USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 832 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 7 GLN : amide:sc= -0.981 X(o=-1.5,f=-1.5) USER MOD Set 1.2: A 95 THR OG1 : rot 170:sc= -0.516 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 6 LYS NZ :NH3+ 166:sc= -0.169 (180deg=-0.847) USER MOD Single : A 11 SER OG : rot 92:sc= 1.26 USER MOD Single : A 28 GLN : amide:sc= -0.199 X(o=-0.2,f=-0.056) USER MOD Single : A 29 TYR OH : rot 144:sc= -11.5! USER MOD Single : A 31 TYR OH : rot -123:sc= -11.9! USER MOD Single : A 32 GLN : amide:sc= -0.452 K(o=-0.45,f=-3.1!) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.609 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 HIS : no HD1:sc= -28.7! C(o=-29!,f=-44!) USER MOD Single : A 42 GLN : amide:sc= -0.158 X(o=-0.16,f=0) USER MOD Single : A 45 ASN : amide:sc= -1.01 X(o=-1,f=-1.1) USER MOD Single : A 47 GLN : amide:sc= -16.7! C(o=-17!,f=-23!) USER MOD Single : A 48 THR OG1 : rot 85:sc= 0.694 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.459 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 91:sc= 0.114 USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= -0.089 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.105 USER MOD Single : A 75 SER OG : rot -71:sc= -2.92! USER MOD Single : A 77 GLN : amide:sc= -3.6! C(o=-3.6!,f=-7!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 150:sc= -0.403 (180deg=-1.77!) USER MOD Single : A 88 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.127) USER MOD Single : A 94 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.620 -3.076 -47.955 1.00 0.00 N ATOM 2 CA MET A 1 13.881 -3.713 -47.492 1.00 0.00 C ATOM 3 C MET A 1 14.769 -2.712 -46.760 1.00 0.00 C ATOM 4 O MET A 1 15.565 -2.004 -47.379 1.00 0.00 O ATOM 5 CB MET A 1 14.616 -4.279 -48.709 1.00 0.00 C ATOM 6 CG MET A 1 15.280 -5.620 -48.448 1.00 0.00 C ATOM 7 SD MET A 1 16.322 -6.157 -49.818 1.00 0.00 S ATOM 8 CE MET A 1 17.119 -7.585 -49.089 1.00 0.00 C ATOM 0 H1 MET A 1 12.036 -3.781 -48.449 1.00 0.00 H new ATOM 0 H2 MET A 1 12.097 -2.706 -47.136 1.00 0.00 H new ATOM 0 H3 MET A 1 12.844 -2.295 -48.604 1.00 0.00 H new ATOM 0 HA MET A 1 13.641 -4.513 -46.791 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.910 -4.387 -49.532 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.373 -3.564 -49.031 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.883 -5.552 -47.543 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.512 -6.372 -48.264 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.799 -8.032 -49.814 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.680 -7.277 -48.207 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.363 -8.316 -48.802 1.00 0.00 H new ATOM 20 N GLU A 2 14.628 -2.657 -45.440 1.00 0.00 N ATOM 21 CA GLU A 2 15.417 -1.741 -44.625 1.00 0.00 C ATOM 22 C GLU A 2 16.276 -2.505 -43.622 1.00 0.00 C ATOM 23 O GLU A 2 15.960 -3.637 -43.254 1.00 0.00 O ATOM 24 CB GLU A 2 14.500 -0.765 -43.886 1.00 0.00 C ATOM 25 CG GLU A 2 14.245 0.525 -44.647 1.00 0.00 C ATOM 26 CD GLU A 2 13.916 1.687 -43.731 1.00 0.00 C ATOM 27 OE1 GLU A 2 14.856 2.379 -43.287 1.00 0.00 O ATOM 28 OE2 GLU A 2 12.717 1.905 -43.457 1.00 0.00 O ATOM 0 H GLU A 2 13.975 -3.236 -44.912 1.00 0.00 H new ATOM 0 HA GLU A 2 16.076 -1.181 -45.288 1.00 0.00 H new ATOM 0 HB2 GLU A 2 13.547 -1.255 -43.688 1.00 0.00 H new ATOM 0 HB3 GLU A 2 14.942 -0.525 -42.919 1.00 0.00 H new ATOM 0 HG2 GLU A 2 15.125 0.773 -45.240 1.00 0.00 H new ATOM 0 HG3 GLU A 2 13.422 0.374 -45.346 1.00 0.00 H new ATOM 35 N ALA A 3 17.362 -1.878 -43.180 1.00 0.00 N ATOM 36 CA ALA A 3 18.263 -2.498 -42.216 1.00 0.00 C ATOM 37 C ALA A 3 18.499 -1.581 -41.023 1.00 0.00 C ATOM 38 O ALA A 3 19.185 -0.564 -41.132 1.00 0.00 O ATOM 39 CB ALA A 3 19.584 -2.858 -42.879 1.00 0.00 C ATOM 0 H ALA A 3 17.639 -0.941 -43.474 1.00 0.00 H new ATOM 0 HA ALA A 3 17.794 -3.413 -41.853 1.00 0.00 H new ATOM 0 HB1 ALA A 3 20.245 -3.320 -42.146 1.00 0.00 H new ATOM 0 HB2 ALA A 3 19.403 -3.557 -43.695 1.00 0.00 H new ATOM 0 HB3 ALA A 3 20.052 -1.955 -43.272 1.00 0.00 H new ATOM 45 N ARG A 4 17.923 -1.949 -39.886 1.00 0.00 N ATOM 46 CA ARG A 4 18.062 -1.164 -38.666 1.00 0.00 C ATOM 47 C ARG A 4 17.136 -1.702 -37.582 1.00 0.00 C ATOM 48 O ARG A 4 17.587 -2.116 -36.513 1.00 0.00 O ATOM 49 CB ARG A 4 17.749 0.308 -38.945 1.00 0.00 C ATOM 50 CG ARG A 4 17.412 1.111 -37.698 1.00 0.00 C ATOM 51 CD ARG A 4 16.750 2.433 -38.049 1.00 0.00 C ATOM 52 NE ARG A 4 15.491 2.621 -37.334 1.00 0.00 N ATOM 53 CZ ARG A 4 14.881 3.795 -37.213 1.00 0.00 C ATOM 54 NH1 ARG A 4 15.413 4.880 -37.760 1.00 0.00 N ATOM 55 NH2 ARG A 4 13.738 3.885 -36.546 1.00 0.00 N ATOM 0 H ARG A 4 17.353 -2.789 -39.783 1.00 0.00 H new ATOM 0 HA ARG A 4 19.091 -1.243 -38.317 1.00 0.00 H new ATOM 0 HB2 ARG A 4 18.606 0.765 -39.439 1.00 0.00 H new ATOM 0 HB3 ARG A 4 16.912 0.366 -39.641 1.00 0.00 H new ATOM 0 HG2 ARG A 4 16.749 0.529 -37.058 1.00 0.00 H new ATOM 0 HG3 ARG A 4 18.322 1.299 -37.128 1.00 0.00 H new ATOM 0 HD2 ARG A 4 17.428 3.253 -37.811 1.00 0.00 H new ATOM 0 HD3 ARG A 4 16.567 2.473 -39.123 1.00 0.00 H new ATOM 0 HE ARG A 4 15.055 1.805 -36.903 1.00 0.00 H new ATOM 0 HH11 ARG A 4 16.291 4.814 -38.274 1.00 0.00 H new ATOM 0 HH12 ARG A 4 14.944 5.781 -37.666 1.00 0.00 H new ATOM 0 HH21 ARG A 4 13.326 3.052 -36.125 1.00 0.00 H new ATOM 0 HH22 ARG A 4 13.271 4.787 -36.454 1.00 0.00 H new ATOM 69 N ASP A 5 15.839 -1.709 -37.871 1.00 0.00 N ATOM 70 CA ASP A 5 14.853 -2.212 -36.924 1.00 0.00 C ATOM 71 C ASP A 5 15.003 -3.718 -36.773 1.00 0.00 C ATOM 72 O ASP A 5 14.851 -4.266 -35.682 1.00 0.00 O ATOM 73 CB ASP A 5 13.438 -1.867 -37.393 1.00 0.00 C ATOM 74 CG ASP A 5 13.051 -0.439 -37.060 1.00 0.00 C ATOM 75 OD1 ASP A 5 13.784 0.209 -36.283 1.00 0.00 O ATOM 76 OD2 ASP A 5 12.015 0.031 -37.576 1.00 0.00 O ATOM 0 H ASP A 5 15.448 -1.373 -38.751 1.00 0.00 H new ATOM 0 HA ASP A 5 15.021 -1.739 -35.957 1.00 0.00 H new ATOM 0 HB2 ASP A 5 13.368 -2.018 -38.470 1.00 0.00 H new ATOM 0 HB3 ASP A 5 12.727 -2.551 -36.929 1.00 0.00 H new ATOM 81 N LYS A 6 15.310 -4.377 -37.884 1.00 0.00 N ATOM 82 CA LYS A 6 15.495 -5.814 -37.904 1.00 0.00 C ATOM 83 C LYS A 6 16.880 -6.188 -37.389 1.00 0.00 C ATOM 84 O LYS A 6 17.066 -7.246 -36.788 1.00 0.00 O ATOM 85 CB LYS A 6 15.312 -6.321 -39.330 1.00 0.00 C ATOM 86 CG LYS A 6 16.109 -5.533 -40.358 1.00 0.00 C ATOM 87 CD LYS A 6 17.208 -6.378 -40.975 1.00 0.00 C ATOM 88 CE LYS A 6 16.674 -7.276 -42.080 1.00 0.00 C ATOM 89 NZ LYS A 6 15.494 -6.678 -42.764 1.00 0.00 N ATOM 0 H LYS A 6 15.436 -3.928 -38.791 1.00 0.00 H new ATOM 0 HA LYS A 6 14.755 -6.277 -37.251 1.00 0.00 H new ATOM 0 HB2 LYS A 6 15.609 -7.369 -39.376 1.00 0.00 H new ATOM 0 HB3 LYS A 6 14.254 -6.278 -39.590 1.00 0.00 H new ATOM 0 HG2 LYS A 6 15.441 -5.174 -41.141 1.00 0.00 H new ATOM 0 HG3 LYS A 6 16.546 -4.654 -39.885 1.00 0.00 H new ATOM 0 HD2 LYS A 6 17.984 -5.728 -41.378 1.00 0.00 H new ATOM 0 HD3 LYS A 6 17.674 -6.990 -40.202 1.00 0.00 H new ATOM 0 HE2 LYS A 6 17.462 -7.459 -42.811 1.00 0.00 H new ATOM 0 HE3 LYS A 6 16.398 -8.243 -41.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 15.307 -7.193 -43.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 14.662 -6.744 -42.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 15.687 -5.679 -42.979 1.00 0.00 H new ATOM 103 N GLN A 7 17.850 -5.311 -37.631 1.00 0.00 N ATOM 104 CA GLN A 7 19.219 -5.548 -37.194 1.00 0.00 C ATOM 105 C GLN A 7 19.323 -5.474 -35.678 1.00 0.00 C ATOM 106 O GLN A 7 20.283 -5.966 -35.083 1.00 0.00 O ATOM 107 CB GLN A 7 20.167 -4.534 -37.836 1.00 0.00 C ATOM 108 CG GLN A 7 20.540 -4.870 -39.271 1.00 0.00 C ATOM 109 CD GLN A 7 21.695 -5.849 -39.359 1.00 0.00 C ATOM 110 OE1 GLN A 7 22.837 -5.458 -39.599 1.00 0.00 O ATOM 111 NE2 GLN A 7 21.401 -7.129 -39.167 1.00 0.00 N ATOM 0 H GLN A 7 17.712 -4.431 -38.127 1.00 0.00 H new ATOM 0 HA GLN A 7 19.508 -6.550 -37.511 1.00 0.00 H new ATOM 0 HB2 GLN A 7 19.701 -3.549 -37.812 1.00 0.00 H new ATOM 0 HB3 GLN A 7 21.077 -4.471 -37.239 1.00 0.00 H new ATOM 0 HG2 GLN A 7 19.672 -5.291 -39.779 1.00 0.00 H new ATOM 0 HG3 GLN A 7 20.805 -3.953 -39.798 1.00 0.00 H new ATOM 0 HE21 GLN A 7 20.440 -7.408 -38.971 1.00 0.00 H new ATOM 0 HE22 GLN A 7 22.136 -7.834 -39.216 1.00 0.00 H new ATOM 120 N VAL A 8 18.319 -4.874 -35.060 1.00 0.00 N ATOM 121 CA VAL A 8 18.276 -4.747 -33.620 1.00 0.00 C ATOM 122 C VAL A 8 17.596 -5.966 -33.026 1.00 0.00 C ATOM 123 O VAL A 8 18.112 -6.604 -32.108 1.00 0.00 O ATOM 124 CB VAL A 8 17.503 -3.485 -33.206 1.00 0.00 C ATOM 125 CG1 VAL A 8 17.124 -3.547 -31.741 1.00 0.00 C ATOM 126 CG2 VAL A 8 18.314 -2.236 -33.500 1.00 0.00 C ATOM 0 H VAL A 8 17.518 -4.465 -35.542 1.00 0.00 H new ATOM 0 HA VAL A 8 19.298 -4.669 -33.249 1.00 0.00 H new ATOM 0 HB VAL A 8 16.586 -3.439 -33.793 1.00 0.00 H new ATOM 0 HG11 VAL A 8 16.578 -2.644 -31.468 1.00 0.00 H new ATOM 0 HG12 VAL A 8 16.495 -4.419 -31.565 1.00 0.00 H new ATOM 0 HG13 VAL A 8 18.027 -3.622 -31.135 1.00 0.00 H new ATOM 0 HG21 VAL A 8 17.747 -1.355 -33.199 1.00 0.00 H new ATOM 0 HG22 VAL A 8 19.251 -2.272 -32.945 1.00 0.00 H new ATOM 0 HG23 VAL A 8 18.527 -2.183 -34.568 1.00 0.00 H new ATOM 136 N LEU A 9 16.436 -6.284 -33.577 1.00 0.00 N ATOM 137 CA LEU A 9 15.667 -7.428 -33.134 1.00 0.00 C ATOM 138 C LEU A 9 16.525 -8.685 -33.177 1.00 0.00 C ATOM 139 O LEU A 9 16.264 -9.648 -32.463 1.00 0.00 O ATOM 140 CB LEU A 9 14.434 -7.589 -34.022 1.00 0.00 C ATOM 141 CG LEU A 9 13.466 -6.406 -33.982 1.00 0.00 C ATOM 142 CD1 LEU A 9 12.359 -6.570 -35.010 1.00 0.00 C ATOM 143 CD2 LEU A 9 12.887 -6.243 -32.585 1.00 0.00 C ATOM 0 H LEU A 9 16.006 -5.759 -34.338 1.00 0.00 H new ATOM 0 HA LEU A 9 15.344 -7.270 -32.105 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.760 -7.741 -35.051 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.900 -8.490 -33.721 1.00 0.00 H new ATOM 0 HG LEU A 9 14.021 -5.503 -34.234 1.00 0.00 H new ATOM 0 HD11 LEU A 9 11.686 -5.714 -34.959 1.00 0.00 H new ATOM 0 HD12 LEU A 9 12.795 -6.630 -36.007 1.00 0.00 H new ATOM 0 HD13 LEU A 9 11.802 -7.483 -34.802 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.200 -5.397 -32.572 1.00 0.00 H new ATOM 0 HD22 LEU A 9 12.351 -7.150 -32.305 1.00 0.00 H new ATOM 0 HD23 LEU A 9 13.695 -6.065 -31.875 1.00 0.00 H new ATOM 155 N ARG A 10 17.558 -8.654 -34.018 1.00 0.00 N ATOM 156 CA ARG A 10 18.474 -9.783 -34.162 1.00 0.00 C ATOM 157 C ARG A 10 19.570 -9.732 -33.094 1.00 0.00 C ATOM 158 O ARG A 10 19.814 -10.714 -32.388 1.00 0.00 O ATOM 159 CB ARG A 10 19.079 -9.788 -35.576 1.00 0.00 C ATOM 160 CG ARG A 10 20.598 -9.896 -35.620 1.00 0.00 C ATOM 161 CD ARG A 10 21.115 -9.870 -37.048 1.00 0.00 C ATOM 162 NE ARG A 10 22.464 -10.418 -37.150 1.00 0.00 N ATOM 163 CZ ARG A 10 22.739 -11.715 -37.067 1.00 0.00 C ATOM 164 NH1 ARG A 10 21.762 -12.593 -36.883 1.00 0.00 N ATOM 165 NH2 ARG A 10 23.992 -12.136 -37.167 1.00 0.00 N ATOM 0 H ARG A 10 17.781 -7.855 -34.612 1.00 0.00 H new ATOM 0 HA ARG A 10 17.918 -10.709 -34.020 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.653 -10.621 -36.135 1.00 0.00 H new ATOM 0 HB3 ARG A 10 18.779 -8.874 -36.088 1.00 0.00 H new ATOM 0 HG2 ARG A 10 21.039 -9.074 -35.057 1.00 0.00 H new ATOM 0 HG3 ARG A 10 20.913 -10.820 -35.134 1.00 0.00 H new ATOM 0 HD2 ARG A 10 20.442 -10.441 -37.688 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.111 -8.844 -37.417 1.00 0.00 H new ATOM 0 HE ARG A 10 23.238 -9.769 -37.293 1.00 0.00 H new ATOM 0 HH11 ARG A 10 20.797 -12.273 -36.805 1.00 0.00 H new ATOM 0 HH12 ARG A 10 21.976 -13.588 -36.820 1.00 0.00 H new ATOM 0 HH21 ARG A 10 24.746 -11.464 -37.308 1.00 0.00 H new ATOM 0 HH22 ARG A 10 24.202 -13.132 -37.103 1.00 0.00 H new ATOM 179 N SER A 11 20.229 -8.584 -32.976 1.00 0.00 N ATOM 180 CA SER A 11 21.287 -8.421 -31.987 1.00 0.00 C ATOM 181 C SER A 11 20.781 -8.836 -30.611 1.00 0.00 C ATOM 182 O SER A 11 21.206 -9.854 -30.054 1.00 0.00 O ATOM 183 CB SER A 11 21.769 -6.969 -31.954 1.00 0.00 C ATOM 184 OG SER A 11 22.057 -6.498 -33.259 1.00 0.00 O ATOM 0 H SER A 11 20.051 -7.759 -33.548 1.00 0.00 H new ATOM 0 HA SER A 11 22.126 -9.059 -32.265 1.00 0.00 H new ATOM 0 HB2 SER A 11 21.006 -6.339 -31.497 1.00 0.00 H new ATOM 0 HB3 SER A 11 22.660 -6.892 -31.331 1.00 0.00 H new ATOM 0 HG SER A 11 21.262 -6.065 -33.633 1.00 0.00 H new ATOM 190 N LEU A 12 19.858 -8.050 -30.072 1.00 0.00 N ATOM 191 CA LEU A 12 19.282 -8.344 -28.773 1.00 0.00 C ATOM 192 C LEU A 12 18.593 -9.700 -28.796 1.00 0.00 C ATOM 193 O LEU A 12 18.486 -10.372 -27.771 1.00 0.00 O ATOM 194 CB LEU A 12 18.290 -7.257 -28.370 1.00 0.00 C ATOM 195 CG LEU A 12 18.893 -6.119 -27.551 1.00 0.00 C ATOM 196 CD1 LEU A 12 19.960 -5.395 -28.355 1.00 0.00 C ATOM 197 CD2 LEU A 12 17.810 -5.152 -27.101 1.00 0.00 C ATOM 0 H LEU A 12 19.495 -7.206 -30.516 1.00 0.00 H new ATOM 0 HA LEU A 12 20.086 -8.371 -28.037 1.00 0.00 H new ATOM 0 HB2 LEU A 12 17.842 -6.840 -29.272 1.00 0.00 H new ATOM 0 HB3 LEU A 12 17.484 -7.714 -27.795 1.00 0.00 H new ATOM 0 HG LEU A 12 19.361 -6.543 -26.662 1.00 0.00 H new ATOM 0 HD11 LEU A 12 20.380 -4.586 -27.757 1.00 0.00 H new ATOM 0 HD12 LEU A 12 20.750 -6.096 -28.624 1.00 0.00 H new ATOM 0 HD13 LEU A 12 19.516 -4.983 -29.261 1.00 0.00 H new ATOM 0 HD21 LEU A 12 18.259 -4.348 -26.519 1.00 0.00 H new ATOM 0 HD22 LEU A 12 17.311 -4.732 -27.975 1.00 0.00 H new ATOM 0 HD23 LEU A 12 17.082 -5.682 -26.487 1.00 0.00 H new ATOM 209 N ARG A 13 18.128 -10.100 -29.977 1.00 0.00 N ATOM 210 CA ARG A 13 17.451 -11.381 -30.130 1.00 0.00 C ATOM 211 C ARG A 13 18.161 -12.459 -29.316 1.00 0.00 C ATOM 212 O ARG A 13 17.572 -13.067 -28.424 1.00 0.00 O ATOM 213 CB ARG A 13 17.383 -11.777 -31.617 1.00 0.00 C ATOM 214 CG ARG A 13 18.120 -13.062 -31.974 1.00 0.00 C ATOM 215 CD ARG A 13 17.724 -13.566 -33.352 1.00 0.00 C ATOM 216 NE ARG A 13 18.889 -13.880 -34.174 1.00 0.00 N ATOM 217 CZ ARG A 13 19.722 -14.884 -33.918 1.00 0.00 C ATOM 218 NH1 ARG A 13 19.519 -15.664 -32.865 1.00 0.00 N ATOM 219 NH2 ARG A 13 20.758 -15.108 -34.714 1.00 0.00 N ATOM 0 H ARG A 13 18.208 -9.557 -30.837 1.00 0.00 H new ATOM 0 HA ARG A 13 16.432 -11.284 -29.754 1.00 0.00 H new ATOM 0 HB2 ARG A 13 16.336 -11.885 -31.902 1.00 0.00 H new ATOM 0 HB3 ARG A 13 17.793 -10.962 -32.214 1.00 0.00 H new ATOM 0 HG2 ARG A 13 19.195 -12.886 -31.945 1.00 0.00 H new ATOM 0 HG3 ARG A 13 17.902 -13.827 -31.229 1.00 0.00 H new ATOM 0 HD2 ARG A 13 17.103 -14.456 -33.248 1.00 0.00 H new ATOM 0 HD3 ARG A 13 17.119 -12.811 -33.854 1.00 0.00 H new ATOM 0 HE ARG A 13 19.074 -13.297 -34.990 1.00 0.00 H new ATOM 0 HH11 ARG A 13 18.723 -15.494 -32.250 1.00 0.00 H new ATOM 0 HH12 ARG A 13 20.159 -16.434 -32.670 1.00 0.00 H new ATOM 0 HH21 ARG A 13 20.917 -14.510 -35.525 1.00 0.00 H new ATOM 0 HH22 ARG A 13 21.396 -15.879 -34.516 1.00 0.00 H new ATOM 233 N LEU A 14 19.427 -12.693 -29.642 1.00 0.00 N ATOM 234 CA LEU A 14 20.222 -13.702 -28.956 1.00 0.00 C ATOM 235 C LEU A 14 20.561 -13.276 -27.529 1.00 0.00 C ATOM 236 O LEU A 14 20.627 -14.111 -26.627 1.00 0.00 O ATOM 237 CB LEU A 14 21.510 -13.962 -29.733 1.00 0.00 C ATOM 238 CG LEU A 14 22.608 -12.928 -29.500 1.00 0.00 C ATOM 239 CD1 LEU A 14 23.772 -13.540 -28.736 1.00 0.00 C ATOM 240 CD2 LEU A 14 23.082 -12.346 -30.823 1.00 0.00 C ATOM 0 H LEU A 14 19.925 -12.195 -30.380 1.00 0.00 H new ATOM 0 HA LEU A 14 19.630 -14.615 -28.904 1.00 0.00 H new ATOM 0 HB2 LEU A 14 21.891 -14.946 -29.461 1.00 0.00 H new ATOM 0 HB3 LEU A 14 21.278 -13.993 -30.797 1.00 0.00 H new ATOM 0 HG LEU A 14 22.194 -12.120 -28.897 1.00 0.00 H new ATOM 0 HD11 LEU A 14 24.543 -12.785 -28.581 1.00 0.00 H new ATOM 0 HD12 LEU A 14 23.422 -13.904 -27.770 1.00 0.00 H new ATOM 0 HD13 LEU A 14 24.187 -14.370 -29.308 1.00 0.00 H new ATOM 0 HD21 LEU A 14 23.865 -11.611 -30.637 1.00 0.00 H new ATOM 0 HD22 LEU A 14 23.476 -13.145 -31.451 1.00 0.00 H new ATOM 0 HD23 LEU A 14 22.245 -11.865 -31.330 1.00 0.00 H new ATOM 252 N GLU A 15 20.788 -11.980 -27.327 1.00 0.00 N ATOM 253 CA GLU A 15 21.131 -11.475 -26.002 1.00 0.00 C ATOM 254 C GLU A 15 20.025 -11.788 -25.007 1.00 0.00 C ATOM 255 O GLU A 15 20.199 -12.615 -24.111 1.00 0.00 O ATOM 256 CB GLU A 15 21.388 -9.969 -26.046 1.00 0.00 C ATOM 257 CG GLU A 15 22.858 -9.609 -26.194 1.00 0.00 C ATOM 258 CD GLU A 15 23.383 -8.804 -25.021 1.00 0.00 C ATOM 259 OE1 GLU A 15 22.789 -7.751 -24.710 1.00 0.00 O ATOM 260 OE2 GLU A 15 24.389 -9.228 -24.414 1.00 0.00 O ATOM 0 H GLU A 15 20.741 -11.268 -28.056 1.00 0.00 H new ATOM 0 HA GLU A 15 22.044 -11.973 -25.677 1.00 0.00 H new ATOM 0 HB2 GLU A 15 20.831 -9.537 -26.878 1.00 0.00 H new ATOM 0 HB3 GLU A 15 21.001 -9.515 -25.133 1.00 0.00 H new ATOM 0 HG2 GLU A 15 23.444 -10.523 -26.294 1.00 0.00 H new ATOM 0 HG3 GLU A 15 22.998 -9.039 -27.113 1.00 0.00 H new ATOM 267 N LEU A 16 18.884 -11.134 -25.173 1.00 0.00 N ATOM 268 CA LEU A 16 17.752 -11.361 -24.291 1.00 0.00 C ATOM 269 C LEU A 16 17.084 -12.690 -24.611 1.00 0.00 C ATOM 270 O LEU A 16 16.254 -13.180 -23.845 1.00 0.00 O ATOM 271 CB LEU A 16 16.739 -10.224 -24.409 1.00 0.00 C ATOM 272 CG LEU A 16 16.345 -9.839 -25.835 1.00 0.00 C ATOM 273 CD1 LEU A 16 16.017 -11.079 -26.651 1.00 0.00 C ATOM 274 CD2 LEU A 16 15.162 -8.880 -25.814 1.00 0.00 C ATOM 0 H LEU A 16 18.720 -10.445 -25.907 1.00 0.00 H new ATOM 0 HA LEU A 16 18.122 -11.392 -23.266 1.00 0.00 H new ATOM 0 HB2 LEU A 16 15.837 -10.506 -23.865 1.00 0.00 H new ATOM 0 HB3 LEU A 16 17.148 -9.344 -23.913 1.00 0.00 H new ATOM 0 HG LEU A 16 17.189 -9.336 -26.306 1.00 0.00 H new ATOM 0 HD11 LEU A 16 15.739 -10.785 -27.663 1.00 0.00 H new ATOM 0 HD12 LEU A 16 16.890 -11.731 -26.689 1.00 0.00 H new ATOM 0 HD13 LEU A 16 15.187 -11.611 -26.186 1.00 0.00 H new ATOM 0 HD21 LEU A 16 14.891 -8.614 -26.836 1.00 0.00 H new ATOM 0 HD22 LEU A 16 14.313 -9.360 -25.327 1.00 0.00 H new ATOM 0 HD23 LEU A 16 15.434 -7.979 -25.264 1.00 0.00 H new ATOM 286 N GLY A 17 17.453 -13.271 -25.749 1.00 0.00 N ATOM 287 CA GLY A 17 16.876 -14.545 -26.145 1.00 0.00 C ATOM 288 C GLY A 17 17.625 -15.723 -25.552 1.00 0.00 C ATOM 289 O GLY A 17 17.149 -16.857 -25.598 1.00 0.00 O ATOM 0 H GLY A 17 18.137 -12.886 -26.401 1.00 0.00 H new ATOM 0 HA2 GLY A 17 15.833 -14.583 -25.829 1.00 0.00 H new ATOM 0 HA3 GLY A 17 16.883 -14.623 -27.232 1.00 0.00 H new ATOM 293 N ALA A 18 18.801 -15.451 -24.994 1.00 0.00 N ATOM 294 CA ALA A 18 19.619 -16.494 -24.389 1.00 0.00 C ATOM 295 C ALA A 18 18.856 -17.223 -23.288 1.00 0.00 C ATOM 296 O ALA A 18 18.536 -18.404 -23.417 1.00 0.00 O ATOM 297 CB ALA A 18 20.905 -15.898 -23.834 1.00 0.00 C ATOM 0 H ALA A 18 19.208 -14.517 -24.949 1.00 0.00 H new ATOM 0 HA ALA A 18 19.869 -17.220 -25.163 1.00 0.00 H new ATOM 0 HB1 ALA A 18 21.508 -16.687 -23.385 1.00 0.00 H new ATOM 0 HB2 ALA A 18 21.466 -15.428 -24.642 1.00 0.00 H new ATOM 0 HB3 ALA A 18 20.663 -15.151 -23.078 1.00 0.00 H new ATOM 303 N GLU A 19 18.571 -16.510 -22.204 1.00 0.00 N ATOM 304 CA GLU A 19 17.848 -17.087 -21.078 1.00 0.00 C ATOM 305 C GLU A 19 17.650 -16.053 -19.975 1.00 0.00 C ATOM 306 O GLU A 19 18.579 -15.747 -19.227 1.00 0.00 O ATOM 307 CB GLU A 19 18.607 -18.295 -20.527 1.00 0.00 C ATOM 308 CG GLU A 19 17.805 -19.114 -19.530 1.00 0.00 C ATOM 309 CD GLU A 19 18.643 -20.171 -18.839 1.00 0.00 C ATOM 310 OE1 GLU A 19 19.840 -19.913 -18.595 1.00 0.00 O ATOM 311 OE2 GLU A 19 18.102 -21.257 -18.542 1.00 0.00 O ATOM 0 H GLU A 19 18.830 -15.531 -22.082 1.00 0.00 H new ATOM 0 HA GLU A 19 16.869 -17.410 -21.431 1.00 0.00 H new ATOM 0 HB2 GLU A 19 18.903 -18.937 -21.357 1.00 0.00 H new ATOM 0 HB3 GLU A 19 19.523 -17.950 -20.048 1.00 0.00 H new ATOM 0 HG2 GLU A 19 17.375 -18.449 -18.781 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.973 -19.594 -20.045 1.00 0.00 H new ATOM 318 N VAL A 20 16.439 -15.517 -19.879 1.00 0.00 N ATOM 319 CA VAL A 20 16.133 -14.516 -18.866 1.00 0.00 C ATOM 320 C VAL A 20 14.674 -14.595 -18.427 1.00 0.00 C ATOM 321 O VAL A 20 13.789 -14.041 -19.079 1.00 0.00 O ATOM 322 CB VAL A 20 16.425 -13.092 -19.377 1.00 0.00 C ATOM 323 CG1 VAL A 20 16.175 -12.070 -18.278 1.00 0.00 C ATOM 324 CG2 VAL A 20 17.852 -12.991 -19.895 1.00 0.00 C ATOM 0 H VAL A 20 15.657 -15.758 -20.488 1.00 0.00 H new ATOM 0 HA VAL A 20 16.776 -14.730 -18.012 1.00 0.00 H new ATOM 0 HB VAL A 20 15.748 -12.876 -20.204 1.00 0.00 H new ATOM 0 HG11 VAL A 20 16.386 -11.070 -18.656 1.00 0.00 H new ATOM 0 HG12 VAL A 20 15.134 -12.125 -17.960 1.00 0.00 H new ATOM 0 HG13 VAL A 20 16.826 -12.282 -17.429 1.00 0.00 H new ATOM 0 HG21 VAL A 20 18.039 -11.978 -20.251 1.00 0.00 H new ATOM 0 HG22 VAL A 20 18.549 -13.227 -19.091 1.00 0.00 H new ATOM 0 HG23 VAL A 20 17.992 -13.696 -20.715 1.00 0.00 H new ATOM 334 N LEU A 21 14.431 -15.278 -17.313 1.00 0.00 N ATOM 335 CA LEU A 21 13.080 -15.420 -16.781 1.00 0.00 C ATOM 336 C LEU A 21 12.244 -16.365 -17.639 1.00 0.00 C ATOM 337 O LEU A 21 12.576 -16.630 -18.795 1.00 0.00 O ATOM 338 CB LEU A 21 12.399 -14.053 -16.702 1.00 0.00 C ATOM 339 CG LEU A 21 11.198 -13.981 -15.758 1.00 0.00 C ATOM 340 CD1 LEU A 21 11.200 -12.667 -14.994 1.00 0.00 C ATOM 341 CD2 LEU A 21 9.899 -14.144 -16.534 1.00 0.00 C ATOM 0 H LEU A 21 15.152 -15.742 -16.761 1.00 0.00 H new ATOM 0 HA LEU A 21 13.157 -15.845 -15.780 1.00 0.00 H new ATOM 0 HB2 LEU A 21 13.136 -13.315 -16.385 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.073 -13.768 -17.702 1.00 0.00 H new ATOM 0 HG LEU A 21 11.275 -14.798 -15.040 1.00 0.00 H new ATOM 0 HD11 LEU A 21 10.339 -12.633 -14.327 1.00 0.00 H new ATOM 0 HD12 LEU A 21 12.116 -12.588 -14.408 1.00 0.00 H new ATOM 0 HD13 LEU A 21 11.147 -11.837 -15.698 1.00 0.00 H new ATOM 0 HD21 LEU A 21 9.055 -14.090 -15.846 1.00 0.00 H new ATOM 0 HD22 LEU A 21 9.815 -13.348 -17.274 1.00 0.00 H new ATOM 0 HD23 LEU A 21 9.895 -15.110 -17.038 1.00 0.00 H new ATOM 353 N VAL A 22 11.155 -16.866 -17.063 1.00 0.00 N ATOM 354 CA VAL A 22 10.263 -17.778 -17.768 1.00 0.00 C ATOM 355 C VAL A 22 8.959 -17.083 -18.145 1.00 0.00 C ATOM 356 O VAL A 22 8.005 -17.068 -17.368 1.00 0.00 O ATOM 357 CB VAL A 22 9.936 -19.021 -16.918 1.00 0.00 C ATOM 358 CG1 VAL A 22 9.000 -19.953 -17.673 1.00 0.00 C ATOM 359 CG2 VAL A 22 11.212 -19.746 -16.517 1.00 0.00 C ATOM 0 H VAL A 22 10.869 -16.654 -16.107 1.00 0.00 H new ATOM 0 HA VAL A 22 10.785 -18.093 -18.672 1.00 0.00 H new ATOM 0 HB VAL A 22 9.431 -18.694 -16.009 1.00 0.00 H new ATOM 0 HG11 VAL A 22 8.780 -20.825 -17.057 1.00 0.00 H new ATOM 0 HG12 VAL A 22 8.073 -19.429 -17.904 1.00 0.00 H new ATOM 0 HG13 VAL A 22 9.476 -20.274 -18.600 1.00 0.00 H new ATOM 0 HG21 VAL A 22 10.960 -20.621 -15.917 1.00 0.00 H new ATOM 0 HG22 VAL A 22 11.748 -20.062 -17.412 1.00 0.00 H new ATOM 0 HG23 VAL A 22 11.843 -19.076 -15.934 1.00 0.00 H new ATOM 369 N GLU A 23 8.925 -16.507 -19.342 1.00 0.00 N ATOM 370 CA GLU A 23 7.737 -15.809 -19.820 1.00 0.00 C ATOM 371 C GLU A 23 6.913 -16.703 -20.740 1.00 0.00 C ATOM 372 O GLU A 23 7.193 -17.894 -20.879 1.00 0.00 O ATOM 373 CB GLU A 23 8.133 -14.526 -20.556 1.00 0.00 C ATOM 374 CG GLU A 23 8.892 -14.776 -21.849 1.00 0.00 C ATOM 375 CD GLU A 23 8.521 -13.792 -22.941 1.00 0.00 C ATOM 376 OE1 GLU A 23 8.776 -12.583 -22.762 1.00 0.00 O ATOM 377 OE2 GLU A 23 7.972 -14.231 -23.973 1.00 0.00 O ATOM 0 H GLU A 23 9.706 -16.510 -19.998 1.00 0.00 H new ATOM 0 HA GLU A 23 7.127 -15.549 -18.955 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.233 -13.952 -20.778 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.748 -13.913 -19.896 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.963 -14.712 -21.656 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.690 -15.790 -22.194 1.00 0.00 H new ATOM 384 N GLY A 24 5.895 -16.121 -21.365 1.00 0.00 N ATOM 385 CA GLY A 24 5.045 -16.880 -22.264 1.00 0.00 C ATOM 386 C GLY A 24 3.748 -16.164 -22.585 1.00 0.00 C ATOM 387 O GLY A 24 2.700 -16.796 -22.722 1.00 0.00 O ATOM 0 H GLY A 24 5.643 -15.138 -21.265 1.00 0.00 H new ATOM 0 HA2 GLY A 24 5.586 -17.076 -23.190 1.00 0.00 H new ATOM 0 HA3 GLY A 24 4.820 -17.847 -21.815 1.00 0.00 H new ATOM 391 N LEU A 25 3.816 -14.842 -22.708 1.00 0.00 N ATOM 392 CA LEU A 25 2.636 -14.043 -23.018 1.00 0.00 C ATOM 393 C LEU A 25 3.027 -12.729 -23.685 1.00 0.00 C ATOM 394 O LEU A 25 3.024 -11.672 -23.055 1.00 0.00 O ATOM 395 CB LEU A 25 1.829 -13.765 -21.747 1.00 0.00 C ATOM 396 CG LEU A 25 0.310 -13.778 -21.933 1.00 0.00 C ATOM 397 CD1 LEU A 25 -0.391 -13.378 -20.644 1.00 0.00 C ATOM 398 CD2 LEU A 25 -0.092 -12.852 -23.070 1.00 0.00 C ATOM 0 H LEU A 25 4.674 -14.302 -22.598 1.00 0.00 H new ATOM 0 HA LEU A 25 2.018 -14.612 -23.713 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.095 -14.508 -20.995 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.124 -12.793 -21.352 1.00 0.00 H new ATOM 0 HG LEU A 25 0.002 -14.792 -22.188 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.470 -13.393 -20.797 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.127 -14.080 -19.853 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.079 -12.374 -20.357 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.175 -12.872 -23.190 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.229 -11.836 -22.842 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.382 -13.184 -23.994 1.00 0.00 H new ATOM 410 N VAL A 26 3.358 -12.809 -24.968 1.00 0.00 N ATOM 411 CA VAL A 26 3.748 -11.635 -25.739 1.00 0.00 C ATOM 412 C VAL A 26 3.355 -11.803 -27.202 1.00 0.00 C ATOM 413 O VAL A 26 2.859 -10.873 -27.837 1.00 0.00 O ATOM 414 CB VAL A 26 5.264 -11.379 -25.649 1.00 0.00 C ATOM 415 CG1 VAL A 26 6.042 -12.631 -26.021 1.00 0.00 C ATOM 416 CG2 VAL A 26 5.663 -10.211 -26.539 1.00 0.00 C ATOM 0 H VAL A 26 3.364 -13.680 -25.499 1.00 0.00 H new ATOM 0 HA VAL A 26 3.224 -10.779 -25.314 1.00 0.00 H new ATOM 0 HB VAL A 26 5.508 -11.121 -24.618 1.00 0.00 H new ATOM 0 HG11 VAL A 26 7.111 -12.429 -25.951 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.780 -13.439 -25.338 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.794 -12.924 -27.041 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.738 -10.045 -26.462 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.404 -10.437 -27.573 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.134 -9.313 -26.220 1.00 0.00 H new ATOM 426 N LEU A 27 3.572 -13.005 -27.723 1.00 0.00 N ATOM 427 CA LEU A 27 3.236 -13.316 -29.106 1.00 0.00 C ATOM 428 C LEU A 27 1.728 -13.254 -29.321 1.00 0.00 C ATOM 429 O LEU A 27 1.252 -13.288 -30.452 1.00 0.00 O ATOM 430 CB LEU A 27 3.768 -14.700 -29.482 1.00 0.00 C ATOM 431 CG LEU A 27 5.107 -15.072 -28.841 1.00 0.00 C ATOM 432 CD1 LEU A 27 4.974 -16.354 -28.034 1.00 0.00 C ATOM 433 CD2 LEU A 27 6.184 -15.219 -29.905 1.00 0.00 C ATOM 0 H LEU A 27 3.981 -13.783 -27.205 1.00 0.00 H new ATOM 0 HA LEU A 27 3.706 -12.572 -29.749 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.026 -15.447 -29.199 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.874 -14.750 -30.566 1.00 0.00 H new ATOM 0 HG LEU A 27 5.400 -14.270 -28.164 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.936 -16.603 -27.586 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.232 -16.214 -27.248 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.658 -17.166 -28.690 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.129 -15.484 -29.432 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.898 -16.002 -30.607 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.298 -14.276 -30.440 1.00 0.00 H new ATOM 445 N GLN A 28 0.981 -13.160 -28.225 1.00 0.00 N ATOM 446 CA GLN A 28 -0.475 -13.091 -28.291 1.00 0.00 C ATOM 447 C GLN A 28 -0.921 -11.734 -28.820 1.00 0.00 C ATOM 448 O GLN A 28 -1.762 -11.648 -29.715 1.00 0.00 O ATOM 449 CB GLN A 28 -1.081 -13.343 -26.910 1.00 0.00 C ATOM 450 CG GLN A 28 -1.028 -14.799 -26.480 1.00 0.00 C ATOM 451 CD GLN A 28 -2.406 -15.397 -26.277 1.00 0.00 C ATOM 452 OE1 GLN A 28 -2.659 -16.076 -25.282 1.00 0.00 O ATOM 453 NE2 GLN A 28 -3.306 -15.147 -27.220 1.00 0.00 N ATOM 0 H GLN A 28 1.361 -13.130 -27.279 1.00 0.00 H new ATOM 0 HA GLN A 28 -0.826 -13.863 -28.975 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -0.553 -12.736 -26.174 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -2.119 -13.011 -26.912 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -0.492 -15.377 -27.233 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -0.461 -14.880 -25.553 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -3.053 -14.579 -28.029 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -4.250 -15.523 -27.136 1.00 0.00 H new ATOM 462 N TYR A 29 -0.323 -10.678 -28.283 1.00 0.00 N ATOM 463 CA TYR A 29 -0.623 -9.322 -28.720 1.00 0.00 C ATOM 464 C TYR A 29 -0.126 -9.169 -30.139 1.00 0.00 C ATOM 465 O TYR A 29 -0.696 -8.455 -30.964 1.00 0.00 O ATOM 466 CB TYR A 29 0.080 -8.315 -27.790 1.00 0.00 C ATOM 467 CG TYR A 29 0.668 -7.098 -28.488 1.00 0.00 C ATOM 468 CD1 TYR A 29 1.708 -7.209 -29.413 1.00 0.00 C ATOM 469 CD2 TYR A 29 0.172 -5.833 -28.221 1.00 0.00 C ATOM 470 CE1 TYR A 29 2.221 -6.091 -30.043 1.00 0.00 C ATOM 471 CE2 TYR A 29 0.682 -4.714 -28.844 1.00 0.00 C ATOM 472 CZ TYR A 29 1.704 -4.848 -29.755 1.00 0.00 C ATOM 473 OH TYR A 29 2.210 -3.734 -30.382 1.00 0.00 O ATOM 0 H TYR A 29 0.375 -10.736 -27.541 1.00 0.00 H new ATOM 0 HA TYR A 29 -1.695 -9.131 -28.682 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -0.635 -7.975 -27.040 1.00 0.00 H new ATOM 0 HB3 TYR A 29 0.879 -8.831 -27.258 1.00 0.00 H new ATOM 0 HD1 TYR A 29 2.117 -8.182 -29.639 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -0.632 -5.721 -27.509 1.00 0.00 H new ATOM 0 HE1 TYR A 29 3.024 -6.192 -30.758 1.00 0.00 H new ATOM 0 HE2 TYR A 29 0.281 -3.737 -28.618 1.00 0.00 H new ATOM 0 HH TYR A 29 1.485 -3.098 -30.555 1.00 0.00 H new ATOM 483 N LEU A 30 0.964 -9.861 -30.378 1.00 0.00 N ATOM 484 CA LEU A 30 1.642 -9.876 -31.648 1.00 0.00 C ATOM 485 C LEU A 30 0.854 -10.624 -32.704 1.00 0.00 C ATOM 486 O LEU A 30 0.231 -10.027 -33.576 1.00 0.00 O ATOM 487 CB LEU A 30 2.983 -10.547 -31.422 1.00 0.00 C ATOM 488 CG LEU A 30 3.834 -9.841 -30.390 1.00 0.00 C ATOM 489 CD1 LEU A 30 5.022 -10.685 -29.984 1.00 0.00 C ATOM 490 CD2 LEU A 30 4.272 -8.513 -30.946 1.00 0.00 C ATOM 0 H LEU A 30 1.414 -10.444 -29.673 1.00 0.00 H new ATOM 0 HA LEU A 30 1.759 -8.857 -32.016 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.818 -11.577 -31.105 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.526 -10.587 -32.366 1.00 0.00 H new ATOM 0 HG LEU A 30 3.243 -9.677 -29.489 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.613 -10.149 -29.241 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.672 -11.625 -29.559 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.639 -10.890 -30.859 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.887 -7.995 -30.210 1.00 0.00 H new ATOM 0 HD22 LEU A 30 4.852 -8.673 -31.855 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.395 -7.908 -31.177 1.00 0.00 H new ATOM 502 N TYR A 31 0.900 -11.938 -32.616 1.00 0.00 N ATOM 503 CA TYR A 31 0.200 -12.792 -33.566 1.00 0.00 C ATOM 504 C TYR A 31 -1.134 -12.171 -33.952 1.00 0.00 C ATOM 505 O TYR A 31 -1.604 -12.336 -35.078 1.00 0.00 O ATOM 506 CB TYR A 31 -0.031 -14.181 -32.977 1.00 0.00 C ATOM 507 CG TYR A 31 0.953 -15.247 -33.415 1.00 0.00 C ATOM 508 CD1 TYR A 31 1.145 -15.543 -34.761 1.00 0.00 C ATOM 509 CD2 TYR A 31 1.658 -15.996 -32.478 1.00 0.00 C ATOM 510 CE1 TYR A 31 2.008 -16.537 -35.155 1.00 0.00 C ATOM 511 CE2 TYR A 31 2.512 -16.996 -32.869 1.00 0.00 C ATOM 512 CZ TYR A 31 2.685 -17.261 -34.209 1.00 0.00 C ATOM 513 OH TYR A 31 3.532 -18.259 -34.602 1.00 0.00 O ATOM 0 H TYR A 31 1.416 -12.443 -31.895 1.00 0.00 H new ATOM 0 HA TYR A 31 0.822 -12.888 -34.456 1.00 0.00 H new ATOM 0 HB2 TYR A 31 0.002 -14.106 -31.890 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -1.036 -14.507 -33.244 1.00 0.00 H new ATOM 0 HD1 TYR A 31 0.606 -14.981 -35.510 1.00 0.00 H new ATOM 0 HD2 TYR A 31 1.531 -15.787 -31.426 1.00 0.00 H new ATOM 0 HE1 TYR A 31 2.152 -16.746 -36.205 1.00 0.00 H new ATOM 0 HE2 TYR A 31 3.046 -17.573 -32.129 1.00 0.00 H new ATOM 0 HH TYR A 31 3.260 -19.103 -34.184 1.00 0.00 H new ATOM 523 N GLN A 32 -1.741 -11.450 -33.014 1.00 0.00 N ATOM 524 CA GLN A 32 -3.018 -10.804 -33.275 1.00 0.00 C ATOM 525 C GLN A 32 -2.805 -9.464 -33.961 1.00 0.00 C ATOM 526 O GLN A 32 -3.515 -9.119 -34.905 1.00 0.00 O ATOM 527 CB GLN A 32 -3.807 -10.621 -31.976 1.00 0.00 C ATOM 528 CG GLN A 32 -4.339 -11.923 -31.400 1.00 0.00 C ATOM 529 CD GLN A 32 -5.498 -12.486 -32.200 1.00 0.00 C ATOM 530 OE1 GLN A 32 -5.778 -12.036 -33.311 1.00 0.00 O ATOM 531 NE2 GLN A 32 -6.181 -13.475 -31.635 1.00 0.00 N ATOM 0 H GLN A 32 -1.371 -11.301 -32.075 1.00 0.00 H new ATOM 0 HA GLN A 32 -3.597 -11.445 -33.939 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -3.167 -10.141 -31.236 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -4.643 -9.946 -32.160 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -3.534 -12.657 -31.368 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -4.659 -11.757 -30.372 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -5.914 -13.817 -30.712 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -6.973 -13.893 -32.124 1.00 0.00 H new ATOM 540 N GLU A 33 -1.809 -8.721 -33.497 1.00 0.00 N ATOM 541 CA GLU A 33 -1.494 -7.431 -34.088 1.00 0.00 C ATOM 542 C GLU A 33 -1.032 -7.624 -35.527 1.00 0.00 C ATOM 543 O GLU A 33 -1.311 -6.799 -36.397 1.00 0.00 O ATOM 544 CB GLU A 33 -0.410 -6.719 -33.277 1.00 0.00 C ATOM 545 CG GLU A 33 -0.926 -6.093 -31.992 1.00 0.00 C ATOM 546 CD GLU A 33 -1.399 -4.667 -32.188 1.00 0.00 C ATOM 547 OE1 GLU A 33 -2.307 -4.451 -33.019 1.00 0.00 O ATOM 548 OE2 GLU A 33 -0.862 -3.765 -31.511 1.00 0.00 O ATOM 0 H GLU A 33 -1.209 -8.989 -32.717 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.391 -6.812 -34.079 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.378 -7.432 -33.033 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.043 -5.943 -33.894 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.748 -6.694 -31.604 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.136 -6.110 -31.241 1.00 0.00 H new ATOM 555 N GLY A 34 -0.327 -8.728 -35.769 1.00 0.00 N ATOM 556 CA GLY A 34 0.159 -9.019 -37.104 1.00 0.00 C ATOM 557 C GLY A 34 1.633 -9.331 -37.118 1.00 0.00 C ATOM 558 O GLY A 34 2.126 -9.996 -38.029 1.00 0.00 O ATOM 0 H GLY A 34 -0.085 -9.424 -35.064 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.393 -9.865 -37.514 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.036 -8.166 -37.754 1.00 0.00 H new ATOM 562 N ILE A 35 2.331 -8.865 -36.092 1.00 0.00 N ATOM 563 CA ILE A 35 3.753 -9.106 -35.958 1.00 0.00 C ATOM 564 C ILE A 35 4.117 -10.459 -36.505 1.00 0.00 C ATOM 565 O ILE A 35 5.059 -10.611 -37.284 1.00 0.00 O ATOM 566 CB ILE A 35 4.144 -9.090 -34.481 1.00 0.00 C ATOM 567 CG1 ILE A 35 4.009 -7.684 -33.931 1.00 0.00 C ATOM 568 CG2 ILE A 35 5.544 -9.643 -34.278 1.00 0.00 C ATOM 569 CD1 ILE A 35 5.333 -7.009 -33.636 1.00 0.00 C ATOM 0 H ILE A 35 1.927 -8.313 -35.335 1.00 0.00 H new ATOM 0 HA ILE A 35 4.276 -8.325 -36.510 1.00 0.00 H new ATOM 0 HB ILE A 35 3.466 -9.740 -33.928 1.00 0.00 H new ATOM 0 HG12 ILE A 35 3.454 -7.077 -34.646 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.418 -7.718 -33.016 1.00 0.00 H new ATOM 0 HG21 ILE A 35 5.794 -9.619 -33.217 1.00 0.00 H new ATOM 0 HG22 ILE A 35 5.585 -10.671 -34.637 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.259 -9.036 -34.833 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.152 -6.007 -33.246 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.882 -7.592 -32.897 1.00 0.00 H new ATOM 0 HD13 ILE A 35 5.919 -6.941 -34.553 1.00 0.00 H new ATOM 581 N LEU A 36 3.372 -11.445 -36.054 1.00 0.00 N ATOM 582 CA LEU A 36 3.619 -12.812 -36.458 1.00 0.00 C ATOM 583 C LEU A 36 2.827 -13.196 -37.696 1.00 0.00 C ATOM 584 O LEU A 36 1.835 -12.557 -38.048 1.00 0.00 O ATOM 585 CB LEU A 36 3.301 -13.749 -35.306 1.00 0.00 C ATOM 586 CG LEU A 36 4.184 -13.568 -34.075 1.00 0.00 C ATOM 587 CD1 LEU A 36 3.436 -12.824 -32.988 1.00 0.00 C ATOM 588 CD2 LEU A 36 4.675 -14.911 -33.560 1.00 0.00 C ATOM 0 H LEU A 36 2.591 -11.326 -35.408 1.00 0.00 H new ATOM 0 HA LEU A 36 4.674 -12.900 -36.719 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.261 -13.605 -35.015 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.394 -14.777 -35.655 1.00 0.00 H new ATOM 0 HG LEU A 36 5.052 -12.976 -34.364 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.082 -12.705 -32.118 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.139 -11.842 -33.357 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.548 -13.389 -32.705 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.303 -14.757 -32.682 1.00 0.00 H new ATOM 0 HD22 LEU A 36 3.821 -15.532 -33.291 1.00 0.00 H new ATOM 0 HD23 LEU A 36 5.255 -15.409 -34.337 1.00 0.00 H new ATOM 600 N THR A 37 3.291 -14.248 -38.353 1.00 0.00 N ATOM 601 CA THR A 37 2.656 -14.748 -39.564 1.00 0.00 C ATOM 602 C THR A 37 2.759 -16.267 -39.642 1.00 0.00 C ATOM 603 O THR A 37 3.423 -16.894 -38.815 1.00 0.00 O ATOM 604 CB THR A 37 3.302 -14.115 -40.798 1.00 0.00 C ATOM 605 OG1 THR A 37 3.445 -15.069 -41.834 1.00 0.00 O ATOM 606 CG2 THR A 37 4.671 -13.528 -40.522 1.00 0.00 C ATOM 0 H THR A 37 4.114 -14.777 -38.064 1.00 0.00 H new ATOM 0 HA THR A 37 1.601 -14.475 -39.534 1.00 0.00 H new ATOM 0 HB THR A 37 2.631 -13.309 -41.094 1.00 0.00 H new ATOM 0 HG1 THR A 37 3.858 -14.645 -42.615 1.00 0.00 H new ATOM 0 HG21 THR A 37 5.073 -13.095 -41.438 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.588 -12.752 -39.761 1.00 0.00 H new ATOM 0 HG23 THR A 37 5.339 -14.313 -40.168 1.00 0.00 H new ATOM 614 N GLU A 38 2.101 -16.855 -40.637 1.00 0.00 N ATOM 615 CA GLU A 38 2.126 -18.303 -40.813 1.00 0.00 C ATOM 616 C GLU A 38 3.501 -18.859 -40.467 1.00 0.00 C ATOM 617 O GLU A 38 3.622 -19.818 -39.703 1.00 0.00 O ATOM 618 CB GLU A 38 1.759 -18.673 -42.252 1.00 0.00 C ATOM 619 CG GLU A 38 1.232 -20.091 -42.399 1.00 0.00 C ATOM 620 CD GLU A 38 2.333 -21.095 -42.682 1.00 0.00 C ATOM 621 OE1 GLU A 38 2.939 -21.022 -43.771 1.00 0.00 O ATOM 622 OE2 GLU A 38 2.589 -21.956 -41.813 1.00 0.00 O ATOM 0 H GLU A 38 1.546 -16.353 -41.331 1.00 0.00 H new ATOM 0 HA GLU A 38 1.391 -18.742 -40.139 1.00 0.00 H new ATOM 0 HB2 GLU A 38 1.006 -17.975 -42.617 1.00 0.00 H new ATOM 0 HB3 GLU A 38 2.638 -18.553 -42.885 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.710 -20.377 -41.486 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.501 -20.121 -43.207 1.00 0.00 H new ATOM 629 N ASN A 39 4.537 -18.246 -41.030 1.00 0.00 N ATOM 630 CA ASN A 39 5.905 -18.673 -40.776 1.00 0.00 C ATOM 631 C ASN A 39 6.158 -18.783 -39.278 1.00 0.00 C ATOM 632 O ASN A 39 6.781 -19.740 -38.809 1.00 0.00 O ATOM 633 CB ASN A 39 6.897 -17.693 -41.405 1.00 0.00 C ATOM 634 CG ASN A 39 7.161 -17.994 -42.867 1.00 0.00 C ATOM 635 OD1 ASN A 39 6.435 -17.534 -43.748 1.00 0.00 O ATOM 636 ND2 ASN A 39 8.204 -18.772 -43.132 1.00 0.00 N ATOM 0 H ASN A 39 4.454 -17.452 -41.665 1.00 0.00 H new ATOM 0 HA ASN A 39 6.048 -19.654 -41.229 1.00 0.00 H new ATOM 0 HB2 ASN A 39 6.510 -16.678 -41.310 1.00 0.00 H new ATOM 0 HB3 ASN A 39 7.837 -17.729 -40.854 1.00 0.00 H new ATOM 0 HD21 ASN A 39 8.430 -19.010 -44.098 1.00 0.00 H new ATOM 0 HD22 ASN A 39 8.779 -19.131 -42.370 1.00 0.00 H new ATOM 643 N HIS A 40 5.663 -17.805 -38.524 1.00 0.00 N ATOM 644 CA HIS A 40 5.838 -17.815 -37.081 1.00 0.00 C ATOM 645 C HIS A 40 5.091 -18.993 -36.472 1.00 0.00 C ATOM 646 O HIS A 40 5.660 -19.772 -35.710 1.00 0.00 O ATOM 647 CB HIS A 40 5.349 -16.504 -36.454 1.00 0.00 C ATOM 648 CG HIS A 40 6.063 -15.276 -36.942 1.00 0.00 C ATOM 649 ND1 HIS A 40 6.329 -14.193 -36.132 1.00 0.00 N ATOM 650 CD2 HIS A 40 6.553 -14.956 -38.158 1.00 0.00 C ATOM 651 CE1 HIS A 40 6.946 -13.255 -36.828 1.00 0.00 C ATOM 652 NE2 HIS A 40 7.094 -13.694 -38.064 1.00 0.00 N ATOM 0 H HIS A 40 5.144 -17.005 -38.886 1.00 0.00 H new ATOM 0 HA HIS A 40 6.903 -17.916 -36.871 1.00 0.00 H new ATOM 0 HB2 HIS A 40 4.284 -16.394 -36.657 1.00 0.00 H new ATOM 0 HB3 HIS A 40 5.462 -16.569 -35.372 1.00 0.00 H new ATOM 0 HD2 HIS A 40 6.526 -15.576 -39.042 1.00 0.00 H new ATOM 0 HE1 HIS A 40 7.272 -12.297 -36.452 1.00 0.00 H new ATOM 0 HE2 HIS A 40 7.537 -13.181 -38.826 1.00 0.00 H new ATOM 661 N ILE A 41 3.817 -19.124 -36.827 1.00 0.00 N ATOM 662 CA ILE A 41 2.989 -20.207 -36.338 1.00 0.00 C ATOM 663 C ILE A 41 3.811 -21.479 -36.167 1.00 0.00 C ATOM 664 O ILE A 41 3.703 -22.182 -35.162 1.00 0.00 O ATOM 665 CB ILE A 41 1.830 -20.443 -37.329 1.00 0.00 C ATOM 666 CG1 ILE A 41 0.495 -20.075 -36.685 1.00 0.00 C ATOM 667 CG2 ILE A 41 1.805 -21.878 -37.831 1.00 0.00 C ATOM 668 CD1 ILE A 41 0.489 -18.724 -35.997 1.00 0.00 C ATOM 0 H ILE A 41 3.337 -18.483 -37.459 1.00 0.00 H new ATOM 0 HA ILE A 41 2.584 -19.937 -35.362 1.00 0.00 H new ATOM 0 HB ILE A 41 1.994 -19.797 -38.191 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -0.280 -20.083 -37.451 1.00 0.00 H new ATOM 0 HG13 ILE A 41 0.232 -20.842 -35.957 1.00 0.00 H new ATOM 0 HG21 ILE A 41 0.975 -22.006 -38.526 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.743 -22.102 -38.340 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.679 -22.556 -36.987 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.495 -18.539 -35.566 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.239 -18.715 -35.206 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.719 -17.945 -36.724 1.00 0.00 H new ATOM 680 N GLN A 42 4.617 -21.766 -37.175 1.00 0.00 N ATOM 681 CA GLN A 42 5.455 -22.960 -37.172 1.00 0.00 C ATOM 682 C GLN A 42 6.514 -22.891 -36.079 1.00 0.00 C ATOM 683 O GLN A 42 6.636 -23.802 -35.259 1.00 0.00 O ATOM 684 CB GLN A 42 6.125 -23.139 -38.536 1.00 0.00 C ATOM 685 CG GLN A 42 5.268 -23.890 -39.542 1.00 0.00 C ATOM 686 CD GLN A 42 5.693 -25.336 -39.707 1.00 0.00 C ATOM 687 OE1 GLN A 42 5.748 -25.856 -40.822 1.00 0.00 O ATOM 688 NE2 GLN A 42 5.994 -25.995 -38.595 1.00 0.00 N ATOM 0 H GLN A 42 4.711 -21.188 -38.010 1.00 0.00 H new ATOM 0 HA GLN A 42 4.814 -23.818 -36.970 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.371 -22.158 -38.942 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.065 -23.673 -38.402 1.00 0.00 H new ATOM 0 HG2 GLN A 42 4.226 -23.856 -39.223 1.00 0.00 H new ATOM 0 HG3 GLN A 42 5.323 -23.387 -40.507 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.935 -25.525 -37.692 1.00 0.00 H new ATOM 0 HE22 GLN A 42 6.285 -26.972 -38.644 1.00 0.00 H new ATOM 697 N GLU A 43 7.285 -21.812 -36.081 1.00 0.00 N ATOM 698 CA GLU A 43 8.344 -21.629 -35.097 1.00 0.00 C ATOM 699 C GLU A 43 7.790 -21.577 -33.669 1.00 0.00 C ATOM 700 O GLU A 43 8.347 -22.192 -32.754 1.00 0.00 O ATOM 701 CB GLU A 43 9.129 -20.357 -35.418 1.00 0.00 C ATOM 702 CG GLU A 43 10.116 -20.524 -36.561 1.00 0.00 C ATOM 703 CD GLU A 43 10.687 -19.203 -37.036 1.00 0.00 C ATOM 704 OE1 GLU A 43 11.456 -18.581 -36.274 1.00 0.00 O ATOM 705 OE2 GLU A 43 10.364 -18.790 -38.170 1.00 0.00 O ATOM 0 H GLU A 43 7.197 -21.050 -36.753 1.00 0.00 H new ATOM 0 HA GLU A 43 9.012 -22.489 -35.151 1.00 0.00 H new ATOM 0 HB2 GLU A 43 8.428 -19.561 -35.668 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.669 -20.038 -34.526 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.931 -21.173 -36.241 1.00 0.00 H new ATOM 0 HG3 GLU A 43 9.620 -21.022 -37.394 1.00 0.00 H new ATOM 712 N ILE A 44 6.692 -20.848 -33.476 1.00 0.00 N ATOM 713 CA ILE A 44 6.081 -20.729 -32.171 1.00 0.00 C ATOM 714 C ILE A 44 5.582 -22.075 -31.681 1.00 0.00 C ATOM 715 O ILE A 44 5.943 -22.519 -30.591 1.00 0.00 O ATOM 716 CB ILE A 44 4.930 -19.724 -32.220 1.00 0.00 C ATOM 717 CG1 ILE A 44 5.454 -18.358 -32.682 1.00 0.00 C ATOM 718 CG2 ILE A 44 4.263 -19.627 -30.869 1.00 0.00 C ATOM 719 CD1 ILE A 44 6.193 -17.593 -31.607 1.00 0.00 C ATOM 0 H ILE A 44 6.213 -20.333 -34.215 1.00 0.00 H new ATOM 0 HA ILE A 44 6.836 -20.371 -31.471 1.00 0.00 H new ATOM 0 HB ILE A 44 4.183 -20.064 -32.937 1.00 0.00 H new ATOM 0 HG12 ILE A 44 6.119 -18.503 -33.534 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.615 -17.756 -33.031 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.445 -18.908 -30.918 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.871 -20.604 -30.586 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.991 -19.299 -30.127 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.533 -16.638 -32.008 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.526 -17.415 -30.763 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.053 -18.173 -31.273 1.00 0.00 H new ATOM 731 N ASN A 45 4.777 -22.741 -32.499 1.00 0.00 N ATOM 732 CA ASN A 45 4.275 -24.054 -32.136 1.00 0.00 C ATOM 733 C ASN A 45 5.431 -24.897 -31.617 1.00 0.00 C ATOM 734 O ASN A 45 5.246 -25.811 -30.813 1.00 0.00 O ATOM 735 CB ASN A 45 3.618 -24.733 -33.339 1.00 0.00 C ATOM 736 CG ASN A 45 2.192 -24.266 -33.557 1.00 0.00 C ATOM 737 OD1 ASN A 45 1.809 -23.901 -34.668 1.00 0.00 O ATOM 738 ND2 ASN A 45 1.399 -24.276 -32.493 1.00 0.00 N ATOM 0 H ASN A 45 4.463 -22.397 -33.406 1.00 0.00 H new ATOM 0 HA ASN A 45 3.519 -23.950 -31.358 1.00 0.00 H new ATOM 0 HB2 ASN A 45 4.205 -24.529 -34.234 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.626 -25.813 -33.192 1.00 0.00 H new ATOM 0 HD21 ASN A 45 0.429 -23.973 -32.577 1.00 0.00 H new ATOM 0 HD22 ASN A 45 1.760 -24.587 -31.591 1.00 0.00 H new ATOM 745 N ALA A 46 6.635 -24.564 -32.082 1.00 0.00 N ATOM 746 CA ALA A 46 7.841 -25.265 -31.669 1.00 0.00 C ATOM 747 C ALA A 46 8.127 -25.028 -30.191 1.00 0.00 C ATOM 748 O ALA A 46 8.472 -25.965 -29.470 1.00 0.00 O ATOM 749 CB ALA A 46 9.026 -24.828 -32.516 1.00 0.00 C ATOM 0 H ALA A 46 6.797 -23.809 -32.748 1.00 0.00 H new ATOM 0 HA ALA A 46 7.682 -26.333 -31.818 1.00 0.00 H new ATOM 0 HB1 ALA A 46 9.920 -25.362 -32.194 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.827 -25.053 -33.564 1.00 0.00 H new ATOM 0 HB3 ALA A 46 9.182 -23.756 -32.398 1.00 0.00 H new ATOM 755 N GLN A 47 7.984 -23.771 -29.748 1.00 0.00 N ATOM 756 CA GLN A 47 8.224 -23.405 -28.351 1.00 0.00 C ATOM 757 C GLN A 47 8.062 -24.597 -27.413 1.00 0.00 C ATOM 758 O GLN A 47 9.043 -25.231 -27.025 1.00 0.00 O ATOM 759 CB GLN A 47 7.265 -22.293 -27.931 1.00 0.00 C ATOM 760 CG GLN A 47 7.494 -20.988 -28.669 1.00 0.00 C ATOM 761 CD GLN A 47 6.322 -20.026 -28.562 1.00 0.00 C ATOM 762 OE1 GLN A 47 6.226 -19.071 -29.329 1.00 0.00 O ATOM 763 NE2 GLN A 47 5.428 -20.263 -27.606 1.00 0.00 N ATOM 0 H GLN A 47 7.702 -22.991 -30.342 1.00 0.00 H new ATOM 0 HA GLN A 47 9.254 -23.057 -28.277 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.240 -22.623 -28.102 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.369 -22.119 -26.860 1.00 0.00 H new ATOM 0 HG2 GLN A 47 8.388 -20.506 -28.273 1.00 0.00 H new ATOM 0 HG3 GLN A 47 7.686 -21.202 -29.721 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.543 -21.067 -26.989 1.00 0.00 H new ATOM 0 HE22 GLN A 47 4.628 -19.641 -27.490 1.00 0.00 H new ATOM 772 N THR A 48 6.820 -24.896 -27.050 1.00 0.00 N ATOM 773 CA THR A 48 6.534 -26.012 -26.156 1.00 0.00 C ATOM 774 C THR A 48 7.070 -25.738 -24.752 1.00 0.00 C ATOM 775 O THR A 48 6.315 -25.733 -23.781 1.00 0.00 O ATOM 776 CB THR A 48 7.144 -27.302 -26.707 1.00 0.00 C ATOM 777 OG1 THR A 48 6.617 -27.599 -27.988 1.00 0.00 O ATOM 778 CG2 THR A 48 6.901 -28.503 -25.820 1.00 0.00 C ATOM 0 H THR A 48 5.996 -24.382 -27.361 1.00 0.00 H new ATOM 0 HA THR A 48 5.452 -26.128 -26.094 1.00 0.00 H new ATOM 0 HB THR A 48 8.217 -27.117 -26.756 1.00 0.00 H new ATOM 0 HG1 THR A 48 7.129 -27.119 -28.672 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.359 -29.385 -26.268 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.340 -28.325 -24.838 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.828 -28.666 -25.714 1.00 0.00 H new ATOM 786 N THR A 49 8.378 -25.510 -24.653 1.00 0.00 N ATOM 787 CA THR A 49 9.011 -25.236 -23.367 1.00 0.00 C ATOM 788 C THR A 49 8.454 -23.958 -22.745 1.00 0.00 C ATOM 789 O THR A 49 7.441 -23.988 -22.046 1.00 0.00 O ATOM 790 CB THR A 49 10.527 -25.120 -23.536 1.00 0.00 C ATOM 791 OG1 THR A 49 10.853 -24.067 -24.425 1.00 0.00 O ATOM 792 CG2 THR A 49 11.170 -26.383 -24.066 1.00 0.00 C ATOM 0 H THR A 49 9.018 -25.510 -25.447 1.00 0.00 H new ATOM 0 HA THR A 49 8.791 -26.067 -22.697 1.00 0.00 H new ATOM 0 HB THR A 49 10.914 -24.927 -22.535 1.00 0.00 H new ATOM 0 HG1 THR A 49 11.827 -24.008 -24.519 1.00 0.00 H new ATOM 0 HG21 THR A 49 12.245 -26.231 -24.162 1.00 0.00 H new ATOM 0 HG22 THR A 49 10.979 -27.205 -23.376 1.00 0.00 H new ATOM 0 HG23 THR A 49 10.749 -26.623 -25.042 1.00 0.00 H new ATOM 800 N GLY A 50 9.121 -22.835 -23.000 1.00 0.00 N ATOM 801 CA GLY A 50 8.672 -21.566 -22.454 1.00 0.00 C ATOM 802 C GLY A 50 9.600 -20.418 -22.804 1.00 0.00 C ATOM 803 O GLY A 50 9.155 -19.281 -22.968 1.00 0.00 O ATOM 0 H GLY A 50 9.963 -22.781 -23.574 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.672 -21.347 -22.829 1.00 0.00 H new ATOM 0 HA3 GLY A 50 8.595 -21.648 -21.370 1.00 0.00 H new ATOM 807 N LEU A 51 10.891 -20.712 -22.916 1.00 0.00 N ATOM 808 CA LEU A 51 11.882 -19.694 -23.248 1.00 0.00 C ATOM 809 C LEU A 51 11.991 -19.510 -24.757 1.00 0.00 C ATOM 810 O LEU A 51 12.330 -18.429 -25.240 1.00 0.00 O ATOM 811 CB LEU A 51 13.247 -20.074 -22.672 1.00 0.00 C ATOM 812 CG LEU A 51 13.670 -19.287 -21.430 1.00 0.00 C ATOM 813 CD1 LEU A 51 13.816 -17.809 -21.757 1.00 0.00 C ATOM 814 CD2 LEU A 51 12.667 -19.490 -20.305 1.00 0.00 C ATOM 0 H LEU A 51 11.276 -21.647 -22.782 1.00 0.00 H new ATOM 0 HA LEU A 51 11.557 -18.752 -22.807 1.00 0.00 H new ATOM 0 HB2 LEU A 51 13.237 -21.135 -22.424 1.00 0.00 H new ATOM 0 HB3 LEU A 51 14.002 -19.935 -23.446 1.00 0.00 H new ATOM 0 HG LEU A 51 14.639 -19.661 -21.099 1.00 0.00 H new ATOM 0 HD11 LEU A 51 14.117 -17.266 -20.861 1.00 0.00 H new ATOM 0 HD12 LEU A 51 14.573 -17.681 -22.531 1.00 0.00 H new ATOM 0 HD13 LEU A 51 12.863 -17.419 -22.114 1.00 0.00 H new ATOM 0 HD21 LEU A 51 12.983 -18.923 -19.429 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.685 -19.144 -20.626 1.00 0.00 H new ATOM 0 HD23 LEU A 51 12.613 -20.549 -20.052 1.00 0.00 H new ATOM 826 N ARG A 52 11.704 -20.574 -25.498 1.00 0.00 N ATOM 827 CA ARG A 52 11.773 -20.527 -26.952 1.00 0.00 C ATOM 828 C ARG A 52 10.840 -19.455 -27.505 1.00 0.00 C ATOM 829 O ARG A 52 11.189 -18.744 -28.446 1.00 0.00 O ATOM 830 CB ARG A 52 11.415 -21.888 -27.548 1.00 0.00 C ATOM 831 CG ARG A 52 12.532 -22.503 -28.375 1.00 0.00 C ATOM 832 CD ARG A 52 12.001 -23.100 -29.668 1.00 0.00 C ATOM 833 NE ARG A 52 11.969 -24.559 -29.624 1.00 0.00 N ATOM 834 CZ ARG A 52 13.049 -25.323 -29.753 1.00 0.00 C ATOM 835 NH1 ARG A 52 14.239 -24.766 -29.934 1.00 0.00 N ATOM 836 NH2 ARG A 52 12.939 -26.644 -29.702 1.00 0.00 N ATOM 0 H ARG A 52 11.422 -21.477 -25.116 1.00 0.00 H new ATOM 0 HA ARG A 52 12.796 -20.275 -27.233 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.154 -22.572 -26.740 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.529 -21.780 -28.173 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.279 -21.742 -28.603 1.00 0.00 H new ATOM 0 HG3 ARG A 52 13.033 -23.277 -27.794 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.997 -22.721 -29.857 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.626 -22.776 -30.500 1.00 0.00 H new ATOM 0 HE ARG A 52 11.068 -25.017 -29.487 1.00 0.00 H new ATOM 0 HH11 ARG A 52 14.326 -23.751 -29.974 1.00 0.00 H new ATOM 0 HH12 ARG A 52 15.067 -25.353 -30.033 1.00 0.00 H new ATOM 0 HH21 ARG A 52 12.025 -27.075 -29.564 1.00 0.00 H new ATOM 0 HH22 ARG A 52 13.769 -27.229 -29.801 1.00 0.00 H new ATOM 850 N LYS A 53 9.654 -19.339 -26.915 1.00 0.00 N ATOM 851 CA LYS A 53 8.681 -18.344 -27.356 1.00 0.00 C ATOM 852 C LYS A 53 9.383 -17.018 -27.643 1.00 0.00 C ATOM 853 O LYS A 53 9.317 -16.488 -28.757 1.00 0.00 O ATOM 854 CB LYS A 53 7.594 -18.145 -26.296 1.00 0.00 C ATOM 855 CG LYS A 53 7.262 -19.406 -25.512 1.00 0.00 C ATOM 856 CD LYS A 53 5.999 -19.232 -24.685 1.00 0.00 C ATOM 857 CE LYS A 53 5.384 -20.573 -24.313 1.00 0.00 C ATOM 858 NZ LYS A 53 4.501 -20.467 -23.118 1.00 0.00 N ATOM 0 H LYS A 53 9.344 -19.918 -26.135 1.00 0.00 H new ATOM 0 HA LYS A 53 8.209 -18.703 -28.271 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.916 -17.370 -25.600 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.688 -17.781 -26.782 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.135 -20.241 -26.201 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.096 -19.658 -24.856 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.231 -18.674 -23.778 1.00 0.00 H new ATOM 0 HD3 LYS A 53 5.274 -18.642 -25.246 1.00 0.00 H new ATOM 0 HE2 LYS A 53 4.809 -20.955 -25.156 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.177 -21.294 -24.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 4.102 -21.402 -22.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.055 -20.127 -22.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 3.729 -19.799 -23.315 1.00 0.00 H new ATOM 872 N THR A 54 10.076 -16.489 -26.638 1.00 0.00 N ATOM 873 CA THR A 54 10.804 -15.251 -26.807 1.00 0.00 C ATOM 874 C THR A 54 11.758 -15.395 -27.977 1.00 0.00 C ATOM 875 O THR A 54 11.817 -14.539 -28.859 1.00 0.00 O ATOM 876 CB THR A 54 11.576 -14.913 -25.536 1.00 0.00 C ATOM 877 OG1 THR A 54 10.941 -15.470 -24.399 1.00 0.00 O ATOM 878 CG2 THR A 54 11.709 -13.429 -25.308 1.00 0.00 C ATOM 0 H THR A 54 10.144 -16.901 -25.707 1.00 0.00 H new ATOM 0 HA THR A 54 10.102 -14.441 -27.006 1.00 0.00 H new ATOM 0 HB THR A 54 12.570 -15.337 -25.674 1.00 0.00 H new ATOM 0 HG1 THR A 54 11.304 -16.364 -24.226 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.267 -13.251 -24.389 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.238 -12.978 -26.147 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.718 -12.984 -25.222 1.00 0.00 H new ATOM 886 N MET A 55 12.487 -16.506 -27.993 1.00 0.00 N ATOM 887 CA MET A 55 13.417 -16.780 -29.072 1.00 0.00 C ATOM 888 C MET A 55 12.714 -16.615 -30.400 1.00 0.00 C ATOM 889 O MET A 55 13.279 -16.080 -31.351 1.00 0.00 O ATOM 890 CB MET A 55 13.996 -18.190 -28.946 1.00 0.00 C ATOM 891 CG MET A 55 15.315 -18.242 -28.192 1.00 0.00 C ATOM 892 SD MET A 55 16.428 -19.509 -28.831 1.00 0.00 S ATOM 893 CE MET A 55 18.022 -18.809 -28.408 1.00 0.00 C ATOM 0 H MET A 55 12.449 -17.226 -27.272 1.00 0.00 H new ATOM 0 HA MET A 55 14.243 -16.072 -29.013 1.00 0.00 H new ATOM 0 HB2 MET A 55 13.272 -18.827 -28.438 1.00 0.00 H new ATOM 0 HB3 MET A 55 14.141 -18.605 -29.944 1.00 0.00 H new ATOM 0 HG2 MET A 55 15.803 -17.270 -28.254 1.00 0.00 H new ATOM 0 HG3 MET A 55 15.119 -18.434 -27.137 1.00 0.00 H new ATOM 0 HE1 MET A 55 18.814 -19.480 -28.740 1.00 0.00 H new ATOM 0 HE2 MET A 55 18.136 -17.842 -28.898 1.00 0.00 H new ATOM 0 HE3 MET A 55 18.087 -18.678 -27.328 1.00 0.00 H new ATOM 903 N LEU A 56 11.474 -17.074 -30.454 1.00 0.00 N ATOM 904 CA LEU A 56 10.687 -16.979 -31.651 1.00 0.00 C ATOM 905 C LEU A 56 10.666 -15.575 -32.200 1.00 0.00 C ATOM 906 O LEU A 56 11.407 -15.286 -33.126 1.00 0.00 O ATOM 907 CB LEU A 56 9.282 -17.487 -31.388 1.00 0.00 C ATOM 908 CG LEU A 56 8.925 -18.706 -32.202 1.00 0.00 C ATOM 909 CD1 LEU A 56 8.366 -18.260 -33.545 1.00 0.00 C ATOM 910 CD2 LEU A 56 10.158 -19.596 -32.344 1.00 0.00 C ATOM 0 H LEU A 56 10.996 -17.518 -29.670 1.00 0.00 H new ATOM 0 HA LEU A 56 11.151 -17.607 -32.412 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.181 -17.724 -30.329 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.569 -16.692 -31.606 1.00 0.00 H new ATOM 0 HG LEU A 56 8.155 -19.296 -31.706 1.00 0.00 H new ATOM 0 HD11 LEU A 56 8.105 -19.136 -34.140 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.476 -17.652 -33.385 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.116 -17.672 -34.074 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.904 -20.478 -32.932 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.951 -19.042 -32.846 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.500 -19.904 -31.356 1.00 0.00 H new ATOM 922 N LEU A 57 9.830 -14.700 -31.650 1.00 0.00 N ATOM 923 CA LEU A 57 9.773 -13.337 -32.144 1.00 0.00 C ATOM 924 C LEU A 57 11.157 -12.830 -32.502 1.00 0.00 C ATOM 925 O LEU A 57 11.394 -12.345 -33.608 1.00 0.00 O ATOM 926 CB LEU A 57 9.129 -12.427 -31.130 1.00 0.00 C ATOM 927 CG LEU A 57 7.908 -11.725 -31.675 1.00 0.00 C ATOM 928 CD1 LEU A 57 8.340 -10.610 -32.606 1.00 0.00 C ATOM 929 CD2 LEU A 57 7.019 -12.705 -32.424 1.00 0.00 C ATOM 0 H LEU A 57 9.196 -14.908 -30.878 1.00 0.00 H new ATOM 0 HA LEU A 57 9.163 -13.335 -33.048 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.848 -13.008 -30.252 1.00 0.00 H new ATOM 0 HB3 LEU A 57 9.855 -11.683 -30.801 1.00 0.00 H new ATOM 0 HG LEU A 57 7.340 -11.308 -30.843 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.459 -10.103 -33.000 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.955 -9.896 -32.058 1.00 0.00 H new ATOM 0 HD13 LEU A 57 8.917 -11.028 -33.431 1.00 0.00 H new ATOM 0 HD21 LEU A 57 6.144 -12.181 -32.810 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.576 -13.141 -33.254 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.699 -13.497 -31.747 1.00 0.00 H new ATOM 941 N LEU A 58 12.066 -12.964 -31.558 1.00 0.00 N ATOM 942 CA LEU A 58 13.442 -12.543 -31.751 1.00 0.00 C ATOM 943 C LEU A 58 14.074 -13.284 -32.928 1.00 0.00 C ATOM 944 O LEU A 58 14.996 -12.786 -33.575 1.00 0.00 O ATOM 945 CB LEU A 58 14.234 -12.813 -30.477 1.00 0.00 C ATOM 946 CG LEU A 58 13.564 -12.345 -29.186 1.00 0.00 C ATOM 947 CD1 LEU A 58 14.183 -13.041 -27.987 1.00 0.00 C ATOM 948 CD2 LEU A 58 13.669 -10.835 -29.048 1.00 0.00 C ATOM 0 H LEU A 58 11.875 -13.365 -30.640 1.00 0.00 H new ATOM 0 HA LEU A 58 13.458 -11.476 -31.973 1.00 0.00 H new ATOM 0 HB2 LEU A 58 14.420 -13.884 -30.404 1.00 0.00 H new ATOM 0 HB3 LEU A 58 15.205 -12.326 -30.561 1.00 0.00 H new ATOM 0 HG LEU A 58 12.507 -12.609 -29.227 1.00 0.00 H new ATOM 0 HD11 LEU A 58 13.695 -12.697 -27.075 1.00 0.00 H new ATOM 0 HD12 LEU A 58 14.052 -14.119 -28.084 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.247 -12.807 -27.940 1.00 0.00 H new ATOM 0 HD21 LEU A 58 13.186 -10.520 -28.123 1.00 0.00 H new ATOM 0 HD22 LEU A 58 14.719 -10.544 -29.027 1.00 0.00 H new ATOM 0 HD23 LEU A 58 13.177 -10.357 -29.895 1.00 0.00 H new ATOM 960 N ASP A 59 13.561 -14.477 -33.191 1.00 0.00 N ATOM 961 CA ASP A 59 14.045 -15.324 -34.283 1.00 0.00 C ATOM 962 C ASP A 59 13.322 -15.012 -35.590 1.00 0.00 C ATOM 963 O ASP A 59 13.860 -15.202 -36.680 1.00 0.00 O ATOM 964 CB ASP A 59 13.829 -16.798 -33.929 1.00 0.00 C ATOM 965 CG ASP A 59 15.050 -17.426 -33.288 1.00 0.00 C ATOM 966 OD1 ASP A 59 16.108 -16.762 -33.248 1.00 0.00 O ATOM 967 OD2 ASP A 59 14.950 -18.583 -32.826 1.00 0.00 O ATOM 0 H ASP A 59 12.797 -14.890 -32.656 1.00 0.00 H new ATOM 0 HA ASP A 59 15.108 -15.122 -34.418 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.981 -16.885 -33.250 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.572 -17.351 -34.832 1.00 0.00 H new ATOM 972 N ILE A 60 12.094 -14.546 -35.454 1.00 0.00 N ATOM 973 CA ILE A 60 11.247 -14.209 -36.594 1.00 0.00 C ATOM 974 C ILE A 60 11.435 -12.753 -37.000 1.00 0.00 C ATOM 975 O ILE A 60 11.488 -12.424 -38.185 1.00 0.00 O ATOM 976 CB ILE A 60 9.751 -14.449 -36.271 1.00 0.00 C ATOM 977 CG1 ILE A 60 9.574 -14.958 -34.853 1.00 0.00 C ATOM 978 CG2 ILE A 60 9.153 -15.443 -37.230 1.00 0.00 C ATOM 979 CD1 ILE A 60 8.136 -15.125 -34.444 1.00 0.00 C ATOM 0 H ILE A 60 11.650 -14.389 -34.549 1.00 0.00 H new ATOM 0 HA ILE A 60 11.545 -14.858 -37.417 1.00 0.00 H new ATOM 0 HB ILE A 60 9.238 -13.493 -36.372 1.00 0.00 H new ATOM 0 HG12 ILE A 60 10.084 -15.916 -34.754 1.00 0.00 H new ATOM 0 HG13 ILE A 60 10.060 -14.266 -34.165 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.102 -15.597 -36.986 1.00 0.00 H new ATOM 0 HG22 ILE A 60 9.237 -15.062 -38.248 1.00 0.00 H new ATOM 0 HG23 ILE A 60 9.687 -16.390 -37.152 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.090 -15.492 -33.419 1.00 0.00 H new ATOM 0 HD12 ILE A 60 7.625 -14.164 -34.509 1.00 0.00 H new ATOM 0 HD13 ILE A 60 7.650 -15.840 -35.108 1.00 0.00 H new ATOM 991 N LEU A 61 11.530 -11.890 -35.999 1.00 0.00 N ATOM 992 CA LEU A 61 11.707 -10.463 -36.221 1.00 0.00 C ATOM 993 C LEU A 61 12.802 -10.178 -37.246 1.00 0.00 C ATOM 994 O LEU A 61 12.579 -9.458 -38.219 1.00 0.00 O ATOM 995 CB LEU A 61 12.034 -9.775 -34.897 1.00 0.00 C ATOM 996 CG LEU A 61 10.815 -9.442 -34.036 1.00 0.00 C ATOM 997 CD1 LEU A 61 11.217 -8.662 -32.797 1.00 0.00 C ATOM 998 CD2 LEU A 61 9.797 -8.659 -34.844 1.00 0.00 C ATOM 0 H LEU A 61 11.487 -12.157 -35.016 1.00 0.00 H new ATOM 0 HA LEU A 61 10.774 -10.067 -36.622 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.703 -10.417 -34.324 1.00 0.00 H new ATOM 0 HB3 LEU A 61 12.578 -8.854 -35.106 1.00 0.00 H new ATOM 0 HG LEU A 61 10.363 -10.380 -33.713 1.00 0.00 H new ATOM 0 HD11 LEU A 61 10.330 -8.439 -32.204 1.00 0.00 H new ATOM 0 HD12 LEU A 61 11.911 -9.256 -32.203 1.00 0.00 H new ATOM 0 HD13 LEU A 61 11.698 -7.730 -33.094 1.00 0.00 H new ATOM 0 HD21 LEU A 61 8.935 -8.429 -34.218 1.00 0.00 H new ATOM 0 HD22 LEU A 61 10.248 -7.731 -35.196 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.476 -9.254 -35.699 1.00 0.00 H new ATOM 1010 N PRO A 62 14.007 -10.729 -37.034 1.00 0.00 N ATOM 1011 CA PRO A 62 15.145 -10.518 -37.939 1.00 0.00 C ATOM 1012 C PRO A 62 14.951 -11.164 -39.307 1.00 0.00 C ATOM 1013 O PRO A 62 15.811 -11.045 -40.181 1.00 0.00 O ATOM 1014 CB PRO A 62 16.314 -11.176 -37.202 1.00 0.00 C ATOM 1015 CG PRO A 62 15.680 -12.181 -36.306 1.00 0.00 C ATOM 1016 CD PRO A 62 14.363 -11.588 -35.891 1.00 0.00 C ATOM 0 HA PRO A 62 15.292 -9.459 -38.152 1.00 0.00 H new ATOM 0 HB2 PRO A 62 17.006 -11.648 -37.899 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.886 -10.443 -36.633 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.536 -13.130 -36.823 1.00 0.00 H new ATOM 0 HG3 PRO A 62 16.308 -12.383 -35.439 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.612 -12.358 -35.716 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.452 -11.015 -34.968 1.00 0.00 H new ATOM 1024 N SER A 63 13.828 -11.849 -39.496 1.00 0.00 N ATOM 1025 CA SER A 63 13.551 -12.504 -40.769 1.00 0.00 C ATOM 1026 C SER A 63 12.123 -12.234 -41.230 1.00 0.00 C ATOM 1027 O SER A 63 11.896 -11.470 -42.168 1.00 0.00 O ATOM 1028 CB SER A 63 13.787 -14.012 -40.653 1.00 0.00 C ATOM 1029 OG SER A 63 13.923 -14.607 -41.932 1.00 0.00 O ATOM 0 H SER A 63 13.101 -11.965 -38.790 1.00 0.00 H new ATOM 0 HA SER A 63 14.233 -12.091 -41.513 1.00 0.00 H new ATOM 0 HB2 SER A 63 14.685 -14.198 -40.064 1.00 0.00 H new ATOM 0 HB3 SER A 63 12.955 -14.473 -40.120 1.00 0.00 H new ATOM 0 HG SER A 63 14.075 -15.570 -41.830 1.00 0.00 H new ATOM 1035 N ARG A 64 11.166 -12.869 -40.566 1.00 0.00 N ATOM 1036 CA ARG A 64 9.757 -12.704 -40.907 1.00 0.00 C ATOM 1037 C ARG A 64 9.085 -11.686 -39.992 1.00 0.00 C ATOM 1038 O ARG A 64 8.009 -11.938 -39.454 1.00 0.00 O ATOM 1039 CB ARG A 64 9.029 -14.046 -40.823 1.00 0.00 C ATOM 1040 CG ARG A 64 9.878 -15.227 -41.266 1.00 0.00 C ATOM 1041 CD ARG A 64 9.674 -15.535 -42.741 1.00 0.00 C ATOM 1042 NE ARG A 64 10.533 -14.719 -43.595 1.00 0.00 N ATOM 1043 CZ ARG A 64 11.748 -15.088 -43.994 1.00 0.00 C ATOM 1044 NH1 ARG A 64 12.250 -16.257 -43.619 1.00 0.00 N ATOM 1045 NH2 ARG A 64 12.465 -14.284 -44.768 1.00 0.00 N ATOM 0 H ARG A 64 11.339 -13.504 -39.787 1.00 0.00 H new ATOM 0 HA ARG A 64 9.701 -12.332 -41.930 1.00 0.00 H new ATOM 0 HB2 ARG A 64 8.702 -14.209 -39.796 1.00 0.00 H new ATOM 0 HB3 ARG A 64 8.132 -14.002 -41.440 1.00 0.00 H new ATOM 0 HG2 ARG A 64 10.930 -15.011 -41.080 1.00 0.00 H new ATOM 0 HG3 ARG A 64 9.623 -16.104 -40.671 1.00 0.00 H new ATOM 0 HD2 ARG A 64 9.879 -16.590 -42.923 1.00 0.00 H new ATOM 0 HD3 ARG A 64 8.631 -15.363 -43.006 1.00 0.00 H new ATOM 0 HE ARG A 64 10.181 -13.813 -43.904 1.00 0.00 H new ATOM 0 HH11 ARG A 64 11.704 -16.878 -43.022 1.00 0.00 H new ATOM 0 HH12 ARG A 64 13.182 -16.535 -43.928 1.00 0.00 H new ATOM 0 HH21 ARG A 64 12.085 -13.383 -45.058 1.00 0.00 H new ATOM 0 HH22 ARG A 64 13.396 -14.567 -45.074 1.00 0.00 H new ATOM 1059 N GLY A 65 9.726 -10.535 -39.820 1.00 0.00 N ATOM 1060 CA GLY A 65 9.169 -9.502 -38.966 1.00 0.00 C ATOM 1061 C GLY A 65 9.134 -8.139 -39.633 1.00 0.00 C ATOM 1062 O GLY A 65 9.891 -7.244 -39.260 1.00 0.00 O ATOM 0 H GLY A 65 10.618 -10.299 -40.255 1.00 0.00 H new ATOM 0 HA2 GLY A 65 8.157 -9.785 -38.675 1.00 0.00 H new ATOM 0 HA3 GLY A 65 9.758 -9.438 -38.051 1.00 0.00 H new ATOM 1066 N PRO A 66 8.252 -7.950 -40.627 1.00 0.00 N ATOM 1067 CA PRO A 66 8.123 -6.673 -41.338 1.00 0.00 C ATOM 1068 C PRO A 66 7.672 -5.550 -40.410 1.00 0.00 C ATOM 1069 O PRO A 66 6.506 -5.489 -40.019 1.00 0.00 O ATOM 1070 CB PRO A 66 7.049 -6.947 -42.400 1.00 0.00 C ATOM 1071 CG PRO A 66 6.949 -8.433 -42.490 1.00 0.00 C ATOM 1072 CD PRO A 66 7.309 -8.958 -41.130 1.00 0.00 C ATOM 0 HA PRO A 66 9.074 -6.346 -41.758 1.00 0.00 H new ATOM 0 HB2 PRO A 66 6.094 -6.506 -42.115 1.00 0.00 H new ATOM 0 HB3 PRO A 66 7.327 -6.513 -43.361 1.00 0.00 H new ATOM 0 HG2 PRO A 66 5.942 -8.739 -42.772 1.00 0.00 H new ATOM 0 HG3 PRO A 66 7.625 -8.824 -43.250 1.00 0.00 H new ATOM 0 HD2 PRO A 66 6.433 -9.048 -40.487 1.00 0.00 H new ATOM 0 HD3 PRO A 66 7.766 -9.946 -41.186 1.00 0.00 H new ATOM 1080 N LYS A 67 8.599 -4.669 -40.050 1.00 0.00 N ATOM 1081 CA LYS A 67 8.286 -3.560 -39.158 1.00 0.00 C ATOM 1082 C LYS A 67 7.680 -4.080 -37.858 1.00 0.00 C ATOM 1083 O LYS A 67 7.024 -3.340 -37.124 1.00 0.00 O ATOM 1084 CB LYS A 67 7.318 -2.586 -39.833 1.00 0.00 C ATOM 1085 CG LYS A 67 8.004 -1.386 -40.464 1.00 0.00 C ATOM 1086 CD LYS A 67 8.343 -1.642 -41.923 1.00 0.00 C ATOM 1087 CE LYS A 67 9.391 -0.666 -42.430 1.00 0.00 C ATOM 1088 NZ LYS A 67 9.253 -0.411 -43.890 1.00 0.00 N ATOM 0 H LYS A 67 9.570 -4.701 -40.361 1.00 0.00 H new ATOM 0 HA LYS A 67 9.212 -3.032 -38.930 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.757 -3.118 -40.601 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.596 -2.235 -39.096 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.356 -0.513 -40.388 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.915 -1.155 -39.913 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.708 -2.662 -42.039 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.441 -1.555 -42.528 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.303 0.275 -41.887 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.385 -1.061 -42.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.986 0.260 -44.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.362 -1.305 -44.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.314 -0.010 -44.085 1.00 0.00 H new ATOM 1102 N ALA A 68 7.904 -5.361 -37.587 1.00 0.00 N ATOM 1103 CA ALA A 68 7.384 -5.998 -36.386 1.00 0.00 C ATOM 1104 C ALA A 68 7.897 -5.323 -35.125 1.00 0.00 C ATOM 1105 O ALA A 68 7.366 -5.540 -34.043 1.00 0.00 O ATOM 1106 CB ALA A 68 7.776 -7.465 -36.365 1.00 0.00 C ATOM 0 H ALA A 68 8.446 -5.981 -38.188 1.00 0.00 H new ATOM 0 HA ALA A 68 6.298 -5.902 -36.407 1.00 0.00 H new ATOM 0 HB1 ALA A 68 7.383 -7.934 -35.463 1.00 0.00 H new ATOM 0 HB2 ALA A 68 7.364 -7.964 -37.242 1.00 0.00 H new ATOM 0 HB3 ALA A 68 8.863 -7.551 -36.375 1.00 0.00 H new ATOM 1112 N PHE A 69 8.944 -4.526 -35.257 1.00 0.00 N ATOM 1113 CA PHE A 69 9.524 -3.857 -34.103 1.00 0.00 C ATOM 1114 C PHE A 69 8.476 -3.089 -33.301 1.00 0.00 C ATOM 1115 O PHE A 69 8.115 -3.489 -32.194 1.00 0.00 O ATOM 1116 CB PHE A 69 10.646 -2.918 -34.534 1.00 0.00 C ATOM 1117 CG PHE A 69 11.795 -2.938 -33.579 1.00 0.00 C ATOM 1118 CD1 PHE A 69 11.590 -3.309 -32.263 1.00 0.00 C ATOM 1119 CD2 PHE A 69 13.072 -2.598 -33.987 1.00 0.00 C ATOM 1120 CE1 PHE A 69 12.634 -3.341 -31.368 1.00 0.00 C ATOM 1121 CE2 PHE A 69 14.125 -2.627 -33.095 1.00 0.00 C ATOM 1122 CZ PHE A 69 13.905 -3.000 -31.781 1.00 0.00 C ATOM 0 H PHE A 69 9.407 -4.327 -36.144 1.00 0.00 H new ATOM 0 HA PHE A 69 9.935 -4.632 -33.455 1.00 0.00 H new ATOM 0 HB2 PHE A 69 10.995 -3.203 -35.526 1.00 0.00 H new ATOM 0 HB3 PHE A 69 10.258 -1.902 -34.612 1.00 0.00 H new ATOM 0 HD1 PHE A 69 10.597 -3.577 -31.933 1.00 0.00 H new ATOM 0 HD2 PHE A 69 13.247 -2.307 -35.012 1.00 0.00 H new ATOM 0 HE1 PHE A 69 12.459 -3.633 -30.343 1.00 0.00 H new ATOM 0 HE2 PHE A 69 15.119 -2.359 -33.422 1.00 0.00 H new ATOM 0 HZ PHE A 69 14.727 -3.024 -31.080 1.00 0.00 H new ATOM 1132 N ASP A 70 8.009 -1.981 -33.859 1.00 0.00 N ATOM 1133 CA ASP A 70 7.016 -1.139 -33.197 1.00 0.00 C ATOM 1134 C ASP A 70 6.070 -1.948 -32.314 1.00 0.00 C ATOM 1135 O ASP A 70 5.947 -1.681 -31.118 1.00 0.00 O ATOM 1136 CB ASP A 70 6.213 -0.356 -34.235 1.00 0.00 C ATOM 1137 CG ASP A 70 6.819 1.002 -34.531 1.00 0.00 C ATOM 1138 OD1 ASP A 70 6.785 1.875 -33.638 1.00 0.00 O ATOM 1139 OD2 ASP A 70 7.328 1.193 -35.655 1.00 0.00 O ATOM 0 H ASP A 70 8.303 -1.641 -34.775 1.00 0.00 H new ATOM 0 HA ASP A 70 7.558 -0.447 -32.552 1.00 0.00 H new ATOM 0 HB2 ASP A 70 6.156 -0.934 -35.157 1.00 0.00 H new ATOM 0 HB3 ASP A 70 5.192 -0.225 -33.877 1.00 0.00 H new ATOM 1144 N THR A 71 5.392 -2.924 -32.904 1.00 0.00 N ATOM 1145 CA THR A 71 4.448 -3.750 -32.158 1.00 0.00 C ATOM 1146 C THR A 71 5.173 -4.747 -31.264 1.00 0.00 C ATOM 1147 O THR A 71 4.761 -4.984 -30.129 1.00 0.00 O ATOM 1148 CB THR A 71 3.507 -4.488 -33.112 1.00 0.00 C ATOM 1149 OG1 THR A 71 3.824 -4.191 -34.460 1.00 0.00 O ATOM 1150 CG2 THR A 71 2.049 -4.147 -32.893 1.00 0.00 C ATOM 0 H THR A 71 5.476 -3.163 -33.892 1.00 0.00 H new ATOM 0 HA THR A 71 3.859 -3.088 -31.523 1.00 0.00 H new ATOM 0 HB THR A 71 3.651 -5.547 -32.900 1.00 0.00 H new ATOM 0 HG1 THR A 71 3.212 -4.674 -35.054 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.435 -4.703 -33.601 1.00 0.00 H new ATOM 0 HG22 THR A 71 1.762 -4.414 -31.876 1.00 0.00 H new ATOM 0 HG23 THR A 71 1.899 -3.078 -33.044 1.00 0.00 H new ATOM 1158 N PHE A 72 6.254 -5.329 -31.772 1.00 0.00 N ATOM 1159 CA PHE A 72 7.016 -6.294 -30.993 1.00 0.00 C ATOM 1160 C PHE A 72 7.399 -5.684 -29.647 1.00 0.00 C ATOM 1161 O PHE A 72 7.528 -6.394 -28.650 1.00 0.00 O ATOM 1162 CB PHE A 72 8.257 -6.778 -31.759 1.00 0.00 C ATOM 1163 CG PHE A 72 9.408 -7.151 -30.867 1.00 0.00 C ATOM 1164 CD1 PHE A 72 9.391 -8.341 -30.157 1.00 0.00 C ATOM 1165 CD2 PHE A 72 10.503 -6.313 -30.736 1.00 0.00 C ATOM 1166 CE1 PHE A 72 10.445 -8.689 -29.335 1.00 0.00 C ATOM 1167 CE2 PHE A 72 11.560 -6.655 -29.916 1.00 0.00 C ATOM 1168 CZ PHE A 72 11.531 -7.844 -29.214 1.00 0.00 C ATOM 0 H PHE A 72 6.618 -5.152 -32.708 1.00 0.00 H new ATOM 0 HA PHE A 72 6.390 -7.169 -30.815 1.00 0.00 H new ATOM 0 HB2 PHE A 72 7.985 -7.641 -32.367 1.00 0.00 H new ATOM 0 HB3 PHE A 72 8.579 -5.994 -32.445 1.00 0.00 H new ATOM 0 HD1 PHE A 72 8.543 -9.004 -30.248 1.00 0.00 H new ATOM 0 HD2 PHE A 72 10.530 -5.381 -31.282 1.00 0.00 H new ATOM 0 HE1 PHE A 72 10.420 -9.620 -28.788 1.00 0.00 H new ATOM 0 HE2 PHE A 72 12.409 -5.993 -29.824 1.00 0.00 H new ATOM 0 HZ PHE A 72 12.356 -8.113 -28.571 1.00 0.00 H new ATOM 1178 N LEU A 73 7.548 -4.360 -29.617 1.00 0.00 N ATOM 1179 CA LEU A 73 7.878 -3.670 -28.374 1.00 0.00 C ATOM 1180 C LEU A 73 6.607 -3.369 -27.604 1.00 0.00 C ATOM 1181 O LEU A 73 6.553 -3.510 -26.386 1.00 0.00 O ATOM 1182 CB LEU A 73 8.629 -2.363 -28.635 1.00 0.00 C ATOM 1183 CG LEU A 73 9.949 -2.497 -29.381 1.00 0.00 C ATOM 1184 CD1 LEU A 73 9.978 -1.532 -30.550 1.00 0.00 C ATOM 1185 CD2 LEU A 73 11.121 -2.234 -28.444 1.00 0.00 C ATOM 0 H LEU A 73 7.447 -3.751 -30.429 1.00 0.00 H new ATOM 0 HA LEU A 73 8.526 -4.326 -27.793 1.00 0.00 H new ATOM 0 HB2 LEU A 73 7.978 -1.699 -29.203 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.822 -1.879 -27.678 1.00 0.00 H new ATOM 0 HG LEU A 73 10.038 -3.515 -29.760 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.925 -1.632 -31.081 1.00 0.00 H new ATOM 0 HD12 LEU A 73 9.156 -1.758 -31.229 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.874 -0.511 -30.182 1.00 0.00 H new ATOM 0 HD21 LEU A 73 12.056 -2.334 -28.994 1.00 0.00 H new ATOM 0 HD22 LEU A 73 11.044 -1.225 -28.040 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.102 -2.955 -27.627 1.00 0.00 H new ATOM 1197 N ASP A 74 5.577 -2.970 -28.332 1.00 0.00 N ATOM 1198 CA ASP A 74 4.293 -2.667 -27.721 1.00 0.00 C ATOM 1199 C ASP A 74 3.729 -3.921 -27.069 1.00 0.00 C ATOM 1200 O ASP A 74 2.804 -3.855 -26.259 1.00 0.00 O ATOM 1201 CB ASP A 74 3.317 -2.114 -28.759 1.00 0.00 C ATOM 1202 CG ASP A 74 3.168 -0.609 -28.666 1.00 0.00 C ATOM 1203 OD1 ASP A 74 3.557 -0.037 -27.627 1.00 0.00 O ATOM 1204 OD2 ASP A 74 2.663 -0.002 -29.634 1.00 0.00 O ATOM 0 H ASP A 74 5.604 -2.849 -29.344 1.00 0.00 H new ATOM 0 HA ASP A 74 4.437 -1.903 -26.957 1.00 0.00 H new ATOM 0 HB2 ASP A 74 3.663 -2.381 -29.758 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.342 -2.582 -28.623 1.00 0.00 H new ATOM 1209 N SER A 75 4.311 -5.065 -27.425 1.00 0.00 N ATOM 1210 CA SER A 75 3.895 -6.350 -26.870 1.00 0.00 C ATOM 1211 C SER A 75 4.697 -6.671 -25.623 1.00 0.00 C ATOM 1212 O SER A 75 4.182 -7.258 -24.676 1.00 0.00 O ATOM 1213 CB SER A 75 4.115 -7.467 -27.884 1.00 0.00 C ATOM 1214 OG SER A 75 5.433 -7.980 -27.789 1.00 0.00 O ATOM 0 H SER A 75 5.075 -5.127 -28.098 1.00 0.00 H new ATOM 0 HA SER A 75 2.836 -6.279 -26.623 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.395 -8.267 -27.712 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.938 -7.090 -28.891 1.00 0.00 H new ATOM 0 HG SER A 75 6.068 -7.316 -28.129 1.00 0.00 H new ATOM 1220 N LEU A 76 5.969 -6.288 -25.661 1.00 0.00 N ATOM 1221 CA LEU A 76 6.908 -6.524 -24.573 1.00 0.00 C ATOM 1222 C LEU A 76 6.240 -6.738 -23.225 1.00 0.00 C ATOM 1223 O LEU A 76 6.238 -5.859 -22.388 1.00 0.00 O ATOM 1224 CB LEU A 76 7.874 -5.357 -24.498 1.00 0.00 C ATOM 1225 CG LEU A 76 9.054 -5.492 -25.435 1.00 0.00 C ATOM 1226 CD1 LEU A 76 9.820 -4.189 -25.534 1.00 0.00 C ATOM 1227 CD2 LEU A 76 9.932 -6.613 -24.946 1.00 0.00 C ATOM 0 H LEU A 76 6.380 -5.800 -26.457 1.00 0.00 H new ATOM 0 HA LEU A 76 7.434 -7.453 -24.796 1.00 0.00 H new ATOM 0 HB2 LEU A 76 7.339 -4.436 -24.730 1.00 0.00 H new ATOM 0 HB3 LEU A 76 8.240 -5.263 -23.476 1.00 0.00 H new ATOM 0 HG LEU A 76 8.701 -5.726 -26.439 1.00 0.00 H new ATOM 0 HD11 LEU A 76 10.663 -4.313 -26.214 1.00 0.00 H new ATOM 0 HD12 LEU A 76 9.161 -3.407 -25.912 1.00 0.00 H new ATOM 0 HD13 LEU A 76 10.188 -3.907 -24.547 1.00 0.00 H new ATOM 0 HD21 LEU A 76 10.788 -6.722 -25.612 1.00 0.00 H new ATOM 0 HD22 LEU A 76 10.283 -6.388 -23.939 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.362 -7.542 -24.932 1.00 0.00 H new ATOM 1239 N GLN A 77 5.695 -7.921 -23.013 1.00 0.00 N ATOM 1240 CA GLN A 77 5.037 -8.244 -21.749 1.00 0.00 C ATOM 1241 C GLN A 77 5.723 -7.580 -20.540 1.00 0.00 C ATOM 1242 O GLN A 77 5.080 -7.343 -19.517 1.00 0.00 O ATOM 1243 CB GLN A 77 5.004 -9.761 -21.551 1.00 0.00 C ATOM 1244 CG GLN A 77 6.369 -10.419 -21.661 1.00 0.00 C ATOM 1245 CD GLN A 77 6.611 -11.444 -20.572 1.00 0.00 C ATOM 1246 OE1 GLN A 77 7.606 -11.378 -19.850 1.00 0.00 O ATOM 1247 NE2 GLN A 77 5.698 -12.399 -20.448 1.00 0.00 N ATOM 0 H GLN A 77 5.692 -8.678 -23.696 1.00 0.00 H new ATOM 0 HA GLN A 77 4.022 -7.850 -21.806 1.00 0.00 H new ATOM 0 HB2 GLN A 77 4.581 -9.982 -20.571 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.337 -10.201 -22.292 1.00 0.00 H new ATOM 0 HG2 GLN A 77 6.459 -10.901 -22.635 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.143 -9.653 -21.612 1.00 0.00 H new ATOM 0 HE21 GLN A 77 4.889 -12.415 -21.069 1.00 0.00 H new ATOM 0 HE22 GLN A 77 5.805 -13.117 -19.732 1.00 0.00 H new ATOM 1256 N GLU A 78 7.028 -7.305 -20.644 1.00 0.00 N ATOM 1257 CA GLU A 78 7.777 -6.698 -19.532 1.00 0.00 C ATOM 1258 C GLU A 78 8.349 -5.324 -19.879 1.00 0.00 C ATOM 1259 O GLU A 78 9.198 -4.802 -19.157 1.00 0.00 O ATOM 1260 CB GLU A 78 8.918 -7.619 -19.125 1.00 0.00 C ATOM 1261 CG GLU A 78 9.231 -8.686 -20.160 1.00 0.00 C ATOM 1262 CD GLU A 78 10.443 -9.520 -19.795 1.00 0.00 C ATOM 1263 OE1 GLU A 78 11.381 -8.969 -19.183 1.00 0.00 O ATOM 1264 OE2 GLU A 78 10.453 -10.726 -20.124 1.00 0.00 O ATOM 0 H GLU A 78 7.586 -7.490 -21.478 1.00 0.00 H new ATOM 0 HA GLU A 78 7.072 -6.562 -18.712 1.00 0.00 H new ATOM 0 HB2 GLU A 78 9.812 -7.021 -18.949 1.00 0.00 H new ATOM 0 HB3 GLU A 78 8.666 -8.102 -18.181 1.00 0.00 H new ATOM 0 HG2 GLU A 78 8.366 -9.340 -20.274 1.00 0.00 H new ATOM 0 HG3 GLU A 78 9.400 -8.210 -21.126 1.00 0.00 H new ATOM 1271 N PHE A 79 7.894 -4.766 -20.990 1.00 0.00 N ATOM 1272 CA PHE A 79 8.357 -3.452 -21.479 1.00 0.00 C ATOM 1273 C PHE A 79 9.131 -2.633 -20.441 1.00 0.00 C ATOM 1274 O PHE A 79 10.282 -2.266 -20.676 1.00 0.00 O ATOM 1275 CB PHE A 79 7.197 -2.608 -21.985 1.00 0.00 C ATOM 1276 CG PHE A 79 5.960 -3.393 -22.257 1.00 0.00 C ATOM 1277 CD1 PHE A 79 5.221 -3.937 -21.222 1.00 0.00 C ATOM 1278 CD2 PHE A 79 5.560 -3.624 -23.556 1.00 0.00 C ATOM 1279 CE1 PHE A 79 4.105 -4.702 -21.483 1.00 0.00 C ATOM 1280 CE2 PHE A 79 4.444 -4.380 -23.827 1.00 0.00 C ATOM 1281 CZ PHE A 79 3.713 -4.925 -22.790 1.00 0.00 C ATOM 0 H PHE A 79 7.192 -5.202 -21.588 1.00 0.00 H new ATOM 0 HA PHE A 79 9.043 -3.692 -22.291 1.00 0.00 H new ATOM 0 HB2 PHE A 79 6.972 -1.836 -21.249 1.00 0.00 H new ATOM 0 HB3 PHE A 79 7.502 -2.098 -22.899 1.00 0.00 H new ATOM 0 HD1 PHE A 79 5.521 -3.761 -20.200 1.00 0.00 H new ATOM 0 HD2 PHE A 79 6.131 -3.206 -24.372 1.00 0.00 H new ATOM 0 HE1 PHE A 79 3.538 -5.127 -20.668 1.00 0.00 H new ATOM 0 HE2 PHE A 79 4.140 -4.547 -24.850 1.00 0.00 H new ATOM 0 HZ PHE A 79 2.838 -5.523 -22.999 1.00 0.00 H new ATOM 1291 N PRO A 80 8.506 -2.307 -19.292 1.00 0.00 N ATOM 1292 CA PRO A 80 9.129 -1.508 -18.242 1.00 0.00 C ATOM 1293 C PRO A 80 10.647 -1.639 -18.199 1.00 0.00 C ATOM 1294 O PRO A 80 11.350 -0.677 -17.889 1.00 0.00 O ATOM 1295 CB PRO A 80 8.480 -2.086 -16.994 1.00 0.00 C ATOM 1296 CG PRO A 80 7.080 -2.390 -17.425 1.00 0.00 C ATOM 1297 CD PRO A 80 7.129 -2.672 -18.914 1.00 0.00 C ATOM 0 HA PRO A 80 8.979 -0.437 -18.379 1.00 0.00 H new ATOM 0 HB2 PRO A 80 8.997 -2.983 -16.654 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.498 -1.375 -16.168 1.00 0.00 H new ATOM 0 HG2 PRO A 80 6.687 -3.249 -16.882 1.00 0.00 H new ATOM 0 HG3 PRO A 80 6.419 -1.549 -17.213 1.00 0.00 H new ATOM 0 HD2 PRO A 80 6.918 -3.719 -19.131 1.00 0.00 H new ATOM 0 HD3 PRO A 80 6.394 -2.080 -19.458 1.00 0.00 H new ATOM 1305 N TRP A 81 11.152 -2.822 -18.516 1.00 0.00 N ATOM 1306 CA TRP A 81 12.591 -3.050 -18.515 1.00 0.00 C ATOM 1307 C TRP A 81 13.067 -3.595 -19.857 1.00 0.00 C ATOM 1308 O TRP A 81 14.216 -3.383 -20.247 1.00 0.00 O ATOM 1309 CB TRP A 81 12.985 -4.017 -17.396 1.00 0.00 C ATOM 1310 CG TRP A 81 11.852 -4.382 -16.487 1.00 0.00 C ATOM 1311 CD1 TRP A 81 10.880 -5.310 -16.724 1.00 0.00 C ATOM 1312 CD2 TRP A 81 11.573 -3.827 -15.197 1.00 0.00 C ATOM 1313 NE1 TRP A 81 10.012 -5.366 -15.660 1.00 0.00 N ATOM 1314 CE2 TRP A 81 10.417 -4.465 -14.709 1.00 0.00 C ATOM 1315 CE3 TRP A 81 12.189 -2.853 -14.406 1.00 0.00 C ATOM 1316 CZ2 TRP A 81 9.865 -4.160 -13.468 1.00 0.00 C ATOM 1317 CZ3 TRP A 81 11.640 -2.551 -13.174 1.00 0.00 C ATOM 1318 CH2 TRP A 81 10.489 -3.203 -12.715 1.00 0.00 C ATOM 0 H TRP A 81 10.592 -3.634 -18.776 1.00 0.00 H new ATOM 0 HA TRP A 81 13.074 -2.088 -18.342 1.00 0.00 H new ATOM 0 HB2 TRP A 81 13.390 -4.926 -17.840 1.00 0.00 H new ATOM 0 HB3 TRP A 81 13.783 -3.568 -16.805 1.00 0.00 H new ATOM 0 HD1 TRP A 81 10.804 -5.912 -17.617 1.00 0.00 H new ATOM 0 HE1 TRP A 81 9.199 -5.978 -15.589 1.00 0.00 H new ATOM 0 HE3 TRP A 81 13.078 -2.346 -14.751 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 8.976 -4.661 -13.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 12.107 -1.799 -12.555 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.086 -2.945 -11.747 1.00 0.00 H new ATOM 1329 N VAL A 82 12.188 -4.295 -20.567 1.00 0.00 N ATOM 1330 CA VAL A 82 12.554 -4.859 -21.859 1.00 0.00 C ATOM 1331 C VAL A 82 12.422 -3.822 -22.963 1.00 0.00 C ATOM 1332 O VAL A 82 13.255 -3.760 -23.862 1.00 0.00 O ATOM 1333 CB VAL A 82 11.681 -6.073 -22.213 1.00 0.00 C ATOM 1334 CG1 VAL A 82 11.831 -7.170 -21.172 1.00 0.00 C ATOM 1335 CG2 VAL A 82 10.235 -5.646 -22.335 1.00 0.00 C ATOM 0 H VAL A 82 11.229 -4.483 -20.274 1.00 0.00 H new ATOM 0 HA VAL A 82 13.593 -5.179 -21.779 1.00 0.00 H new ATOM 0 HB VAL A 82 12.013 -6.475 -23.170 1.00 0.00 H new ATOM 0 HG11 VAL A 82 11.203 -8.019 -21.445 1.00 0.00 H new ATOM 0 HG12 VAL A 82 12.872 -7.489 -21.127 1.00 0.00 H new ATOM 0 HG13 VAL A 82 11.525 -6.791 -20.197 1.00 0.00 H new ATOM 0 HG21 VAL A 82 9.620 -6.510 -22.586 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.899 -5.225 -21.388 1.00 0.00 H new ATOM 0 HG23 VAL A 82 10.142 -4.895 -23.119 1.00 0.00 H new ATOM 1345 N ARG A 83 11.372 -3.009 -22.884 1.00 0.00 N ATOM 1346 CA ARG A 83 11.128 -1.970 -23.880 1.00 0.00 C ATOM 1347 C ARG A 83 12.240 -0.931 -23.857 1.00 0.00 C ATOM 1348 O ARG A 83 12.784 -0.571 -24.900 1.00 0.00 O ATOM 1349 CB ARG A 83 9.749 -1.325 -23.648 1.00 0.00 C ATOM 1350 CG ARG A 83 9.773 0.189 -23.471 1.00 0.00 C ATOM 1351 CD ARG A 83 8.404 0.801 -23.721 1.00 0.00 C ATOM 1352 NE ARG A 83 8.378 2.227 -23.410 1.00 0.00 N ATOM 1353 CZ ARG A 83 7.263 2.903 -23.150 1.00 0.00 C ATOM 1354 NH1 ARG A 83 6.090 2.285 -23.171 1.00 0.00 N ATOM 1355 NH2 ARG A 83 7.322 4.197 -22.869 1.00 0.00 N ATOM 0 H ARG A 83 10.676 -3.050 -22.140 1.00 0.00 H new ATOM 0 HA ARG A 83 11.125 -2.425 -24.870 1.00 0.00 H new ATOM 0 HB2 ARG A 83 9.103 -1.568 -24.492 1.00 0.00 H new ATOM 0 HB3 ARG A 83 9.298 -1.773 -22.763 1.00 0.00 H new ATOM 0 HG2 ARG A 83 10.103 0.433 -22.461 1.00 0.00 H new ATOM 0 HG3 ARG A 83 10.499 0.625 -24.158 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.125 0.652 -24.764 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.660 0.284 -23.115 1.00 0.00 H new ATOM 0 HE ARG A 83 9.264 2.733 -23.391 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.042 1.289 -23.387 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.236 2.805 -22.971 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.223 4.675 -22.852 1.00 0.00 H new ATOM 0 HH22 ARG A 83 6.466 4.715 -22.670 1.00 0.00 H new ATOM 1369 N GLU A 84 12.590 -0.465 -22.666 1.00 0.00 N ATOM 1370 CA GLU A 84 13.651 0.512 -22.530 1.00 0.00 C ATOM 1371 C GLU A 84 14.931 -0.042 -23.126 1.00 0.00 C ATOM 1372 O GLU A 84 15.446 0.480 -24.112 1.00 0.00 O ATOM 1373 CB GLU A 84 13.859 0.856 -21.058 1.00 0.00 C ATOM 1374 CG GLU A 84 12.583 1.261 -20.344 1.00 0.00 C ATOM 1375 CD GLU A 84 12.545 2.740 -20.012 1.00 0.00 C ATOM 1376 OE1 GLU A 84 12.239 3.544 -20.918 1.00 0.00 O ATOM 1377 OE2 GLU A 84 12.821 3.095 -18.847 1.00 0.00 O ATOM 0 H GLU A 84 12.155 -0.748 -21.788 1.00 0.00 H new ATOM 0 HA GLU A 84 13.374 1.421 -23.064 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.292 -0.005 -20.550 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.582 1.668 -20.982 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.726 1.011 -20.969 1.00 0.00 H new ATOM 0 HG3 GLU A 84 12.486 0.683 -19.425 1.00 0.00 H new ATOM 1384 N LYS A 85 15.428 -1.115 -22.527 1.00 0.00 N ATOM 1385 CA LYS A 85 16.644 -1.754 -23.005 1.00 0.00 C ATOM 1386 C LYS A 85 16.547 -2.058 -24.498 1.00 0.00 C ATOM 1387 O LYS A 85 17.562 -2.254 -25.166 1.00 0.00 O ATOM 1388 CB LYS A 85 16.907 -3.041 -22.222 1.00 0.00 C ATOM 1389 CG LYS A 85 16.983 -2.827 -20.720 1.00 0.00 C ATOM 1390 CD LYS A 85 18.106 -1.875 -20.351 1.00 0.00 C ATOM 1391 CE LYS A 85 17.614 -0.753 -19.450 1.00 0.00 C ATOM 1392 NZ LYS A 85 18.735 0.087 -18.947 1.00 0.00 N ATOM 0 H LYS A 85 15.008 -1.560 -21.711 1.00 0.00 H new ATOM 0 HA LYS A 85 17.475 -1.067 -22.848 1.00 0.00 H new ATOM 0 HB2 LYS A 85 16.116 -3.758 -22.440 1.00 0.00 H new ATOM 0 HB3 LYS A 85 17.842 -3.483 -22.567 1.00 0.00 H new ATOM 0 HG2 LYS A 85 16.034 -2.430 -20.359 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.137 -3.784 -20.222 1.00 0.00 H new ATOM 0 HD2 LYS A 85 18.900 -2.426 -19.847 1.00 0.00 H new ATOM 0 HD3 LYS A 85 18.538 -1.452 -21.258 1.00 0.00 H new ATOM 0 HE2 LYS A 85 16.910 -0.128 -20.000 1.00 0.00 H new ATOM 0 HE3 LYS A 85 17.071 -1.177 -18.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 18.358 0.840 -18.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 19.394 -0.504 -18.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 19.238 0.513 -19.752 1.00 0.00 H new ATOM 1406 N LEU A 86 15.322 -2.094 -25.022 1.00 0.00 N ATOM 1407 CA LEU A 86 15.112 -2.374 -26.436 1.00 0.00 C ATOM 1408 C LEU A 86 15.275 -1.133 -27.285 1.00 0.00 C ATOM 1409 O LEU A 86 16.168 -1.057 -28.126 1.00 0.00 O ATOM 1410 CB LEU A 86 13.728 -2.957 -26.681 1.00 0.00 C ATOM 1411 CG LEU A 86 13.758 -4.325 -27.332 1.00 0.00 C ATOM 1412 CD1 LEU A 86 12.359 -4.780 -27.717 1.00 0.00 C ATOM 1413 CD2 LEU A 86 14.677 -4.282 -28.543 1.00 0.00 C ATOM 0 H LEU A 86 14.467 -1.933 -24.490 1.00 0.00 H new ATOM 0 HA LEU A 86 15.872 -3.101 -26.723 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.198 -3.026 -25.731 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.161 -2.274 -27.314 1.00 0.00 H new ATOM 0 HG LEU A 86 14.144 -5.053 -26.618 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.412 -5.765 -28.182 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.735 -4.833 -26.825 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.926 -4.069 -28.421 1.00 0.00 H new ATOM 0 HD21 LEU A 86 14.702 -5.264 -29.015 1.00 0.00 H new ATOM 0 HD22 LEU A 86 14.305 -3.546 -29.256 1.00 0.00 H new ATOM 0 HD23 LEU A 86 15.683 -4.005 -28.227 1.00 0.00 H new ATOM 1425 N LYS A 87 14.409 -0.162 -27.063 1.00 0.00 N ATOM 1426 CA LYS A 87 14.465 1.073 -27.814 1.00 0.00 C ATOM 1427 C LYS A 87 15.831 1.699 -27.637 1.00 0.00 C ATOM 1428 O LYS A 87 16.281 2.490 -28.468 1.00 0.00 O ATOM 1429 CB LYS A 87 13.353 2.022 -27.369 1.00 0.00 C ATOM 1430 CG LYS A 87 11.959 1.528 -27.718 1.00 0.00 C ATOM 1431 CD LYS A 87 11.781 1.380 -29.220 1.00 0.00 C ATOM 1432 CE LYS A 87 10.406 1.849 -29.665 1.00 0.00 C ATOM 1433 NZ LYS A 87 10.064 3.184 -29.101 1.00 0.00 N ATOM 0 H LYS A 87 13.661 -0.206 -26.370 1.00 0.00 H new ATOM 0 HA LYS A 87 14.309 0.866 -28.873 1.00 0.00 H new ATOM 0 HB2 LYS A 87 13.419 2.166 -26.291 1.00 0.00 H new ATOM 0 HB3 LYS A 87 13.511 2.996 -27.831 1.00 0.00 H new ATOM 0 HG2 LYS A 87 11.780 0.568 -27.233 1.00 0.00 H new ATOM 0 HG3 LYS A 87 11.217 2.225 -27.329 1.00 0.00 H new ATOM 0 HD2 LYS A 87 12.548 1.956 -29.737 1.00 0.00 H new ATOM 0 HD3 LYS A 87 11.920 0.337 -29.503 1.00 0.00 H new ATOM 0 HE2 LYS A 87 10.373 1.896 -30.754 1.00 0.00 H new ATOM 0 HE3 LYS A 87 9.656 1.121 -29.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.435 3.688 -29.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.583 3.062 -28.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.935 3.736 -28.963 1.00 0.00 H new ATOM 1447 N LYS A 88 16.515 1.293 -26.574 1.00 0.00 N ATOM 1448 CA LYS A 88 17.846 1.767 -26.325 1.00 0.00 C ATOM 1449 C LYS A 88 18.800 0.926 -27.164 1.00 0.00 C ATOM 1450 O LYS A 88 19.860 1.388 -27.588 1.00 0.00 O ATOM 1451 CB LYS A 88 18.168 1.702 -24.819 1.00 0.00 C ATOM 1452 CG LYS A 88 19.331 0.796 -24.447 1.00 0.00 C ATOM 1453 CD LYS A 88 20.605 1.236 -25.131 1.00 0.00 C ATOM 1454 CE LYS A 88 21.775 1.301 -24.160 1.00 0.00 C ATOM 1455 NZ LYS A 88 23.030 0.769 -24.761 1.00 0.00 N ATOM 0 H LYS A 88 16.159 0.637 -25.879 1.00 0.00 H new ATOM 0 HA LYS A 88 17.951 2.814 -26.611 1.00 0.00 H new ATOM 0 HB2 LYS A 88 18.385 2.710 -24.466 1.00 0.00 H new ATOM 0 HB3 LYS A 88 17.279 1.363 -24.287 1.00 0.00 H new ATOM 0 HG2 LYS A 88 19.473 0.806 -23.366 1.00 0.00 H new ATOM 0 HG3 LYS A 88 19.100 -0.231 -24.728 1.00 0.00 H new ATOM 0 HD2 LYS A 88 20.841 0.544 -25.939 1.00 0.00 H new ATOM 0 HD3 LYS A 88 20.454 2.216 -25.585 1.00 0.00 H new ATOM 0 HE2 LYS A 88 21.931 2.334 -23.850 1.00 0.00 H new ATOM 0 HE3 LYS A 88 21.533 0.732 -23.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 23.733 0.609 -24.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 22.830 -0.130 -25.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 23.405 1.455 -25.447 1.00 0.00 H new ATOM 1469 N ALA A 89 18.381 -0.312 -27.417 1.00 0.00 N ATOM 1470 CA ALA A 89 19.147 -1.242 -28.224 1.00 0.00 C ATOM 1471 C ALA A 89 18.742 -1.127 -29.689 1.00 0.00 C ATOM 1472 O ALA A 89 19.417 -1.654 -30.573 1.00 0.00 O ATOM 1473 CB ALA A 89 18.942 -2.664 -27.726 1.00 0.00 C ATOM 0 H ALA A 89 17.502 -0.692 -27.066 1.00 0.00 H new ATOM 0 HA ALA A 89 20.205 -0.993 -28.136 1.00 0.00 H new ATOM 0 HB1 ALA A 89 19.523 -3.352 -28.341 1.00 0.00 H new ATOM 0 HB2 ALA A 89 19.271 -2.737 -26.689 1.00 0.00 H new ATOM 0 HB3 ALA A 89 17.885 -2.923 -27.791 1.00 0.00 H new ATOM 1479 N ARG A 90 17.645 -0.412 -29.944 1.00 0.00 N ATOM 1480 CA ARG A 90 17.171 -0.208 -31.297 1.00 0.00 C ATOM 1481 C ARG A 90 17.982 0.913 -31.898 1.00 0.00 C ATOM 1482 O ARG A 90 18.282 0.935 -33.091 1.00 0.00 O ATOM 1483 CB ARG A 90 15.671 0.119 -31.301 1.00 0.00 C ATOM 1484 CG ARG A 90 15.276 1.252 -32.238 1.00 0.00 C ATOM 1485 CD ARG A 90 13.831 1.123 -32.690 1.00 0.00 C ATOM 1486 NE ARG A 90 13.135 2.405 -32.662 1.00 0.00 N ATOM 1487 CZ ARG A 90 11.822 2.533 -32.809 1.00 0.00 C ATOM 1488 NH1 ARG A 90 11.066 1.458 -32.989 1.00 0.00 N ATOM 1489 NH2 ARG A 90 11.263 3.735 -32.775 1.00 0.00 N ATOM 0 H ARG A 90 17.074 0.032 -29.225 1.00 0.00 H new ATOM 0 HA ARG A 90 17.296 -1.114 -31.890 1.00 0.00 H new ATOM 0 HB2 ARG A 90 15.117 -0.777 -31.581 1.00 0.00 H new ATOM 0 HB3 ARG A 90 15.366 0.379 -30.287 1.00 0.00 H new ATOM 0 HG2 ARG A 90 15.417 2.208 -31.734 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.932 1.251 -33.108 1.00 0.00 H new ATOM 0 HD2 ARG A 90 13.802 0.716 -33.701 1.00 0.00 H new ATOM 0 HD3 ARG A 90 13.311 0.414 -32.046 1.00 0.00 H new ATOM 0 HE ARG A 90 13.688 3.250 -32.522 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.494 0.532 -33.014 1.00 0.00 H new ATOM 0 HH12 ARG A 90 10.057 1.557 -33.102 1.00 0.00 H new ATOM 0 HH21 ARG A 90 11.842 4.563 -32.636 1.00 0.00 H new ATOM 0 HH22 ARG A 90 10.254 3.832 -32.888 1.00 0.00 H new ATOM 1503 N GLU A 91 18.350 1.828 -31.022 1.00 0.00 N ATOM 1504 CA GLU A 91 19.156 2.970 -31.379 1.00 0.00 C ATOM 1505 C GLU A 91 20.618 2.553 -31.518 1.00 0.00 C ATOM 1506 O GLU A 91 21.353 3.082 -32.352 1.00 0.00 O ATOM 1507 CB GLU A 91 19.007 4.027 -30.291 1.00 0.00 C ATOM 1508 CG GLU A 91 17.780 4.905 -30.462 1.00 0.00 C ATOM 1509 CD GLU A 91 18.049 6.359 -30.122 1.00 0.00 C ATOM 1510 OE1 GLU A 91 19.221 6.699 -29.857 1.00 0.00 O ATOM 1511 OE2 GLU A 91 17.088 7.156 -30.121 1.00 0.00 O ATOM 0 H GLU A 91 18.094 1.796 -30.035 1.00 0.00 H new ATOM 0 HA GLU A 91 18.825 3.378 -32.334 1.00 0.00 H new ATOM 0 HB2 GLU A 91 18.958 3.533 -29.320 1.00 0.00 H new ATOM 0 HB3 GLU A 91 19.896 4.657 -30.284 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.429 4.836 -31.492 1.00 0.00 H new ATOM 0 HG3 GLU A 91 16.978 4.530 -29.826 1.00 0.00 H new ATOM 1518 N GLU A 92 21.030 1.599 -30.683 1.00 0.00 N ATOM 1519 CA GLU A 92 22.403 1.101 -30.693 1.00 0.00 C ATOM 1520 C GLU A 92 22.571 -0.103 -31.622 1.00 0.00 C ATOM 1521 O GLU A 92 23.411 -0.089 -32.520 1.00 0.00 O ATOM 1522 CB GLU A 92 22.836 0.723 -29.275 1.00 0.00 C ATOM 1523 CG GLU A 92 23.811 1.709 -28.652 1.00 0.00 C ATOM 1524 CD GLU A 92 25.255 1.390 -28.983 1.00 0.00 C ATOM 1525 OE1 GLU A 92 25.646 1.558 -30.157 1.00 0.00 O ATOM 1526 OE2 GLU A 92 25.996 0.970 -28.068 1.00 0.00 O ATOM 0 H GLU A 92 20.429 1.155 -29.989 1.00 0.00 H new ATOM 0 HA GLU A 92 23.037 1.903 -31.071 1.00 0.00 H new ATOM 0 HB2 GLU A 92 21.952 0.650 -28.642 1.00 0.00 H new ATOM 0 HB3 GLU A 92 23.296 -0.265 -29.296 1.00 0.00 H new ATOM 0 HG2 GLU A 92 23.576 2.715 -29.000 1.00 0.00 H new ATOM 0 HG3 GLU A 92 23.681 1.708 -27.570 1.00 0.00 H new ATOM 1533 N ALA A 93 21.781 -1.153 -31.390 1.00 0.00 N ATOM 1534 CA ALA A 93 21.868 -2.368 -32.200 1.00 0.00 C ATOM 1535 C ALA A 93 21.613 -2.083 -33.678 1.00 0.00 C ATOM 1536 O ALA A 93 21.873 -2.929 -34.534 1.00 0.00 O ATOM 1537 CB ALA A 93 20.900 -3.428 -31.685 1.00 0.00 C ATOM 0 H ALA A 93 21.078 -1.186 -30.652 1.00 0.00 H new ATOM 0 HA ALA A 93 22.885 -2.749 -32.109 1.00 0.00 H new ATOM 0 HB1 ALA A 93 20.980 -4.324 -32.301 1.00 0.00 H new ATOM 0 HB2 ALA A 93 21.146 -3.675 -30.652 1.00 0.00 H new ATOM 0 HB3 ALA A 93 19.881 -3.044 -31.733 1.00 0.00 H new ATOM 1543 N MET A 94 21.107 -0.891 -33.976 1.00 0.00 N ATOM 1544 CA MET A 94 20.827 -0.508 -35.355 1.00 0.00 C ATOM 1545 C MET A 94 22.063 -0.689 -36.231 1.00 0.00 C ATOM 1546 O MET A 94 23.115 -1.117 -35.757 1.00 0.00 O ATOM 1547 CB MET A 94 20.354 0.946 -35.418 1.00 0.00 C ATOM 1548 CG MET A 94 21.395 1.947 -34.944 1.00 0.00 C ATOM 1549 SD MET A 94 22.448 2.540 -36.284 1.00 0.00 S ATOM 1550 CE MET A 94 21.534 3.986 -36.817 1.00 0.00 C ATOM 0 H MET A 94 20.883 -0.176 -33.284 1.00 0.00 H new ATOM 0 HA MET A 94 20.036 -1.157 -35.732 1.00 0.00 H new ATOM 0 HB2 MET A 94 20.075 1.184 -36.444 1.00 0.00 H new ATOM 0 HB3 MET A 94 19.456 1.054 -34.810 1.00 0.00 H new ATOM 0 HG2 MET A 94 20.893 2.795 -34.479 1.00 0.00 H new ATOM 0 HG3 MET A 94 22.016 1.484 -34.177 1.00 0.00 H new ATOM 0 HE1 MET A 94 22.059 4.464 -37.644 1.00 0.00 H new ATOM 0 HE2 MET A 94 20.538 3.687 -37.145 1.00 0.00 H new ATOM 0 HE3 MET A 94 21.447 4.688 -35.988 1.00 0.00 H new ATOM 1560 N THR A 95 21.928 -0.357 -37.511 1.00 0.00 N ATOM 1561 CA THR A 95 23.033 -0.479 -38.454 1.00 0.00 C ATOM 1562 C THR A 95 22.816 0.428 -39.661 1.00 0.00 C ATOM 1563 O THR A 95 22.436 -0.035 -40.736 1.00 0.00 O ATOM 1564 CB THR A 95 23.185 -1.930 -38.914 1.00 0.00 C ATOM 1565 OG1 THR A 95 22.934 -2.825 -37.845 1.00 0.00 O ATOM 1566 CG2 THR A 95 24.561 -2.241 -39.462 1.00 0.00 C ATOM 0 H THR A 95 21.063 -0.001 -37.919 1.00 0.00 H new ATOM 0 HA THR A 95 23.947 -0.171 -37.946 1.00 0.00 H new ATOM 0 HB THR A 95 22.455 -2.058 -39.714 1.00 0.00 H new ATOM 0 HG1 THR A 95 22.880 -3.740 -38.191 1.00 0.00 H new ATOM 0 HG21 THR A 95 24.602 -3.286 -39.770 1.00 0.00 H new ATOM 0 HG22 THR A 95 24.764 -1.601 -40.321 1.00 0.00 H new ATOM 0 HG23 THR A 95 25.309 -2.061 -38.690 1.00 0.00 H new ATOM 1574 N ASP A 96 23.060 1.722 -39.476 1.00 0.00 N ATOM 1575 CA ASP A 96 22.890 2.692 -40.551 1.00 0.00 C ATOM 1576 C ASP A 96 21.684 2.339 -41.416 1.00 0.00 C ATOM 1577 O ASP A 96 20.790 1.612 -40.984 1.00 0.00 O ATOM 1578 CB ASP A 96 24.153 2.751 -41.412 1.00 0.00 C ATOM 1579 CG ASP A 96 24.373 1.475 -42.201 1.00 0.00 C ATOM 1580 OD1 ASP A 96 23.424 1.023 -42.876 1.00 0.00 O ATOM 1581 OD2 ASP A 96 25.494 0.928 -42.144 1.00 0.00 O ATOM 0 H ASP A 96 23.376 2.122 -38.592 1.00 0.00 H new ATOM 0 HA ASP A 96 22.717 3.671 -40.103 1.00 0.00 H new ATOM 0 HB2 ASP A 96 24.082 3.593 -42.100 1.00 0.00 H new ATOM 0 HB3 ASP A 96 25.017 2.934 -40.773 1.00 0.00 H new ATOM 1586 N LEU A 97 21.666 2.859 -42.640 1.00 0.00 N ATOM 1587 CA LEU A 97 20.570 2.596 -43.564 1.00 0.00 C ATOM 1588 C LEU A 97 21.084 2.478 -44.995 1.00 0.00 C ATOM 1589 O LEU A 97 21.269 3.481 -45.685 1.00 0.00 O ATOM 1590 CB LEU A 97 19.520 3.704 -43.478 1.00 0.00 C ATOM 1591 CG LEU A 97 18.687 3.707 -42.196 1.00 0.00 C ATOM 1592 CD1 LEU A 97 19.090 4.868 -41.300 1.00 0.00 C ATOM 1593 CD2 LEU A 97 17.204 3.774 -42.527 1.00 0.00 C ATOM 0 H LEU A 97 22.397 3.464 -43.014 1.00 0.00 H new ATOM 0 HA LEU A 97 20.110 1.649 -43.280 1.00 0.00 H new ATOM 0 HB2 LEU A 97 20.022 4.667 -43.570 1.00 0.00 H new ATOM 0 HB3 LEU A 97 18.847 3.613 -44.331 1.00 0.00 H new ATOM 0 HG LEU A 97 18.877 2.779 -41.658 1.00 0.00 H new ATOM 0 HD11 LEU A 97 18.486 4.854 -40.392 1.00 0.00 H new ATOM 0 HD12 LEU A 97 20.144 4.776 -41.037 1.00 0.00 H new ATOM 0 HD13 LEU A 97 18.929 5.808 -41.828 1.00 0.00 H new ATOM 0 HD21 LEU A 97 16.625 3.775 -41.604 1.00 0.00 H new ATOM 0 HD22 LEU A 97 16.997 4.686 -43.087 1.00 0.00 H new ATOM 0 HD23 LEU A 97 16.926 2.909 -43.128 1.00 0.00 H new ATOM 1605 N PRO A 98 21.318 1.243 -45.458 1.00 0.00 N ATOM 1606 CA PRO A 98 21.811 0.985 -46.813 1.00 0.00 C ATOM 1607 C PRO A 98 20.759 1.290 -47.873 1.00 0.00 C ATOM 1608 O PRO A 98 20.402 0.428 -48.675 1.00 0.00 O ATOM 1609 CB PRO A 98 22.136 -0.509 -46.795 1.00 0.00 C ATOM 1610 CG PRO A 98 21.250 -1.074 -45.739 1.00 0.00 C ATOM 1611 CD PRO A 98 21.117 0.000 -44.694 1.00 0.00 C ATOM 0 HA PRO A 98 22.664 1.615 -47.066 1.00 0.00 H new ATOM 0 HB2 PRO A 98 21.941 -0.969 -47.764 1.00 0.00 H new ATOM 0 HB3 PRO A 98 23.187 -0.683 -46.565 1.00 0.00 H new ATOM 0 HG2 PRO A 98 20.276 -1.343 -46.149 1.00 0.00 H new ATOM 0 HG3 PRO A 98 21.679 -1.982 -45.314 1.00 0.00 H new ATOM 0 HD2 PRO A 98 20.138 -0.024 -44.215 1.00 0.00 H new ATOM 0 HD3 PRO A 98 21.861 -0.112 -43.905 1.00 0.00 H new ATOM 1619 N ALA A 99 20.266 2.524 -47.869 1.00 0.00 N ATOM 1620 CA ALA A 99 19.253 2.944 -48.827 1.00 0.00 C ATOM 1621 C ALA A 99 19.050 4.455 -48.785 1.00 0.00 C ATOM 1622 O ALA A 99 17.953 4.936 -48.502 1.00 0.00 O ATOM 1623 CB ALA A 99 17.939 2.226 -48.555 1.00 0.00 C ATOM 0 H ALA A 99 20.552 3.250 -47.212 1.00 0.00 H new ATOM 0 HA ALA A 99 19.600 2.678 -49.825 1.00 0.00 H new ATOM 0 HB1 ALA A 99 17.191 2.550 -49.279 1.00 0.00 H new ATOM 0 HB2 ALA A 99 18.087 1.150 -48.643 1.00 0.00 H new ATOM 0 HB3 ALA A 99 17.596 2.464 -47.548 1.00 0.00 H new ATOM 1629 N GLY A 100 20.115 5.198 -49.068 1.00 0.00 N ATOM 1630 CA GLY A 100 20.032 6.646 -49.056 1.00 0.00 C ATOM 1631 C GLY A 100 20.920 7.287 -50.104 1.00 0.00 C ATOM 1632 O GLY A 100 20.378 7.919 -51.035 1.00 0.00 O ATOM 1633 OXT GLY A 100 22.157 7.159 -49.994 1.00 0.00 O ATOM 0 H GLY A 100 21.033 4.823 -49.305 1.00 0.00 H new ATOM 0 HA2 GLY A 100 18.999 6.949 -49.225 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.315 7.015 -48.070 1.00 0.00 H new TER 1637 GLY A 100