8.099 1.101 1.00 0.00 C ATOM 1014 C ASN A 71 -6.702 7.006 0.071 1.00 0.00 C ATOM 1015 O ASN A 71 -7.761 6.975 -0.555 1.00 0.00 O ATOM 1016 CB ASN A 71 -7.442 7.995 2.246 1.00 0.00 C ATOM 1017 CG ASN A 71 -7.672 6.563 2.686 1.00 0.00 C ATOM 1018 OD1 ASN A 71 -8.032 5.705 1.880 1.00 0.00 O ATOM 1019 ND2 ASN A 71 -7.465 6.298 3.971 1.00 0.00 N ATOM 0 H ASN A 71 -7.314 9.971 0.758 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.427 7.960 1.498 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -7.086 8.580 3.094 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -8.390 8.432 1.932 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -7.604 5.352 4.325 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -7.167 7.041 4.603 1.00 0.00 H new ATOM 1026 N TYR A 72 -5.736 6.110 -0.098 1.00 0.00 N ATOM 1027 CA TYR A 72 -5.866 5.016 -1.052 1.00 0.00 C ATOM 1028 C TYR A 72 -5.777 3.665 -0.348 1.00 0.00 C ATOM 1029 O TYR A 72 -4.832 3.400 0.396 1.00 0.00 O ATOM 1030 CB TYR A 72 -4.783 5.116 -2.127 1.00 0.00 C ATOM 1031 CG TYR A 72 -5.184 5.960 -3.315 1.00 0.00 C ATOM 1032 CD1 TYR A 72 -5.887 5.409 -4.378 1.00 0.00 C ATOM 1033 CD2 TYR A 72 -4.861 7.311 -3.373 1.00 0.00 C ATOM 1034 CE1 TYR A 72 -6.255 6.176 -5.466 1.00 0.00 C ATOM 1035 CE2 TYR A 72 -5.226 8.086 -4.457 1.00 0.00 C ATOM 1036 CZ TYR A 72 -5.922 7.515 -5.501 1.00 0.00 C ATOM 1037 OH TYR A 72 -6.288 8.282 -6.582 1.00 0.00 O ATOM 0 H TYR A 72 -4.854 6.120 0.414 1.00 0.00 H new ATOM 0 HA TYR A 72 -6.845 5.095 -1.524 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -3.880 5.535 -1.683 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -4.533 4.113 -2.473 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.151 4.362 -4.354 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -4.316 7.762 -2.557 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -6.800 5.731 -6.285 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -4.967 9.134 -4.486 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.578 8.256 -7.257 1.00 0.00 H new ATOM 1047 N THR A 73 -6.769 2.813 -0.589 1.00 0.00 N ATOM 1048 CA THR A 73 -6.805 1.489 0.021 1.00 0.00 C ATOM 1049 C THR A 73 -6.482 0.404 -1.001 1.00 0.00 C ATOM 1050 O THR A 73 -7.177 0.260 -2.006 1.00 0.00 O ATOM 1051 CB THR A 73 -8.181 1.196 0.647 1.00 0.00 C ATOM 1052 OG1 THR A 73 -8.472 2.163 1.662 1.00 0.00 O ATOM 1053 CG2 THR A 73 -8.216 -0.202 1.246 1.00 0.00 C ATOM 0 H THR A 73 -7.558 3.016 -1.202 1.00 0.00 H new ATOM 0 HA THR A 73 -6.049 1.482 0.806 1.00 0.00 H new ATOM 0 HB THR A 73 -8.934 1.256 -0.139 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.349 1.971 2.054 1.00 0.00 H new ATOM 0 HG21 THR A 73 -9.198 -0.386 1.682 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.022 -0.937 0.465 1.00 0.00 H new ATOM 0 HG23 THR A 73 -7.453 -0.285 2.020 1.00 0.00 H new ATOM 1061 N ALA A 74 -5.426 -0.357 -0.735 1.00 0.00 N ATOM 1062 CA ALA A 74 -5.013 -1.430 -1.630 1.00 0.00 C ATOM 1063 C ALA A 74 -5.261 -2.796 -0.999 1.00 0.00 C ATOM 1064 O ALA A 74 -5.080 -2.978 0.206 1.00 0.00 O ATOM 1065 CB ALA A 74 -3.546 -1.275 -2.001 1.00 0.00 C ATOM 0 H ALA A 74 -4.841 -0.250 0.094 1.00 0.00 H new ATOM 0 HA ALA A 74 -5.613 -1.364 -2.538 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -3.252 -2.084 -2.670 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.396 -0.318 -2.501 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.937 -1.312 -1.098 1.00 0.00 H new ATOM 1071 N THR A 75 -5.675 -3.757 -1.820 1.00 0.00 N ATOM 1072 CA THR A 75 -5.949 -5.105 -1.341 1.00 0.00 C ATOM 1073 C THR A 75 -5.212 -6.146 -2.177 1.00 0.00 C ATOM 1074 O THR A 75 -5.522 -6.346 -3.352 1.00 0.00 O ATOM 1075 CB THR A 75 -7.457 -5.417 -1.368 1.00 0.00 C ATOM 1076 OG1 THR A 75 -8.173 -4.442 -0.601 1.00 0.00 O ATOM 1077 CG2 THR A 75 -7.734 -6.807 -0.815 1.00 0.00 C ATOM 0 H THR A 75 -5.828 -3.626 -2.820 1.00 0.00 H new ATOM 0 HA THR A 75 -5.595 -5.151 -0.311 1.00 0.00 H new ATOM 0 HB THR A 75 -7.793 -5.383 -2.404 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.131 -4.646 -0.625 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.806 -7.003 -0.845 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.212 -7.549 -1.419 1.00 0.00 H new ATOM 0 HG23 THR A 75 -7.383 -6.865 0.215 1.00 0.00 H new ATOM 1085 N VAL A 76 -4.235 -6.807 -1.565 1.00 0.00 N ATOM 1086 CA VAL A 76 -3.455 -7.828 -2.253 1.00 0.00 C ATOM 1087 C VAL A 76 -4.011 -9.221 -1.980 1.00 0.00 C ATOM 1088 O VAL A 76 -4.594 -9.473 -0.925 1.00 0.00 O ATOM 1089 CB VAL A 76 -1.975 -7.786 -1.827 1.00 0.00 C ATOM 1090 CG1 VAL A 76 -1.179 -8.860 -2.553 1.00 0.00 C ATOM 1091 CG2 VAL A 76 -1.386 -6.407 -2.087 1.00 0.00 C ATOM 0 H VAL A 76 -3.965 -6.653 -0.593 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.525 -7.614 -3.320 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.917 -7.986 -0.757 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.136 -8.815 -2.239 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.588 -9.841 -2.312 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -1.242 -8.695 -3.629 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -0.340 -6.394 -1.781 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.455 -6.176 -3.150 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.940 -5.661 -1.517 1.00 0.00 H new ATOM 1101 N ARG A 77 -3.826 -10.125 -2.937 1.00 0.00 N ATOM 1102 CA ARG A 77 -4.310 -11.493 -2.800 1.00 0.00 C ATOM 1103 C ARG A 77 -3.327 -12.482 -3.420 1.00 0.00 C ATOM 1104 O ARG A 77 -2.350 -12.087 -4.055 1.00 0.00 O ATOM 1105 CB ARG A 77 -5.682 -11.640 -3.460 1.00 0.00 C ATOM 1106 CG ARG A 77 -6.843 -11.366 -2.518 1.00 0.00 C ATOM 1107 CD ARG A 77 -8.116 -12.050 -2.990 1.00 0.00 C ATOM 1108 NE ARG A 77 -8.700 -11.381 -4.150 1.00 0.00 N ATOM 1109 CZ ARG A 77 -9.406 -10.259 -4.073 1.00 0.00 C ATOM 1110 NH1 ARG A 77 -9.615 -9.683 -2.897 1.00 0.00 N ATOM 1111 NH2 ARG A 77 -9.905 -9.710 -5.174 1.00 0.00 N ATOM 0 H ARG A 77 -3.344 -9.934 -3.816 1.00 0.00 H new ATOM 0 HA ARG A 77 -4.400 -11.715 -1.737 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -5.743 -10.957 -4.307 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -5.778 -12.650 -3.858 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -6.591 -11.715 -1.517 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -7.011 -10.291 -2.448 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -7.898 -13.088 -3.242 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -8.842 -12.065 -2.177 1.00 0.00 H new ATOM 0 HE ARG A 77 -8.558 -11.799 -5.070 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -9.233 -10.102 -2.049 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -10.158 -8.821 -2.840 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -9.746 -10.150 -6.080 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -10.447 -8.848 -5.113 1.00 0.00 H new ATOM 1125 N GLY A 78 -3.594 -13.771 -3.231 1.00 0.00 N ATOM 1126 CA GLY A 78 -2.723 -14.796 -3.776 1.00 0.00 C ATOM 1127 C GLY A 78 -3.476 -15.807 -4.619 1.00 0.00 C ATOM 1128 O GLY A 78 -4.312 -16.552 -4.108 1.00 0.00 O ATOM 0 H GLY A 78 -4.397 -14.123 -2.711 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.949 -14.326 -4.383 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -2.218 -15.312 -2.959 1.00 0.00 H new ATOM 1132 N LEU A 79 -3.181 -15.831 -5.914 1.00 0.00 N ATOM 1133 CA LEU A 79 -3.837 -16.757 -6.830 1.00 0.00 C ATOM 1134 C LEU A 79 -3.115 -18.101 -6.857 1.00 0.00 C ATOM 1135 O LEU A 79 -2.076 -18.245 -7.501 1.00 0.00 O ATOM 1136 CB LEU A 79 -3.885 -16.164 -8.240 1.00 0.00 C ATOM 1137 CG LEU A 79 -5.035 -15.196 -8.521 1.00 0.00 C ATOM 1138 CD1 LEU A 79 -6.350 -15.950 -8.637 1.00 0.00 C ATOM 1139 CD2 LEU A 79 -5.119 -14.136 -7.432 1.00 0.00 C ATOM 0 H LEU A 79 -2.492 -15.220 -6.353 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.855 -16.919 -6.475 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.945 -15.644 -8.426 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.943 -16.984 -8.956 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.841 -14.697 -9.470 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.157 -15.245 -8.837 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.286 -16.670 -9.453 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.551 -16.477 -7.704 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -5.943 -13.456 -7.649 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.289 -14.617 -6.469 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.185 -13.575 -7.398 1.00 0.00 H new ATOM 1151 N ARG A 80 -3.673 -19.081 -6.154 1.00 0.00 N ATOM 1152 CA ARG A 80 -3.083 -20.413 -6.098 1.00 0.00 C ATOM 1153 C ARG A 80 -4.070 -21.467 -6.594 1.00 0.00 C ATOM 1154 O ARG A 80 -4.909 -21.950 -5.836 1.00 0.00 O ATOM 1155 CB ARG A 80 -2.647 -20.741 -4.669 1.00 0.00 C ATOM 1156 CG ARG A 80 -1.471 -19.908 -4.186 1.00 0.00 C ATOM 1157 CD ARG A 80 -0.632 -20.666 -3.168 1.00 0.00 C ATOM 1158 NE ARG A 80 -1.459 -21.409 -2.221 1.00 0.00 N ATOM 1159 CZ ARG A 80 -0.964 -22.182 -1.262 1.00 0.00 C ATOM 1160 NH1 ARG A 80 0.349 -22.314 -1.123 1.00 0.00 N ATOM 1161 NH2 ARG A 80 -1.781 -22.826 -0.439 1.00 0.00 N ATOM 0 H ARG A 80 -4.533 -18.978 -5.615 1.00 0.00 H new ATOM 0 HA ARG A 80 -2.209 -20.423 -6.749 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -3.491 -20.588 -3.996 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -2.382 -21.797 -4.612 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.849 -19.628 -5.036 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -1.837 -18.983 -3.741 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.033 -21.356 -3.688 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.000 -19.964 -2.624 1.00 0.00 H new ATOM 0 HE ARG A 80 -2.473 -21.330 -2.301 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.981 -21.821 -1.754 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.727 -22.909 -0.385 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -2.791 -22.728 -0.543 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -1.399 -23.420 0.297 1.00 0.00 H new ATOM 1175 N GLY A 81 -3.962 -21.815 -7.873 1.00 0.00 N ATOM 1176 CA GLY A 81 -4.852 -22.808 -8.447 1.00 0.00 C ATOM 1177 C GLY A 81 -6.299 -22.358 -8.448 1.00 0.00 C ATOM 1178 O GLY A 81 -6.602 -21.164 -8.475 1.00 0.00 O ATOM 0 H GLY A 81 -3.276 -21.428 -8.521 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.541 -23.023 -9.469 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.764 -23.738 -7.885 1.00 0.00 H new ATOM 1182 N PRO A 82 -7.225 -23.329 -8.421 1.00 0.00 N ATOM 1183 CA PRO A 82 -8.664 -23.051 -8.419 1.00 0.00 C ATOM 1184 C PRO A 82 -9.133 -22.432 -7.107 1.00 0.00 C ATOM 1185 O PRO A 82 -10.325 -22.203 -6.910 1.00 0.00 O ATOM 1186 CB PRO A 82 -9.292 -24.433 -8.613 1.00 0.00 C ATOM 1187 CG PRO A 82 -8.275 -25.388 -8.089 1.00 0.00 C ATOM 1188 CD PRO A 82 -6.937 -24.773 -8.389 1.00 0.00 C ATOM 0 HA PRO A 82 -8.941 -22.330 -9.188 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -10.233 -24.520 -8.070 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -9.511 -24.625 -9.663 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -8.401 -25.544 -7.018 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -8.372 -26.363 -8.567 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -6.201 -25.019 -7.624 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -6.537 -25.124 -9.340 1.00 0.00 H new ATOM 1196 N ASN A 83 -8.187 -22.164 -6.213 1.00 0.00 N ATOM 1197 CA ASN A 83 -8.505 -21.571 -4.919 1.00 0.00 C ATOM 1198 C ASN A 83 -7.795 -20.231 -4.745 1.00 0.00 C ATOM 1199 O ASN A 83 -6.969 -19.842 -5.572 1.00 0.00 O ATOM 1200 CB ASN A 83 -8.107 -22.521 -3.788 1.00 0.00 C ATOM 1201 CG ASN A 83 -9.065 -23.689 -3.651 1.00 0.00 C ATOM 1202 OD1 ASN A 83 -9.619 -23.929 -2.577 1.00 0.00 O ATOM 1203 ND2 ASN A 83 -9.266 -24.421 -4.741 1.00 0.00 N ATOM 0 H ASN A 83 -7.195 -22.348 -6.361 1.00 0.00 H new ATOM 0 HA ASN A 83 -9.581 -21.400 -4.880 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.101 -22.899 -3.971 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -8.074 -21.969 -2.848 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -9.901 -25.219 -4.710 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -8.786 -24.185 -5.609 1.00 0.00 H new ATOM 1210 N LEU A 84 -8.121 -19.531 -3.665 1.00 0.00 N ATOM 1211 CA LEU A 84 -7.514 -18.234 -3.381 1.00 0.00 C ATOM 1212 C LEU A 84 -6.964 -18.191 -1.959 1.00 0.00 C ATOM 1213 O LEU A 84 -7.402 -18.944 -1.088 1.00 0.00 O ATOM 1214 CB LEU A 84 -8.539 -17.116 -3.580 1.00 0.00 C ATOM 1215 CG LEU A 84 -8.643 -16.543 -4.993 1.00 0.00 C ATOM 1216 CD1 LEU A 84 -10.046 -16.021 -5.255 1.00 0.00 C ATOM 1217 CD2 LEU A 84 -7.614 -15.440 -5.199 1.00 0.00 C ATOM 0 H LEU A 84 -8.802 -19.839 -2.971 1.00 0.00 H new ATOM 0 HA LEU A 84 -6.686 -18.086 -4.075 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -9.519 -17.494 -3.290 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.296 -16.302 -2.897 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.436 -17.342 -5.705 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -10.101 -15.617 -6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -10.763 -16.836 -5.150 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -10.282 -15.236 -4.537 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.703 -15.044 -6.211 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.789 -14.640 -4.479 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.612 -15.845 -5.055 1.00 0.00 H new ATOM 1229 N THR A 85 -6.003 -17.301 -1.729 1.00 0.00 N ATOM 1230 CA THR A 85 -5.393 -17.158 -0.414 1.00 0.00 C ATOM 1231 C THR A 85 -6.019 -16.001 0.359 1.00 0.00 C ATOM 1232 O THR A 85 -6.853 -15.268 -0.172 1.00 0.00 O ATOM 1233 CB THR A 85 -3.874 -16.928 -0.520 1.00 0.00 C ATOM 1234 OG1 THR A 85 -3.610 -15.577 -0.917 1.00 0.00 O ATOM 1235 CG2 THR A 85 -3.251 -17.887 -1.522 1.00 0.00 C ATOM 0 H THR A 85 -5.631 -16.669 -2.437 1.00 0.00 H new ATOM 0 HA THR A 85 -5.574 -18.090 0.121 1.00 0.00 H new ATOM 0 HB THR A 85 -3.431 -17.112 0.459 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.855 -14.968 -0.189 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.178 -17.706 -1.580 1.00 0.00 H new ATOM 0 HG22 THR A 85 -3.429 -18.914 -1.202 1.00 0.00 H new ATOM 0 HG23 THR A 85 -3.699 -17.730 -2.503 1.00 0.00 H new ATOM 1243 N SER A 86 -5.609 -15.844 1.614 1.00 0.00 N ATOM 1244 CA SER A 86 -6.131 -14.777 2.459 1.00 0.00 C ATOM 1245 C SER A 86 -5.685 -13.411 1.949 1.00 0.00 C ATOM 1246 O SER A 86 -4.499 -13.155 1.740 1.00 0.00 O ATOM 1247 CB SER A 86 -5.669 -14.971 3.904 1.00 0.00 C ATOM 1248 OG SER A 86 -4.288 -14.681 4.041 1.00 0.00 O ATOM 0 H SER A 86 -4.918 -16.442 2.067 1.00 0.00 H new ATOM 0 HA SER A 86 -7.220 -14.819 2.424 1.00 0.00 H new ATOM 0 HB2 SER A 86 -6.247 -14.324 4.564 1.00 0.00 H new ATOM 0 HB3 SER A 86 -5.861 -15.998 4.216 1.00 0.00 H new ATOM 0 HG SER A 86 -3.969 -14.221 3.237 1.00 0.00 H new ATOM 1254 N PRO A 87 -6.657 -12.510 1.744 1.00 0.00 N ATOM 1255 CA PRO A 87 -6.390 -11.154 1.256 1.00 0.00 C ATOM 1256 C PRO A 87 -5.678 -10.294 2.295 1.00 0.00 C ATOM 1257 O PRO A 87 -5.884 -10.459 3.498 1.00 0.00 O ATOM 1258 CB PRO A 87 -7.787 -10.598 0.968 1.00 0.00 C ATOM 1259 CG PRO A 87 -8.694 -11.372 1.862 1.00 0.00 C ATOM 1260 CD PRO A 87 -8.093 -12.746 1.972 1.00 0.00 C ATOM 0 HA PRO A 87 -5.730 -11.156 0.388 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -7.839 -9.530 1.179 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -8.057 -10.729 -0.080 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -8.772 -10.901 2.842 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -9.702 -11.419 1.450 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -8.277 -13.188 2.951 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.511 -13.428 1.231 1.00 0.00 H new ATOM 1268 N ALA A 88 -4.841 -9.376 1.824 1.00 0.00 N ATOM 1269 CA ALA A 88 -4.101 -8.489 2.712 1.00 0.00 C ATOM 1270 C ALA A 88 -4.151 -7.048 2.215 1.00 0.00 C ATOM 1271 O ALA A 88 -3.633 -6.733 1.143 1.00 0.00 O ATOM 1272 CB ALA A 88 -2.659 -8.954 2.843 1.00 0.00 C ATOM 0 H ALA A 88 -4.658 -9.227 0.832 1.00 0.00 H new ATOM 0 HA ALA A 88 -4.572 -8.524 3.694 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -2.119 -8.281 3.509 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.638 -9.964 3.252 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.185 -8.950 1.862 1.00 0.00 H new ATOM 1278 N SER A 89 -4.776 -6.176 3.001 1.00 0.00 N ATOM 1279 CA SER A 89 -4.897 -4.769 2.638 1.00 0.00 C ATOM 1280 C SER A 89 -4.199 -3.881 3.664 1.00 0.00 C ATOM 1281 O SER A 89 -3.948 -4.300 4.795 1.00 0.00 O ATOM 1282 CB SER A 89 -6.370 -4.375 2.523 1.00 0.00 C ATOM 1283 OG SER A 89 -6.512 -2.975 2.358 1.00 0.00 O ATOM 0 H SER A 89 -5.206 -6.420 3.893 1.00 0.00 H new ATOM 0 HA SER A 89 -4.414 -4.626 1.671 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.823 -4.892 1.677 1.00 0.00 H new ATOM 0 HB3 SER A 89 -6.906 -4.695 3.416 1.00 0.00 H new ATOM 0 HG SER A 89 -6.227 -2.721 1.455 1.00 0.00 H new ATOM 1289 N ILE A 90 -3.889 -2.654 3.262 1.00 0.00 N ATOM 1290 CA ILE A 90 -3.222 -1.707 4.145 1.00 0.00 C ATOM 1291 C ILE A 90 -3.559 -0.269 3.766 1.00 0.00 C ATOM 1292 O ILE A 90 -3.821 0.033 2.601 1.00 0.00 O ATOM 1293 CB ILE A 90 -1.692 -1.889 4.114 1.00 0.00 C ATOM 1294 CG1 ILE A 90 -1.021 -0.913 5.082 1.00 0.00 C ATOM 1295 CG2 ILE A 90 -1.164 -1.689 2.702 1.00 0.00 C ATOM 1296 CD1 ILE A 90 0.443 -1.209 5.322 1.00 0.00 C ATOM 0 H ILE A 90 -4.089 -2.292 2.330 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.584 -1.908 5.153 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.455 -2.905 4.429 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.119 0.099 4.690 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.549 -0.938 6.035 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.082 -1.821 2.696 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.622 -2.420 2.035 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.409 -0.683 2.361 1.00 0.00 H new ATOM 0 HD11 ILE A 90 0.853 -0.477 6.018 1.00 0.00 H new ATOM 0 HD12 ILE A 90 0.548 -2.209 5.743 1.00 0.00 H new ATOM 0 HD13 ILE A 90 0.985 -1.155 4.378 1.00 0.00 H new ATOM 1308 N THR A 91 -3.549 0.618 4.756 1.00 0.00 N ATOM 1309 CA THR A 91 -3.853 2.024 4.528 1.00 0.00 C ATOM 1310 C THR A 91 -2.581 2.863 4.498 1.00 0.00 C ATOM 1311 O THR A 91 -1.894 3.001 5.510 1.00 0.00 O ATOM 1312 CB THR A 91 -4.797 2.579 5.611 1.00 0.00 C ATOM 1313 OG1 THR A 91 -5.929 1.716 5.764 1.00 0.00 O ATOM 1314 CG2 THR A 91 -5.266 3.981 5.254 1.00 0.00 C ATOM 0 H THR A 91 -3.333 0.386 5.726 1.00 0.00 H new ATOM 0 HA THR A 91 -4.349 2.087 3.560 1.00 0.00 H new ATOM 0 HB THR A 91 -4.247 2.626 6.551 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.523 2.075 6.456 1.00 0.00 H new ATOM 0 HG21 THR A 91 -5.931 4.352 6.034 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.404 4.642 5.168 1.00 0.00 H new ATOM 0 HG23 THR A 91 -5.799 3.955 4.304 1.00 0.00 H new ATOM 1322 N PHE A 92 -2.275 3.424 3.333 1.00 0.00 N ATOM 1323 CA PHE A 92 -1.084 4.251 3.172 1.00 0.00 C ATOM 1324 C PHE A 92 -1.393 5.494 2.343 1.00 0.00 C ATOM 1325 O PHE A 92 -1.986 5.407 1.267 1.00 0.00 O ATOM 1326 CB PHE A 92 0.036 3.447 2.508 1.00 0.00 C ATOM 1327 CG PHE A 92 -0.258 3.076 1.081 1.00 0.00 C ATOM 1328 CD1 PHE A 92 -0.142 4.017 0.070 1.00 0.00 C ATOM 1329 CD2 PHE A 92 -0.649 1.789 0.753 1.00 0.00 C ATOM 1330 CE1 PHE A 92 -0.410 3.679 -1.243 1.00 0.00 C ATOM 1331 CE2 PHE A 92 -0.918 1.446 -0.558 1.00 0.00 C ATOM 1332 CZ PHE A 92 -0.800 2.392 -1.557 1.00 0.00 C ATOM 0 H PHE A 92 -2.835 3.321 2.487 1.00 0.00 H new ATOM 0 HA PHE A 92 -0.756 4.568 4.162 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.958 4.027 2.542 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.210 2.538 3.083 1.00 0.00 H new ATOM 0 HD1 PHE A 92 0.161 5.025 0.311 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -0.745 1.045 1.530 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -0.315 4.420 -2.022 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -1.221 0.438 -0.801 1.00 0.00 H new ATOM 0 HZ PHE A 92 -1.012 2.126 -2.582 1.00 0.00 H new ATOM 1342 N THR A 93 -0.988 6.654 2.852 1.00 0.00 N ATOM 1343 CA THR A 93 -1.223 7.916 2.161 1.00 0.00 C ATOM 1344 C THR A 93 -0.276 8.078 0.978 1.00 0.00 C ATOM 1345 O THR A 93 0.863 7.610 1.009 1.00 0.00 O ATOM 1346 CB THR A 93 -1.050 9.116 3.111 1.00 0.00 C ATOM 1347 OG1 THR A 93 -1.822 8.915 4.300 1.00 0.00 O ATOM 1348 CG2 THR A 93 -1.480 10.408 2.433 1.00 0.00 C ATOM 0 H THR A 93 -0.496 6.745 3.741 1.00 0.00 H new ATOM 0 HA THR A 93 -2.251 7.893 1.800 1.00 0.00 H new ATOM 0 HB THR A 93 0.005 9.195 3.373 1.00 0.00 H new ATOM 0 HG1 THR A 93 -1.705 9.681 4.899 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.349 11.242 3.123 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.871 10.573 1.544 1.00 0.00 H new ATOM 0 HG23 THR A 93 -2.529 10.336 2.145 1.00 0.00 H new ATOM 1356 N THR A 94 -0.754 8.747 -0.068 1.00 0.00 N ATOM 1357 CA THR A 94 0.050 8.971 -1.263 1.00 0.00 C ATOM 1358 C THR A 94 0.686 10.356 -1.246 1.00 0.00 C ATOM 1359 O THR A 94 0.163 11.283 -0.629 1.00 0.00 O ATOM 1360 CB THR A 94 -0.794 8.823 -2.543 1.00 0.00 C ATOM 1361 OG1 THR A 94 -2.095 9.386 -2.341 1.00 0.00 O ATOM 1362 CG2 THR A 94 -0.926 7.359 -2.939 1.00 0.00 C ATOM 0 H THR A 94 -1.693 9.143 -0.111 1.00 0.00 H new ATOM 0 HA THR A 94 0.834 8.214 -1.263 1.00 0.00 H new ATOM 0 HB THR A 94 -0.288 9.357 -3.348 1.00 0.00 H new ATOM 0 HG1 THR A 94 -2.279 10.045 -3.042 1.00 0.00 H new ATOM 0 HG21 THR A 94 -1.526 7.280 -3.845 1.00 0.00 H new ATOM 0 HG22 THR A 94 0.064 6.941 -3.121 1.00 0.00 H new ATOM 0 HG23 THR A 94 -1.410 6.807 -2.134 1.00 0.00 H new ATOM 1370 N GLY A 95 1.820 10.490 -1.927 1.00 0.00 N ATOM 1371 CA GLY A 95 2.510 11.766 -1.976 1.00 0.00 C ATOM 1372 C GLY A 95 2.923 12.256 -0.602 1.00 0.00 C ATOM 1373 O GLY A 95 2.285 13.143 -0.034 1.00 0.00 O ATOM 0 H GLY A 95 2.273 9.738 -2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 95 3.395 11.673 -2.606 1.00 0.00 H new ATOM 0 HA3 GLY A 95 1.862 12.508 -2.443 1.00 0.00 H new ATOM 1377 N LEU A 96 3.991 11.676 -0.065 1.00 0.00 N ATOM 1378 CA LEU A 96 4.488 12.058 1.252 1.00 0.00 C ATOM 1379 C LEU A 96 5.715 12.956 1.132 1.00 0.00 C ATOM 1380 O LEU A 96 6.753 12.688 1.737 1.00 0.00 O ATOM 1381 CB LEU A 96 4.832 10.811 2.069 1.00 0.00 C ATOM 1382 CG LEU A 96 4.979 11.017 3.578 1.00 0.00 C ATOM 1383 CD1 LEU A 96 3.630 11.328 4.207 1.00 0.00 C ATOM 1384 CD2 LEU A 96 5.602 9.790 4.226 1.00 0.00 C ATOM 0 H LEU A 96 4.529 10.940 -0.521 1.00 0.00 H new ATOM 0 HA LEU A 96 3.702 12.615 1.763 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.057 10.064 1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.765 10.396 1.686 1.00 0.00 H new ATOM 0 HG LEU A 96 5.641 11.867 3.747 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.753 11.471 5.280 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.223 12.237 3.764 1.00 0.00 H new ATOM 0 HD13 LEU A 96 2.945 10.499 4.028 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.699 9.955 5.299 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.967 8.922 4.048 1.00 0.00 H new ATOM 0 HD23 LEU A 96 6.588 9.612 3.796 1.00 0.00 H new ATOM 1396 N GLU A 97 5.587 14.023 0.349 1.00 0.00 N ATOM 1397 CA GLU A 97 6.685 14.961 0.152 1.00 0.00 C ATOM 1398 C GLU A 97 6.732 15.990 1.279 1.00 0.00 C ATOM 1399 O GLU A 97 7.760 16.162 1.934 1.00 0.00 O ATOM 1400 CB GLU A 97 6.544 15.672 -1.196 1.00 0.00 C ATOM 1401 CG GLU A 97 6.751 14.756 -2.391 1.00 0.00 C ATOM 1402 CD GLU A 97 5.470 14.075 -2.833 1.00 0.00 C ATOM 1403 OE1 GLU A 97 4.401 14.716 -2.762 1.00 0.00 O ATOM 1404 OE2 GLU A 97 5.538 12.901 -3.251 1.00 0.00 O ATOM 0 H GLU A 97 4.734 14.259 -0.159 1.00 0.00 H new ATOM 0 HA GLU A 97 7.617 14.395 0.161 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.552 16.120 -1.259 1.00 0.00 H new ATOM 0 HB3 GLU A 97 7.266 16.488 -1.245 1.00 0.00 H new ATOM 0 HG2 GLU A 97 7.156 15.334 -3.222 1.00 0.00 H new ATOM 0 HG3 GLU A 97 7.493 13.998 -2.139 1.00 0.00 H new ATOM 1411 N ALA A 98 5.611 16.669 1.498 1.00 0.00 N ATOM 1412 CA ALA A 98 5.523 17.678 2.546 1.00 0.00 C ATOM 1413 C ALA A 98 4.224 17.540 3.334 1.00 0.00 C ATOM 1414 O ALA A 98 3.127 17.713 2.803 1.00 0.00 O ATOM 1415 CB ALA A 98 5.632 19.073 1.946 1.00 0.00 C ATOM 0 H ALA A 98 4.752 16.539 0.964 1.00 0.00 H new ATOM 0 HA ALA A 98 6.354 17.524 3.235 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.565 19.817 2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 98 6.589 19.175 1.433 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.821 19.227 1.234 1.00 0.00 H new ATOM 1421 N PRO A 99 4.349 17.221 4.629 1.00 0.00 N ATOM 1422 CA PRO A 99 3.196 17.051 5.518 1.00 0.00 C ATOM 1423 C PRO A 99 2.491 18.371 5.811 1.00 0.00 C ATOM 1424 O PRO A 99 1.502 18.409 6.543 1.00 0.00 O ATOM 1425 CB PRO A 99 3.813 16.480 6.797 1.00 0.00 C ATOM 1426 CG PRO A 99 5.227 16.949 6.778 1.00 0.00 C ATOM 1427 CD PRO A 99 5.627 16.999 5.329 1.00 0.00 C ATOM 0 HA PRO A 99 2.432 16.412 5.075 1.00 0.00 H new ATOM 0 HB2 PRO A 99 3.289 16.838 7.683 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.757 15.392 6.812 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.319 17.931 7.242 1.00 0.00 H new ATOM 0 HG3 PRO A 99 5.871 16.270 7.337 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.336 17.804 5.136 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.103 16.071 5.011 1.00 0.00 H new ATOM 1435 N ARG A 100 3.006 19.453 5.234 1.00 0.00 N ATOM 1436 CA ARG A 100 2.426 20.776 5.435 1.00 0.00 C ATOM 1437 C ARG A 100 0.943 20.779 5.074 1.00 0.00 C ATOM 1438 O ARG A 100 0.212 21.703 5.427 1.00 0.00 O ATOM 1439 CB ARG A 100 3.170 21.814 4.593 1.00 0.00 C ATOM 1440 CG ARG A 100 3.157 21.512 3.103 1.00 0.00 C ATOM 1441 CD ARG A 100 3.447 22.757 2.279 1.00 0.00 C ATOM 1442 NE ARG A 100 4.876 22.933 2.038 1.00 0.00 N ATOM 1443 CZ ARG A 100 5.425 24.091 1.685 1.00 0.00 C ATOM 1444 NH1 ARG A 100 4.667 25.169 1.534 1.00 0.00 N ATOM 1445 NH2 ARG A 100 6.733 24.172 1.483 1.00 0.00 N ATOM 0 H ARG A 100 3.823 19.439 4.624 1.00 0.00 H new ATOM 0 HA ARG A 100 2.526 21.034 6.489 1.00 0.00 H new ATOM 0 HB2 ARG A 100 2.723 22.794 4.761 1.00 0.00 H new ATOM 0 HB3 ARG A 100 4.204 21.873 4.934 1.00 0.00 H new ATOM 0 HG2 ARG A 100 3.899 20.746 2.880 1.00 0.00 H new ATOM 0 HG3 ARG A 100 2.185 21.106 2.821 1.00 0.00 H new ATOM 0 HD2 ARG A 100 2.924 22.690 1.325 1.00 0.00 H new ATOM 0 HD3 ARG A 100 3.056 23.633 2.796 1.00 0.00 H new ATOM 0 HE ARG A 100 5.487 22.123 2.146 1.00 0.00 H new ATOM 0 HH11 ARG A 100 3.661 25.111 1.689 1.00 0.00 H new ATOM 0 HH12 ARG A 100 5.091 26.056 1.263 1.00 0.00 H new ATOM 0 HH21 ARG A 100 7.319 23.345 1.598 1.00 0.00 H new ATOM 0 HH22 ARG A 100 7.153 25.061 1.212 1.00 0.00 H new ATOM 1459 N ASP A 101 0.509 19.741 4.369 1.00 0.00 N ATOM 1460 CA ASP A 101 -0.886 19.623 3.961 1.00 0.00 C ATOM 1461 C ASP A 101 -1.486 18.308 4.447 1.00 0.00 C ATOM 1462 O ASP A 101 -2.318 18.290 5.355 1.00 0.00 O ATOM 1463 CB ASP A 101 -1.005 19.720 2.440 1.00 0.00 C ATOM 1464 CG ASP A 101 -0.176 20.853 1.866 1.00 0.00 C ATOM 1465 OD1 ASP A 101 0.097 21.823 2.604 1.00 0.00 O ATOM 1466 OD2 ASP A 101 0.199 20.770 0.678 1.00 0.00 O ATOM 0 H ASP A 101 1.103 18.969 4.068 1.00 0.00 H new ATOM 0 HA ASP A 101 -1.441 20.444 4.414 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.687 18.778 1.993 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.051 19.865 2.169 1.00 0.00 H new ATOM 1471 N LEU A 102 -1.059 17.207 3.837 1.00 0.00 N ATOM 1472 CA LEU A 102 -1.554 15.886 4.207 1.00 0.00 C ATOM 1473 C LEU A 102 -1.377 15.637 5.701 1.00 0.00 C ATOM 1474 O LEU A 102 -0.452 16.159 6.322 1.00 0.00 O ATOM 1475 CB LEU A 102 -0.824 14.805 3.408 1.00 0.00 C ATOM 1476 CG LEU A 102 0.701 14.813 3.505 1.00 0.00 C ATOM 1477 CD1 LEU A 102 1.167 13.946 4.664 1.00 0.00 C ATOM 1478 CD2 LEU A 102 1.321 14.338 2.199 1.00 0.00 C ATOM 0 H LEU A 102 -0.371 17.204 3.084 1.00 0.00 H new ATOM 0 HA LEU A 102 -2.618 15.845 3.975 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.184 13.831 3.740 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -1.102 14.907 2.359 1.00 0.00 H new ATOM 0 HG LEU A 102 1.029 15.836 3.689 1.00 0.00 H new ATOM 0 HD11 LEU A 102 2.256 13.964 4.717 1.00 0.00 H new ATOM 0 HD12 LEU A 102 0.752 14.330 5.596 1.00 0.00 H new ATOM 0 HD13 LEU A 102 0.828 12.921 4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.407 14.350 2.286 1.00 0.00 H new ATOM 0 HD22 LEU A 102 0.986 13.323 1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.015 15.000 1.389 1.00 0.00 H new ATOM 1490 N GLU A 103 -2.271 14.834 6.271 1.00 0.00 N ATOM 1491 CA GLU A 103 -2.212 14.514 7.692 1.00 0.00 C ATOM 1492 C GLU A 103 -0.959 13.705 8.018 1.00 0.00 C ATOM 1493 O GLU A 103 -0.583 12.799 7.275 1.00 0.00 O ATOM 1494 CB GLU A 103 -3.459 13.735 8.116 1.00 0.00 C ATOM 1495 CG GLU A 103 -3.509 13.426 9.602 1.00 0.00 C ATOM 1496 CD GLU A 103 -3.377 14.669 10.461 1.00 0.00 C ATOM 1497 OE1 GLU A 103 -3.922 15.722 10.068 1.00 0.00 O ATOM 1498 OE2 GLU A 103 -2.730 14.589 11.526 1.00 0.00 O ATOM 0 H GLU A 103 -3.043 14.394 5.771 1.00 0.00 H new ATOM 0 HA GLU A 103 -2.172 15.452 8.246 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -4.345 14.308 7.843 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -3.500 12.800 7.558 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -4.450 12.927 9.834 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -2.708 12.730 9.852 1.00 0.00 H new ATOM 1505 N ALA A 104 -0.318 14.039 9.132 1.00 0.00 N ATOM 1506 CA ALA A 104 0.891 13.345 9.557 1.00 0.00 C ATOM 1507 C ALA A 104 0.994 13.302 11.077 1.00 0.00 C ATOM 1508 O ALA A 104 0.897 14.331 11.746 1.00 0.00 O ATOM 1509 CB ALA A 104 2.121 14.013 8.960 1.00 0.00 C ATOM 0 H ALA A 104 -0.616 14.787 9.758 1.00 0.00 H new ATOM 0 HA ALA A 104 0.837 12.318 9.194 1.00 0.00 H new ATOM 0 HB1 ALA A 104 3.017 13.484 9.286 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.059 13.985 7.872 1.00 0.00 H new ATOM 0 HB3 ALA A 104 2.170 15.050 9.294 1.00 0.00 H new ATOM 1515 N LYS A 105 1.193 12.105 11.619 1.00 0.00 N ATOM 1516 CA LYS A 105 1.311 11.927 13.061 1.00 0.00 C ATOM 1517 C LYS A 105 2.763 12.066 13.509 1.00 0.00 C ATOM 1518 O LYS A 105 3.677 11.584 12.842 1.00 0.00 O ATOM 1519 CB LYS A 105 0.769 10.558 13.473 1.00 0.00 C ATOM 1520 CG LYS A 105 1.584 9.393 12.936 1.00 0.00 C ATOM 1521 CD LYS A 105 1.019 8.058 13.393 1.00 0.00 C ATOM 1522 CE LYS A 105 -0.216 7.673 12.594 1.00 0.00 C ATOM 1523 NZ LYS A 105 0.131 7.231 11.215 1.00 0.00 N ATOM 0 H LYS A 105 1.276 11.243 11.080 1.00 0.00 H new ATOM 0 HA LYS A 105 0.722 12.705 13.547 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.742 10.500 14.561 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.259 10.463 13.123 1.00 0.00 H new ATOM 0 HG2 LYS A 105 1.598 9.429 11.847 1.00 0.00 H new ATOM 0 HG3 LYS A 105 2.617 9.486 13.271 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.779 7.284 13.286 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.766 8.112 14.452 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.747 6.872 13.109 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -0.895 8.524 12.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -0.695 6.773 10.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 0.410 8.056 10.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 0.920 6.555 11.255 1.00 0.00 H new ATOM 1537 N GLU A 106 2.966 12.727 14.644 1.00 0.00 N ATOM 1538 CA GLU A 106 4.307 12.928 15.182 1.00 0.00 C ATOM 1539 C GLU A 106 4.318 12.753 16.697 1.00 0.00 C ATOM 1540 O GLU A 106 3.313 12.989 17.368 1.00 0.00 O ATOM 1541 CB GLU A 106 4.824 14.321 14.815 1.00 0.00 C ATOM 1542 CG GLU A 106 6.339 14.416 14.770 1.00 0.00 C ATOM 1543 CD GLU A 106 6.960 13.400 13.830 1.00 0.00 C ATOM 1544 OE1 GLU A 106 6.270 12.972 12.882 1.00 0.00 O ATOM 1545 OE2 GLU A 106 8.134 13.034 14.043 1.00 0.00 O ATOM 0 H GLU A 106 2.220 13.132 15.209 1.00 0.00 H new ATOM 0 HA GLU A 106 4.963 12.177 14.742 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.422 14.604 13.842 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.445 15.042 15.539 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.627 15.419 14.456 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.738 14.269 15.773 1.00 0.00 H new ATOM 1552 N VAL A 107 5.462 12.336 17.230 1.00 0.00 N ATOM 1553 CA VAL A 107 5.606 12.128 18.666 1.00 0.00 C ATOM 1554 C VAL A 107 4.925 13.242 19.454 1.00 0.00 C ATOM 1555 O VAL A 107 4.719 14.342 18.942 1.00 0.00 O ATOM 1556 CB VAL A 107 7.089 12.056 19.077 1.00 0.00 C ATOM 1557 CG1 VAL A 107 7.783 10.901 18.373 1.00 0.00 C ATOM 1558 CG2 VAL A 107 7.789 13.373 18.778 1.00 0.00 C ATOM 0 H VAL A 107 6.303 12.135 16.689 1.00 0.00 H new ATOM 0 HA VAL A 107 5.126 11.177 18.898 1.00 0.00 H new ATOM 0 HB VAL A 107 7.142 11.879 20.151 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.830 10.866 18.676 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.296 9.964 18.644 1.00 0.00 H new ATOM 0 HG13 VAL A 107 7.722 11.043 17.294 1.00 0.00 H new ATOM 0 HG21 VAL A 107 8.836 13.304 19.075 1.00 0.00 H new ATOM 0 HG22 VAL A 107 7.727 13.584 17.710 1.00 0.00 H new ATOM 0 HG23 VAL A 107 7.306 14.176 19.335 1.00 0.00 H new ATOM 1568 N THR A 108 4.577 12.949 20.703 1.00 0.00 N ATOM 1569 CA THR A 108 3.919 13.925 21.562 1.00 0.00 C ATOM 1570 C THR A 108 4.760 14.228 22.796 1.00 0.00 C ATOM 1571 O THR A 108 5.473 13.369 23.317 1.00 0.00 O ATOM 1572 CB THR A 108 2.529 13.432 22.009 1.00 0.00 C ATOM 1573 OG1 THR A 108 2.660 12.226 22.770 1.00 0.00 O ATOM 1574 CG2 THR A 108 1.629 13.187 20.808 1.00 0.00 C ATOM 0 H THR A 108 4.740 12.043 21.142 1.00 0.00 H new ATOM 0 HA THR A 108 3.802 14.836 20.974 1.00 0.00 H new ATOM 0 HB THR A 108 2.075 14.205 22.629 1.00 0.00 H new ATOM 0 HG1 THR A 108 1.773 11.919 23.052 1.00 0.00 H new ATOM 0 HG21 THR A 108 0.654 12.840 21.149 1.00 0.00 H new ATOM 0 HG22 THR A 108 1.509 14.115 20.248 1.00 0.00 H new ATOM 0 HG23 THR A 108 2.079 12.431 20.165 1.00 0.00 H new ATOM 1582 N PRO A 109 4.677 15.477 23.277 1.00 0.00 N ATOM 1583 CA PRO A 109 5.425 15.922 24.458 1.00 0.00 C ATOM 1584 C PRO A 109 4.907 15.286 25.744 1.00 0.00 C ATOM 1585 O PRO A 109 3.792 14.765 25.786 1.00 0.00 O ATOM 1586 CB PRO A 109 5.191 17.434 24.477 1.00 0.00 C ATOM 1587 CG PRO A 109 3.901 17.627 23.757 1.00 0.00 C ATOM 1588 CD PRO A 109 3.848 16.552 22.707 1.00 0.00 C ATOM 0 HA PRO A 109 6.477 15.641 24.405 1.00 0.00 H new ATOM 0 HB2 PRO A 109 5.135 17.813 25.497 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.004 17.967 23.983 1.00 0.00 H new ATOM 0 HG2 PRO A 109 3.056 17.546 24.441 1.00 0.00 H new ATOM 0 HG3 PRO A 109 3.851 18.617 23.304 1.00 0.00 H new ATOM 0 HD2 PRO A 109 2.826 16.218 22.525 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.244 16.902 21.753 1.00 0.00 H new ATOM 1596 N SER A 110 5.722 15.334 26.793 1.00 0.00 N ATOM 1597 CA SER A 110 5.348 14.761 28.080 1.00 0.00 C ATOM 1598 C SER A 110 5.167 15.852 29.129 1.00 0.00 C ATOM 1599 O SER A 110 5.796 16.908 29.058 1.00 0.00 O ATOM 1600 CB SER A 110 6.409 13.761 28.545 1.00 0.00 C ATOM 1601 OG SER A 110 7.536 14.428 29.085 1.00 0.00 O ATOM 0 H SER A 110 6.647 15.764 26.776 1.00 0.00 H new ATOM 0 HA SER A 110 4.398 14.241 27.955 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.982 13.096 29.295 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.719 13.138 27.706 1.00 0.00 H new ATOM 0 HG SER A 110 8.199 13.767 29.376 1.00 0.00 H new ATOM 1607 N GLY A 111 4.302 15.591 30.104 1.00 0.00 N ATOM 1608 CA GLY A 111 4.053 16.559 31.156 1.00 0.00 C ATOM 1609 C GLY A 111 3.343 15.952 32.349 1.00 0.00 C ATOM 1610 O GLY A 111 2.717 14.896 32.253 1.00 0.00 O ATOM 0 H GLY A 111 3.769 14.725 30.184 1.00 0.00 H new ATOM 0 HA2 GLY A 111 5.001 16.988 31.481 1.00 0.00 H new ATOM 0 HA3 GLY A 111 3.452 17.377 30.758 1.00 0.00 H new ATOM 1614 N PRO A 112 3.437 16.625 33.505 1.00 0.00 N ATOM 1615 CA PRO A 112 2.805 16.162 34.745 1.00 0.00 C ATOM 1616 C PRO A 112 1.285 16.267 34.693 1.00 0.00 C ATOM 1617 O PRO A 112 0.725 16.888 33.789 1.00 0.00 O ATOM 1618 CB PRO A 112 3.372 17.107 35.806 1.00 0.00 C ATOM 1619 CG PRO A 112 3.733 18.344 35.058 1.00 0.00 C ATOM 1620 CD PRO A 112 4.168 17.889 33.692 1.00 0.00 C ATOM 0 HA PRO A 112 3.010 15.109 34.940 1.00 0.00 H new ATOM 0 HB2 PRO A 112 2.637 17.315 36.584 1.00 0.00 H new ATOM 0 HB3 PRO A 112 4.243 16.673 36.298 1.00 0.00 H new ATOM 0 HG2 PRO A 112 2.882 19.022 34.991 1.00 0.00 H new ATOM 0 HG3 PRO A 112 4.533 18.886 35.562 1.00 0.00 H new ATOM 0 HD2 PRO A 112 3.911 18.619 32.925 1.00 0.00 H new ATOM 0 HD3 PRO A 112 5.247 17.741 33.642 1.00 0.00 H new ATOM 1628 N SER A 113 0.622 15.658 35.671 1.00 0.00 N ATOM 1629 CA SER A 113 -0.836 15.680 35.736 1.00 0.00 C ATOM 1630 C SER A 113 -1.311 16.131 37.114 1.00 0.00 C ATOM 1631 O SER A 113 -0.512 16.297 38.035 1.00 0.00 O ATOM 1632 CB SER A 113 -1.403 14.297 35.415 1.00 0.00 C ATOM 1633 OG SER A 113 -1.234 13.411 36.509 1.00 0.00 O ATOM 0 H SER A 113 1.070 15.143 36.429 1.00 0.00 H new ATOM 0 HA SER A 113 -1.198 16.393 34.995 1.00 0.00 H new ATOM 0 HB2 SER A 113 -2.462 14.382 35.172 1.00 0.00 H new ATOM 0 HB3 SER A 113 -0.905 13.892 34.534 1.00 0.00 H new ATOM 0 HG SER A 113 -1.606 12.534 36.280 1.00 0.00 H new ATOM 1639 N SER A 114 -2.619 16.329 37.246 1.00 0.00 N ATOM 1640 CA SER A 114 -3.202 16.763 38.511 1.00 0.00 C ATOM 1641 C SER A 114 -4.484 15.993 38.811 1.00 0.00 C ATOM 1642 O SER A 114 -4.927 15.167 38.013 1.00 0.00 O ATOM 1643 CB SER A 114 -3.493 18.265 38.472 1.00 0.00 C ATOM 1644 OG SER A 114 -2.369 19.013 38.902 1.00 0.00 O ATOM 0 H SER A 114 -3.295 16.196 36.493 1.00 0.00 H new ATOM 0 HA SER A 114 -2.483 16.559 39.304 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.764 18.560 37.458 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.349 18.490 39.109 1.00 0.00 H new ATOM 0 HG SER A 114 -2.579 19.969 38.866 1.00 0.00 H new ATOM 1650 N GLY A 115 -5.076 16.269 39.969 1.00 0.00 N ATOM 1651 CA GLY A 115 -6.301 15.594 40.356 1.00 0.00 C ATOM 1652 C GLY A 115 -6.591 15.725 41.837 1.00 0.00 C ATOM 1653 O GLY A 115 -7.683 16.139 42.229 1.00 0.00 O ATOM 0 H GLY A 115 -4.729 16.948 40.646 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -7.135 16.006 39.788 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -6.229 14.538 40.095 1.00 0.00 H new TER 1657 GLY A 115