USER MOD reduce.3.24.130724 H: found=0, std=0, add=723, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 723 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 67 SER OG : rot 27:sc= 0.462 USER MOD Set 1.2: A 68 ASN : amide:sc= -0.192 K(o=0.27,f=-5.3!) USER MOD Set 2.1: A 3 HIS : no HD1:sc= -0.0238 X(o=-0.049,f=0) USER MOD Set 2.2: A 5 HIS : no HD1:sc= -0.025 X(o=-0.049,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HE2:sc= 0.0109 K(o=0.011,f=-1) USER MOD Single : A 4 HIS : no HD1:sc=-0.00186 X(o=-0.0019,f=-0.0034) USER MOD Single : A 6 HIS : no HD1:sc= -0.12 X(o=-0.12,f=-0.0032) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 SER OG : rot 180:sc=-0.00461 USER MOD Single : A 9 SER OG : rot -170:sc= -0.355 USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 MET CE :methyl -162:sc= -0.0641 (180deg=-0.403) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 149:sc= 0.4 USER MOD Single : A 30 SER OG : rot 42:sc= 0.0869 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -165:sc= 0.406 (180deg=-0.1) USER MOD Single : A 44 TYR OH : rot 30:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.111 K(o=-0.11,f=-1.3) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ -108:sc= -1.11 (180deg=-3.37!) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.593 USER MOD Single : A 62 THR OG1 : rot -33:sc= 0.286 USER MOD Single : A 70 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.046) USER MOD Single : A 71 GLN : amide:sc= -0.176 X(o=-0.18,f=-0.32) USER MOD Single : A 74 GLN : amide:sc=-0.00831 K(o=-0.0083,f=-1.6!) USER MOD Single : A 75 TYR OH : rot 180:sc= -0.894 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -28:sc= 0.194 USER MOD Single : A 79 HIS : no HE2:sc= 0.233 K(o=0.23,f=-1.1) USER MOD Single : A 82 ASN : amide:sc= -1.11 X(o=-1.1,f=-1.6) USER MOD Single : A 91 THR OG1 : rot -37:sc= 0.8 USER MOD Single : A 92 THR OG1 : rot -36:sc= 0.0647 USER MOD Single : A 93 SER OG : rot 180:sc= 0.0122 USER MOD Single : A 95 THR OG1 : rot 44:sc= 0.165 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.959 -34.965 8.673 1.00 0.00 N ATOM 2 CA MET A 1 7.622 -33.879 9.419 1.00 0.00 C ATOM 3 C MET A 1 8.272 -32.891 8.435 1.00 0.00 C ATOM 4 O MET A 1 9.319 -33.209 7.848 1.00 0.00 O ATOM 5 CB MET A 1 8.698 -34.433 10.392 1.00 0.00 C ATOM 6 CG MET A 1 8.183 -35.351 11.495 1.00 0.00 C ATOM 7 SD MET A 1 9.486 -35.831 12.646 1.00 0.00 S ATOM 8 CE MET A 1 8.598 -36.964 13.707 1.00 0.00 C ATOM 0 H1 MET A 1 6.522 -35.630 9.343 1.00 0.00 H new ATOM 0 H2 MET A 1 6.226 -34.564 8.054 1.00 0.00 H new ATOM 0 H3 MET A 1 7.662 -35.469 8.095 1.00 0.00 H new ATOM 0 HA MET A 1 6.864 -33.365 10.010 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.442 -34.977 9.810 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.210 -33.590 10.856 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.385 -34.848 12.041 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.748 -36.245 11.048 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.271 -37.348 14.474 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.767 -36.442 14.182 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.214 -37.793 13.113 1.00 0.00 H new ATOM 20 N HIS A 2 7.597 -31.745 8.215 1.00 0.00 N ATOM 21 CA HIS A 2 8.145 -30.563 7.514 1.00 0.00 C ATOM 22 C HIS A 2 7.109 -29.428 7.548 1.00 0.00 C ATOM 23 O HIS A 2 6.223 -29.356 6.693 1.00 0.00 O ATOM 24 CB HIS A 2 8.622 -30.856 6.039 1.00 0.00 C ATOM 25 CG HIS A 2 10.119 -30.776 5.865 1.00 0.00 C ATOM 26 ND1 HIS A 2 10.940 -31.877 5.953 1.00 0.00 N ATOM 27 CD2 HIS A 2 10.942 -29.718 5.646 1.00 0.00 C ATOM 28 CE1 HIS A 2 12.193 -31.504 5.794 1.00 0.00 C ATOM 29 NE2 HIS A 2 12.223 -30.203 5.600 1.00 0.00 N ATOM 0 H HIS A 2 6.635 -31.611 8.526 1.00 0.00 H new ATOM 0 HA HIS A 2 9.047 -30.264 8.048 1.00 0.00 H new ATOM 0 HB2 HIS A 2 8.282 -31.849 5.746 1.00 0.00 H new ATOM 0 HB3 HIS A 2 8.147 -30.145 5.364 1.00 0.00 H new ATOM 0 HD1 HIS A 2 10.627 -32.834 6.116 1.00 0.00 H new ATOM 0 HD2 HIS A 2 10.643 -28.687 5.530 1.00 0.00 H new ATOM 0 HE1 HIS A 2 13.053 -32.157 5.819 1.00 0.00 H new ATOM 38 N HIS A 3 7.219 -28.573 8.579 1.00 0.00 N ATOM 39 CA HIS A 3 6.404 -27.360 8.720 1.00 0.00 C ATOM 40 C HIS A 3 6.888 -26.328 7.684 1.00 0.00 C ATOM 41 O HIS A 3 7.788 -25.525 7.961 1.00 0.00 O ATOM 42 CB HIS A 3 6.510 -26.825 10.181 1.00 0.00 C ATOM 43 CG HIS A 3 5.616 -25.660 10.507 1.00 0.00 C ATOM 44 ND1 HIS A 3 4.322 -25.809 10.953 1.00 0.00 N ATOM 45 CD2 HIS A 3 5.852 -24.329 10.489 1.00 0.00 C ATOM 46 CE1 HIS A 3 3.803 -24.625 11.196 1.00 0.00 C ATOM 47 NE2 HIS A 3 4.713 -23.708 10.924 1.00 0.00 N ATOM 0 H HIS A 3 7.882 -28.708 9.342 1.00 0.00 H new ATOM 0 HA HIS A 3 5.351 -27.570 8.531 1.00 0.00 H new ATOM 0 HB2 HIS A 3 6.280 -27.641 10.866 1.00 0.00 H new ATOM 0 HB3 HIS A 3 7.543 -26.532 10.369 1.00 0.00 H new ATOM 0 HD2 HIS A 3 6.769 -23.846 10.187 1.00 0.00 H new ATOM 0 HE1 HIS A 3 2.803 -24.435 11.557 1.00 0.00 H new ATOM 0 HE2 HIS A 3 4.587 -22.701 11.022 1.00 0.00 H new ATOM 56 N HIS A 4 6.318 -26.402 6.472 1.00 0.00 N ATOM 57 CA HIS A 4 6.752 -25.595 5.320 1.00 0.00 C ATOM 58 C HIS A 4 5.533 -24.954 4.644 1.00 0.00 C ATOM 59 O HIS A 4 4.586 -25.652 4.279 1.00 0.00 O ATOM 60 CB HIS A 4 7.533 -26.484 4.309 1.00 0.00 C ATOM 61 CG HIS A 4 8.170 -25.719 3.167 1.00 0.00 C ATOM 62 ND1 HIS A 4 9.510 -25.403 3.139 1.00 0.00 N ATOM 63 CD2 HIS A 4 7.650 -25.212 2.014 1.00 0.00 C ATOM 64 CE1 HIS A 4 9.786 -24.741 2.036 1.00 0.00 C ATOM 65 NE2 HIS A 4 8.678 -24.613 1.338 1.00 0.00 N ATOM 0 H HIS A 4 5.539 -27.026 6.262 1.00 0.00 H new ATOM 0 HA HIS A 4 7.415 -24.803 5.667 1.00 0.00 H new ATOM 0 HB2 HIS A 4 8.311 -27.026 4.846 1.00 0.00 H new ATOM 0 HB3 HIS A 4 6.852 -27.229 3.897 1.00 0.00 H new ATOM 0 HD2 HIS A 4 6.620 -25.272 1.694 1.00 0.00 H new ATOM 0 HE1 HIS A 4 10.758 -24.366 1.752 1.00 0.00 H new ATOM 0 HE2 HIS A 4 8.598 -24.142 0.437 1.00 0.00 H new ATOM 74 N HIS A 5 5.567 -23.626 4.487 1.00 0.00 N ATOM 75 CA HIS A 5 4.541 -22.862 3.760 1.00 0.00 C ATOM 76 C HIS A 5 5.227 -22.013 2.687 1.00 0.00 C ATOM 77 O HIS A 5 6.244 -21.373 2.960 1.00 0.00 O ATOM 78 CB HIS A 5 3.732 -21.970 4.733 1.00 0.00 C ATOM 79 CG HIS A 5 3.044 -22.746 5.820 1.00 0.00 C ATOM 80 ND1 HIS A 5 3.486 -22.760 7.121 1.00 0.00 N ATOM 81 CD2 HIS A 5 1.969 -23.567 5.788 1.00 0.00 C ATOM 82 CE1 HIS A 5 2.723 -23.549 7.838 1.00 0.00 C ATOM 83 NE2 HIS A 5 1.792 -24.054 7.058 1.00 0.00 N ATOM 0 H HIS A 5 6.314 -23.043 4.864 1.00 0.00 H new ATOM 0 HA HIS A 5 3.841 -23.550 3.286 1.00 0.00 H new ATOM 0 HB2 HIS A 5 4.402 -21.239 5.186 1.00 0.00 H new ATOM 0 HB3 HIS A 5 2.986 -21.411 4.167 1.00 0.00 H new ATOM 0 HD2 HIS A 5 1.363 -23.796 4.924 1.00 0.00 H new ATOM 0 HE1 HIS A 5 2.839 -23.751 8.893 1.00 0.00 H new ATOM 0 HE2 HIS A 5 1.059 -24.701 7.349 1.00 0.00 H new ATOM 92 N HIS A 6 4.674 -22.033 1.473 1.00 0.00 N ATOM 93 CA HIS A 6 5.166 -21.245 0.338 1.00 0.00 C ATOM 94 C HIS A 6 3.965 -20.546 -0.307 1.00 0.00 C ATOM 95 O HIS A 6 3.080 -21.202 -0.863 1.00 0.00 O ATOM 96 CB HIS A 6 5.913 -22.157 -0.682 1.00 0.00 C ATOM 97 CG HIS A 6 6.597 -21.428 -1.833 1.00 0.00 C ATOM 98 ND1 HIS A 6 7.951 -21.536 -2.091 1.00 0.00 N ATOM 99 CD2 HIS A 6 6.111 -20.618 -2.808 1.00 0.00 C ATOM 100 CE1 HIS A 6 8.257 -20.832 -3.160 1.00 0.00 C ATOM 101 NE2 HIS A 6 7.161 -20.267 -3.614 1.00 0.00 N ATOM 0 H HIS A 6 3.860 -22.605 1.246 1.00 0.00 H new ATOM 0 HA HIS A 6 5.884 -20.498 0.676 1.00 0.00 H new ATOM 0 HB2 HIS A 6 6.664 -22.736 -0.144 1.00 0.00 H new ATOM 0 HB3 HIS A 6 5.199 -22.868 -1.098 1.00 0.00 H new ATOM 0 HD2 HIS A 6 5.084 -20.307 -2.926 1.00 0.00 H new ATOM 0 HE1 HIS A 6 9.242 -20.735 -3.591 1.00 0.00 H new ATOM 0 HE2 HIS A 6 7.102 -19.664 -4.435 1.00 0.00 H new ATOM 110 N HIS A 7 3.925 -19.214 -0.194 1.00 0.00 N ATOM 111 CA HIS A 7 2.916 -18.367 -0.852 1.00 0.00 C ATOM 112 C HIS A 7 3.602 -17.479 -1.884 1.00 0.00 C ATOM 113 O HIS A 7 4.790 -17.153 -1.745 1.00 0.00 O ATOM 114 CB HIS A 7 2.137 -17.516 0.185 1.00 0.00 C ATOM 115 CG HIS A 7 1.241 -18.343 1.069 1.00 0.00 C ATOM 116 ND1 HIS A 7 -0.096 -18.531 0.801 1.00 0.00 N ATOM 117 CD2 HIS A 7 1.497 -19.049 2.197 1.00 0.00 C ATOM 118 CE1 HIS A 7 -0.623 -19.308 1.717 1.00 0.00 C ATOM 119 NE2 HIS A 7 0.321 -19.642 2.576 1.00 0.00 N ATOM 0 H HIS A 7 4.597 -18.685 0.362 1.00 0.00 H new ATOM 0 HA HIS A 7 2.189 -19.005 -1.355 1.00 0.00 H new ATOM 0 HB2 HIS A 7 2.847 -16.970 0.806 1.00 0.00 H new ATOM 0 HB3 HIS A 7 1.536 -16.774 -0.340 1.00 0.00 H new ATOM 0 HD2 HIS A 7 2.448 -19.129 2.702 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -1.656 -19.621 1.761 1.00 0.00 H new ATOM 0 HE2 HIS A 7 0.196 -20.244 3.390 1.00 0.00 H new ATOM 128 N SER A 8 2.843 -17.081 -2.912 1.00 0.00 N ATOM 129 CA SER A 8 3.368 -16.325 -4.053 1.00 0.00 C ATOM 130 C SER A 8 2.235 -15.551 -4.747 1.00 0.00 C ATOM 131 O SER A 8 1.045 -15.813 -4.509 1.00 0.00 O ATOM 132 CB SER A 8 4.083 -17.283 -5.042 1.00 0.00 C ATOM 133 OG SER A 8 4.723 -16.573 -6.091 1.00 0.00 O ATOM 0 H SER A 8 1.844 -17.276 -2.975 1.00 0.00 H new ATOM 0 HA SER A 8 4.099 -15.599 -3.695 1.00 0.00 H new ATOM 0 HB2 SER A 8 4.820 -17.878 -4.503 1.00 0.00 H new ATOM 0 HB3 SER A 8 3.357 -17.979 -5.463 1.00 0.00 H new ATOM 0 HG SER A 8 5.164 -17.207 -6.694 1.00 0.00 H new ATOM 139 N SER A 9 2.631 -14.584 -5.586 1.00 0.00 N ATOM 140 CA SER A 9 1.706 -13.720 -6.346 1.00 0.00 C ATOM 141 C SER A 9 1.165 -14.447 -7.599 1.00 0.00 C ATOM 142 O SER A 9 0.044 -14.171 -8.054 1.00 0.00 O ATOM 143 CB SER A 9 2.443 -12.415 -6.739 1.00 0.00 C ATOM 144 OG SER A 9 3.672 -12.692 -7.397 1.00 0.00 O ATOM 0 H SER A 9 3.614 -14.374 -5.761 1.00 0.00 H new ATOM 0 HA SER A 9 0.848 -13.477 -5.720 1.00 0.00 H new ATOM 0 HB2 SER A 9 1.806 -11.818 -7.391 1.00 0.00 H new ATOM 0 HB3 SER A 9 2.633 -11.819 -5.846 1.00 0.00 H new ATOM 0 HG SER A 9 4.187 -11.863 -7.491 1.00 0.00 H new ATOM 150 N GLY A 10 1.980 -15.377 -8.142 1.00 0.00 N ATOM 151 CA GLY A 10 1.634 -16.123 -9.362 1.00 0.00 C ATOM 152 C GLY A 10 1.832 -15.289 -10.624 1.00 0.00 C ATOM 153 O GLY A 10 1.138 -15.485 -11.627 1.00 0.00 O ATOM 0 H GLY A 10 2.887 -15.627 -7.748 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.248 -17.022 -9.423 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.596 -16.450 -9.304 1.00 0.00 H new ATOM 157 N ARG A 11 2.796 -14.348 -10.557 1.00 0.00 N ATOM 158 CA ARG A 11 3.107 -13.413 -11.653 1.00 0.00 C ATOM 159 C ARG A 11 3.732 -14.137 -12.854 1.00 0.00 C ATOM 160 O ARG A 11 4.645 -14.959 -12.694 1.00 0.00 O ATOM 161 CB ARG A 11 4.042 -12.274 -11.152 1.00 0.00 C ATOM 162 CG ARG A 11 3.343 -11.208 -10.284 1.00 0.00 C ATOM 163 CD ARG A 11 2.241 -10.472 -11.058 1.00 0.00 C ATOM 164 NE ARG A 11 1.623 -9.406 -10.272 1.00 0.00 N ATOM 165 CZ ARG A 11 0.613 -8.633 -10.687 1.00 0.00 C ATOM 166 NH1 ARG A 11 0.071 -8.809 -11.888 1.00 0.00 N ATOM 167 NH2 ARG A 11 0.139 -7.705 -9.879 1.00 0.00 N ATOM 0 H ARG A 11 3.384 -14.216 -9.734 1.00 0.00 H new ATOM 0 HA ARG A 11 2.168 -12.972 -11.987 1.00 0.00 H new ATOM 0 HB2 ARG A 11 4.856 -12.716 -10.577 1.00 0.00 H new ATOM 0 HB3 ARG A 11 4.491 -11.784 -12.016 1.00 0.00 H new ATOM 0 HG2 ARG A 11 2.912 -11.683 -9.403 1.00 0.00 H new ATOM 0 HG3 ARG A 11 4.080 -10.488 -9.930 1.00 0.00 H new ATOM 0 HD2 ARG A 11 2.662 -10.049 -11.970 1.00 0.00 H new ATOM 0 HD3 ARG A 11 1.475 -11.186 -11.362 1.00 0.00 H new ATOM 0 HE ARG A 11 1.990 -9.239 -9.335 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.425 -9.540 -12.505 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.699 -8.213 -12.193 1.00 0.00 H new ATOM 0 HH21 ARG A 11 0.542 -7.583 -8.950 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -0.631 -7.109 -10.183 1.00 0.00 H new ATOM 181 N GLU A 12 3.227 -13.804 -14.052 1.00 0.00 N ATOM 182 CA GLU A 12 3.631 -14.413 -15.326 1.00 0.00 C ATOM 183 C GLU A 12 4.176 -13.324 -16.265 1.00 0.00 C ATOM 184 O GLU A 12 3.579 -12.246 -16.383 1.00 0.00 O ATOM 185 CB GLU A 12 2.404 -15.114 -15.974 1.00 0.00 C ATOM 186 CG GLU A 12 2.693 -15.814 -17.319 1.00 0.00 C ATOM 187 CD GLU A 12 1.427 -16.376 -17.990 1.00 0.00 C ATOM 188 OE1 GLU A 12 0.970 -17.471 -17.600 1.00 0.00 O ATOM 189 OE2 GLU A 12 0.875 -15.715 -18.898 1.00 0.00 O ATOM 0 H GLU A 12 2.510 -13.087 -14.163 1.00 0.00 H new ATOM 0 HA GLU A 12 4.412 -15.152 -15.150 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.013 -15.852 -15.273 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.619 -14.373 -16.127 1.00 0.00 H new ATOM 0 HG2 GLU A 12 3.172 -15.106 -17.995 1.00 0.00 H new ATOM 0 HG3 GLU A 12 3.401 -16.626 -17.155 1.00 0.00 H new ATOM 196 N ASN A 13 5.306 -13.620 -16.927 1.00 0.00 N ATOM 197 CA ASN A 13 5.908 -12.752 -17.949 1.00 0.00 C ATOM 198 C ASN A 13 6.735 -13.624 -18.914 1.00 0.00 C ATOM 199 O ASN A 13 7.623 -14.369 -18.478 1.00 0.00 O ATOM 200 CB ASN A 13 6.795 -11.646 -17.310 1.00 0.00 C ATOM 201 CG ASN A 13 7.328 -10.629 -18.332 1.00 0.00 C ATOM 202 OD1 ASN A 13 6.693 -10.362 -19.351 1.00 0.00 O ATOM 203 ND2 ASN A 13 8.484 -10.049 -18.069 1.00 0.00 N ATOM 0 H ASN A 13 5.832 -14.479 -16.765 1.00 0.00 H new ATOM 0 HA ASN A 13 5.113 -12.245 -18.496 1.00 0.00 H new ATOM 0 HB2 ASN A 13 6.216 -11.119 -16.551 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.637 -12.114 -16.801 1.00 0.00 H new ATOM 0 HD21 ASN A 13 8.869 -9.363 -18.718 1.00 0.00 H new ATOM 0 HD22 ASN A 13 8.992 -10.287 -17.217 1.00 0.00 H new ATOM 210 N LEU A 14 6.410 -13.525 -20.212 1.00 0.00 N ATOM 211 CA LEU A 14 7.059 -14.283 -21.299 1.00 0.00 C ATOM 212 C LEU A 14 7.108 -13.416 -22.575 1.00 0.00 C ATOM 213 O LEU A 14 6.632 -12.272 -22.577 1.00 0.00 O ATOM 214 CB LEU A 14 6.308 -15.631 -21.581 1.00 0.00 C ATOM 215 CG LEU A 14 4.830 -15.544 -22.138 1.00 0.00 C ATOM 216 CD1 LEU A 14 4.376 -16.891 -22.760 1.00 0.00 C ATOM 217 CD2 LEU A 14 3.817 -15.086 -21.053 1.00 0.00 C ATOM 0 H LEU A 14 5.673 -12.903 -20.545 1.00 0.00 H new ATOM 0 HA LEU A 14 8.075 -14.530 -20.990 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.902 -16.204 -22.293 1.00 0.00 H new ATOM 0 HB3 LEU A 14 6.284 -16.203 -20.653 1.00 0.00 H new ATOM 0 HG LEU A 14 4.843 -14.786 -22.921 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.356 -16.794 -23.132 1.00 0.00 H new ATOM 0 HD12 LEU A 14 5.040 -17.153 -23.584 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.413 -17.673 -22.001 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.817 -15.042 -21.484 1.00 0.00 H new ATOM 0 HD22 LEU A 14 3.824 -15.796 -20.226 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.098 -14.099 -20.687 1.00 0.00 H new ATOM 229 N TYR A 15 7.681 -13.968 -23.659 1.00 0.00 N ATOM 230 CA TYR A 15 7.774 -13.274 -24.950 1.00 0.00 C ATOM 231 C TYR A 15 6.448 -13.406 -25.734 1.00 0.00 C ATOM 232 O TYR A 15 5.916 -14.510 -25.902 1.00 0.00 O ATOM 233 CB TYR A 15 8.990 -13.786 -25.775 1.00 0.00 C ATOM 234 CG TYR A 15 9.034 -15.301 -26.072 1.00 0.00 C ATOM 235 CD1 TYR A 15 9.546 -16.212 -25.137 1.00 0.00 C ATOM 236 CD2 TYR A 15 8.582 -15.820 -27.293 1.00 0.00 C ATOM 237 CE1 TYR A 15 9.616 -17.567 -25.416 1.00 0.00 C ATOM 238 CE2 TYR A 15 8.645 -17.175 -27.568 1.00 0.00 C ATOM 239 CZ TYR A 15 9.157 -18.044 -26.629 1.00 0.00 C ATOM 240 OH TYR A 15 9.232 -19.393 -26.911 1.00 0.00 O ATOM 0 H TYR A 15 8.090 -14.903 -23.663 1.00 0.00 H new ATOM 0 HA TYR A 15 7.941 -12.214 -24.761 1.00 0.00 H new ATOM 0 HB2 TYR A 15 9.007 -13.252 -26.725 1.00 0.00 H new ATOM 0 HB3 TYR A 15 9.902 -13.517 -25.242 1.00 0.00 H new ATOM 0 HD1 TYR A 15 9.893 -15.850 -24.180 1.00 0.00 H new ATOM 0 HD2 TYR A 15 8.176 -15.148 -28.035 1.00 0.00 H new ATOM 0 HE1 TYR A 15 10.028 -18.249 -24.687 1.00 0.00 H new ATOM 0 HE2 TYR A 15 8.293 -17.551 -28.517 1.00 0.00 H new ATOM 0 HH TYR A 15 8.866 -19.561 -27.804 1.00 0.00 H new ATOM 250 N PHE A 16 5.913 -12.253 -26.178 1.00 0.00 N ATOM 251 CA PHE A 16 4.640 -12.164 -26.936 1.00 0.00 C ATOM 252 C PHE A 16 4.904 -11.896 -28.439 1.00 0.00 C ATOM 253 O PHE A 16 3.963 -11.657 -29.213 1.00 0.00 O ATOM 254 CB PHE A 16 3.734 -11.058 -26.316 1.00 0.00 C ATOM 255 CG PHE A 16 4.259 -9.616 -26.457 1.00 0.00 C ATOM 256 CD1 PHE A 16 5.230 -9.108 -25.584 1.00 0.00 C ATOM 257 CD2 PHE A 16 3.781 -8.765 -27.463 1.00 0.00 C ATOM 258 CE1 PHE A 16 5.698 -7.808 -25.714 1.00 0.00 C ATOM 259 CE2 PHE A 16 4.251 -7.469 -27.589 1.00 0.00 C ATOM 260 CZ PHE A 16 5.211 -6.991 -26.716 1.00 0.00 C ATOM 0 H PHE A 16 6.353 -11.346 -26.022 1.00 0.00 H new ATOM 0 HA PHE A 16 4.121 -13.120 -26.865 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.750 -11.115 -26.781 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.599 -11.275 -25.256 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.620 -9.738 -24.798 1.00 0.00 H new ATOM 0 HD2 PHE A 16 3.032 -9.127 -28.152 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.445 -7.434 -25.030 1.00 0.00 H new ATOM 0 HE2 PHE A 16 3.867 -6.830 -28.371 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.579 -5.981 -26.817 1.00 0.00 H new ATOM 270 N GLN A 17 6.193 -11.942 -28.828 1.00 0.00 N ATOM 271 CA GLN A 17 6.648 -11.734 -30.220 1.00 0.00 C ATOM 272 C GLN A 17 6.054 -12.795 -31.174 1.00 0.00 C ATOM 273 O GLN A 17 5.808 -13.939 -30.768 1.00 0.00 O ATOM 274 CB GLN A 17 8.202 -11.757 -30.273 1.00 0.00 C ATOM 275 CG GLN A 17 8.845 -13.034 -29.688 1.00 0.00 C ATOM 276 CD GLN A 17 10.374 -13.037 -29.700 1.00 0.00 C ATOM 277 OE1 GLN A 17 11.013 -11.987 -29.651 1.00 0.00 O ATOM 278 NE2 GLN A 17 10.970 -14.218 -29.742 1.00 0.00 N ATOM 0 H GLN A 17 6.958 -12.127 -28.179 1.00 0.00 H new ATOM 0 HA GLN A 17 6.292 -10.760 -30.555 1.00 0.00 H new ATOM 0 HB2 GLN A 17 8.519 -11.648 -31.310 1.00 0.00 H new ATOM 0 HB3 GLN A 17 8.584 -10.892 -29.731 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.502 -13.160 -28.661 1.00 0.00 H new ATOM 0 HG3 GLN A 17 8.488 -13.896 -30.252 1.00 0.00 H new ATOM 0 HE21 GLN A 17 10.411 -15.070 -29.782 1.00 0.00 H new ATOM 0 HE22 GLN A 17 11.988 -14.276 -29.734 1.00 0.00 H new ATOM 287 N GLY A 18 5.804 -12.385 -32.427 1.00 0.00 N ATOM 288 CA GLY A 18 5.230 -13.270 -33.433 1.00 0.00 C ATOM 289 C GLY A 18 5.058 -12.574 -34.770 1.00 0.00 C ATOM 290 O GLY A 18 3.939 -12.229 -35.161 1.00 0.00 O ATOM 0 H GLY A 18 5.994 -11.440 -32.762 1.00 0.00 H new ATOM 0 HA2 GLY A 18 5.872 -14.142 -33.558 1.00 0.00 H new ATOM 0 HA3 GLY A 18 4.263 -13.634 -33.086 1.00 0.00 H new ATOM 294 N HIS A 19 6.185 -12.326 -35.461 1.00 0.00 N ATOM 295 CA HIS A 19 6.193 -11.737 -36.818 1.00 0.00 C ATOM 296 C HIS A 19 6.476 -12.822 -37.864 1.00 0.00 C ATOM 297 O HIS A 19 7.473 -13.540 -37.749 1.00 0.00 O ATOM 298 CB HIS A 19 7.257 -10.618 -36.940 1.00 0.00 C ATOM 299 CG HIS A 19 7.033 -9.429 -36.043 1.00 0.00 C ATOM 300 ND1 HIS A 19 8.040 -8.849 -35.299 1.00 0.00 N ATOM 301 CD2 HIS A 19 5.932 -8.679 -35.820 1.00 0.00 C ATOM 302 CE1 HIS A 19 7.573 -7.801 -34.661 1.00 0.00 C ATOM 303 NE2 HIS A 19 6.298 -7.672 -34.961 1.00 0.00 N ATOM 0 H HIS A 19 7.117 -12.527 -35.097 1.00 0.00 H new ATOM 0 HA HIS A 19 5.210 -11.302 -36.996 1.00 0.00 H new ATOM 0 HB2 HIS A 19 8.236 -11.042 -36.719 1.00 0.00 H new ATOM 0 HB3 HIS A 19 7.285 -10.274 -37.974 1.00 0.00 H new ATOM 0 HD2 HIS A 19 4.949 -8.841 -36.238 1.00 0.00 H new ATOM 0 HE1 HIS A 19 8.137 -7.156 -34.004 1.00 0.00 H new ATOM 0 HE2 HIS A 19 5.680 -6.940 -34.611 1.00 0.00 H new ATOM 312 N MET A 20 5.603 -12.930 -38.881 1.00 0.00 N ATOM 313 CA MET A 20 5.776 -13.883 -39.992 1.00 0.00 C ATOM 314 C MET A 20 5.096 -13.351 -41.265 1.00 0.00 C ATOM 315 O MET A 20 3.869 -13.209 -41.318 1.00 0.00 O ATOM 316 CB MET A 20 5.228 -15.285 -39.606 1.00 0.00 C ATOM 317 CG MET A 20 5.391 -16.361 -40.695 1.00 0.00 C ATOM 318 SD MET A 20 4.896 -18.009 -40.138 1.00 0.00 S ATOM 319 CE MET A 20 6.139 -18.370 -38.890 1.00 0.00 C ATOM 0 H MET A 20 4.760 -12.361 -38.956 1.00 0.00 H new ATOM 0 HA MET A 20 6.842 -13.988 -40.196 1.00 0.00 H new ATOM 0 HB2 MET A 20 5.735 -15.622 -38.702 1.00 0.00 H new ATOM 0 HB3 MET A 20 4.170 -15.192 -39.362 1.00 0.00 H new ATOM 0 HG2 MET A 20 4.796 -16.083 -41.565 1.00 0.00 H new ATOM 0 HG3 MET A 20 6.432 -16.390 -41.017 1.00 0.00 H new ATOM 0 HE1 MET A 20 6.159 -19.442 -38.696 1.00 0.00 H new ATOM 0 HE2 MET A 20 7.117 -18.047 -39.247 1.00 0.00 H new ATOM 0 HE3 MET A 20 5.895 -17.839 -37.970 1.00 0.00 H new ATOM 329 N ALA A 21 5.921 -13.030 -42.271 1.00 0.00 N ATOM 330 CA ALA A 21 5.484 -12.627 -43.615 1.00 0.00 C ATOM 331 C ALA A 21 6.534 -13.123 -44.616 1.00 0.00 C ATOM 332 O ALA A 21 7.619 -12.534 -44.720 1.00 0.00 O ATOM 333 CB ALA A 21 5.305 -11.099 -43.701 1.00 0.00 C ATOM 0 H ALA A 21 6.936 -13.044 -42.170 1.00 0.00 H new ATOM 0 HA ALA A 21 4.514 -13.068 -43.845 1.00 0.00 H new ATOM 0 HB1 ALA A 21 4.981 -10.827 -44.706 1.00 0.00 H new ATOM 0 HB2 ALA A 21 4.554 -10.779 -42.979 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.253 -10.609 -43.480 1.00 0.00 H new ATOM 339 N SER A 22 6.227 -14.232 -45.305 1.00 0.00 N ATOM 340 CA SER A 22 7.181 -14.912 -46.197 1.00 0.00 C ATOM 341 C SER A 22 6.451 -15.803 -47.214 1.00 0.00 C ATOM 342 O SER A 22 5.227 -15.987 -47.137 1.00 0.00 O ATOM 343 CB SER A 22 8.178 -15.746 -45.347 1.00 0.00 C ATOM 344 OG SER A 22 7.505 -16.686 -44.517 1.00 0.00 O ATOM 0 H SER A 22 5.313 -14.683 -45.261 1.00 0.00 H new ATOM 0 HA SER A 22 7.733 -14.160 -46.761 1.00 0.00 H new ATOM 0 HB2 SER A 22 8.868 -16.272 -46.007 1.00 0.00 H new ATOM 0 HB3 SER A 22 8.777 -15.077 -44.728 1.00 0.00 H new ATOM 0 HG SER A 22 8.163 -17.194 -43.998 1.00 0.00 H new ATOM 350 N GLY A 23 7.226 -16.340 -48.178 1.00 0.00 N ATOM 351 CA GLY A 23 6.712 -17.255 -49.198 1.00 0.00 C ATOM 352 C GLY A 23 6.345 -16.531 -50.488 1.00 0.00 C ATOM 353 O GLY A 23 5.761 -15.436 -50.449 1.00 0.00 O ATOM 0 H GLY A 23 8.224 -16.147 -48.265 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.462 -18.017 -49.412 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.834 -17.772 -48.811 1.00 0.00 H new ATOM 357 N SER A 24 6.701 -17.135 -51.628 1.00 0.00 N ATOM 358 CA SER A 24 6.326 -16.632 -52.954 1.00 0.00 C ATOM 359 C SER A 24 4.901 -17.093 -53.324 1.00 0.00 C ATOM 360 O SER A 24 4.365 -18.037 -52.722 1.00 0.00 O ATOM 361 CB SER A 24 7.349 -17.126 -53.999 1.00 0.00 C ATOM 362 OG SER A 24 7.480 -18.538 -53.960 1.00 0.00 O ATOM 0 H SER A 24 7.259 -17.989 -51.656 1.00 0.00 H new ATOM 0 HA SER A 24 6.332 -15.542 -52.939 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.035 -16.815 -54.995 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.318 -16.663 -53.811 1.00 0.00 H new ATOM 0 HG SER A 24 7.701 -18.871 -54.855 1.00 0.00 H new ATOM 368 N GLU A 25 4.298 -16.427 -54.322 1.00 0.00 N ATOM 369 CA GLU A 25 2.971 -16.791 -54.859 1.00 0.00 C ATOM 370 C GLU A 25 3.130 -17.993 -55.822 1.00 0.00 C ATOM 371 O GLU A 25 3.074 -17.845 -57.047 1.00 0.00 O ATOM 372 CB GLU A 25 2.330 -15.559 -55.570 1.00 0.00 C ATOM 373 CG GLU A 25 0.900 -15.779 -56.106 1.00 0.00 C ATOM 374 CD GLU A 25 0.359 -14.590 -56.922 1.00 0.00 C ATOM 375 OE1 GLU A 25 0.701 -14.472 -58.123 1.00 0.00 O ATOM 376 OE2 GLU A 25 -0.411 -13.769 -56.376 1.00 0.00 O ATOM 0 H GLU A 25 4.716 -15.618 -54.782 1.00 0.00 H new ATOM 0 HA GLU A 25 2.302 -17.085 -54.050 1.00 0.00 H new ATOM 0 HB2 GLU A 25 2.314 -14.724 -54.870 1.00 0.00 H new ATOM 0 HB3 GLU A 25 2.971 -15.266 -56.401 1.00 0.00 H new ATOM 0 HG2 GLU A 25 0.888 -16.673 -56.730 1.00 0.00 H new ATOM 0 HG3 GLU A 25 0.231 -15.967 -55.266 1.00 0.00 H new ATOM 383 N GLU A 26 3.403 -19.174 -55.242 1.00 0.00 N ATOM 384 CA GLU A 26 3.583 -20.436 -55.986 1.00 0.00 C ATOM 385 C GLU A 26 2.874 -21.566 -55.224 1.00 0.00 C ATOM 386 O GLU A 26 3.396 -22.070 -54.223 1.00 0.00 O ATOM 387 CB GLU A 26 5.093 -20.781 -56.203 1.00 0.00 C ATOM 388 CG GLU A 26 5.833 -19.826 -57.160 1.00 0.00 C ATOM 389 CD GLU A 26 7.292 -20.233 -57.400 1.00 0.00 C ATOM 390 OE1 GLU A 26 7.568 -20.966 -58.376 1.00 0.00 O ATOM 391 OE2 GLU A 26 8.171 -19.843 -56.601 1.00 0.00 O ATOM 0 H GLU A 26 3.506 -19.282 -54.233 1.00 0.00 H new ATOM 0 HA GLU A 26 3.144 -20.320 -56.977 1.00 0.00 H new ATOM 0 HB2 GLU A 26 5.598 -20.771 -55.237 1.00 0.00 H new ATOM 0 HB3 GLU A 26 5.169 -21.796 -56.592 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.308 -19.797 -58.115 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.806 -18.816 -56.750 1.00 0.00 H new ATOM 398 N GLU A 27 1.657 -21.919 -55.677 1.00 0.00 N ATOM 399 CA GLU A 27 0.879 -23.038 -55.128 1.00 0.00 C ATOM 400 C GLU A 27 1.389 -24.353 -55.738 1.00 0.00 C ATOM 401 O GLU A 27 0.877 -24.833 -56.758 1.00 0.00 O ATOM 402 CB GLU A 27 -0.642 -22.823 -55.371 1.00 0.00 C ATOM 403 CG GLU A 27 -1.222 -21.598 -54.633 1.00 0.00 C ATOM 404 CD GLU A 27 -2.708 -21.356 -54.941 1.00 0.00 C ATOM 405 OE1 GLU A 27 -3.019 -20.557 -55.851 1.00 0.00 O ATOM 406 OE2 GLU A 27 -3.580 -21.964 -54.279 1.00 0.00 O ATOM 0 H GLU A 27 1.186 -21.431 -56.439 1.00 0.00 H new ATOM 0 HA GLU A 27 1.015 -23.089 -54.048 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.817 -22.708 -56.441 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.181 -23.716 -55.054 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -1.098 -21.736 -53.559 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.651 -20.711 -54.909 1.00 0.00 H new ATOM 413 N VAL A 28 2.464 -24.875 -55.131 1.00 0.00 N ATOM 414 CA VAL A 28 3.143 -26.120 -55.542 1.00 0.00 C ATOM 415 C VAL A 28 3.462 -26.962 -54.297 1.00 0.00 C ATOM 416 O VAL A 28 3.751 -26.414 -53.224 1.00 0.00 O ATOM 417 CB VAL A 28 4.476 -25.845 -56.362 1.00 0.00 C ATOM 418 CG1 VAL A 28 4.170 -25.478 -57.842 1.00 0.00 C ATOM 419 CG2 VAL A 28 5.329 -24.740 -55.673 1.00 0.00 C ATOM 0 H VAL A 28 2.899 -24.435 -54.320 1.00 0.00 H new ATOM 0 HA VAL A 28 2.466 -26.661 -56.203 1.00 0.00 H new ATOM 0 HB VAL A 28 5.058 -26.767 -56.370 1.00 0.00 H new ATOM 0 HG11 VAL A 28 5.105 -25.297 -58.373 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.636 -26.301 -58.318 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.554 -24.579 -57.874 1.00 0.00 H new ATOM 0 HG21 VAL A 28 6.237 -24.568 -56.251 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.753 -23.816 -55.619 1.00 0.00 H new ATOM 0 HG23 VAL A 28 5.596 -25.061 -54.666 1.00 0.00 H new ATOM 429 N VAL A 29 3.394 -28.293 -54.450 1.00 0.00 N ATOM 430 CA VAL A 29 3.682 -29.238 -53.358 1.00 0.00 C ATOM 431 C VAL A 29 5.211 -29.423 -53.193 1.00 0.00 C ATOM 432 O VAL A 29 5.941 -29.654 -54.165 1.00 0.00 O ATOM 433 CB VAL A 29 2.946 -30.625 -53.559 1.00 0.00 C ATOM 434 CG1 VAL A 29 1.404 -30.434 -53.510 1.00 0.00 C ATOM 435 CG2 VAL A 29 3.378 -31.334 -54.879 1.00 0.00 C ATOM 0 H VAL A 29 3.139 -28.744 -55.329 1.00 0.00 H new ATOM 0 HA VAL A 29 3.287 -28.810 -52.437 1.00 0.00 H new ATOM 0 HB VAL A 29 3.245 -31.275 -52.737 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.913 -31.397 -53.650 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.119 -30.019 -52.543 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.097 -29.752 -54.303 1.00 0.00 H new ATOM 0 HG21 VAL A 29 2.847 -32.281 -54.974 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.138 -30.697 -55.730 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.452 -31.520 -54.857 1.00 0.00 H new ATOM 445 N SER A 30 5.687 -29.257 -51.948 1.00 0.00 N ATOM 446 CA SER A 30 7.097 -29.443 -51.576 1.00 0.00 C ATOM 447 C SER A 30 7.160 -30.091 -50.181 1.00 0.00 C ATOM 448 O SER A 30 6.681 -29.517 -49.199 1.00 0.00 O ATOM 449 CB SER A 30 7.845 -28.086 -51.618 1.00 0.00 C ATOM 450 OG SER A 30 7.163 -27.085 -50.877 1.00 0.00 O ATOM 0 H SER A 30 5.095 -28.986 -51.163 1.00 0.00 H new ATOM 0 HA SER A 30 7.592 -30.104 -52.288 1.00 0.00 H new ATOM 0 HB2 SER A 30 8.851 -28.213 -51.218 1.00 0.00 H new ATOM 0 HB3 SER A 30 7.953 -27.762 -52.653 1.00 0.00 H new ATOM 0 HG SER A 30 6.829 -27.469 -50.039 1.00 0.00 H new ATOM 456 N VAL A 31 7.739 -31.297 -50.109 1.00 0.00 N ATOM 457 CA VAL A 31 7.794 -32.104 -48.882 1.00 0.00 C ATOM 458 C VAL A 31 9.183 -31.944 -48.248 1.00 0.00 C ATOM 459 O VAL A 31 10.193 -32.314 -48.848 1.00 0.00 O ATOM 460 CB VAL A 31 7.496 -33.625 -49.179 1.00 0.00 C ATOM 461 CG1 VAL A 31 7.561 -34.479 -47.884 1.00 0.00 C ATOM 462 CG2 VAL A 31 6.128 -33.793 -49.903 1.00 0.00 C ATOM 0 H VAL A 31 8.187 -31.745 -50.909 1.00 0.00 H new ATOM 0 HA VAL A 31 7.027 -31.753 -48.192 1.00 0.00 H new ATOM 0 HB VAL A 31 8.274 -33.992 -49.848 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.351 -35.521 -48.125 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.556 -34.401 -47.446 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.822 -34.115 -47.171 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.946 -34.850 -50.096 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.332 -33.397 -49.273 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.147 -33.249 -50.848 1.00 0.00 H new ATOM 472 N GLU A 32 9.221 -31.354 -47.046 1.00 0.00 N ATOM 473 CA GLU A 32 10.461 -31.110 -46.306 1.00 0.00 C ATOM 474 C GLU A 32 10.905 -32.398 -45.585 1.00 0.00 C ATOM 475 O GLU A 32 10.286 -32.823 -44.604 1.00 0.00 O ATOM 476 CB GLU A 32 10.260 -29.936 -45.311 1.00 0.00 C ATOM 477 CG GLU A 32 9.853 -28.608 -45.989 1.00 0.00 C ATOM 478 CD GLU A 32 9.704 -27.442 -45.001 1.00 0.00 C ATOM 479 OE1 GLU A 32 8.583 -27.200 -44.510 1.00 0.00 O ATOM 480 OE2 GLU A 32 10.708 -26.758 -44.706 1.00 0.00 O ATOM 0 H GLU A 32 8.385 -31.031 -46.559 1.00 0.00 H new ATOM 0 HA GLU A 32 11.252 -30.827 -47.000 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.494 -30.213 -44.586 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.184 -29.781 -44.755 1.00 0.00 H new ATOM 0 HG2 GLU A 32 10.600 -28.347 -46.738 1.00 0.00 H new ATOM 0 HG3 GLU A 32 8.910 -28.751 -46.516 1.00 0.00 H new ATOM 487 N LEU A 33 11.957 -33.032 -46.127 1.00 0.00 N ATOM 488 CA LEU A 33 12.558 -34.273 -45.579 1.00 0.00 C ATOM 489 C LEU A 33 13.559 -33.915 -44.454 1.00 0.00 C ATOM 490 O LEU A 33 13.950 -32.749 -44.349 1.00 0.00 O ATOM 491 CB LEU A 33 13.227 -35.085 -46.750 1.00 0.00 C ATOM 492 CG LEU A 33 12.289 -36.047 -47.544 1.00 0.00 C ATOM 493 CD1 LEU A 33 11.798 -37.211 -46.659 1.00 0.00 C ATOM 494 CD2 LEU A 33 11.111 -35.296 -48.169 1.00 0.00 C ATOM 0 H LEU A 33 12.425 -32.698 -46.969 1.00 0.00 H new ATOM 0 HA LEU A 33 11.791 -34.908 -45.135 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.665 -34.376 -47.453 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.048 -35.671 -46.336 1.00 0.00 H new ATOM 0 HG LEU A 33 12.877 -36.472 -48.358 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.147 -37.862 -47.242 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.655 -37.782 -46.300 1.00 0.00 H new ATOM 0 HD13 LEU A 33 11.245 -36.813 -45.808 1.00 0.00 H new ATOM 0 HD21 LEU A 33 10.480 -35.998 -48.714 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.527 -34.817 -47.383 1.00 0.00 H new ATOM 0 HD23 LEU A 33 11.486 -34.537 -48.856 1.00 0.00 H new ATOM 506 N PRO A 34 13.990 -34.896 -43.576 1.00 0.00 N ATOM 507 CA PRO A 34 14.870 -34.587 -42.420 1.00 0.00 C ATOM 508 C PRO A 34 16.256 -34.041 -42.834 1.00 0.00 C ATOM 509 O PRO A 34 16.787 -34.377 -43.902 1.00 0.00 O ATOM 510 CB PRO A 34 14.986 -35.944 -41.673 1.00 0.00 C ATOM 511 CG PRO A 34 14.713 -36.971 -42.726 1.00 0.00 C ATOM 512 CD PRO A 34 13.655 -36.351 -43.606 1.00 0.00 C ATOM 0 HA PRO A 34 14.456 -33.790 -41.802 1.00 0.00 H new ATOM 0 HB2 PRO A 34 15.977 -36.075 -41.237 1.00 0.00 H new ATOM 0 HB3 PRO A 34 14.267 -36.011 -40.856 1.00 0.00 H new ATOM 0 HG2 PRO A 34 15.614 -37.203 -43.294 1.00 0.00 H new ATOM 0 HG3 PRO A 34 14.364 -37.905 -42.286 1.00 0.00 H new ATOM 0 HD2 PRO A 34 13.690 -36.751 -44.619 1.00 0.00 H new ATOM 0 HD3 PRO A 34 12.652 -36.541 -43.223 1.00 0.00 H new ATOM 520 N ALA A 35 16.822 -33.202 -41.957 1.00 0.00 N ATOM 521 CA ALA A 35 18.069 -32.460 -42.207 1.00 0.00 C ATOM 522 C ALA A 35 18.921 -32.397 -40.920 1.00 0.00 C ATOM 523 O ALA A 35 18.420 -32.757 -39.845 1.00 0.00 O ATOM 524 CB ALA A 35 17.710 -31.036 -42.682 1.00 0.00 C ATOM 0 H ALA A 35 16.421 -33.015 -41.038 1.00 0.00 H new ATOM 0 HA ALA A 35 18.652 -32.968 -42.975 1.00 0.00 H new ATOM 0 HB1 ALA A 35 18.625 -30.474 -42.871 1.00 0.00 H new ATOM 0 HB2 ALA A 35 17.124 -31.095 -43.599 1.00 0.00 H new ATOM 0 HB3 ALA A 35 17.127 -30.531 -41.911 1.00 0.00 H new ATOM 530 N PRO A 36 20.234 -31.971 -41.003 1.00 0.00 N ATOM 531 CA PRO A 36 20.990 -31.521 -39.807 1.00 0.00 C ATOM 532 C PRO A 36 20.341 -30.252 -39.198 1.00 0.00 C ATOM 533 O PRO A 36 19.668 -29.503 -39.909 1.00 0.00 O ATOM 534 CB PRO A 36 22.415 -31.219 -40.361 1.00 0.00 C ATOM 535 CG PRO A 36 22.212 -30.990 -41.831 1.00 0.00 C ATOM 536 CD PRO A 36 21.083 -31.918 -42.234 1.00 0.00 C ATOM 0 HA PRO A 36 21.004 -32.260 -39.006 1.00 0.00 H new ATOM 0 HB2 PRO A 36 22.849 -30.343 -39.880 1.00 0.00 H new ATOM 0 HB3 PRO A 36 23.095 -32.052 -40.180 1.00 0.00 H new ATOM 0 HG2 PRO A 36 21.957 -29.950 -42.034 1.00 0.00 H new ATOM 0 HG3 PRO A 36 23.120 -31.211 -42.392 1.00 0.00 H new ATOM 0 HD2 PRO A 36 20.529 -31.532 -43.090 1.00 0.00 H new ATOM 0 HD3 PRO A 36 21.452 -32.905 -42.512 1.00 0.00 H new ATOM 544 N SER A 37 20.572 -30.023 -37.892 1.00 0.00 N ATOM 545 CA SER A 37 20.041 -28.847 -37.158 1.00 0.00 C ATOM 546 C SER A 37 20.579 -27.521 -37.746 1.00 0.00 C ATOM 547 O SER A 37 19.966 -26.461 -37.582 1.00 0.00 O ATOM 548 CB SER A 37 20.409 -28.950 -35.655 1.00 0.00 C ATOM 549 OG SER A 37 19.968 -30.182 -35.096 1.00 0.00 O ATOM 0 H SER A 37 21.132 -30.646 -37.310 1.00 0.00 H new ATOM 0 HA SER A 37 18.956 -28.845 -37.267 1.00 0.00 H new ATOM 0 HB2 SER A 37 21.489 -28.861 -35.536 1.00 0.00 H new ATOM 0 HB3 SER A 37 19.959 -28.120 -35.111 1.00 0.00 H new ATOM 0 HG SER A 37 20.216 -30.219 -34.149 1.00 0.00 H new ATOM 555 N SER A 38 21.740 -27.615 -38.422 1.00 0.00 N ATOM 556 CA SER A 38 22.410 -26.482 -39.068 1.00 0.00 C ATOM 557 C SER A 38 21.645 -26.002 -40.330 1.00 0.00 C ATOM 558 O SER A 38 21.565 -24.802 -40.603 1.00 0.00 O ATOM 559 CB SER A 38 23.836 -26.917 -39.454 1.00 0.00 C ATOM 560 OG SER A 38 24.496 -27.532 -38.360 1.00 0.00 O ATOM 0 H SER A 38 22.242 -28.496 -38.533 1.00 0.00 H new ATOM 0 HA SER A 38 22.437 -25.646 -38.369 1.00 0.00 H new ATOM 0 HB2 SER A 38 23.793 -27.611 -40.294 1.00 0.00 H new ATOM 0 HB3 SER A 38 24.407 -26.050 -39.786 1.00 0.00 H new ATOM 0 HG SER A 38 25.399 -27.800 -38.631 1.00 0.00 H new ATOM 566 N TRP A 39 21.094 -26.966 -41.095 1.00 0.00 N ATOM 567 CA TRP A 39 20.439 -26.717 -42.403 1.00 0.00 C ATOM 568 C TRP A 39 18.959 -27.144 -42.371 1.00 0.00 C ATOM 569 O TRP A 39 18.408 -27.461 -41.316 1.00 0.00 O ATOM 570 CB TRP A 39 21.181 -27.509 -43.528 1.00 0.00 C ATOM 571 CG TRP A 39 22.526 -26.959 -43.927 1.00 0.00 C ATOM 572 CD1 TRP A 39 23.652 -26.841 -43.152 1.00 0.00 C ATOM 573 CD2 TRP A 39 22.891 -26.489 -45.225 1.00 0.00 C ATOM 574 NE1 TRP A 39 24.679 -26.315 -43.889 1.00 0.00 N ATOM 575 CE2 TRP A 39 24.235 -26.091 -45.164 1.00 0.00 C ATOM 576 CE3 TRP A 39 22.203 -26.357 -46.432 1.00 0.00 C ATOM 577 CZ2 TRP A 39 24.906 -25.589 -46.265 1.00 0.00 C ATOM 578 CZ3 TRP A 39 22.868 -25.854 -47.526 1.00 0.00 C ATOM 579 CH2 TRP A 39 24.211 -25.469 -47.437 1.00 0.00 C ATOM 0 H TRP A 39 21.089 -27.949 -40.823 1.00 0.00 H new ATOM 0 HA TRP A 39 20.489 -25.648 -42.608 1.00 0.00 H new ATOM 0 HB2 TRP A 39 21.312 -28.539 -43.197 1.00 0.00 H new ATOM 0 HB3 TRP A 39 20.542 -27.537 -44.411 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.719 -27.122 -42.111 1.00 0.00 H new ATOM 0 HE1 TRP A 39 25.620 -26.122 -43.545 1.00 0.00 H new ATOM 0 HE3 TRP A 39 21.165 -26.645 -46.506 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 25.945 -25.301 -46.201 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 22.347 -25.755 -48.467 1.00 0.00 H new ATOM 0 HH2 TRP A 39 24.707 -25.070 -48.309 1.00 0.00 H new ATOM 590 N LYS A 40 18.332 -27.102 -43.558 1.00 0.00 N ATOM 591 CA LYS A 40 17.016 -27.691 -43.828 1.00 0.00 C ATOM 592 C LYS A 40 17.054 -28.372 -45.212 1.00 0.00 C ATOM 593 O LYS A 40 17.752 -27.925 -46.123 1.00 0.00 O ATOM 594 CB LYS A 40 15.877 -26.629 -43.702 1.00 0.00 C ATOM 595 CG LYS A 40 15.270 -26.504 -42.278 1.00 0.00 C ATOM 596 CD LYS A 40 14.106 -25.498 -42.209 1.00 0.00 C ATOM 597 CE LYS A 40 14.539 -24.089 -42.624 1.00 0.00 C ATOM 598 NZ LYS A 40 13.431 -23.119 -42.524 1.00 0.00 N ATOM 0 H LYS A 40 18.739 -26.646 -44.375 1.00 0.00 H new ATOM 0 HA LYS A 40 16.788 -28.449 -43.079 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.268 -25.657 -44.003 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.081 -26.883 -44.402 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.918 -27.482 -41.951 1.00 0.00 H new ATOM 0 HG3 LYS A 40 16.050 -26.197 -41.581 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.297 -25.834 -42.858 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.710 -25.471 -41.194 1.00 0.00 H new ATOM 0 HE2 LYS A 40 15.365 -23.763 -41.992 1.00 0.00 H new ATOM 0 HE3 LYS A 40 14.911 -24.111 -43.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.766 -22.178 -42.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.652 -23.416 -43.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 13.093 -23.079 -41.541 1.00 0.00 H new ATOM 612 N LYS A 41 16.347 -29.497 -45.310 1.00 0.00 N ATOM 613 CA LYS A 41 16.232 -30.335 -46.514 1.00 0.00 C ATOM 614 C LYS A 41 14.782 -30.290 -47.005 1.00 0.00 C ATOM 615 O LYS A 41 13.854 -30.690 -46.298 1.00 0.00 O ATOM 616 CB LYS A 41 16.685 -31.785 -46.162 1.00 0.00 C ATOM 617 CG LYS A 41 16.169 -32.931 -47.065 1.00 0.00 C ATOM 618 CD LYS A 41 16.602 -32.835 -48.540 1.00 0.00 C ATOM 619 CE LYS A 41 16.122 -34.051 -49.348 1.00 0.00 C ATOM 620 NZ LYS A 41 16.611 -35.328 -48.754 1.00 0.00 N ATOM 0 H LYS A 41 15.815 -29.869 -44.523 1.00 0.00 H new ATOM 0 HA LYS A 41 16.873 -29.968 -47.316 1.00 0.00 H new ATOM 0 HB2 LYS A 41 17.775 -31.810 -46.175 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.374 -31.996 -45.139 1.00 0.00 H new ATOM 0 HG2 LYS A 41 16.519 -33.880 -46.659 1.00 0.00 H new ATOM 0 HG3 LYS A 41 15.080 -32.947 -47.021 1.00 0.00 H new ATOM 0 HD2 LYS A 41 16.199 -31.923 -48.980 1.00 0.00 H new ATOM 0 HD3 LYS A 41 17.688 -32.764 -48.598 1.00 0.00 H new ATOM 0 HE2 LYS A 41 15.033 -34.059 -49.384 1.00 0.00 H new ATOM 0 HE3 LYS A 41 16.474 -33.968 -50.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 16.494 -36.098 -49.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 17.617 -35.234 -48.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 16.064 -35.544 -47.896 1.00 0.00 H new ATOM 634 N LEU A 42 14.607 -29.783 -48.219 1.00 0.00 N ATOM 635 CA LEU A 42 13.320 -29.733 -48.907 1.00 0.00 C ATOM 636 C LEU A 42 13.447 -30.533 -50.213 1.00 0.00 C ATOM 637 O LEU A 42 14.360 -30.316 -51.006 1.00 0.00 O ATOM 638 CB LEU A 42 12.912 -28.241 -49.127 1.00 0.00 C ATOM 639 CG LEU A 42 11.576 -27.943 -49.911 1.00 0.00 C ATOM 640 CD1 LEU A 42 10.919 -26.612 -49.464 1.00 0.00 C ATOM 641 CD2 LEU A 42 11.813 -27.913 -51.434 1.00 0.00 C ATOM 0 H LEU A 42 15.371 -29.386 -48.766 1.00 0.00 H new ATOM 0 HA LEU A 42 12.523 -30.187 -48.318 1.00 0.00 H new ATOM 0 HB2 LEU A 42 12.836 -27.768 -48.148 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.727 -27.747 -49.657 1.00 0.00 H new ATOM 0 HG LEU A 42 10.894 -28.758 -49.671 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.003 -26.450 -50.032 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.683 -26.662 -48.401 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.608 -25.787 -49.645 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.873 -27.705 -51.945 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.536 -27.134 -51.674 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.198 -28.879 -51.761 1.00 0.00 H new ATOM 653 N PHE A 43 12.544 -31.494 -50.395 1.00 0.00 N ATOM 654 CA PHE A 43 12.379 -32.251 -51.638 1.00 0.00 C ATOM 655 C PHE A 43 11.138 -31.713 -52.364 1.00 0.00 C ATOM 656 O PHE A 43 10.105 -31.473 -51.739 1.00 0.00 O ATOM 657 CB PHE A 43 12.224 -33.756 -51.303 1.00 0.00 C ATOM 658 CG PHE A 43 11.940 -34.669 -52.502 1.00 0.00 C ATOM 659 CD1 PHE A 43 12.948 -35.005 -53.402 1.00 0.00 C ATOM 660 CD2 PHE A 43 10.661 -35.199 -52.724 1.00 0.00 C ATOM 661 CE1 PHE A 43 12.698 -35.832 -54.484 1.00 0.00 C ATOM 662 CE2 PHE A 43 10.413 -36.027 -53.807 1.00 0.00 C ATOM 663 CZ PHE A 43 11.432 -36.343 -54.686 1.00 0.00 C ATOM 0 H PHE A 43 11.890 -31.776 -49.665 1.00 0.00 H new ATOM 0 HA PHE A 43 13.249 -32.137 -52.285 1.00 0.00 H new ATOM 0 HB2 PHE A 43 13.136 -34.098 -50.815 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.415 -33.869 -50.582 1.00 0.00 H new ATOM 0 HD1 PHE A 43 13.943 -34.613 -53.253 1.00 0.00 H new ATOM 0 HD2 PHE A 43 9.859 -34.959 -52.042 1.00 0.00 H new ATOM 0 HE1 PHE A 43 13.495 -36.077 -55.171 1.00 0.00 H new ATOM 0 HE2 PHE A 43 9.422 -36.426 -53.965 1.00 0.00 H new ATOM 0 HZ PHE A 43 11.238 -36.989 -55.530 1.00 0.00 H new ATOM 673 N TYR A 44 11.258 -31.488 -53.673 1.00 0.00 N ATOM 674 CA TYR A 44 10.132 -31.084 -54.524 1.00 0.00 C ATOM 675 C TYR A 44 9.595 -32.322 -55.290 1.00 0.00 C ATOM 676 O TYR A 44 10.241 -32.774 -56.239 1.00 0.00 O ATOM 677 CB TYR A 44 10.578 -29.959 -55.518 1.00 0.00 C ATOM 678 CG TYR A 44 10.010 -28.562 -55.233 1.00 0.00 C ATOM 679 CD1 TYR A 44 10.767 -27.589 -54.592 1.00 0.00 C ATOM 680 CD2 TYR A 44 8.703 -28.230 -55.604 1.00 0.00 C ATOM 681 CE1 TYR A 44 10.253 -26.336 -54.328 1.00 0.00 C ATOM 682 CE2 TYR A 44 8.187 -26.979 -55.348 1.00 0.00 C ATOM 683 CZ TYR A 44 8.964 -26.035 -54.709 1.00 0.00 C ATOM 684 OH TYR A 44 8.446 -24.788 -54.448 1.00 0.00 O ATOM 0 H TYR A 44 12.140 -31.580 -54.177 1.00 0.00 H new ATOM 0 HA TYR A 44 9.332 -30.682 -53.902 1.00 0.00 H new ATOM 0 HB2 TYR A 44 11.666 -29.899 -55.507 1.00 0.00 H new ATOM 0 HB3 TYR A 44 10.285 -30.252 -56.526 1.00 0.00 H new ATOM 0 HD1 TYR A 44 11.779 -27.818 -54.294 1.00 0.00 H new ATOM 0 HD2 TYR A 44 8.088 -28.967 -56.099 1.00 0.00 H new ATOM 0 HE1 TYR A 44 10.858 -25.596 -53.826 1.00 0.00 H new ATOM 0 HE2 TYR A 44 7.177 -26.738 -55.646 1.00 0.00 H new ATOM 0 HH TYR A 44 9.169 -24.126 -54.451 1.00 0.00 H new ATOM 694 N PRO A 45 8.422 -32.905 -54.887 1.00 0.00 N ATOM 695 CA PRO A 45 7.699 -33.886 -55.723 1.00 0.00 C ATOM 696 C PRO A 45 6.891 -33.166 -56.820 1.00 0.00 C ATOM 697 O PRO A 45 6.589 -31.969 -56.694 1.00 0.00 O ATOM 698 CB PRO A 45 6.784 -34.606 -54.702 1.00 0.00 C ATOM 699 CG PRO A 45 6.473 -33.549 -53.684 1.00 0.00 C ATOM 700 CD PRO A 45 7.716 -32.671 -53.601 1.00 0.00 C ATOM 0 HA PRO A 45 8.350 -34.579 -56.257 1.00 0.00 H new ATOM 0 HB2 PRO A 45 5.877 -34.983 -55.175 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.287 -35.461 -54.249 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.602 -32.965 -53.981 1.00 0.00 H new ATOM 0 HG3 PRO A 45 6.244 -33.994 -52.716 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.453 -31.620 -53.478 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.340 -32.945 -52.750 1.00 0.00 H new ATOM 708 N ASN A 46 6.546 -33.885 -57.893 1.00 0.00 N ATOM 709 CA ASN A 46 5.796 -33.311 -59.023 1.00 0.00 C ATOM 710 C ASN A 46 4.483 -34.097 -59.214 1.00 0.00 C ATOM 711 O ASN A 46 3.446 -33.697 -58.673 1.00 0.00 O ATOM 712 CB ASN A 46 6.681 -33.281 -60.302 1.00 0.00 C ATOM 713 CG ASN A 46 6.011 -32.563 -61.469 1.00 0.00 C ATOM 714 OD1 ASN A 46 5.345 -33.183 -62.295 1.00 0.00 O ATOM 715 ND2 ASN A 46 6.162 -31.244 -61.537 1.00 0.00 N ATOM 0 H ASN A 46 6.775 -34.873 -58.006 1.00 0.00 H new ATOM 0 HA ASN A 46 5.529 -32.275 -58.813 1.00 0.00 H new ATOM 0 HB2 ASN A 46 7.626 -32.788 -60.073 1.00 0.00 H new ATOM 0 HB3 ASN A 46 6.918 -34.303 -60.598 1.00 0.00 H new ATOM 0 HD21 ASN A 46 5.719 -30.718 -62.290 1.00 0.00 H new ATOM 0 HD22 ASN A 46 6.721 -30.758 -60.836 1.00 0.00 H new ATOM 722 N LYS A 47 4.529 -35.231 -59.949 1.00 0.00 N ATOM 723 CA LYS A 47 3.351 -36.093 -60.201 1.00 0.00 C ATOM 724 C LYS A 47 3.761 -37.576 -60.063 1.00 0.00 C ATOM 725 O LYS A 47 3.784 -38.108 -58.946 1.00 0.00 O ATOM 726 CB LYS A 47 2.711 -35.791 -61.602 1.00 0.00 C ATOM 727 CG LYS A 47 2.189 -34.344 -61.782 1.00 0.00 C ATOM 728 CD LYS A 47 1.537 -34.102 -63.164 1.00 0.00 C ATOM 729 CE LYS A 47 1.074 -32.645 -63.367 1.00 0.00 C ATOM 730 NZ LYS A 47 0.341 -32.478 -64.649 1.00 0.00 N ATOM 0 H LYS A 47 5.385 -35.575 -60.385 1.00 0.00 H new ATOM 0 HA LYS A 47 2.584 -35.875 -59.458 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.452 -35.993 -62.375 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.884 -36.483 -61.764 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.461 -34.127 -61.000 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.016 -33.647 -61.650 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.250 -34.363 -63.946 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.682 -34.768 -63.277 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.431 -32.348 -62.538 1.00 0.00 H new ATOM 0 HE3 LYS A 47 1.939 -31.982 -63.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.045 -31.487 -64.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 0.963 -32.738 -65.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.498 -33.092 -64.652 1.00 0.00 H new ATOM 744 N VAL A 48 4.133 -38.227 -61.193 1.00 0.00 N ATOM 745 CA VAL A 48 4.565 -39.641 -61.237 1.00 0.00 C ATOM 746 C VAL A 48 5.706 -39.756 -62.271 1.00 0.00 C ATOM 747 O VAL A 48 6.834 -40.139 -61.934 1.00 0.00 O ATOM 748 CB VAL A 48 3.381 -40.637 -61.617 1.00 0.00 C ATOM 749 CG1 VAL A 48 3.887 -42.096 -61.779 1.00 0.00 C ATOM 750 CG2 VAL A 48 2.208 -40.573 -60.594 1.00 0.00 C ATOM 0 H VAL A 48 4.141 -37.777 -62.108 1.00 0.00 H new ATOM 0 HA VAL A 48 4.901 -39.931 -60.242 1.00 0.00 H new ATOM 0 HB VAL A 48 2.996 -40.304 -62.581 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.050 -42.745 -62.038 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.635 -42.136 -62.570 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.331 -42.433 -60.842 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.425 -41.269 -60.895 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.574 -40.844 -59.604 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.804 -39.561 -60.567 1.00 0.00 H new ATOM 760 N GLY A 49 5.390 -39.403 -63.538 1.00 0.00 N ATOM 761 CA GLY A 49 6.348 -39.489 -64.644 1.00 0.00 C ATOM 762 C GLY A 49 5.814 -38.879 -65.936 1.00 0.00 C ATOM 763 O GLY A 49 4.674 -38.401 -65.972 1.00 0.00 O ATOM 0 H GLY A 49 4.471 -39.055 -63.812 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.270 -38.980 -64.361 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.602 -40.535 -64.819 1.00 0.00 H new ATOM 767 N SER A 50 6.669 -38.890 -66.987 1.00 0.00 N ATOM 768 CA SER A 50 6.408 -38.248 -68.300 1.00 0.00 C ATOM 769 C SER A 50 6.199 -36.725 -68.143 1.00 0.00 C ATOM 770 O SER A 50 5.445 -36.089 -68.894 1.00 0.00 O ATOM 771 CB SER A 50 5.220 -38.946 -69.016 1.00 0.00 C ATOM 772 OG SER A 50 5.453 -40.347 -69.154 1.00 0.00 O ATOM 0 H SER A 50 7.577 -39.354 -66.946 1.00 0.00 H new ATOM 0 HA SER A 50 7.285 -38.373 -68.935 1.00 0.00 H new ATOM 0 HB2 SER A 50 4.303 -38.781 -68.450 1.00 0.00 H new ATOM 0 HB3 SER A 50 5.072 -38.500 -70.000 1.00 0.00 H new ATOM 0 HG SER A 50 4.689 -40.763 -69.606 1.00 0.00 H new ATOM 778 N VAL A 51 6.921 -36.153 -67.166 1.00 0.00 N ATOM 779 CA VAL A 51 6.806 -34.743 -66.759 1.00 0.00 C ATOM 780 C VAL A 51 8.200 -34.084 -66.729 1.00 0.00 C ATOM 781 O VAL A 51 9.224 -34.776 -66.853 1.00 0.00 O ATOM 782 CB VAL A 51 6.106 -34.598 -65.342 1.00 0.00 C ATOM 783 CG1 VAL A 51 4.602 -34.998 -65.401 1.00 0.00 C ATOM 784 CG2 VAL A 51 6.868 -35.410 -64.255 1.00 0.00 C ATOM 0 H VAL A 51 7.616 -36.669 -66.626 1.00 0.00 H new ATOM 0 HA VAL A 51 6.181 -34.236 -67.494 1.00 0.00 H new ATOM 0 HB VAL A 51 6.148 -33.546 -65.061 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.157 -34.886 -64.412 1.00 0.00 H new ATOM 0 HG12 VAL A 51 4.081 -34.353 -66.109 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.514 -36.036 -65.723 1.00 0.00 H new ATOM 0 HG21 VAL A 51 6.366 -35.292 -63.295 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.881 -36.464 -64.531 1.00 0.00 H new ATOM 0 HG23 VAL A 51 7.891 -35.043 -64.177 1.00 0.00 H new ATOM 794 N LYS A 52 8.210 -32.746 -66.565 1.00 0.00 N ATOM 795 CA LYS A 52 9.443 -31.944 -66.402 1.00 0.00 C ATOM 796 C LYS A 52 10.154 -32.321 -65.079 1.00 0.00 C ATOM 797 O LYS A 52 11.392 -32.436 -65.048 1.00 0.00 O ATOM 798 CB LYS A 52 9.110 -30.416 -66.448 1.00 0.00 C ATOM 799 CG LYS A 52 8.094 -29.949 -65.381 1.00 0.00 C ATOM 800 CD LYS A 52 7.695 -28.463 -65.506 1.00 0.00 C ATOM 801 CE LYS A 52 6.662 -28.045 -64.442 1.00 0.00 C ATOM 802 NZ LYS A 52 6.281 -26.615 -64.570 1.00 0.00 N ATOM 0 H LYS A 52 7.358 -32.186 -66.542 1.00 0.00 H new ATOM 0 HA LYS A 52 10.120 -32.165 -67.227 1.00 0.00 H new ATOM 0 HB2 LYS A 52 10.034 -29.852 -66.323 1.00 0.00 H new ATOM 0 HB3 LYS A 52 8.719 -30.172 -67.436 1.00 0.00 H new ATOM 0 HG2 LYS A 52 7.197 -30.563 -65.454 1.00 0.00 H new ATOM 0 HG3 LYS A 52 8.517 -30.120 -64.391 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.585 -27.841 -65.410 1.00 0.00 H new ATOM 0 HD3 LYS A 52 7.284 -28.281 -66.499 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.772 -28.667 -64.536 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.072 -28.224 -63.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.585 -26.374 -63.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 7.126 -26.019 -64.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.866 -26.449 -65.509 1.00 0.00 H new ATOM 816 N LYS A 53 9.338 -32.505 -63.991 1.00 0.00 N ATOM 817 CA LYS A 53 9.792 -32.957 -62.650 1.00 0.00 C ATOM 818 C LYS A 53 10.713 -31.905 -61.965 1.00 0.00 C ATOM 819 O LYS A 53 11.550 -31.279 -62.608 1.00 0.00 O ATOM 820 CB LYS A 53 10.438 -34.387 -62.765 1.00 0.00 C ATOM 821 CG LYS A 53 11.026 -35.055 -61.480 1.00 0.00 C ATOM 822 CD LYS A 53 12.475 -34.597 -61.086 1.00 0.00 C ATOM 823 CE LYS A 53 13.544 -34.751 -62.199 1.00 0.00 C ATOM 824 NZ LYS A 53 13.475 -33.680 -63.239 1.00 0.00 N ATOM 0 H LYS A 53 8.333 -32.338 -64.032 1.00 0.00 H new ATOM 0 HA LYS A 53 8.931 -33.045 -61.988 1.00 0.00 H new ATOM 0 HB2 LYS A 53 9.681 -35.059 -63.169 1.00 0.00 H new ATOM 0 HB3 LYS A 53 11.239 -34.329 -63.502 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.358 -34.847 -60.645 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.031 -36.136 -61.623 1.00 0.00 H new ATOM 0 HD2 LYS A 53 12.438 -33.551 -60.783 1.00 0.00 H new ATOM 0 HD3 LYS A 53 12.795 -35.170 -60.216 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.535 -34.743 -61.745 1.00 0.00 H new ATOM 0 HE3 LYS A 53 13.421 -35.722 -62.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.100 -34.079 -64.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.850 -32.917 -62.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.428 -33.298 -63.408 1.00 0.00 H new ATOM 838 N THR A 54 10.558 -31.749 -60.644 1.00 0.00 N ATOM 839 CA THR A 54 11.313 -30.768 -59.833 1.00 0.00 C ATOM 840 C THR A 54 12.314 -31.481 -58.887 1.00 0.00 C ATOM 841 O THR A 54 12.099 -32.632 -58.489 1.00 0.00 O ATOM 842 CB THR A 54 10.321 -29.858 -59.042 1.00 0.00 C ATOM 843 OG1 THR A 54 9.254 -30.662 -58.501 1.00 0.00 O ATOM 844 CG2 THR A 54 9.736 -28.738 -59.920 1.00 0.00 C ATOM 0 H THR A 54 9.899 -32.303 -60.097 1.00 0.00 H new ATOM 0 HA THR A 54 11.899 -30.135 -60.499 1.00 0.00 H new ATOM 0 HB THR A 54 10.879 -29.383 -58.235 1.00 0.00 H new ATOM 0 HG1 THR A 54 8.633 -30.090 -58.003 1.00 0.00 H new ATOM 0 HG21 THR A 54 9.052 -28.131 -59.327 1.00 0.00 H new ATOM 0 HG22 THR A 54 10.544 -28.111 -60.296 1.00 0.00 H new ATOM 0 HG23 THR A 54 9.197 -29.178 -60.759 1.00 0.00 H new ATOM 852 N GLU A 55 13.392 -30.760 -58.534 1.00 0.00 N ATOM 853 CA GLU A 55 14.606 -31.308 -57.877 1.00 0.00 C ATOM 854 C GLU A 55 14.646 -30.999 -56.359 1.00 0.00 C ATOM 855 O GLU A 55 13.732 -30.382 -55.804 1.00 0.00 O ATOM 856 CB GLU A 55 15.892 -30.749 -58.583 1.00 0.00 C ATOM 857 CG GLU A 55 16.099 -29.209 -58.503 1.00 0.00 C ATOM 858 CD GLU A 55 15.132 -28.397 -59.382 1.00 0.00 C ATOM 859 OE1 GLU A 55 15.284 -28.417 -60.621 1.00 0.00 O ATOM 860 OE2 GLU A 55 14.199 -27.762 -58.841 1.00 0.00 O ATOM 0 H GLU A 55 13.451 -29.755 -58.699 1.00 0.00 H new ATOM 0 HA GLU A 55 14.574 -32.393 -57.980 1.00 0.00 H new ATOM 0 HB2 GLU A 55 16.763 -31.236 -58.145 1.00 0.00 H new ATOM 0 HB3 GLU A 55 15.860 -31.037 -59.634 1.00 0.00 H new ATOM 0 HG2 GLU A 55 15.984 -28.891 -57.467 1.00 0.00 H new ATOM 0 HG3 GLU A 55 17.122 -28.975 -58.796 1.00 0.00 H new ATOM 867 N VAL A 56 15.747 -31.437 -55.712 1.00 0.00 N ATOM 868 CA VAL A 56 16.010 -31.238 -54.271 1.00 0.00 C ATOM 869 C VAL A 56 16.643 -29.850 -54.027 1.00 0.00 C ATOM 870 O VAL A 56 17.585 -29.460 -54.718 1.00 0.00 O ATOM 871 CB VAL A 56 16.990 -32.348 -53.718 1.00 0.00 C ATOM 872 CG1 VAL A 56 17.296 -32.145 -52.213 1.00 0.00 C ATOM 873 CG2 VAL A 56 16.446 -33.778 -53.985 1.00 0.00 C ATOM 0 H VAL A 56 16.492 -31.948 -56.186 1.00 0.00 H new ATOM 0 HA VAL A 56 15.056 -31.307 -53.748 1.00 0.00 H new ATOM 0 HB VAL A 56 17.928 -32.242 -54.264 1.00 0.00 H new ATOM 0 HG11 VAL A 56 17.973 -32.928 -51.870 1.00 0.00 H new ATOM 0 HG12 VAL A 56 17.763 -31.171 -52.065 1.00 0.00 H new ATOM 0 HG13 VAL A 56 16.368 -32.193 -51.643 1.00 0.00 H new ATOM 0 HG21 VAL A 56 17.147 -34.514 -53.591 1.00 0.00 H new ATOM 0 HG22 VAL A 56 15.480 -33.897 -53.494 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.328 -33.928 -55.058 1.00 0.00 H new ATOM 883 N VAL A 57 16.118 -29.114 -53.032 1.00 0.00 N ATOM 884 CA VAL A 57 16.682 -27.831 -52.574 1.00 0.00 C ATOM 885 C VAL A 57 17.015 -27.919 -51.071 1.00 0.00 C ATOM 886 O VAL A 57 16.139 -28.197 -50.251 1.00 0.00 O ATOM 887 CB VAL A 57 15.687 -26.630 -52.830 1.00 0.00 C ATOM 888 CG1 VAL A 57 16.248 -25.288 -52.263 1.00 0.00 C ATOM 889 CG2 VAL A 57 15.338 -26.507 -54.342 1.00 0.00 C ATOM 0 H VAL A 57 15.283 -29.395 -52.518 1.00 0.00 H new ATOM 0 HA VAL A 57 17.590 -27.640 -53.147 1.00 0.00 H new ATOM 0 HB VAL A 57 14.764 -26.846 -52.292 1.00 0.00 H new ATOM 0 HG11 VAL A 57 15.537 -24.485 -52.458 1.00 0.00 H new ATOM 0 HG12 VAL A 57 16.402 -25.383 -51.188 1.00 0.00 H new ATOM 0 HG13 VAL A 57 17.197 -25.057 -52.747 1.00 0.00 H new ATOM 0 HG21 VAL A 57 14.652 -25.673 -54.490 1.00 0.00 H new ATOM 0 HG22 VAL A 57 16.250 -26.333 -54.913 1.00 0.00 H new ATOM 0 HG23 VAL A 57 14.867 -27.429 -54.683 1.00 0.00 H new ATOM 899 N PHE A 58 18.291 -27.706 -50.723 1.00 0.00 N ATOM 900 CA PHE A 58 18.732 -27.551 -49.325 1.00 0.00 C ATOM 901 C PHE A 58 18.693 -26.072 -48.942 1.00 0.00 C ATOM 902 O PHE A 58 19.312 -25.242 -49.599 1.00 0.00 O ATOM 903 CB PHE A 58 20.164 -28.124 -49.106 1.00 0.00 C ATOM 904 CG PHE A 58 20.179 -29.603 -48.740 1.00 0.00 C ATOM 905 CD1 PHE A 58 20.119 -30.585 -49.719 1.00 0.00 C ATOM 906 CD2 PHE A 58 20.256 -30.007 -47.401 1.00 0.00 C ATOM 907 CE1 PHE A 58 20.133 -31.922 -49.380 1.00 0.00 C ATOM 908 CE2 PHE A 58 20.267 -31.347 -47.064 1.00 0.00 C ATOM 909 CZ PHE A 58 20.213 -32.301 -48.054 1.00 0.00 C ATOM 0 H PHE A 58 19.049 -27.636 -51.401 1.00 0.00 H new ATOM 0 HA PHE A 58 18.052 -28.117 -48.688 1.00 0.00 H new ATOM 0 HB2 PHE A 58 20.748 -27.977 -50.014 1.00 0.00 H new ATOM 0 HB3 PHE A 58 20.656 -27.557 -48.315 1.00 0.00 H new ATOM 0 HD1 PHE A 58 20.061 -30.299 -50.759 1.00 0.00 H new ATOM 0 HD2 PHE A 58 20.307 -29.261 -46.622 1.00 0.00 H new ATOM 0 HE1 PHE A 58 20.081 -32.674 -50.153 1.00 0.00 H new ATOM 0 HE2 PHE A 58 20.318 -31.645 -46.027 1.00 0.00 H new ATOM 0 HZ PHE A 58 20.233 -33.349 -47.794 1.00 0.00 H new ATOM 919 N VAL A 59 17.961 -25.751 -47.876 1.00 0.00 N ATOM 920 CA VAL A 59 17.943 -24.414 -47.286 1.00 0.00 C ATOM 921 C VAL A 59 19.171 -24.241 -46.384 1.00 0.00 C ATOM 922 O VAL A 59 19.403 -25.035 -45.464 1.00 0.00 O ATOM 923 CB VAL A 59 16.605 -24.168 -46.490 1.00 0.00 C ATOM 924 CG1 VAL A 59 16.734 -23.037 -45.431 1.00 0.00 C ATOM 925 CG2 VAL A 59 15.457 -23.864 -47.471 1.00 0.00 C ATOM 0 H VAL A 59 17.359 -26.418 -47.394 1.00 0.00 H new ATOM 0 HA VAL A 59 17.984 -23.669 -48.081 1.00 0.00 H new ATOM 0 HB VAL A 59 16.383 -25.083 -45.941 1.00 0.00 H new ATOM 0 HG11 VAL A 59 15.782 -22.912 -44.914 1.00 0.00 H new ATOM 0 HG12 VAL A 59 17.507 -23.301 -44.709 1.00 0.00 H new ATOM 0 HG13 VAL A 59 17.003 -22.104 -45.926 1.00 0.00 H new ATOM 0 HG21 VAL A 59 14.536 -23.695 -46.913 1.00 0.00 H new ATOM 0 HG22 VAL A 59 15.699 -22.972 -48.049 1.00 0.00 H new ATOM 0 HG23 VAL A 59 15.322 -24.709 -48.146 1.00 0.00 H new ATOM 935 N ALA A 60 19.947 -23.189 -46.681 1.00 0.00 N ATOM 936 CA ALA A 60 21.173 -22.842 -45.951 1.00 0.00 C ATOM 937 C ALA A 60 20.826 -22.069 -44.669 1.00 0.00 C ATOM 938 O ALA A 60 19.787 -21.399 -44.634 1.00 0.00 O ATOM 939 CB ALA A 60 22.114 -22.022 -46.849 1.00 0.00 C ATOM 0 H ALA A 60 19.737 -22.547 -47.445 1.00 0.00 H new ATOM 0 HA ALA A 60 21.688 -23.760 -45.668 1.00 0.00 H new ATOM 0 HB1 ALA A 60 23.019 -21.772 -46.295 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.378 -22.607 -47.730 1.00 0.00 H new ATOM 0 HB3 ALA A 60 21.613 -21.105 -47.159 1.00 0.00 H new ATOM 945 N PRO A 61 21.702 -22.133 -43.608 1.00 0.00 N ATOM 946 CA PRO A 61 21.492 -21.391 -42.328 1.00 0.00 C ATOM 947 C PRO A 61 21.407 -19.853 -42.531 1.00 0.00 C ATOM 948 O PRO A 61 20.666 -19.162 -41.821 1.00 0.00 O ATOM 949 CB PRO A 61 22.744 -21.784 -41.475 1.00 0.00 C ATOM 950 CG PRO A 61 23.752 -22.285 -42.472 1.00 0.00 C ATOM 951 CD PRO A 61 22.942 -22.960 -43.548 1.00 0.00 C ATOM 0 HA PRO A 61 20.545 -21.650 -41.855 1.00 0.00 H new ATOM 0 HB2 PRO A 61 23.129 -20.928 -40.921 1.00 0.00 H new ATOM 0 HB3 PRO A 61 22.497 -22.553 -40.743 1.00 0.00 H new ATOM 0 HG2 PRO A 61 24.343 -21.465 -42.880 1.00 0.00 H new ATOM 0 HG3 PRO A 61 24.451 -22.982 -42.009 1.00 0.00 H new ATOM 0 HD2 PRO A 61 23.468 -22.968 -44.503 1.00 0.00 H new ATOM 0 HD3 PRO A 61 22.723 -23.998 -43.296 1.00 0.00 H new ATOM 959 N THR A 62 22.162 -19.338 -43.526 1.00 0.00 N ATOM 960 CA THR A 62 22.219 -17.893 -43.847 1.00 0.00 C ATOM 961 C THR A 62 21.158 -17.503 -44.909 1.00 0.00 C ATOM 962 O THR A 62 20.982 -16.317 -45.208 1.00 0.00 O ATOM 963 CB THR A 62 23.656 -17.501 -44.334 1.00 0.00 C ATOM 964 OG1 THR A 62 23.783 -16.071 -44.452 1.00 0.00 O ATOM 965 CG2 THR A 62 24.011 -18.166 -45.678 1.00 0.00 C ATOM 0 H THR A 62 22.750 -19.912 -44.130 1.00 0.00 H new ATOM 0 HA THR A 62 21.992 -17.339 -42.936 1.00 0.00 H new ATOM 0 HB THR A 62 24.356 -17.865 -43.582 1.00 0.00 H new ATOM 0 HG1 THR A 62 22.922 -15.687 -44.719 1.00 0.00 H new ATOM 0 HG21 THR A 62 25.015 -17.867 -45.978 1.00 0.00 H new ATOM 0 HG22 THR A 62 23.973 -19.250 -45.569 1.00 0.00 H new ATOM 0 HG23 THR A 62 23.297 -17.852 -46.439 1.00 0.00 H new ATOM 973 N GLY A 63 20.465 -18.509 -45.485 1.00 0.00 N ATOM 974 CA GLY A 63 19.426 -18.266 -46.492 1.00 0.00 C ATOM 975 C GLY A 63 19.931 -18.332 -47.933 1.00 0.00 C ATOM 976 O GLY A 63 19.139 -18.166 -48.862 1.00 0.00 O ATOM 0 H GLY A 63 20.611 -19.494 -45.266 1.00 0.00 H new ATOM 0 HA2 GLY A 63 18.630 -18.999 -46.363 1.00 0.00 H new ATOM 0 HA3 GLY A 63 18.986 -17.284 -46.316 1.00 0.00 H new ATOM 980 N GLU A 64 21.250 -18.567 -48.124 1.00 0.00 N ATOM 981 CA GLU A 64 21.843 -18.786 -49.463 1.00 0.00 C ATOM 982 C GLU A 64 21.604 -20.251 -49.884 1.00 0.00 C ATOM 983 O GLU A 64 22.497 -21.105 -49.798 1.00 0.00 O ATOM 984 CB GLU A 64 23.357 -18.411 -49.463 1.00 0.00 C ATOM 985 CG GLU A 64 24.062 -18.561 -50.829 1.00 0.00 C ATOM 986 CD GLU A 64 25.494 -18.003 -50.835 1.00 0.00 C ATOM 987 OE1 GLU A 64 25.661 -16.803 -51.120 1.00 0.00 O ATOM 988 OE2 GLU A 64 26.449 -18.747 -50.524 1.00 0.00 O ATOM 0 H GLU A 64 21.927 -18.610 -47.362 1.00 0.00 H new ATOM 0 HA GLU A 64 21.362 -18.136 -50.194 1.00 0.00 H new ATOM 0 HB2 GLU A 64 23.461 -17.379 -49.128 1.00 0.00 H new ATOM 0 HB3 GLU A 64 23.872 -19.037 -48.734 1.00 0.00 H new ATOM 0 HG2 GLU A 64 24.089 -19.616 -51.103 1.00 0.00 H new ATOM 0 HG3 GLU A 64 23.476 -18.048 -51.592 1.00 0.00 H new ATOM 995 N GLU A 65 20.347 -20.531 -50.269 1.00 0.00 N ATOM 996 CA GLU A 65 19.856 -21.898 -50.512 1.00 0.00 C ATOM 997 C GLU A 65 20.554 -22.553 -51.722 1.00 0.00 C ATOM 998 O GLU A 65 20.902 -21.887 -52.704 1.00 0.00 O ATOM 999 CB GLU A 65 18.316 -21.881 -50.713 1.00 0.00 C ATOM 1000 CG GLU A 65 17.836 -21.074 -51.944 1.00 0.00 C ATOM 1001 CD GLU A 65 16.307 -20.988 -52.056 1.00 0.00 C ATOM 1002 OE1 GLU A 65 15.723 -20.020 -51.541 1.00 0.00 O ATOM 1003 OE2 GLU A 65 15.682 -21.890 -52.648 1.00 0.00 O ATOM 0 H GLU A 65 19.640 -19.812 -50.421 1.00 0.00 H new ATOM 0 HA GLU A 65 20.097 -22.500 -49.636 1.00 0.00 H new ATOM 0 HB2 GLU A 65 17.964 -22.908 -50.808 1.00 0.00 H new ATOM 0 HB3 GLU A 65 17.851 -21.466 -49.819 1.00 0.00 H new ATOM 0 HG2 GLU A 65 18.247 -20.066 -51.891 1.00 0.00 H new ATOM 0 HG3 GLU A 65 18.234 -21.533 -52.849 1.00 0.00 H new ATOM 1010 N ILE A 66 20.761 -23.860 -51.619 1.00 0.00 N ATOM 1011 CA ILE A 66 21.419 -24.674 -52.638 1.00 0.00 C ATOM 1012 C ILE A 66 20.363 -25.439 -53.457 1.00 0.00 C ATOM 1013 O ILE A 66 19.530 -26.144 -52.889 1.00 0.00 O ATOM 1014 CB ILE A 66 22.411 -25.676 -51.963 1.00 0.00 C ATOM 1015 CG1 ILE A 66 23.438 -24.923 -51.039 1.00 0.00 C ATOM 1016 CG2 ILE A 66 23.119 -26.546 -53.015 1.00 0.00 C ATOM 1017 CD1 ILE A 66 24.273 -23.842 -51.713 1.00 0.00 C ATOM 0 H ILE A 66 20.469 -24.399 -50.804 1.00 0.00 H new ATOM 0 HA ILE A 66 21.981 -24.023 -53.308 1.00 0.00 H new ATOM 0 HB ILE A 66 21.833 -26.345 -51.325 1.00 0.00 H new ATOM 0 HG12 ILE A 66 22.889 -24.469 -50.214 1.00 0.00 H new ATOM 0 HG13 ILE A 66 24.114 -25.659 -50.605 1.00 0.00 H new ATOM 0 HG21 ILE A 66 23.803 -27.234 -52.518 1.00 0.00 H new ATOM 0 HG22 ILE A 66 22.377 -27.114 -53.576 1.00 0.00 H new ATOM 0 HG23 ILE A 66 23.679 -25.907 -53.698 1.00 0.00 H new ATOM 0 HD11 ILE A 66 24.944 -23.392 -50.982 1.00 0.00 H new ATOM 0 HD12 ILE A 66 24.859 -24.284 -52.519 1.00 0.00 H new ATOM 0 HD13 ILE A 66 23.615 -23.075 -52.121 1.00 0.00 H new ATOM 1029 N SER A 67 20.437 -25.303 -54.788 1.00 0.00 N ATOM 1030 CA SER A 67 19.484 -25.924 -55.728 1.00 0.00 C ATOM 1031 C SER A 67 20.034 -27.232 -56.322 1.00 0.00 C ATOM 1032 O SER A 67 19.291 -28.013 -56.926 1.00 0.00 O ATOM 1033 CB SER A 67 19.193 -24.920 -56.867 1.00 0.00 C ATOM 1034 OG SER A 67 20.391 -24.407 -57.434 1.00 0.00 O ATOM 0 H SER A 67 21.164 -24.756 -55.249 1.00 0.00 H new ATOM 0 HA SER A 67 18.572 -26.170 -55.184 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.604 -25.410 -57.642 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.591 -24.097 -56.482 1.00 0.00 H new ATOM 0 HG SER A 67 21.114 -25.058 -57.315 1.00 0.00 H new ATOM 1040 N ASN A 68 21.353 -27.451 -56.158 1.00 0.00 N ATOM 1041 CA ASN A 68 22.094 -28.497 -56.881 1.00 0.00 C ATOM 1042 C ASN A 68 23.348 -28.915 -56.091 1.00 0.00 C ATOM 1043 O ASN A 68 24.021 -28.075 -55.488 1.00 0.00 O ATOM 1044 CB ASN A 68 22.459 -27.991 -58.309 1.00 0.00 C ATOM 1045 CG ASN A 68 23.205 -26.645 -58.323 1.00 0.00 C ATOM 1046 OD1 ASN A 68 22.988 -25.785 -57.471 1.00 0.00 O ATOM 1047 ND2 ASN A 68 24.074 -26.442 -59.295 1.00 0.00 N ATOM 0 H ASN A 68 21.933 -26.906 -55.520 1.00 0.00 H new ATOM 0 HA ASN A 68 21.464 -29.380 -56.983 1.00 0.00 H new ATOM 0 HB2 ASN A 68 23.076 -28.742 -58.803 1.00 0.00 H new ATOM 0 HB3 ASN A 68 21.544 -27.894 -58.894 1.00 0.00 H new ATOM 0 HD21 ASN A 68 24.581 -25.558 -59.350 1.00 0.00 H new ATOM 0 HD22 ASN A 68 24.239 -27.169 -59.992 1.00 0.00 H new ATOM 1054 N ARG A 69 23.687 -30.215 -56.174 1.00 0.00 N ATOM 1055 CA ARG A 69 24.652 -30.890 -55.272 1.00 0.00 C ATOM 1056 C ARG A 69 26.096 -30.333 -55.367 1.00 0.00 C ATOM 1057 O ARG A 69 26.851 -30.397 -54.385 1.00 0.00 O ATOM 1058 CB ARG A 69 24.613 -32.420 -55.530 1.00 0.00 C ATOM 1059 CG ARG A 69 25.438 -33.246 -54.522 1.00 0.00 C ATOM 1060 CD ARG A 69 25.223 -34.759 -54.631 1.00 0.00 C ATOM 1061 NE ARG A 69 26.091 -35.479 -53.686 1.00 0.00 N ATOM 1062 CZ ARG A 69 25.984 -36.771 -53.352 1.00 0.00 C ATOM 1063 NH1 ARG A 69 25.005 -37.531 -53.816 1.00 0.00 N ATOM 1064 NH2 ARG A 69 26.893 -37.296 -52.556 1.00 0.00 N ATOM 0 H ARG A 69 23.295 -30.839 -56.879 1.00 0.00 H new ATOM 0 HA ARG A 69 24.339 -30.680 -54.249 1.00 0.00 H new ATOM 0 HB2 ARG A 69 23.577 -32.757 -55.499 1.00 0.00 H new ATOM 0 HB3 ARG A 69 24.983 -32.618 -56.536 1.00 0.00 H new ATOM 0 HG2 ARG A 69 26.496 -33.028 -54.669 1.00 0.00 H new ATOM 0 HG3 ARG A 69 25.184 -32.925 -53.512 1.00 0.00 H new ATOM 0 HD2 ARG A 69 24.179 -34.998 -54.428 1.00 0.00 H new ATOM 0 HD3 ARG A 69 25.433 -35.088 -55.649 1.00 0.00 H new ATOM 0 HE ARG A 69 26.841 -34.946 -53.246 1.00 0.00 H new ATOM 0 HH11 ARG A 69 24.307 -37.135 -54.445 1.00 0.00 H new ATOM 0 HH12 ARG A 69 24.949 -38.513 -53.544 1.00 0.00 H new ATOM 0 HH21 ARG A 69 27.659 -36.720 -52.207 1.00 0.00 H new ATOM 0 HH22 ARG A 69 26.831 -38.278 -52.289 1.00 0.00 H new ATOM 1078 N LYS A 70 26.461 -29.767 -56.532 1.00 0.00 N ATOM 1079 CA LYS A 70 27.792 -29.132 -56.738 1.00 0.00 C ATOM 1080 C LYS A 70 27.909 -27.884 -55.842 1.00 0.00 C ATOM 1081 O LYS A 70 28.900 -27.725 -55.115 1.00 0.00 O ATOM 1082 CB LYS A 70 28.007 -28.770 -58.246 1.00 0.00 C ATOM 1083 CG LYS A 70 29.464 -28.398 -58.675 1.00 0.00 C ATOM 1084 CD LYS A 70 29.877 -26.941 -58.329 1.00 0.00 C ATOM 1085 CE LYS A 70 31.336 -26.636 -58.679 1.00 0.00 C ATOM 1086 NZ LYS A 70 31.605 -26.802 -60.126 1.00 0.00 N ATOM 0 H LYS A 70 25.856 -29.732 -57.352 1.00 0.00 H new ATOM 0 HA LYS A 70 28.574 -29.838 -56.459 1.00 0.00 H new ATOM 0 HB2 LYS A 70 27.680 -29.616 -58.850 1.00 0.00 H new ATOM 0 HB3 LYS A 70 27.355 -27.932 -58.492 1.00 0.00 H new ATOM 0 HG2 LYS A 70 30.159 -29.085 -58.193 1.00 0.00 H new ATOM 0 HG3 LYS A 70 29.563 -28.546 -59.750 1.00 0.00 H new ATOM 0 HD2 LYS A 70 29.228 -26.248 -58.864 1.00 0.00 H new ATOM 0 HD3 LYS A 70 29.720 -26.767 -57.264 1.00 0.00 H new ATOM 0 HE2 LYS A 70 31.575 -25.615 -58.380 1.00 0.00 H new ATOM 0 HE3 LYS A 70 31.991 -27.296 -58.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 32.574 -26.489 -60.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 31.500 -27.804 -60.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 30.930 -26.230 -60.672 1.00 0.00 H new ATOM 1100 N GLN A 71 26.861 -27.025 -55.882 1.00 0.00 N ATOM 1101 CA GLN A 71 26.828 -25.758 -55.123 1.00 0.00 C ATOM 1102 C GLN A 71 26.852 -25.994 -53.609 1.00 0.00 C ATOM 1103 O GLN A 71 27.279 -25.118 -52.867 1.00 0.00 O ATOM 1104 CB GLN A 71 25.614 -24.877 -55.519 1.00 0.00 C ATOM 1105 CG GLN A 71 25.712 -24.238 -56.920 1.00 0.00 C ATOM 1106 CD GLN A 71 26.978 -23.401 -57.123 1.00 0.00 C ATOM 1107 OE1 GLN A 71 27.992 -23.900 -57.605 1.00 0.00 O ATOM 1108 NE2 GLN A 71 26.944 -22.134 -56.736 1.00 0.00 N ATOM 0 H GLN A 71 26.022 -27.192 -56.438 1.00 0.00 H new ATOM 0 HA GLN A 71 27.736 -25.217 -55.390 1.00 0.00 H new ATOM 0 HB2 GLN A 71 24.711 -25.485 -55.474 1.00 0.00 H new ATOM 0 HB3 GLN A 71 25.501 -24.084 -54.780 1.00 0.00 H new ATOM 0 HG2 GLN A 71 25.682 -25.026 -57.673 1.00 0.00 H new ATOM 0 HG3 GLN A 71 24.839 -23.607 -57.085 1.00 0.00 H new ATOM 0 HE21 GLN A 71 26.089 -21.745 -56.339 1.00 0.00 H new ATOM 0 HE22 GLN A 71 27.773 -21.548 -56.835 1.00 0.00 H new ATOM 1117 N LEU A 72 26.408 -27.187 -53.172 1.00 0.00 N ATOM 1118 CA LEU A 72 26.456 -27.591 -51.754 1.00 0.00 C ATOM 1119 C LEU A 72 27.929 -27.687 -51.303 1.00 0.00 C ATOM 1120 O LEU A 72 28.335 -27.045 -50.334 1.00 0.00 O ATOM 1121 CB LEU A 72 25.717 -28.960 -51.567 1.00 0.00 C ATOM 1122 CG LEU A 72 25.133 -29.307 -50.147 1.00 0.00 C ATOM 1123 CD1 LEU A 72 26.180 -29.266 -49.027 1.00 0.00 C ATOM 1124 CD2 LEU A 72 23.924 -28.421 -49.808 1.00 0.00 C ATOM 0 H LEU A 72 26.008 -27.895 -53.788 1.00 0.00 H new ATOM 0 HA LEU A 72 25.951 -26.848 -51.137 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.895 -28.994 -52.282 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.412 -29.753 -51.843 1.00 0.00 H new ATOM 0 HG LEU A 72 24.798 -30.342 -50.208 1.00 0.00 H new ATOM 0 HD11 LEU A 72 25.707 -29.515 -48.077 1.00 0.00 H new ATOM 0 HD12 LEU A 72 26.969 -29.987 -49.240 1.00 0.00 H new ATOM 0 HD13 LEU A 72 26.610 -28.266 -48.967 1.00 0.00 H new ATOM 0 HD21 LEU A 72 23.544 -28.686 -48.821 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.228 -27.374 -49.811 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.141 -28.574 -50.551 1.00 0.00 H new ATOM 1136 N GLU A 73 28.715 -28.474 -52.054 1.00 0.00 N ATOM 1137 CA GLU A 73 30.121 -28.799 -51.717 1.00 0.00 C ATOM 1138 C GLU A 73 31.001 -27.535 -51.719 1.00 0.00 C ATOM 1139 O GLU A 73 31.755 -27.285 -50.760 1.00 0.00 O ATOM 1140 CB GLU A 73 30.657 -29.849 -52.727 1.00 0.00 C ATOM 1141 CG GLU A 73 29.817 -31.132 -52.785 1.00 0.00 C ATOM 1142 CD GLU A 73 30.331 -32.141 -53.815 1.00 0.00 C ATOM 1143 OE1 GLU A 73 30.124 -31.915 -55.024 1.00 0.00 O ATOM 1144 OE2 GLU A 73 30.966 -33.146 -53.429 1.00 0.00 O ATOM 0 H GLU A 73 28.396 -28.909 -52.920 1.00 0.00 H new ATOM 0 HA GLU A 73 30.158 -29.215 -50.710 1.00 0.00 H new ATOM 0 HB2 GLU A 73 30.690 -29.401 -53.720 1.00 0.00 H new ATOM 0 HB3 GLU A 73 31.682 -30.108 -52.460 1.00 0.00 H new ATOM 0 HG2 GLU A 73 29.810 -31.599 -51.800 1.00 0.00 H new ATOM 0 HG3 GLU A 73 28.785 -30.873 -53.023 1.00 0.00 H new ATOM 1151 N GLN A 74 30.848 -26.715 -52.776 1.00 0.00 N ATOM 1152 CA GLN A 74 31.628 -25.477 -52.948 1.00 0.00 C ATOM 1153 C GLN A 74 31.206 -24.405 -51.910 1.00 0.00 C ATOM 1154 O GLN A 74 32.005 -23.534 -51.552 1.00 0.00 O ATOM 1155 CB GLN A 74 31.542 -24.961 -54.424 1.00 0.00 C ATOM 1156 CG GLN A 74 30.151 -24.500 -54.932 1.00 0.00 C ATOM 1157 CD GLN A 74 29.795 -23.029 -54.650 1.00 0.00 C ATOM 1158 OE1 GLN A 74 29.201 -22.699 -53.624 1.00 0.00 O ATOM 1159 NE2 GLN A 74 30.172 -22.145 -55.558 1.00 0.00 N ATOM 0 H GLN A 74 30.184 -26.891 -53.530 1.00 0.00 H new ATOM 0 HA GLN A 74 32.678 -25.698 -52.756 1.00 0.00 H new ATOM 0 HB2 GLN A 74 32.235 -24.126 -54.531 1.00 0.00 H new ATOM 0 HB3 GLN A 74 31.896 -25.755 -55.081 1.00 0.00 H new ATOM 0 HG2 GLN A 74 30.103 -24.667 -56.008 1.00 0.00 H new ATOM 0 HG3 GLN A 74 29.389 -25.133 -54.477 1.00 0.00 H new ATOM 0 HE21 GLN A 74 30.663 -22.454 -56.397 1.00 0.00 H new ATOM 0 HE22 GLN A 74 29.972 -21.154 -55.419 1.00 0.00 H new ATOM 1168 N TYR A 75 29.944 -24.498 -51.417 1.00 0.00 N ATOM 1169 CA TYR A 75 29.434 -23.645 -50.323 1.00 0.00 C ATOM 1170 C TYR A 75 30.202 -23.956 -49.028 1.00 0.00 C ATOM 1171 O TYR A 75 30.734 -23.048 -48.398 1.00 0.00 O ATOM 1172 CB TYR A 75 27.900 -23.866 -50.132 1.00 0.00 C ATOM 1173 CG TYR A 75 27.230 -23.064 -49.001 1.00 0.00 C ATOM 1174 CD1 TYR A 75 26.506 -21.895 -49.255 1.00 0.00 C ATOM 1175 CD2 TYR A 75 27.318 -23.482 -47.672 1.00 0.00 C ATOM 1176 CE1 TYR A 75 25.893 -21.196 -48.229 1.00 0.00 C ATOM 1177 CE2 TYR A 75 26.716 -22.782 -46.657 1.00 0.00 C ATOM 1178 CZ TYR A 75 26.009 -21.643 -46.933 1.00 0.00 C ATOM 1179 OH TYR A 75 25.403 -20.959 -45.904 1.00 0.00 O ATOM 0 H TYR A 75 29.257 -25.165 -51.768 1.00 0.00 H new ATOM 0 HA TYR A 75 29.591 -22.597 -50.578 1.00 0.00 H new ATOM 0 HB2 TYR A 75 27.400 -23.620 -51.069 1.00 0.00 H new ATOM 0 HB3 TYR A 75 27.728 -24.926 -49.948 1.00 0.00 H new ATOM 0 HD1 TYR A 75 26.424 -21.531 -50.269 1.00 0.00 H new ATOM 0 HD2 TYR A 75 27.873 -24.378 -47.437 1.00 0.00 H new ATOM 0 HE1 TYR A 75 25.326 -20.303 -48.445 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.800 -23.130 -45.638 1.00 0.00 H new ATOM 0 HH TYR A 75 25.587 -21.414 -45.056 1.00 0.00 H new ATOM 1189 N LEU A 76 30.274 -25.258 -48.675 1.00 0.00 N ATOM 1190 CA LEU A 76 30.835 -25.732 -47.381 1.00 0.00 C ATOM 1191 C LEU A 76 32.312 -25.337 -47.212 1.00 0.00 C ATOM 1192 O LEU A 76 32.716 -24.866 -46.146 1.00 0.00 O ATOM 1193 CB LEU A 76 30.698 -27.271 -47.260 1.00 0.00 C ATOM 1194 CG LEU A 76 29.256 -27.852 -47.347 1.00 0.00 C ATOM 1195 CD1 LEU A 76 29.288 -29.385 -47.228 1.00 0.00 C ATOM 1196 CD2 LEU A 76 28.308 -27.210 -46.302 1.00 0.00 C ATOM 0 H LEU A 76 29.946 -26.014 -49.276 1.00 0.00 H new ATOM 0 HA LEU A 76 30.261 -25.248 -46.591 1.00 0.00 H new ATOM 0 HB2 LEU A 76 31.298 -27.729 -48.046 1.00 0.00 H new ATOM 0 HB3 LEU A 76 31.132 -27.578 -46.308 1.00 0.00 H new ATOM 0 HG LEU A 76 28.849 -27.598 -48.326 1.00 0.00 H new ATOM 0 HD11 LEU A 76 28.272 -29.776 -47.291 1.00 0.00 H new ATOM 0 HD12 LEU A 76 29.887 -29.800 -48.038 1.00 0.00 H new ATOM 0 HD13 LEU A 76 29.727 -29.667 -46.271 1.00 0.00 H new ATOM 0 HD21 LEU A 76 27.313 -27.644 -46.398 1.00 0.00 H new ATOM 0 HD22 LEU A 76 28.691 -27.399 -45.299 1.00 0.00 H new ATOM 0 HD23 LEU A 76 28.253 -26.135 -46.473 1.00 0.00 H new ATOM 1208 N LYS A 77 33.108 -25.540 -48.278 1.00 0.00 N ATOM 1209 CA LYS A 77 34.545 -25.180 -48.268 1.00 0.00 C ATOM 1210 C LYS A 77 34.737 -23.649 -48.195 1.00 0.00 C ATOM 1211 O LYS A 77 35.710 -23.162 -47.613 1.00 0.00 O ATOM 1212 CB LYS A 77 35.272 -25.737 -49.516 1.00 0.00 C ATOM 1213 CG LYS A 77 34.722 -25.204 -50.858 1.00 0.00 C ATOM 1214 CD LYS A 77 35.642 -25.494 -52.057 1.00 0.00 C ATOM 1215 CE LYS A 77 35.862 -26.995 -52.307 1.00 0.00 C ATOM 1216 NZ LYS A 77 36.760 -27.234 -53.460 1.00 0.00 N ATOM 0 H LYS A 77 32.786 -25.949 -49.155 1.00 0.00 H new ATOM 0 HA LYS A 77 34.982 -25.632 -47.378 1.00 0.00 H new ATOM 0 HB2 LYS A 77 36.331 -25.490 -49.446 1.00 0.00 H new ATOM 0 HB3 LYS A 77 35.197 -26.824 -49.511 1.00 0.00 H new ATOM 0 HG2 LYS A 77 33.745 -25.650 -51.044 1.00 0.00 H new ATOM 0 HG3 LYS A 77 34.571 -24.127 -50.778 1.00 0.00 H new ATOM 0 HD2 LYS A 77 35.214 -25.043 -52.952 1.00 0.00 H new ATOM 0 HD3 LYS A 77 36.607 -25.016 -51.890 1.00 0.00 H new ATOM 0 HE2 LYS A 77 36.287 -27.454 -51.414 1.00 0.00 H new ATOM 0 HE3 LYS A 77 34.902 -27.478 -52.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 36.884 -28.257 -53.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 36.343 -26.818 -54.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 37.685 -26.795 -53.277 1.00 0.00 H new ATOM 1230 N SER A 78 33.795 -22.896 -48.806 1.00 0.00 N ATOM 1231 CA SER A 78 33.830 -21.414 -48.847 1.00 0.00 C ATOM 1232 C SER A 78 33.189 -20.795 -47.585 1.00 0.00 C ATOM 1233 O SER A 78 33.342 -19.597 -47.335 1.00 0.00 O ATOM 1234 CB SER A 78 33.109 -20.908 -50.131 1.00 0.00 C ATOM 1235 OG SER A 78 33.165 -19.495 -50.266 1.00 0.00 O ATOM 0 H SER A 78 32.989 -23.297 -49.285 1.00 0.00 H new ATOM 0 HA SER A 78 34.873 -21.097 -48.870 1.00 0.00 H new ATOM 0 HB2 SER A 78 33.565 -21.372 -51.006 1.00 0.00 H new ATOM 0 HB3 SER A 78 32.067 -21.226 -50.108 1.00 0.00 H new ATOM 0 HG SER A 78 33.221 -19.084 -49.378 1.00 0.00 H new ATOM 1241 N HIS A 79 32.456 -21.615 -46.800 1.00 0.00 N ATOM 1242 CA HIS A 79 31.713 -21.156 -45.599 1.00 0.00 C ATOM 1243 C HIS A 79 31.925 -22.167 -44.447 1.00 0.00 C ATOM 1244 O HIS A 79 31.197 -23.166 -44.361 1.00 0.00 O ATOM 1245 CB HIS A 79 30.195 -20.985 -45.914 1.00 0.00 C ATOM 1246 CG HIS A 79 29.917 -20.026 -47.043 1.00 0.00 C ATOM 1247 ND1 HIS A 79 29.547 -20.439 -48.305 1.00 0.00 N ATOM 1248 CD2 HIS A 79 30.006 -18.676 -47.111 1.00 0.00 C ATOM 1249 CE1 HIS A 79 29.421 -19.395 -49.096 1.00 0.00 C ATOM 1250 NE2 HIS A 79 29.694 -18.310 -48.400 1.00 0.00 N ATOM 0 H HIS A 79 32.361 -22.615 -46.979 1.00 0.00 H new ATOM 0 HA HIS A 79 32.097 -20.182 -45.295 1.00 0.00 H new ATOM 0 HB2 HIS A 79 29.772 -21.958 -46.163 1.00 0.00 H new ATOM 0 HB3 HIS A 79 29.684 -20.635 -45.017 1.00 0.00 H new ATOM 0 HD1 HIS A 79 29.394 -21.408 -48.584 1.00 0.00 H new ATOM 0 HD2 HIS A 79 30.272 -18.010 -46.303 1.00 0.00 H new ATOM 0 HE1 HIS A 79 29.141 -19.423 -50.139 1.00 0.00 H new ATOM 1259 N PRO A 80 32.957 -21.946 -43.567 1.00 0.00 N ATOM 1260 CA PRO A 80 33.257 -22.860 -42.438 1.00 0.00 C ATOM 1261 C PRO A 80 32.214 -22.748 -41.300 1.00 0.00 C ATOM 1262 O PRO A 80 31.559 -21.711 -41.139 1.00 0.00 O ATOM 1263 CB PRO A 80 34.672 -22.410 -41.991 1.00 0.00 C ATOM 1264 CG PRO A 80 34.737 -20.953 -42.343 1.00 0.00 C ATOM 1265 CD PRO A 80 33.909 -20.792 -43.606 1.00 0.00 C ATOM 0 HA PRO A 80 33.218 -23.912 -42.720 1.00 0.00 H new ATOM 0 HB2 PRO A 80 34.818 -22.566 -40.922 1.00 0.00 H new ATOM 0 HB3 PRO A 80 35.449 -22.977 -42.505 1.00 0.00 H new ATOM 0 HG2 PRO A 80 34.340 -20.338 -41.535 1.00 0.00 H new ATOM 0 HG3 PRO A 80 35.767 -20.637 -42.508 1.00 0.00 H new ATOM 0 HD2 PRO A 80 33.380 -19.839 -43.617 1.00 0.00 H new ATOM 0 HD3 PRO A 80 34.534 -20.820 -44.499 1.00 0.00 H new ATOM 1273 N GLY A 81 32.071 -23.839 -40.524 1.00 0.00 N ATOM 1274 CA GLY A 81 31.036 -23.943 -39.482 1.00 0.00 C ATOM 1275 C GLY A 81 29.859 -24.812 -39.922 1.00 0.00 C ATOM 1276 O GLY A 81 29.095 -25.313 -39.089 1.00 0.00 O ATOM 0 H GLY A 81 32.664 -24.665 -40.601 1.00 0.00 H new ATOM 0 HA2 GLY A 81 31.475 -24.361 -38.576 1.00 0.00 H new ATOM 0 HA3 GLY A 81 30.675 -22.946 -39.230 1.00 0.00 H new ATOM 1280 N ASN A 82 29.716 -24.971 -41.253 1.00 0.00 N ATOM 1281 CA ASN A 82 28.654 -25.780 -41.882 1.00 0.00 C ATOM 1282 C ASN A 82 29.112 -27.258 -42.012 1.00 0.00 C ATOM 1283 O ASN A 82 30.266 -27.510 -42.387 1.00 0.00 O ATOM 1284 CB ASN A 82 28.308 -25.166 -43.269 1.00 0.00 C ATOM 1285 CG ASN A 82 27.803 -23.720 -43.185 1.00 0.00 C ATOM 1286 OD1 ASN A 82 28.168 -22.871 -43.993 1.00 0.00 O ATOM 1287 ND2 ASN A 82 26.939 -23.428 -42.227 1.00 0.00 N ATOM 0 H ASN A 82 30.343 -24.535 -41.929 1.00 0.00 H new ATOM 0 HA ASN A 82 27.758 -25.770 -41.261 1.00 0.00 H new ATOM 0 HB2 ASN A 82 29.194 -25.198 -43.903 1.00 0.00 H new ATOM 0 HB3 ASN A 82 27.548 -25.781 -43.751 1.00 0.00 H new ATOM 0 HD21 ASN A 82 26.563 -22.483 -42.150 1.00 0.00 H new ATOM 0 HD22 ASN A 82 26.648 -24.148 -41.565 1.00 0.00 H new ATOM 1294 N PRO A 83 28.214 -28.258 -41.697 1.00 0.00 N ATOM 1295 CA PRO A 83 28.570 -29.704 -41.702 1.00 0.00 C ATOM 1296 C PRO A 83 28.753 -30.274 -43.128 1.00 0.00 C ATOM 1297 O PRO A 83 28.260 -29.697 -44.104 1.00 0.00 O ATOM 1298 CB PRO A 83 27.375 -30.357 -40.960 1.00 0.00 C ATOM 1299 CG PRO A 83 26.215 -29.461 -41.258 1.00 0.00 C ATOM 1300 CD PRO A 83 26.785 -28.054 -41.335 1.00 0.00 C ATOM 0 HA PRO A 83 29.531 -29.900 -41.227 1.00 0.00 H new ATOM 0 HB2 PRO A 83 27.194 -31.372 -41.315 1.00 0.00 H new ATOM 0 HB3 PRO A 83 27.561 -30.422 -39.888 1.00 0.00 H new ATOM 0 HG2 PRO A 83 25.736 -29.741 -42.197 1.00 0.00 H new ATOM 0 HG3 PRO A 83 25.456 -29.533 -40.479 1.00 0.00 H new ATOM 0 HD2 PRO A 83 26.266 -27.455 -42.083 1.00 0.00 H new ATOM 0 HD3 PRO A 83 26.686 -27.532 -40.383 1.00 0.00 H new ATOM 1308 N ALA A 84 29.476 -31.411 -43.214 1.00 0.00 N ATOM 1309 CA ALA A 84 29.859 -32.040 -44.493 1.00 0.00 C ATOM 1310 C ALA A 84 28.644 -32.609 -45.246 1.00 0.00 C ATOM 1311 O ALA A 84 27.691 -33.071 -44.628 1.00 0.00 O ATOM 1312 CB ALA A 84 30.904 -33.148 -44.263 1.00 0.00 C ATOM 0 H ALA A 84 29.811 -31.919 -42.395 1.00 0.00 H new ATOM 0 HA ALA A 84 30.296 -31.258 -45.114 1.00 0.00 H new ATOM 0 HB1 ALA A 84 31.173 -33.599 -45.218 1.00 0.00 H new ATOM 0 HB2 ALA A 84 31.793 -32.719 -43.801 1.00 0.00 H new ATOM 0 HB3 ALA A 84 30.486 -33.911 -43.606 1.00 0.00 H new ATOM 1318 N ILE A 85 28.730 -32.617 -46.592 1.00 0.00 N ATOM 1319 CA ILE A 85 27.653 -33.104 -47.487 1.00 0.00 C ATOM 1320 C ILE A 85 27.452 -34.638 -47.365 1.00 0.00 C ATOM 1321 O ILE A 85 26.447 -35.194 -47.838 1.00 0.00 O ATOM 1322 CB ILE A 85 27.937 -32.681 -48.981 1.00 0.00 C ATOM 1323 CG1 ILE A 85 26.700 -32.987 -49.897 1.00 0.00 C ATOM 1324 CG2 ILE A 85 29.239 -33.329 -49.527 1.00 0.00 C ATOM 1325 CD1 ILE A 85 26.840 -32.537 -51.329 1.00 0.00 C ATOM 0 H ILE A 85 29.553 -32.284 -47.095 1.00 0.00 H new ATOM 0 HA ILE A 85 26.722 -32.634 -47.170 1.00 0.00 H new ATOM 0 HB ILE A 85 28.096 -31.603 -48.995 1.00 0.00 H new ATOM 0 HG12 ILE A 85 26.516 -34.061 -49.886 1.00 0.00 H new ATOM 0 HG13 ILE A 85 25.821 -32.508 -49.466 1.00 0.00 H new ATOM 0 HG21 ILE A 85 29.398 -33.013 -50.558 1.00 0.00 H new ATOM 0 HG22 ILE A 85 30.085 -33.015 -48.916 1.00 0.00 H new ATOM 0 HG23 ILE A 85 29.148 -34.415 -49.491 1.00 0.00 H new ATOM 0 HD11 ILE A 85 25.935 -32.793 -51.881 1.00 0.00 H new ATOM 0 HD12 ILE A 85 26.990 -31.458 -51.358 1.00 0.00 H new ATOM 0 HD13 ILE A 85 27.696 -33.035 -51.785 1.00 0.00 H new ATOM 1337 N ALA A 86 28.407 -35.303 -46.688 1.00 0.00 N ATOM 1338 CA ALA A 86 28.356 -36.746 -46.378 1.00 0.00 C ATOM 1339 C ALA A 86 27.079 -37.131 -45.585 1.00 0.00 C ATOM 1340 O ALA A 86 26.562 -38.241 -45.735 1.00 0.00 O ATOM 1341 CB ALA A 86 29.620 -37.149 -45.599 1.00 0.00 C ATOM 0 H ALA A 86 29.248 -34.847 -46.335 1.00 0.00 H new ATOM 0 HA ALA A 86 28.317 -37.291 -47.321 1.00 0.00 H new ATOM 0 HB1 ALA A 86 29.582 -38.214 -45.370 1.00 0.00 H new ATOM 0 HB2 ALA A 86 30.502 -36.939 -46.203 1.00 0.00 H new ATOM 0 HB3 ALA A 86 29.672 -36.580 -44.671 1.00 0.00 H new ATOM 1347 N GLU A 87 26.577 -36.196 -44.750 1.00 0.00 N ATOM 1348 CA GLU A 87 25.335 -36.392 -43.951 1.00 0.00 C ATOM 1349 C GLU A 87 24.100 -35.718 -44.608 1.00 0.00 C ATOM 1350 O GLU A 87 23.004 -35.730 -44.037 1.00 0.00 O ATOM 1351 CB GLU A 87 25.544 -35.855 -42.506 1.00 0.00 C ATOM 1352 CG GLU A 87 25.969 -34.375 -42.439 1.00 0.00 C ATOM 1353 CD GLU A 87 26.064 -33.823 -41.015 1.00 0.00 C ATOM 1354 OE1 GLU A 87 25.095 -33.204 -40.537 1.00 0.00 O ATOM 1355 OE2 GLU A 87 27.109 -34.011 -40.359 1.00 0.00 O ATOM 0 H GLU A 87 27.015 -35.286 -44.607 1.00 0.00 H new ATOM 0 HA GLU A 87 25.132 -37.462 -43.915 1.00 0.00 H new ATOM 0 HB2 GLU A 87 24.618 -35.981 -41.946 1.00 0.00 H new ATOM 0 HB3 GLU A 87 26.302 -36.462 -42.011 1.00 0.00 H new ATOM 0 HG2 GLU A 87 26.937 -34.262 -42.928 1.00 0.00 H new ATOM 0 HG3 GLU A 87 25.255 -33.776 -43.004 1.00 0.00 H new ATOM 1362 N PHE A 88 24.284 -35.122 -45.799 1.00 0.00 N ATOM 1363 CA PHE A 88 23.202 -34.437 -46.547 1.00 0.00 C ATOM 1364 C PHE A 88 22.572 -35.417 -47.541 1.00 0.00 C ATOM 1365 O PHE A 88 23.243 -35.873 -48.472 1.00 0.00 O ATOM 1366 CB PHE A 88 23.752 -33.190 -47.299 1.00 0.00 C ATOM 1367 CG PHE A 88 24.099 -31.993 -46.409 1.00 0.00 C ATOM 1368 CD1 PHE A 88 23.795 -30.707 -46.817 1.00 0.00 C ATOM 1369 CD2 PHE A 88 24.739 -32.148 -45.179 1.00 0.00 C ATOM 1370 CE1 PHE A 88 24.120 -29.623 -46.039 1.00 0.00 C ATOM 1371 CE2 PHE A 88 25.061 -31.059 -44.399 1.00 0.00 C ATOM 1372 CZ PHE A 88 24.753 -29.796 -44.833 1.00 0.00 C ATOM 0 H PHE A 88 25.186 -35.099 -46.275 1.00 0.00 H new ATOM 0 HA PHE A 88 22.445 -34.098 -45.840 1.00 0.00 H new ATOM 0 HB2 PHE A 88 24.645 -33.483 -47.851 1.00 0.00 H new ATOM 0 HB3 PHE A 88 23.012 -32.873 -48.034 1.00 0.00 H new ATOM 0 HD1 PHE A 88 23.295 -30.553 -47.762 1.00 0.00 H new ATOM 0 HD2 PHE A 88 24.987 -33.140 -44.832 1.00 0.00 H new ATOM 0 HE1 PHE A 88 23.876 -28.627 -46.378 1.00 0.00 H new ATOM 0 HE2 PHE A 88 25.554 -31.200 -43.449 1.00 0.00 H new ATOM 0 HZ PHE A 88 25.008 -28.939 -44.228 1.00 0.00 H new ATOM 1382 N ASP A 89 21.296 -35.762 -47.313 1.00 0.00 N ATOM 1383 CA ASP A 89 20.552 -36.700 -48.171 1.00 0.00 C ATOM 1384 C ASP A 89 20.081 -35.996 -49.455 1.00 0.00 C ATOM 1385 O ASP A 89 19.390 -34.980 -49.384 1.00 0.00 O ATOM 1386 CB ASP A 89 19.320 -37.294 -47.421 1.00 0.00 C ATOM 1387 CG ASP A 89 18.558 -38.322 -48.269 1.00 0.00 C ATOM 1388 OD1 ASP A 89 18.746 -39.545 -48.079 1.00 0.00 O ATOM 1389 OD2 ASP A 89 17.787 -37.905 -49.144 1.00 0.00 O ATOM 0 H ASP A 89 20.751 -35.400 -46.531 1.00 0.00 H new ATOM 0 HA ASP A 89 21.227 -37.515 -48.432 1.00 0.00 H new ATOM 0 HB2 ASP A 89 19.654 -37.765 -46.497 1.00 0.00 H new ATOM 0 HB3 ASP A 89 18.644 -36.486 -47.141 1.00 0.00 H new ATOM 1394 N TRP A 90 20.443 -36.560 -50.613 1.00 0.00 N ATOM 1395 CA TRP A 90 19.926 -36.133 -51.937 1.00 0.00 C ATOM 1396 C TRP A 90 19.104 -37.278 -52.590 1.00 0.00 C ATOM 1397 O TRP A 90 18.436 -37.071 -53.603 1.00 0.00 O ATOM 1398 CB TRP A 90 21.106 -35.716 -52.863 1.00 0.00 C ATOM 1399 CG TRP A 90 21.864 -34.501 -52.374 1.00 0.00 C ATOM 1400 CD1 TRP A 90 22.900 -34.475 -51.477 1.00 0.00 C ATOM 1401 CD2 TRP A 90 21.628 -33.135 -52.753 1.00 0.00 C ATOM 1402 NE1 TRP A 90 23.316 -33.186 -51.282 1.00 0.00 N ATOM 1403 CE2 TRP A 90 22.553 -32.347 -52.051 1.00 0.00 C ATOM 1404 CE3 TRP A 90 20.726 -32.501 -53.615 1.00 0.00 C ATOM 1405 CZ2 TRP A 90 22.603 -30.966 -52.188 1.00 0.00 C ATOM 1406 CZ3 TRP A 90 20.777 -31.123 -53.745 1.00 0.00 C ATOM 1407 CH2 TRP A 90 21.711 -30.369 -53.033 1.00 0.00 C ATOM 0 H TRP A 90 21.107 -37.332 -50.668 1.00 0.00 H new ATOM 0 HA TRP A 90 19.271 -35.273 -51.797 1.00 0.00 H new ATOM 0 HB2 TRP A 90 21.798 -36.553 -52.953 1.00 0.00 H new ATOM 0 HB3 TRP A 90 20.718 -35.514 -53.862 1.00 0.00 H new ATOM 0 HD1 TRP A 90 23.325 -35.343 -50.995 1.00 0.00 H new ATOM 0 HE1 TRP A 90 24.073 -32.896 -50.663 1.00 0.00 H new ATOM 0 HE3 TRP A 90 20.001 -33.078 -54.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 23.327 -30.380 -51.642 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 20.084 -30.625 -54.407 1.00 0.00 H new ATOM 0 HH2 TRP A 90 21.729 -29.296 -53.152 1.00 0.00 H new ATOM 1418 N THR A 91 19.116 -38.463 -51.941 1.00 0.00 N ATOM 1419 CA THR A 91 18.652 -39.752 -52.522 1.00 0.00 C ATOM 1420 C THR A 91 17.265 -40.183 -51.969 1.00 0.00 C ATOM 1421 O THR A 91 16.842 -41.323 -52.165 1.00 0.00 O ATOM 1422 CB THR A 91 19.746 -40.869 -52.276 1.00 0.00 C ATOM 1423 OG1 THR A 91 19.356 -42.125 -52.874 1.00 0.00 O ATOM 1424 CG2 THR A 91 20.047 -41.082 -50.784 1.00 0.00 C ATOM 0 H THR A 91 19.453 -38.557 -50.983 1.00 0.00 H new ATOM 0 HA THR A 91 18.520 -39.613 -53.595 1.00 0.00 H new ATOM 0 HB THR A 91 20.657 -40.509 -52.754 1.00 0.00 H new ATOM 0 HG1 THR A 91 18.388 -42.244 -52.782 1.00 0.00 H new ATOM 0 HG21 THR A 91 20.804 -41.859 -50.673 1.00 0.00 H new ATOM 0 HG22 THR A 91 20.415 -40.152 -50.351 1.00 0.00 H new ATOM 0 HG23 THR A 91 19.136 -41.387 -50.269 1.00 0.00 H new ATOM 1432 N THR A 92 16.539 -39.250 -51.312 1.00 0.00 N ATOM 1433 CA THR A 92 15.225 -39.534 -50.666 1.00 0.00 C ATOM 1434 C THR A 92 14.100 -39.908 -51.679 1.00 0.00 C ATOM 1435 O THR A 92 12.998 -40.276 -51.251 1.00 0.00 O ATOM 1436 CB THR A 92 14.737 -38.319 -49.797 1.00 0.00 C ATOM 1437 OG1 THR A 92 13.609 -38.679 -48.980 1.00 0.00 O ATOM 1438 CG2 THR A 92 14.382 -37.090 -50.648 1.00 0.00 C ATOM 0 H THR A 92 16.841 -38.281 -51.212 1.00 0.00 H new ATOM 0 HA THR A 92 15.406 -40.401 -50.031 1.00 0.00 H new ATOM 0 HB THR A 92 15.577 -38.053 -49.155 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.037 -39.306 -49.470 1.00 0.00 H new ATOM 0 HG21 THR A 92 14.051 -36.280 -49.998 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.260 -36.769 -51.208 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.582 -37.347 -51.343 1.00 0.00 H new ATOM 1446 N SER A 93 14.387 -39.782 -52.999 1.00 0.00 N ATOM 1447 CA SER A 93 13.429 -39.999 -54.111 1.00 0.00 C ATOM 1448 C SER A 93 12.595 -41.298 -53.934 1.00 0.00 C ATOM 1449 O SER A 93 13.084 -42.410 -54.189 1.00 0.00 O ATOM 1450 CB SER A 93 14.222 -40.029 -55.439 1.00 0.00 C ATOM 1451 OG SER A 93 15.059 -38.886 -55.560 1.00 0.00 O ATOM 0 H SER A 93 15.316 -39.520 -53.327 1.00 0.00 H new ATOM 0 HA SER A 93 12.711 -39.179 -54.117 1.00 0.00 H new ATOM 0 HB2 SER A 93 14.828 -40.934 -55.484 1.00 0.00 H new ATOM 0 HB3 SER A 93 13.529 -40.067 -56.279 1.00 0.00 H new ATOM 0 HG SER A 93 15.551 -38.929 -56.406 1.00 0.00 H new ATOM 1457 N GLY A 94 11.343 -41.128 -53.461 1.00 0.00 N ATOM 1458 CA GLY A 94 10.467 -42.244 -53.105 1.00 0.00 C ATOM 1459 C GLY A 94 10.541 -42.542 -51.606 1.00 0.00 C ATOM 1460 O GLY A 94 10.157 -41.694 -50.791 1.00 0.00 O ATOM 0 H GLY A 94 10.919 -40.211 -53.318 1.00 0.00 H new ATOM 0 HA2 GLY A 94 9.440 -42.007 -53.382 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.754 -43.131 -53.670 1.00 0.00 H new ATOM 1464 N THR A 95 11.044 -43.740 -51.243 1.00 0.00 N ATOM 1465 CA THR A 95 11.221 -44.177 -49.836 1.00 0.00 C ATOM 1466 C THR A 95 12.599 -44.881 -49.680 1.00 0.00 C ATOM 1467 O THR A 95 12.738 -46.030 -50.135 1.00 0.00 O ATOM 1468 CB THR A 95 10.049 -45.126 -49.372 1.00 0.00 C ATOM 1469 OG1 THR A 95 9.821 -46.150 -50.356 1.00 0.00 O ATOM 1470 CG2 THR A 95 8.735 -44.361 -49.112 1.00 0.00 C ATOM 1471 OXT THR A 95 13.545 -44.268 -49.142 1.00 0.00 O ATOM 0 H THR A 95 11.343 -44.440 -51.922 1.00 0.00 H new ATOM 0 HA THR A 95 11.193 -43.297 -49.194 1.00 0.00 H new ATOM 0 HB THR A 95 10.361 -45.575 -48.429 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.681 -46.504 -50.665 1.00 0.00 H new ATOM 0 HG21 THR A 95 7.962 -45.062 -48.795 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.895 -43.619 -48.330 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.418 -43.861 -50.027 1.00 0.00 H new TER 1479 THR A 95