USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 680 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 39 MET CE :methyl -143:sc= -2.01 (180deg=-4.34!) USER MOD Set 1.2: A 78 CYS SG : rot 100:sc= -0.0295 USER MOD Set 2.1: A 48 THR OG1 : rot -40:sc= 0.896 USER MOD Set 2.2: A 52 THR OG1 : rot 70:sc= 1.98 USER MOD Set 3.1: A 45 GLN : amide:sc= 1.15 K(o=1.9,f=0.62) USER MOD Set 3.2: A 47 TYR OH : rot 53:sc= 0.751 USER MOD Set 4.1: A 13 LYS NZ :NH3+ -167:sc= 2.49 (180deg=1.02) USER MOD Set 4.2: A 79 SER OG : rot -43:sc= 1.95 USER MOD Single : A 1 ALA N :NH3+ -110:sc= 0.00935 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot -79:sc= -8.4! USER MOD Single : A 17 MET CE :methyl 167:sc= -0.903 (180deg=-1.04) USER MOD Single : A 18 LYS NZ :NH3+ 130:sc= 1.24 (180deg=-0.0799!) USER MOD Single : A 26 ASN :FLIP amide:sc= -0.232 F(o=-1.8!,f=-0.23) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.385 F(o=-3.6!,f=-0.38) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot -38:sc= 0.265 USER MOD Single : A 37 MET CE :methyl -106:sc= -1.4 (180deg=-5.27!) USER MOD Single : A 41 THR OG1 : rot 70:sc= 0.156 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -41:sc= 1.22 USER MOD Single : A 49 LYS NZ :NH3+ -120:sc= 0.854 (180deg=-0.198) USER MOD Single : A 56 MET CE :methyl -155:sc= 0 (180deg=-0.436) USER MOD Single : A 57 LYS NZ :NH3+ -163:sc= 1.28 (180deg=0.447) USER MOD Single : A 63 LYS NZ :NH3+ -137:sc= 1.28 (180deg=0.16) USER MOD Single : A 66 LYS NZ :NH3+ -151:sc= 1.15 (180deg=1.06) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -3.35 K(o=-3.4,f=-6.8!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0.399 K(o=0.4,f=-0.65) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 30.748 -27.609 -2.611 1.00 0.00 N ATOM 2 CA ALA A 1 30.617 -28.833 -3.421 1.00 0.00 C ATOM 3 C ALA A 1 31.977 -29.412 -3.821 1.00 0.00 C ATOM 4 O ALA A 1 32.949 -28.682 -4.023 1.00 0.00 O ATOM 5 CB ALA A 1 29.748 -28.614 -4.660 1.00 0.00 C ATOM 0 H1 ALA A 1 30.454 -27.807 -1.633 1.00 0.00 H new ATOM 0 H2 ALA A 1 31.739 -27.293 -2.618 1.00 0.00 H new ATOM 0 H3 ALA A 1 30.144 -26.862 -3.010 1.00 0.00 H new ATOM 0 HA ALA A 1 30.117 -29.562 -2.783 1.00 0.00 H new ATOM 0 HB1 ALA A 1 29.680 -29.543 -5.226 1.00 0.00 H new ATOM 0 HB2 ALA A 1 28.750 -28.302 -4.354 1.00 0.00 H new ATOM 0 HB3 ALA A 1 30.194 -27.840 -5.285 1.00 0.00 H new ATOM 13 N ALA A 2 32.055 -30.736 -3.924 1.00 0.00 N ATOM 14 CA ALA A 2 33.331 -31.349 -4.319 1.00 0.00 C ATOM 15 C ALA A 2 33.288 -31.875 -5.766 1.00 0.00 C ATOM 16 O ALA A 2 32.440 -32.701 -6.107 1.00 0.00 O ATOM 17 CB ALA A 2 33.754 -32.467 -3.366 1.00 0.00 C ATOM 0 H ALA A 2 31.289 -31.386 -3.749 1.00 0.00 H new ATOM 0 HA ALA A 2 34.078 -30.558 -4.262 1.00 0.00 H new ATOM 0 HB1 ALA A 2 34.702 -32.889 -3.699 1.00 0.00 H new ATOM 0 HB2 ALA A 2 33.870 -32.063 -2.360 1.00 0.00 H new ATOM 0 HB3 ALA A 2 32.992 -33.247 -3.359 1.00 0.00 H new ATOM 23 N PRO A 3 34.224 -31.446 -6.626 1.00 0.00 N ATOM 24 CA PRO A 3 34.165 -31.898 -8.022 1.00 0.00 C ATOM 25 C PRO A 3 34.889 -33.238 -8.208 1.00 0.00 C ATOM 26 O PRO A 3 36.069 -33.299 -8.559 1.00 0.00 O ATOM 27 CB PRO A 3 34.816 -30.774 -8.839 1.00 0.00 C ATOM 28 CG PRO A 3 35.205 -29.657 -7.867 1.00 0.00 C ATOM 29 CD PRO A 3 34.779 -30.100 -6.471 1.00 0.00 C ATOM 0 HA PRO A 3 33.141 -32.081 -8.347 1.00 0.00 H new ATOM 0 HB2 PRO A 3 35.695 -31.145 -9.367 1.00 0.00 H new ATOM 0 HB3 PRO A 3 34.124 -30.400 -9.594 1.00 0.00 H new ATOM 0 HG2 PRO A 3 36.279 -29.475 -7.901 1.00 0.00 H new ATOM 0 HG3 PRO A 3 34.715 -28.723 -8.140 1.00 0.00 H new ATOM 0 HD2 PRO A 3 35.628 -30.104 -5.787 1.00 0.00 H new ATOM 0 HD3 PRO A 3 34.038 -29.418 -6.055 1.00 0.00 H new ATOM 37 N LYS A 4 34.158 -34.328 -8.003 1.00 0.00 N ATOM 38 CA LYS A 4 34.770 -35.651 -8.201 1.00 0.00 C ATOM 39 C LYS A 4 34.209 -36.341 -9.448 1.00 0.00 C ATOM 40 O LYS A 4 34.902 -36.507 -10.452 1.00 0.00 O ATOM 41 CB LYS A 4 34.660 -36.557 -6.963 1.00 0.00 C ATOM 42 CG LYS A 4 35.392 -35.969 -5.747 1.00 0.00 C ATOM 43 CD LYS A 4 36.910 -36.170 -5.851 1.00 0.00 C ATOM 44 CE LYS A 4 37.639 -35.561 -4.648 1.00 0.00 C ATOM 45 NZ LYS A 4 37.527 -36.446 -3.472 1.00 0.00 N ATOM 0 H LYS A 4 33.180 -34.334 -7.712 1.00 0.00 H new ATOM 0 HA LYS A 4 35.834 -35.476 -8.357 1.00 0.00 H new ATOM 0 HB2 LYS A 4 33.609 -36.705 -6.716 1.00 0.00 H new ATOM 0 HB3 LYS A 4 35.074 -37.538 -7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 4 35.170 -34.905 -5.667 1.00 0.00 H new ATOM 0 HG3 LYS A 4 35.023 -36.441 -4.836 1.00 0.00 H new ATOM 0 HD2 LYS A 4 37.134 -37.235 -5.913 1.00 0.00 H new ATOM 0 HD3 LYS A 4 37.277 -35.713 -6.770 1.00 0.00 H new ATOM 0 HE2 LYS A 4 38.689 -35.404 -4.893 1.00 0.00 H new ATOM 0 HE3 LYS A 4 37.216 -34.583 -4.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 38.026 -36.018 -2.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 36.524 -36.575 -3.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 37.951 -37.370 -3.691 1.00 0.00 H new ATOM 59 N ALA A 5 32.940 -36.735 -9.393 1.00 0.00 N ATOM 60 CA ALA A 5 32.338 -37.376 -10.567 1.00 0.00 C ATOM 61 C ALA A 5 31.407 -36.421 -11.325 1.00 0.00 C ATOM 62 O ALA A 5 30.684 -35.620 -10.732 1.00 0.00 O ATOM 63 CB ALA A 5 31.601 -38.665 -10.199 1.00 0.00 C ATOM 0 H ALA A 5 32.326 -36.630 -8.585 1.00 0.00 H new ATOM 0 HA ALA A 5 33.161 -37.639 -11.231 1.00 0.00 H new ATOM 0 HB1 ALA A 5 31.170 -39.107 -11.097 1.00 0.00 H new ATOM 0 HB2 ALA A 5 32.301 -39.368 -9.748 1.00 0.00 H new ATOM 0 HB3 ALA A 5 30.806 -38.439 -9.489 1.00 0.00 H new ATOM 69 N ARG A 6 31.434 -36.495 -12.652 1.00 0.00 N ATOM 70 CA ARG A 6 30.579 -35.590 -13.438 1.00 0.00 C ATOM 71 C ARG A 6 30.230 -36.184 -14.809 1.00 0.00 C ATOM 72 O ARG A 6 31.087 -36.714 -15.516 1.00 0.00 O ATOM 73 CB ARG A 6 31.155 -34.167 -13.572 1.00 0.00 C ATOM 74 CG ARG A 6 32.599 -34.163 -14.099 1.00 0.00 C ATOM 75 CD ARG A 6 33.292 -32.832 -13.785 1.00 0.00 C ATOM 76 NE ARG A 6 34.753 -33.007 -13.812 1.00 0.00 N ATOM 77 CZ ARG A 6 35.431 -33.063 -12.671 1.00 0.00 C ATOM 78 NH1 ARG A 6 34.871 -33.536 -11.575 1.00 0.00 N ATOM 79 NH2 ARG A 6 36.685 -32.668 -12.642 1.00 0.00 N ATOM 0 H ARG A 6 32.009 -37.140 -13.194 1.00 0.00 H new ATOM 0 HA ARG A 6 29.654 -35.490 -12.870 1.00 0.00 H new ATOM 0 HB2 ARG A 6 30.525 -33.585 -14.245 1.00 0.00 H new ATOM 0 HB3 ARG A 6 31.125 -33.673 -12.601 1.00 0.00 H new ATOM 0 HG2 ARG A 6 33.157 -34.984 -13.648 1.00 0.00 H new ATOM 0 HG3 ARG A 6 32.598 -34.332 -15.176 1.00 0.00 H new ATOM 0 HD2 ARG A 6 32.994 -32.077 -14.513 1.00 0.00 H new ATOM 0 HD3 ARG A 6 32.979 -32.472 -12.805 1.00 0.00 H new ATOM 0 HE ARG A 6 35.243 -33.085 -14.703 1.00 0.00 H new ATOM 0 HH11 ARG A 6 33.906 -33.865 -11.597 1.00 0.00 H new ATOM 0 HH12 ARG A 6 35.403 -33.573 -10.706 1.00 0.00 H new ATOM 0 HH21 ARG A 6 37.130 -32.322 -13.492 1.00 0.00 H new ATOM 0 HH22 ARG A 6 37.212 -32.708 -11.770 1.00 0.00 H new ATOM 93 N ALA A 7 28.955 -36.108 -15.180 1.00 0.00 N ATOM 94 CA ALA A 7 28.545 -36.688 -16.468 1.00 0.00 C ATOM 95 C ALA A 7 27.617 -35.760 -17.262 1.00 0.00 C ATOM 96 O ALA A 7 26.928 -34.904 -16.704 1.00 0.00 O ATOM 97 CB ALA A 7 27.904 -38.067 -16.297 1.00 0.00 C ATOM 0 H ALA A 7 28.210 -35.671 -14.637 1.00 0.00 H new ATOM 0 HA ALA A 7 29.461 -36.809 -17.046 1.00 0.00 H new ATOM 0 HB1 ALA A 7 27.616 -38.458 -17.273 1.00 0.00 H new ATOM 0 HB2 ALA A 7 28.619 -38.745 -15.831 1.00 0.00 H new ATOM 0 HB3 ALA A 7 27.020 -37.981 -15.666 1.00 0.00 H new ATOM 103 N LEU A 8 27.599 -35.929 -18.582 1.00 0.00 N ATOM 104 CA LEU A 8 26.753 -35.053 -19.410 1.00 0.00 C ATOM 105 C LEU A 8 26.383 -35.700 -20.757 1.00 0.00 C ATOM 106 O LEU A 8 26.592 -36.893 -20.979 1.00 0.00 O ATOM 107 CB LEU A 8 27.375 -33.656 -19.599 1.00 0.00 C ATOM 108 CG LEU A 8 28.664 -33.707 -20.436 1.00 0.00 C ATOM 109 CD1 LEU A 8 28.539 -32.809 -21.667 1.00 0.00 C ATOM 110 CD2 LEU A 8 29.849 -33.254 -19.590 1.00 0.00 C ATOM 0 H LEU A 8 28.134 -36.632 -19.091 1.00 0.00 H new ATOM 0 HA LEU A 8 25.822 -34.916 -18.860 1.00 0.00 H new ATOM 0 HB2 LEU A 8 26.653 -33.001 -20.086 1.00 0.00 H new ATOM 0 HB3 LEU A 8 27.593 -33.221 -18.623 1.00 0.00 H new ATOM 0 HG LEU A 8 28.824 -34.734 -20.765 1.00 0.00 H new ATOM 0 HD11 LEU A 8 29.460 -32.857 -22.248 1.00 0.00 H new ATOM 0 HD12 LEU A 8 27.705 -33.148 -22.281 1.00 0.00 H new ATOM 0 HD13 LEU A 8 28.363 -31.781 -21.351 1.00 0.00 H new ATOM 0 HD21 LEU A 8 30.759 -33.292 -20.189 1.00 0.00 H new ATOM 0 HD22 LEU A 8 29.682 -32.233 -19.248 1.00 0.00 H new ATOM 0 HD23 LEU A 8 29.954 -33.913 -18.728 1.00 0.00 H new ATOM 122 N GLY A 9 25.814 -34.909 -21.662 1.00 0.00 N ATOM 123 CA GLY A 9 25.490 -35.464 -22.984 1.00 0.00 C ATOM 124 C GLY A 9 25.097 -34.366 -23.971 1.00 0.00 C ATOM 125 O GLY A 9 25.876 -33.449 -24.217 1.00 0.00 O ATOM 0 H GLY A 9 25.575 -33.927 -21.522 1.00 0.00 H new ATOM 0 HA2 GLY A 9 26.350 -36.012 -23.371 1.00 0.00 H new ATOM 0 HA3 GLY A 9 24.673 -36.179 -22.889 1.00 0.00 H new ATOM 129 N PRO A 10 23.916 -34.477 -24.599 1.00 0.00 N ATOM 130 CA PRO A 10 23.526 -33.512 -25.644 1.00 0.00 C ATOM 131 C PRO A 10 23.744 -32.032 -25.262 1.00 0.00 C ATOM 132 O PRO A 10 24.047 -31.197 -26.115 1.00 0.00 O ATOM 133 CB PRO A 10 22.034 -33.790 -25.868 1.00 0.00 C ATOM 134 CG PRO A 10 21.556 -34.708 -24.735 1.00 0.00 C ATOM 135 CD PRO A 10 22.789 -35.131 -23.937 1.00 0.00 C ATOM 0 HA PRO A 10 24.146 -33.647 -26.530 1.00 0.00 H new ATOM 0 HB2 PRO A 10 21.468 -32.859 -25.871 1.00 0.00 H new ATOM 0 HB3 PRO A 10 21.874 -34.263 -26.837 1.00 0.00 H new ATOM 0 HG2 PRO A 10 20.844 -34.188 -24.094 1.00 0.00 H new ATOM 0 HG3 PRO A 10 21.043 -35.581 -25.139 1.00 0.00 H new ATOM 0 HD2 PRO A 10 22.710 -34.820 -22.895 1.00 0.00 H new ATOM 0 HD3 PRO A 10 22.906 -36.215 -23.938 1.00 0.00 H new ATOM 143 N GLU A 11 23.592 -31.706 -23.980 1.00 0.00 N ATOM 144 CA GLU A 11 23.743 -30.308 -23.570 1.00 0.00 C ATOM 145 C GLU A 11 25.147 -29.723 -23.696 1.00 0.00 C ATOM 146 O GLU A 11 25.365 -28.543 -23.421 1.00 0.00 O ATOM 147 CB GLU A 11 23.154 -30.078 -22.179 1.00 0.00 C ATOM 148 CG GLU A 11 21.661 -30.378 -22.232 1.00 0.00 C ATOM 149 CD GLU A 11 21.021 -30.357 -20.852 1.00 0.00 C ATOM 150 OE1 GLU A 11 20.979 -31.418 -20.193 1.00 0.00 O ATOM 151 OE2 GLU A 11 20.548 -29.282 -20.424 1.00 0.00 O ATOM 0 H GLU A 11 23.373 -32.362 -23.230 1.00 0.00 H new ATOM 0 HA GLU A 11 23.166 -29.745 -24.303 1.00 0.00 H new ATOM 0 HB2 GLU A 11 23.644 -30.722 -21.449 1.00 0.00 H new ATOM 0 HB3 GLU A 11 23.323 -29.049 -21.861 1.00 0.00 H new ATOM 0 HG2 GLU A 11 21.167 -29.645 -22.871 1.00 0.00 H new ATOM 0 HG3 GLU A 11 21.505 -31.355 -22.688 1.00 0.00 H new ATOM 158 N GLU A 12 26.118 -30.538 -24.094 1.00 0.00 N ATOM 159 CA GLU A 12 27.401 -29.956 -24.522 1.00 0.00 C ATOM 160 C GLU A 12 27.200 -28.810 -25.543 1.00 0.00 C ATOM 161 O GLU A 12 27.886 -27.784 -25.503 1.00 0.00 O ATOM 162 CB GLU A 12 28.414 -31.010 -25.006 1.00 0.00 C ATOM 163 CG GLU A 12 27.832 -31.974 -26.057 1.00 0.00 C ATOM 164 CD GLU A 12 28.675 -33.220 -26.215 1.00 0.00 C ATOM 165 OE1 GLU A 12 28.893 -33.938 -25.216 1.00 0.00 O ATOM 166 OE2 GLU A 12 29.090 -33.516 -27.353 1.00 0.00 O ATOM 0 H GLU A 12 26.058 -31.555 -24.132 1.00 0.00 H new ATOM 0 HA GLU A 12 27.848 -29.514 -23.632 1.00 0.00 H new ATOM 0 HB2 GLU A 12 29.282 -30.503 -25.428 1.00 0.00 H new ATOM 0 HB3 GLU A 12 28.766 -31.586 -24.150 1.00 0.00 H new ATOM 0 HG2 GLU A 12 26.820 -32.256 -25.768 1.00 0.00 H new ATOM 0 HG3 GLU A 12 27.759 -31.462 -27.017 1.00 0.00 H new ATOM 173 N LYS A 13 26.186 -28.957 -26.407 1.00 0.00 N ATOM 174 CA LYS A 13 25.834 -27.870 -27.320 1.00 0.00 C ATOM 175 C LYS A 13 25.428 -26.583 -26.600 1.00 0.00 C ATOM 176 O LYS A 13 26.021 -25.522 -26.819 1.00 0.00 O ATOM 177 CB LYS A 13 24.755 -28.268 -28.339 1.00 0.00 C ATOM 178 CG LYS A 13 25.119 -29.547 -29.106 1.00 0.00 C ATOM 179 CD LYS A 13 26.353 -29.344 -29.991 1.00 0.00 C ATOM 180 CE LYS A 13 26.408 -30.431 -31.070 1.00 0.00 C ATOM 181 NZ LYS A 13 27.520 -30.179 -32.003 1.00 0.00 N ATOM 0 H LYS A 13 25.611 -29.795 -26.490 1.00 0.00 H new ATOM 0 HA LYS A 13 26.755 -27.666 -27.867 1.00 0.00 H new ATOM 0 HB2 LYS A 13 23.807 -28.415 -27.822 1.00 0.00 H new ATOM 0 HB3 LYS A 13 24.609 -27.452 -29.047 1.00 0.00 H new ATOM 0 HG2 LYS A 13 25.307 -30.355 -28.399 1.00 0.00 H new ATOM 0 HG3 LYS A 13 24.275 -29.854 -29.723 1.00 0.00 H new ATOM 0 HD2 LYS A 13 26.319 -28.359 -30.457 1.00 0.00 H new ATOM 0 HD3 LYS A 13 27.257 -29.378 -29.383 1.00 0.00 H new ATOM 0 HE2 LYS A 13 26.532 -31.408 -30.603 1.00 0.00 H new ATOM 0 HE3 LYS A 13 25.466 -30.456 -31.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 27.414 -30.785 -32.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 27.510 -29.180 -32.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 28.423 -30.394 -31.533 1.00 0.00 H new ATOM 195 N ASP A 14 24.415 -26.656 -25.733 1.00 0.00 N ATOM 196 CA ASP A 14 24.040 -25.434 -25.015 1.00 0.00 C ATOM 197 C ASP A 14 25.160 -24.904 -24.119 1.00 0.00 C ATOM 198 O ASP A 14 25.333 -23.699 -23.975 1.00 0.00 O ATOM 199 CB ASP A 14 22.729 -25.556 -24.227 1.00 0.00 C ATOM 200 CG ASP A 14 22.093 -24.198 -23.955 1.00 0.00 C ATOM 201 OD1 ASP A 14 21.838 -23.441 -24.918 1.00 0.00 O ATOM 202 OD2 ASP A 14 21.837 -23.882 -22.774 1.00 0.00 O ATOM 0 H ASP A 14 23.869 -27.491 -25.519 1.00 0.00 H new ATOM 0 HA ASP A 14 23.867 -24.702 -25.803 1.00 0.00 H new ATOM 0 HB2 ASP A 14 22.029 -26.178 -24.784 1.00 0.00 H new ATOM 0 HB3 ASP A 14 22.921 -26.061 -23.281 1.00 0.00 H new ATOM 207 N GLU A 15 25.956 -25.802 -23.555 1.00 0.00 N ATOM 208 CA GLU A 15 27.078 -25.359 -22.720 1.00 0.00 C ATOM 209 C GLU A 15 28.049 -24.434 -23.447 1.00 0.00 C ATOM 210 O GLU A 15 28.267 -23.283 -23.051 1.00 0.00 O ATOM 211 CB GLU A 15 27.862 -26.541 -22.129 1.00 0.00 C ATOM 212 CG GLU A 15 27.138 -27.145 -20.920 1.00 0.00 C ATOM 213 CD GLU A 15 27.628 -26.531 -19.621 1.00 0.00 C ATOM 214 OE1 GLU A 15 27.429 -25.314 -19.410 1.00 0.00 O ATOM 215 OE2 GLU A 15 28.221 -27.266 -18.804 1.00 0.00 O ATOM 0 H GLU A 15 25.857 -26.813 -23.652 1.00 0.00 H new ATOM 0 HA GLU A 15 26.612 -24.792 -21.914 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.999 -27.307 -22.893 1.00 0.00 H new ATOM 0 HB3 GLU A 15 28.856 -26.207 -21.830 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.064 -26.984 -21.019 1.00 0.00 H new ATOM 0 HG3 GLU A 15 27.298 -28.223 -20.899 1.00 0.00 H new ATOM 222 N CYS A 16 28.637 -24.930 -24.528 1.00 0.00 N ATOM 223 CA CYS A 16 29.634 -24.097 -25.220 1.00 0.00 C ATOM 224 C CYS A 16 28.964 -22.885 -25.906 1.00 0.00 C ATOM 225 O CYS A 16 29.583 -21.826 -26.030 1.00 0.00 O ATOM 226 CB CYS A 16 30.223 -25.008 -26.292 1.00 0.00 C ATOM 227 SG CYS A 16 28.902 -25.943 -27.125 1.00 0.00 S ATOM 0 H CYS A 16 28.462 -25.850 -24.933 1.00 0.00 H new ATOM 0 HA CYS A 16 30.378 -23.708 -24.525 1.00 0.00 H new ATOM 0 HB2 CYS A 16 30.772 -24.413 -27.022 1.00 0.00 H new ATOM 0 HB3 CYS A 16 30.936 -25.698 -25.841 1.00 0.00 H new ATOM 0 HG CYS A 16 28.540 -26.943 -26.377 1.00 0.00 H new ATOM 233 N MET A 17 27.708 -22.994 -26.351 1.00 0.00 N ATOM 234 CA MET A 17 27.057 -21.779 -26.884 1.00 0.00 C ATOM 235 C MET A 17 26.463 -20.861 -25.790 1.00 0.00 C ATOM 236 O MET A 17 26.063 -19.730 -26.066 1.00 0.00 O ATOM 237 CB MET A 17 26.148 -22.024 -28.099 1.00 0.00 C ATOM 238 CG MET A 17 26.700 -21.292 -29.342 1.00 0.00 C ATOM 239 SD MET A 17 28.501 -21.513 -29.412 1.00 0.00 S ATOM 240 CE MET A 17 28.948 -20.522 -30.857 1.00 0.00 C ATOM 0 H MET A 17 27.147 -23.846 -26.359 1.00 0.00 H new ATOM 0 HA MET A 17 27.871 -21.189 -27.306 1.00 0.00 H new ATOM 0 HB2 MET A 17 26.079 -23.093 -28.300 1.00 0.00 H new ATOM 0 HB3 MET A 17 25.139 -21.675 -27.882 1.00 0.00 H new ATOM 0 HG2 MET A 17 26.237 -21.686 -30.247 1.00 0.00 H new ATOM 0 HG3 MET A 17 26.453 -20.231 -29.294 1.00 0.00 H new ATOM 0 HE1 MET A 17 30.028 -20.380 -30.880 1.00 0.00 H new ATOM 0 HE2 MET A 17 28.630 -21.037 -31.764 1.00 0.00 H new ATOM 0 HE3 MET A 17 28.455 -19.551 -30.799 1.00 0.00 H new ATOM 250 N LYS A 18 26.449 -21.314 -24.534 1.00 0.00 N ATOM 251 CA LYS A 18 26.086 -20.412 -23.443 1.00 0.00 C ATOM 252 C LYS A 18 27.278 -19.577 -23.001 1.00 0.00 C ATOM 253 O LYS A 18 27.157 -18.379 -22.753 1.00 0.00 O ATOM 254 CB LYS A 18 25.486 -21.156 -22.244 1.00 0.00 C ATOM 255 CG LYS A 18 24.361 -20.365 -21.569 1.00 0.00 C ATOM 256 CD LYS A 18 23.001 -20.882 -22.042 1.00 0.00 C ATOM 257 CE LYS A 18 22.687 -20.417 -23.465 1.00 0.00 C ATOM 258 NZ LYS A 18 21.403 -20.988 -23.903 1.00 0.00 N ATOM 0 H LYS A 18 26.677 -22.268 -24.254 1.00 0.00 H new ATOM 0 HA LYS A 18 25.316 -19.747 -23.835 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.101 -22.121 -22.574 1.00 0.00 H new ATOM 0 HB3 LYS A 18 26.271 -21.359 -21.516 1.00 0.00 H new ATOM 0 HG2 LYS A 18 24.438 -20.459 -20.486 1.00 0.00 H new ATOM 0 HG3 LYS A 18 24.458 -19.305 -21.805 1.00 0.00 H new ATOM 0 HD2 LYS A 18 22.992 -21.971 -22.004 1.00 0.00 H new ATOM 0 HD3 LYS A 18 22.222 -20.533 -21.364 1.00 0.00 H new ATOM 0 HE2 LYS A 18 22.643 -19.328 -23.500 1.00 0.00 H new ATOM 0 HE3 LYS A 18 23.483 -20.726 -24.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 20.800 -20.233 -24.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 21.574 -21.702 -24.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 20.927 -21.433 -23.093 1.00 0.00 H new ATOM 272 N ILE A 19 28.442 -20.211 -22.861 1.00 0.00 N ATOM 273 CA ILE A 19 29.663 -19.403 -22.712 1.00 0.00 C ATOM 274 C ILE A 19 29.832 -18.438 -23.881 1.00 0.00 C ATOM 275 O ILE A 19 30.138 -17.262 -23.708 1.00 0.00 O ATOM 276 CB ILE A 19 30.943 -20.230 -22.526 1.00 0.00 C ATOM 277 CG1 ILE A 19 32.181 -19.361 -22.492 1.00 0.00 C ATOM 278 CG2 ILE A 19 31.132 -21.254 -23.645 1.00 0.00 C ATOM 279 CD1 ILE A 19 32.178 -18.422 -21.308 1.00 0.00 C ATOM 0 H ILE A 19 28.571 -21.223 -22.847 1.00 0.00 H new ATOM 0 HA ILE A 19 29.521 -18.841 -21.789 1.00 0.00 H new ATOM 0 HB ILE A 19 30.819 -20.740 -21.571 1.00 0.00 H new ATOM 0 HG12 ILE A 19 33.068 -19.994 -22.451 1.00 0.00 H new ATOM 0 HG13 ILE A 19 32.244 -18.783 -23.414 1.00 0.00 H new ATOM 0 HG21 ILE A 19 32.050 -21.816 -23.473 1.00 0.00 H new ATOM 0 HG22 ILE A 19 30.284 -21.939 -23.659 1.00 0.00 H new ATOM 0 HG23 ILE A 19 31.197 -20.738 -24.603 1.00 0.00 H new ATOM 0 HD11 ILE A 19 33.084 -17.816 -21.322 1.00 0.00 H new ATOM 0 HD12 ILE A 19 31.306 -17.771 -21.362 1.00 0.00 H new ATOM 0 HD13 ILE A 19 32.142 -19.001 -20.385 1.00 0.00 H new ATOM 291 N PHE A 20 29.641 -18.952 -25.086 1.00 0.00 N ATOM 292 CA PHE A 20 29.724 -18.079 -26.252 1.00 0.00 C ATOM 293 C PHE A 20 28.762 -16.894 -26.150 1.00 0.00 C ATOM 294 O PHE A 20 29.165 -15.744 -26.262 1.00 0.00 O ATOM 295 CB PHE A 20 29.519 -18.856 -27.567 1.00 0.00 C ATOM 296 CG PHE A 20 30.218 -18.181 -28.726 1.00 0.00 C ATOM 297 CD1 PHE A 20 29.689 -17.047 -29.237 1.00 0.00 C ATOM 298 CD2 PHE A 20 31.511 -18.484 -28.993 1.00 0.00 C ATOM 299 CE1 PHE A 20 30.505 -16.095 -29.749 1.00 0.00 C ATOM 300 CE2 PHE A 20 32.347 -17.512 -29.431 1.00 0.00 C ATOM 301 CZ PHE A 20 31.846 -16.294 -29.756 1.00 0.00 C ATOM 0 H PHE A 20 29.435 -19.931 -25.282 1.00 0.00 H new ATOM 0 HA PHE A 20 30.736 -17.674 -26.268 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.899 -19.871 -27.454 1.00 0.00 H new ATOM 0 HB3 PHE A 20 28.453 -18.936 -27.781 1.00 0.00 H new ATOM 0 HD1 PHE A 20 28.619 -16.901 -29.237 1.00 0.00 H new ATOM 0 HD2 PHE A 20 31.873 -19.493 -28.858 1.00 0.00 H new ATOM 0 HE1 PHE A 20 30.090 -15.182 -30.150 1.00 0.00 H new ATOM 0 HE2 PHE A 20 33.406 -17.706 -29.521 1.00 0.00 H new ATOM 0 HZ PHE A 20 32.513 -15.486 -30.019 1.00 0.00 H new ATOM 311 N ASP A 21 27.506 -17.173 -25.831 1.00 0.00 N ATOM 312 CA ASP A 21 26.516 -16.083 -25.728 1.00 0.00 C ATOM 313 C ASP A 21 26.692 -15.166 -24.506 1.00 0.00 C ATOM 314 O ASP A 21 26.406 -13.970 -24.555 1.00 0.00 O ATOM 315 CB ASP A 21 25.090 -16.640 -25.757 1.00 0.00 C ATOM 316 CG ASP A 21 24.087 -15.633 -26.313 1.00 0.00 C ATOM 317 OD1 ASP A 21 24.189 -15.274 -27.508 1.00 0.00 O ATOM 318 OD2 ASP A 21 23.191 -15.198 -25.559 1.00 0.00 O ATOM 0 H ASP A 21 27.146 -18.108 -25.643 1.00 0.00 H new ATOM 0 HA ASP A 21 26.697 -15.457 -26.602 1.00 0.00 H new ATOM 0 HB2 ASP A 21 25.068 -17.545 -26.364 1.00 0.00 H new ATOM 0 HB3 ASP A 21 24.793 -16.926 -24.748 1.00 0.00 H new ATOM 323 N ILE A 22 27.129 -15.734 -23.393 1.00 0.00 N ATOM 324 CA ILE A 22 27.388 -14.880 -22.215 1.00 0.00 C ATOM 325 C ILE A 22 28.690 -14.085 -22.377 1.00 0.00 C ATOM 326 O ILE A 22 28.729 -12.869 -22.191 1.00 0.00 O ATOM 327 CB ILE A 22 27.397 -15.591 -20.831 1.00 0.00 C ATOM 328 CG1 ILE A 22 26.101 -16.367 -20.542 1.00 0.00 C ATOM 329 CG2 ILE A 22 27.576 -14.548 -19.723 1.00 0.00 C ATOM 330 CD1 ILE A 22 26.401 -17.583 -19.662 1.00 0.00 C ATOM 0 H ILE A 22 27.309 -16.730 -23.268 1.00 0.00 H new ATOM 0 HA ILE A 22 26.521 -14.220 -22.198 1.00 0.00 H new ATOM 0 HB ILE A 22 28.221 -16.304 -20.855 1.00 0.00 H new ATOM 0 HG12 ILE A 22 25.382 -15.717 -20.044 1.00 0.00 H new ATOM 0 HG13 ILE A 22 25.645 -16.689 -21.478 1.00 0.00 H new ATOM 0 HG21 ILE A 22 27.582 -15.045 -18.753 1.00 0.00 H new ATOM 0 HG22 ILE A 22 28.520 -14.022 -19.867 1.00 0.00 H new ATOM 0 HG23 ILE A 22 26.753 -13.834 -19.759 1.00 0.00 H new ATOM 0 HD11 ILE A 22 25.477 -18.125 -19.463 1.00 0.00 H new ATOM 0 HD12 ILE A 22 27.104 -18.239 -20.176 1.00 0.00 H new ATOM 0 HD13 ILE A 22 26.837 -17.251 -18.720 1.00 0.00 H new ATOM 342 N PHE A 23 29.768 -14.783 -22.711 1.00 0.00 N ATOM 343 CA PHE A 23 31.065 -14.102 -22.810 1.00 0.00 C ATOM 344 C PHE A 23 31.243 -13.308 -24.098 1.00 0.00 C ATOM 345 O PHE A 23 32.047 -12.376 -24.143 1.00 0.00 O ATOM 346 CB PHE A 23 32.253 -15.056 -22.640 1.00 0.00 C ATOM 347 CG PHE A 23 32.498 -15.394 -21.174 1.00 0.00 C ATOM 348 CD1 PHE A 23 31.441 -15.608 -20.351 1.00 0.00 C ATOM 349 CD2 PHE A 23 33.754 -15.634 -20.714 1.00 0.00 C ATOM 350 CE1 PHE A 23 31.636 -15.687 -19.016 1.00 0.00 C ATOM 351 CE2 PHE A 23 33.957 -15.725 -19.374 1.00 0.00 C ATOM 352 CZ PHE A 23 32.897 -15.694 -18.524 1.00 0.00 C ATOM 0 H PHE A 23 29.781 -15.783 -22.912 1.00 0.00 H new ATOM 0 HA PHE A 23 31.055 -13.398 -21.978 1.00 0.00 H new ATOM 0 HB2 PHE A 23 32.066 -15.973 -23.199 1.00 0.00 H new ATOM 0 HB3 PHE A 23 33.149 -14.601 -23.063 1.00 0.00 H new ATOM 0 HD1 PHE A 23 30.448 -15.715 -20.761 1.00 0.00 H new ATOM 0 HD2 PHE A 23 34.578 -15.751 -21.403 1.00 0.00 H new ATOM 0 HE1 PHE A 23 30.791 -15.744 -18.346 1.00 0.00 H new ATOM 0 HE2 PHE A 23 34.960 -15.822 -18.984 1.00 0.00 H new ATOM 0 HZ PHE A 23 33.061 -15.675 -17.457 1.00 0.00 H new ATOM 362 N ASP A 24 30.529 -13.657 -25.170 1.00 0.00 N ATOM 363 CA ASP A 24 30.659 -12.835 -26.370 1.00 0.00 C ATOM 364 C ASP A 24 30.102 -11.405 -26.192 1.00 0.00 C ATOM 365 O ASP A 24 30.168 -10.576 -27.098 1.00 0.00 O ATOM 366 CB ASP A 24 30.079 -13.403 -27.671 1.00 0.00 C ATOM 367 CG ASP A 24 28.561 -13.584 -27.656 1.00 0.00 C ATOM 368 OD1 ASP A 24 27.901 -13.142 -26.691 1.00 0.00 O ATOM 369 OD2 ASP A 24 28.022 -14.158 -28.627 1.00 0.00 O ATOM 0 H ASP A 24 29.893 -14.452 -25.234 1.00 0.00 H new ATOM 0 HA ASP A 24 31.743 -12.825 -26.486 1.00 0.00 H new ATOM 0 HB2 ASP A 24 30.346 -12.740 -28.494 1.00 0.00 H new ATOM 0 HB3 ASP A 24 30.546 -14.367 -27.873 1.00 0.00 H new ATOM 374 N ARG A 25 29.466 -11.144 -25.051 1.00 0.00 N ATOM 375 CA ARG A 25 28.944 -9.793 -24.801 1.00 0.00 C ATOM 376 C ARG A 25 29.153 -9.309 -23.348 1.00 0.00 C ATOM 377 O ARG A 25 28.664 -8.247 -22.958 1.00 0.00 O ATOM 378 CB ARG A 25 27.478 -9.658 -25.218 1.00 0.00 C ATOM 379 CG ARG A 25 27.313 -9.772 -26.741 1.00 0.00 C ATOM 380 CD ARG A 25 25.854 -10.075 -27.081 1.00 0.00 C ATOM 381 NE ARG A 25 25.759 -10.794 -28.362 1.00 0.00 N ATOM 382 CZ ARG A 25 25.152 -11.975 -28.392 1.00 0.00 C ATOM 383 NH1 ARG A 25 25.378 -12.869 -27.450 1.00 0.00 N ATOM 384 NH2 ARG A 25 24.335 -12.267 -29.381 1.00 0.00 N ATOM 0 H ARG A 25 29.301 -11.821 -24.306 1.00 0.00 H new ATOM 0 HA ARG A 25 29.539 -9.134 -25.434 1.00 0.00 H new ATOM 0 HB2 ARG A 25 26.887 -10.431 -24.728 1.00 0.00 H new ATOM 0 HB3 ARG A 25 27.089 -8.697 -24.880 1.00 0.00 H new ATOM 0 HG2 ARG A 25 27.623 -8.843 -27.220 1.00 0.00 H new ATOM 0 HG3 ARG A 25 27.958 -10.561 -27.128 1.00 0.00 H new ATOM 0 HD2 ARG A 25 25.407 -10.674 -26.288 1.00 0.00 H new ATOM 0 HD3 ARG A 25 25.287 -9.146 -27.137 1.00 0.00 H new ATOM 0 HE ARG A 25 26.153 -10.392 -29.213 1.00 0.00 H new ATOM 0 HH11 ARG A 25 26.024 -12.656 -26.690 1.00 0.00 H new ATOM 0 HH12 ARG A 25 24.907 -13.773 -27.482 1.00 0.00 H new ATOM 0 HH21 ARG A 25 24.169 -11.587 -30.123 1.00 0.00 H new ATOM 0 HH22 ARG A 25 23.868 -13.173 -29.406 1.00 0.00 H new ATOM 398 N ASN A 26 29.898 -10.076 -22.547 1.00 0.00 N ATOM 399 CA ASN A 26 30.191 -9.617 -21.181 1.00 0.00 C ATOM 400 C ASN A 26 31.708 -9.515 -21.037 1.00 0.00 C ATOM 401 O ASN A 26 32.232 -8.577 -20.434 1.00 0.00 O ATOM 402 CB ASN A 26 29.490 -10.412 -20.063 1.00 0.00 C ATOM 403 CG ASN A 26 27.972 -10.178 -20.041 1.00 0.00 C ATOM 404 OD1 ASN A 26 27.520 -9.005 -20.459 1.00 0.00 O flip ATOM 405 ND2 ASN A 26 27.200 -11.058 -19.668 1.00 0.00 N flip ATOM 0 H ASN A 26 30.296 -10.980 -22.802 1.00 0.00 H new ATOM 0 HA ASN A 26 29.751 -8.630 -21.040 1.00 0.00 H new ATOM 0 HB2 ASN A 26 29.689 -11.475 -20.197 1.00 0.00 H new ATOM 0 HB3 ASN A 26 29.913 -10.128 -19.099 1.00 0.00 H new ATOM 0 HD21 ASN A 26 27.565 -11.955 -19.349 1.00 0.00 H new ATOM 0 HD22 ASN A 26 26.194 -10.891 -19.677 1.00 0.00 H new ATOM 412 N ALA A 27 32.436 -10.486 -21.597 1.00 0.00 N ATOM 413 CA ALA A 27 33.781 -10.158 -22.040 1.00 0.00 C ATOM 414 C ALA A 27 33.645 -9.168 -23.187 1.00 0.00 C ATOM 415 O ALA A 27 33.972 -7.990 -23.052 1.00 0.00 O ATOM 416 CB ALA A 27 34.703 -11.367 -22.237 1.00 0.00 C ATOM 0 H ALA A 27 32.135 -11.449 -21.746 1.00 0.00 H new ATOM 0 HA ALA A 27 34.346 -9.662 -21.251 1.00 0.00 H new ATOM 0 HB1 ALA A 27 35.684 -11.026 -22.568 1.00 0.00 H new ATOM 0 HB2 ALA A 27 34.804 -11.905 -21.294 1.00 0.00 H new ATOM 0 HB3 ALA A 27 34.277 -12.031 -22.989 1.00 0.00 H new ATOM 422 N GLU A 28 33.270 -9.690 -24.336 1.00 0.00 N ATOM 423 CA GLU A 28 32.435 -8.895 -25.275 1.00 0.00 C ATOM 424 C GLU A 28 32.511 -9.314 -26.755 1.00 0.00 C ATOM 425 O GLU A 28 32.056 -8.582 -27.632 1.00 0.00 O ATOM 426 CB GLU A 28 32.336 -7.375 -25.038 1.00 0.00 C ATOM 427 CG GLU A 28 33.607 -6.631 -25.474 1.00 0.00 C ATOM 428 CD GLU A 28 33.352 -5.741 -26.682 1.00 0.00 C ATOM 429 OE1 GLU A 28 32.705 -4.683 -26.525 1.00 0.00 O ATOM 430 OE2 GLU A 28 33.809 -6.089 -27.791 1.00 0.00 O ATOM 0 H GLU A 28 33.509 -10.629 -24.655 1.00 0.00 H new ATOM 0 HA GLU A 28 31.444 -9.220 -24.957 1.00 0.00 H new ATOM 0 HB2 GLU A 28 31.481 -6.979 -25.586 1.00 0.00 H new ATOM 0 HB3 GLU A 28 32.152 -7.186 -23.980 1.00 0.00 H new ATOM 0 HG2 GLU A 28 33.976 -6.025 -24.647 1.00 0.00 H new ATOM 0 HG3 GLU A 28 34.388 -7.353 -25.712 1.00 0.00 H new ATOM 437 N ASN A 29 33.027 -10.522 -27.012 1.00 0.00 N ATOM 438 CA ASN A 29 32.867 -11.180 -28.345 1.00 0.00 C ATOM 439 C ASN A 29 34.056 -12.065 -28.686 1.00 0.00 C ATOM 440 O ASN A 29 33.911 -13.256 -28.966 1.00 0.00 O ATOM 441 CB ASN A 29 32.337 -10.368 -29.554 1.00 0.00 C ATOM 442 CG ASN A 29 33.329 -9.347 -30.128 1.00 0.00 C ATOM 443 OD1 ASN A 29 34.128 -8.727 -29.283 1.00 0.00 O flip ATOM 444 ND2 ASN A 29 33.398 -9.137 -31.338 1.00 0.00 N flip ATOM 0 H ASN A 29 33.555 -11.070 -26.333 1.00 0.00 H new ATOM 0 HA ASN A 29 31.986 -11.796 -28.163 1.00 0.00 H new ATOM 0 HB2 ASN A 29 32.054 -11.063 -30.345 1.00 0.00 H new ATOM 0 HB3 ASN A 29 31.431 -9.843 -29.252 1.00 0.00 H new ATOM 0 HD21 ASN A 29 32.771 -9.626 -31.977 1.00 0.00 H new ATOM 0 HD22 ASN A 29 34.082 -8.474 -31.702 1.00 0.00 H new ATOM 451 N ILE A 30 35.241 -11.488 -28.680 1.00 0.00 N ATOM 452 CA ILE A 30 36.422 -12.314 -28.878 1.00 0.00 C ATOM 453 C ILE A 30 36.926 -12.808 -27.507 1.00 0.00 C ATOM 454 O ILE A 30 37.499 -12.050 -26.727 1.00 0.00 O ATOM 455 CB ILE A 30 37.494 -11.622 -29.756 1.00 0.00 C ATOM 456 CG1 ILE A 30 37.818 -10.209 -29.223 1.00 0.00 C ATOM 457 CG2 ILE A 30 37.008 -11.520 -31.205 1.00 0.00 C ATOM 458 CD1 ILE A 30 38.726 -9.424 -30.179 1.00 0.00 C ATOM 0 H ILE A 30 35.413 -10.492 -28.546 1.00 0.00 H new ATOM 0 HA ILE A 30 36.159 -13.197 -29.461 1.00 0.00 H new ATOM 0 HB ILE A 30 38.400 -12.227 -29.717 1.00 0.00 H new ATOM 0 HG12 ILE A 30 36.890 -9.658 -29.071 1.00 0.00 H new ATOM 0 HG13 ILE A 30 38.302 -10.292 -28.250 1.00 0.00 H new ATOM 0 HG21 ILE A 30 37.771 -11.032 -31.811 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.818 -12.519 -31.596 1.00 0.00 H new ATOM 0 HG23 ILE A 30 36.088 -10.936 -31.240 1.00 0.00 H new ATOM 0 HD11 ILE A 30 38.926 -8.437 -29.762 1.00 0.00 H new ATOM 0 HD12 ILE A 30 39.666 -9.960 -30.310 1.00 0.00 H new ATOM 0 HD13 ILE A 30 38.232 -9.317 -31.144 1.00 0.00 H new ATOM 470 N ALA A 31 36.645 -14.072 -27.184 1.00 0.00 N ATOM 471 CA ALA A 31 36.981 -14.581 -25.838 1.00 0.00 C ATOM 472 C ALA A 31 38.404 -15.175 -25.753 1.00 0.00 C ATOM 473 O ALA A 31 38.726 -16.108 -26.486 1.00 0.00 O ATOM 474 CB ALA A 31 35.969 -15.634 -25.383 1.00 0.00 C ATOM 0 H ALA A 31 36.201 -14.748 -27.806 1.00 0.00 H new ATOM 0 HA ALA A 31 36.942 -13.716 -25.175 1.00 0.00 H new ATOM 0 HB1 ALA A 31 36.239 -15.993 -24.390 1.00 0.00 H new ATOM 0 HB2 ALA A 31 34.973 -15.192 -25.351 1.00 0.00 H new ATOM 0 HB3 ALA A 31 35.973 -16.469 -26.084 1.00 0.00 H new ATOM 480 N PRO A 32 39.261 -14.718 -24.822 1.00 0.00 N ATOM 481 CA PRO A 32 40.681 -15.110 -24.904 1.00 0.00 C ATOM 482 C PRO A 32 41.003 -16.307 -23.978 1.00 0.00 C ATOM 483 O PRO A 32 40.109 -16.978 -23.459 1.00 0.00 O ATOM 484 CB PRO A 32 41.425 -13.827 -24.504 1.00 0.00 C ATOM 485 CG PRO A 32 40.427 -12.960 -23.736 1.00 0.00 C ATOM 486 CD PRO A 32 39.045 -13.410 -24.195 1.00 0.00 C ATOM 0 HA PRO A 32 40.973 -15.464 -25.893 1.00 0.00 H new ATOM 0 HB2 PRO A 32 42.292 -14.059 -23.885 1.00 0.00 H new ATOM 0 HB3 PRO A 32 41.794 -13.303 -25.386 1.00 0.00 H new ATOM 0 HG2 PRO A 32 40.543 -13.090 -22.660 1.00 0.00 H new ATOM 0 HG3 PRO A 32 40.584 -11.902 -23.948 1.00 0.00 H new ATOM 0 HD2 PRO A 32 38.355 -13.484 -23.355 1.00 0.00 H new ATOM 0 HD3 PRO A 32 38.613 -12.700 -24.901 1.00 0.00 H new ATOM 494 N VAL A 33 42.294 -16.605 -23.807 1.00 0.00 N ATOM 495 CA VAL A 33 42.671 -17.730 -22.890 1.00 0.00 C ATOM 496 C VAL A 33 42.085 -17.567 -21.467 1.00 0.00 C ATOM 497 O VAL A 33 41.570 -18.522 -20.879 1.00 0.00 O ATOM 498 CB VAL A 33 44.189 -18.018 -22.836 1.00 0.00 C ATOM 499 CG1 VAL A 33 44.491 -19.188 -21.892 1.00 0.00 C ATOM 500 CG2 VAL A 33 44.706 -18.380 -24.227 1.00 0.00 C ATOM 0 H VAL A 33 43.073 -16.124 -24.256 1.00 0.00 H new ATOM 0 HA VAL A 33 42.209 -18.609 -23.340 1.00 0.00 H new ATOM 0 HB VAL A 33 44.683 -17.118 -22.471 1.00 0.00 H new ATOM 0 HG11 VAL A 33 45.565 -19.371 -21.871 1.00 0.00 H new ATOM 0 HG12 VAL A 33 44.145 -18.944 -20.888 1.00 0.00 H new ATOM 0 HG13 VAL A 33 43.977 -20.082 -22.245 1.00 0.00 H new ATOM 0 HG21 VAL A 33 45.776 -18.581 -24.177 1.00 0.00 H new ATOM 0 HG22 VAL A 33 44.187 -19.268 -24.588 1.00 0.00 H new ATOM 0 HG23 VAL A 33 44.524 -17.550 -24.910 1.00 0.00 H new ATOM 510 N SER A 34 42.174 -16.368 -20.892 1.00 0.00 N ATOM 511 CA SER A 34 41.540 -16.151 -19.584 1.00 0.00 C ATOM 512 C SER A 34 40.041 -16.489 -19.579 1.00 0.00 C ATOM 513 O SER A 34 39.519 -17.052 -18.618 1.00 0.00 O ATOM 514 CB SER A 34 41.761 -14.732 -19.045 1.00 0.00 C ATOM 515 OG SER A 34 41.145 -13.781 -19.905 1.00 0.00 O ATOM 0 H SER A 34 42.656 -15.561 -21.287 1.00 0.00 H new ATOM 0 HA SER A 34 42.041 -16.849 -18.913 1.00 0.00 H new ATOM 0 HB2 SER A 34 41.347 -14.648 -18.040 1.00 0.00 H new ATOM 0 HB3 SER A 34 42.829 -14.526 -18.968 1.00 0.00 H new ATOM 0 HG SER A 34 41.290 -12.878 -19.552 1.00 0.00 H new ATOM 521 N ASP A 35 39.345 -16.145 -20.663 1.00 0.00 N ATOM 522 CA ASP A 35 37.951 -16.585 -20.794 1.00 0.00 C ATOM 523 C ASP A 35 37.812 -18.118 -20.849 1.00 0.00 C ATOM 524 O ASP A 35 36.819 -18.682 -20.394 1.00 0.00 O ATOM 525 CB ASP A 35 37.237 -15.932 -21.986 1.00 0.00 C ATOM 526 CG ASP A 35 36.769 -14.514 -21.687 1.00 0.00 C ATOM 527 OD1 ASP A 35 37.382 -13.832 -20.837 1.00 0.00 O ATOM 528 OD2 ASP A 35 35.796 -14.064 -22.329 1.00 0.00 O ATOM 0 H ASP A 35 39.703 -15.585 -21.437 1.00 0.00 H new ATOM 0 HA ASP A 35 37.455 -16.245 -19.885 1.00 0.00 H new ATOM 0 HB2 ASP A 35 37.911 -15.915 -22.843 1.00 0.00 H new ATOM 0 HB3 ASP A 35 36.379 -16.541 -22.268 1.00 0.00 H new ATOM 533 N THR A 36 38.803 -18.804 -21.420 1.00 0.00 N ATOM 534 CA THR A 36 38.808 -20.275 -21.341 1.00 0.00 C ATOM 535 C THR A 36 38.901 -20.769 -19.879 1.00 0.00 C ATOM 536 O THR A 36 38.242 -21.732 -19.494 1.00 0.00 O ATOM 537 CB THR A 36 39.864 -20.914 -22.276 1.00 0.00 C ATOM 538 OG1 THR A 36 39.637 -20.466 -23.606 1.00 0.00 O ATOM 539 CG2 THR A 36 39.803 -22.445 -22.279 1.00 0.00 C ATOM 0 H THR A 36 39.587 -18.390 -21.925 1.00 0.00 H new ATOM 0 HA THR A 36 37.845 -20.622 -21.717 1.00 0.00 H new ATOM 0 HB THR A 36 40.844 -20.612 -21.905 1.00 0.00 H new ATOM 0 HG1 THR A 36 38.673 -20.411 -23.773 1.00 0.00 H new ATOM 0 HG21 THR A 36 40.565 -22.838 -22.952 1.00 0.00 H new ATOM 0 HG22 THR A 36 39.981 -22.818 -21.271 1.00 0.00 H new ATOM 0 HG23 THR A 36 38.819 -22.769 -22.617 1.00 0.00 H new ATOM 547 N MET A 37 39.671 -20.075 -19.037 1.00 0.00 N ATOM 548 CA MET A 37 39.688 -20.437 -17.607 1.00 0.00 C ATOM 549 C MET A 37 38.370 -20.099 -16.900 1.00 0.00 C ATOM 550 O MET A 37 37.774 -20.934 -16.215 1.00 0.00 O ATOM 551 CB MET A 37 40.830 -19.789 -16.803 1.00 0.00 C ATOM 552 CG MET A 37 42.177 -19.807 -17.524 1.00 0.00 C ATOM 553 SD MET A 37 42.642 -21.501 -17.905 1.00 0.00 S ATOM 554 CE MET A 37 42.618 -21.394 -19.698 1.00 0.00 C ATOM 0 H MET A 37 40.269 -19.291 -19.299 1.00 0.00 H new ATOM 0 HA MET A 37 39.845 -21.515 -17.624 1.00 0.00 H new ATOM 0 HB2 MET A 37 40.563 -18.757 -16.577 1.00 0.00 H new ATOM 0 HB3 MET A 37 40.931 -20.308 -15.850 1.00 0.00 H new ATOM 0 HG2 MET A 37 42.116 -19.222 -18.442 1.00 0.00 H new ATOM 0 HG3 MET A 37 42.940 -19.343 -16.900 1.00 0.00 H new ATOM 0 HE1 MET A 37 41.735 -21.906 -20.081 1.00 0.00 H new ATOM 0 HE2 MET A 37 42.590 -20.347 -20.000 1.00 0.00 H new ATOM 0 HE3 MET A 37 43.514 -21.864 -20.103 1.00 0.00 H new ATOM 564 N ASP A 38 37.920 -18.855 -17.051 1.00 0.00 N ATOM 565 CA ASP A 38 36.658 -18.456 -16.412 1.00 0.00 C ATOM 566 C ASP A 38 35.452 -19.258 -16.919 1.00 0.00 C ATOM 567 O ASP A 38 34.548 -19.599 -16.154 1.00 0.00 O ATOM 568 CB ASP A 38 36.419 -16.948 -16.501 1.00 0.00 C ATOM 569 CG ASP A 38 37.444 -16.171 -15.684 1.00 0.00 C ATOM 570 OD1 ASP A 38 37.293 -16.098 -14.445 1.00 0.00 O ATOM 571 OD2 ASP A 38 38.402 -15.630 -16.276 1.00 0.00 O ATOM 0 H ASP A 38 38.387 -18.125 -17.589 1.00 0.00 H new ATOM 0 HA ASP A 38 36.765 -18.702 -15.356 1.00 0.00 H new ATOM 0 HB2 ASP A 38 36.467 -16.632 -17.543 1.00 0.00 H new ATOM 0 HB3 ASP A 38 35.416 -16.716 -16.144 1.00 0.00 H new ATOM 576 N MET A 39 35.434 -19.580 -18.213 1.00 0.00 N ATOM 577 CA MET A 39 34.399 -20.505 -18.692 1.00 0.00 C ATOM 578 C MET A 39 34.515 -21.860 -18.022 1.00 0.00 C ATOM 579 O MET A 39 33.573 -22.346 -17.413 1.00 0.00 O ATOM 580 CB MET A 39 34.289 -20.654 -20.223 1.00 0.00 C ATOM 581 CG MET A 39 35.071 -21.817 -20.845 1.00 0.00 C ATOM 582 SD MET A 39 34.475 -22.093 -22.524 1.00 0.00 S ATOM 583 CE MET A 39 35.405 -23.577 -22.938 1.00 0.00 C ATOM 0 H MET A 39 36.086 -19.237 -18.919 1.00 0.00 H new ATOM 0 HA MET A 39 33.464 -20.030 -18.396 1.00 0.00 H new ATOM 0 HB2 MET A 39 33.237 -20.771 -20.482 1.00 0.00 H new ATOM 0 HB3 MET A 39 34.629 -19.726 -20.683 1.00 0.00 H new ATOM 0 HG2 MET A 39 36.137 -21.590 -20.856 1.00 0.00 H new ATOM 0 HG3 MET A 39 34.943 -22.719 -20.247 1.00 0.00 H new ATOM 0 HE1 MET A 39 35.705 -23.538 -23.985 1.00 0.00 H new ATOM 0 HE2 MET A 39 36.293 -23.637 -22.309 1.00 0.00 H new ATOM 0 HE3 MET A 39 34.782 -24.455 -22.771 1.00 0.00 H new ATOM 593 N LEU A 40 35.701 -22.444 -18.049 1.00 0.00 N ATOM 594 CA LEU A 40 35.820 -23.817 -17.541 1.00 0.00 C ATOM 595 C LEU A 40 35.594 -23.932 -16.023 1.00 0.00 C ATOM 596 O LEU A 40 35.410 -25.022 -15.481 1.00 0.00 O ATOM 597 CB LEU A 40 37.077 -24.505 -18.089 1.00 0.00 C ATOM 598 CG LEU A 40 37.069 -24.442 -19.631 1.00 0.00 C ATOM 599 CD1 LEU A 40 38.439 -24.743 -20.215 1.00 0.00 C ATOM 600 CD2 LEU A 40 36.029 -25.394 -20.219 1.00 0.00 C ATOM 0 H LEU A 40 36.562 -22.022 -18.397 1.00 0.00 H new ATOM 0 HA LEU A 40 34.987 -24.396 -17.940 1.00 0.00 H new ATOM 0 HB2 LEU A 40 37.970 -24.017 -17.699 1.00 0.00 H new ATOM 0 HB3 LEU A 40 37.110 -25.543 -17.757 1.00 0.00 H new ATOM 0 HG LEU A 40 36.801 -23.421 -19.903 1.00 0.00 H new ATOM 0 HD11 LEU A 40 38.391 -24.689 -21.303 1.00 0.00 H new ATOM 0 HD12 LEU A 40 39.160 -24.013 -19.847 1.00 0.00 H new ATOM 0 HD13 LEU A 40 38.750 -25.744 -19.915 1.00 0.00 H new ATOM 0 HD21 LEU A 40 36.048 -25.327 -21.307 1.00 0.00 H new ATOM 0 HD22 LEU A 40 36.258 -26.415 -19.915 1.00 0.00 H new ATOM 0 HD23 LEU A 40 35.039 -25.120 -19.856 1.00 0.00 H new ATOM 612 N THR A 41 35.562 -22.787 -15.345 1.00 0.00 N ATOM 613 CA THR A 41 35.038 -22.766 -13.977 1.00 0.00 C ATOM 614 C THR A 41 33.495 -22.666 -13.971 1.00 0.00 C ATOM 615 O THR A 41 32.811 -23.383 -13.240 1.00 0.00 O ATOM 616 CB THR A 41 35.661 -21.643 -13.130 1.00 0.00 C ATOM 617 OG1 THR A 41 37.078 -21.706 -13.232 1.00 0.00 O ATOM 618 CG2 THR A 41 35.271 -21.779 -11.656 1.00 0.00 C ATOM 0 H THR A 41 35.881 -21.887 -15.704 1.00 0.00 H new ATOM 0 HA THR A 41 35.323 -23.712 -13.517 1.00 0.00 H new ATOM 0 HB THR A 41 35.289 -20.690 -13.506 1.00 0.00 H new ATOM 0 HG1 THR A 41 37.353 -21.445 -14.136 1.00 0.00 H new ATOM 0 HG21 THR A 41 35.726 -20.971 -11.083 1.00 0.00 H new ATOM 0 HG22 THR A 41 34.187 -21.725 -11.560 1.00 0.00 H new ATOM 0 HG23 THR A 41 35.622 -22.738 -11.274 1.00 0.00 H new ATOM 626 N LYS A 42 32.941 -21.782 -14.807 1.00 0.00 N ATOM 627 CA LYS A 42 31.476 -21.633 -14.855 1.00 0.00 C ATOM 628 C LYS A 42 30.761 -22.731 -15.668 1.00 0.00 C ATOM 629 O LYS A 42 29.793 -23.330 -15.201 1.00 0.00 O ATOM 630 CB LYS A 42 31.061 -20.230 -15.325 1.00 0.00 C ATOM 631 CG LYS A 42 29.646 -19.856 -14.857 1.00 0.00 C ATOM 632 CD LYS A 42 29.666 -19.137 -13.502 1.00 0.00 C ATOM 633 CE LYS A 42 30.138 -17.688 -13.651 1.00 0.00 C ATOM 634 NZ LYS A 42 30.044 -16.996 -12.353 1.00 0.00 N ATOM 0 H LYS A 42 33.461 -21.175 -15.442 1.00 0.00 H new ATOM 0 HA LYS A 42 31.141 -21.761 -13.826 1.00 0.00 H new ATOM 0 HB2 LYS A 42 31.773 -19.497 -14.946 1.00 0.00 H new ATOM 0 HB3 LYS A 42 31.106 -20.185 -16.413 1.00 0.00 H new ATOM 0 HG2 LYS A 42 29.174 -19.215 -15.602 1.00 0.00 H new ATOM 0 HG3 LYS A 42 29.038 -20.757 -14.781 1.00 0.00 H new ATOM 0 HD2 LYS A 42 28.668 -19.154 -13.064 1.00 0.00 H new ATOM 0 HD3 LYS A 42 30.325 -19.668 -12.815 1.00 0.00 H new ATOM 0 HE2 LYS A 42 31.166 -17.666 -14.011 1.00 0.00 H new ATOM 0 HE3 LYS A 42 29.529 -17.172 -14.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 30.366 -16.013 -12.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 29.057 -17.004 -12.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 30.643 -17.483 -11.656 1.00 0.00 H new ATOM 648 N LEU A 43 31.192 -22.946 -16.916 1.00 0.00 N ATOM 649 CA LEU A 43 30.727 -24.112 -17.674 1.00 0.00 C ATOM 650 C LEU A 43 30.589 -25.388 -16.826 1.00 0.00 C ATOM 651 O LEU A 43 29.606 -26.120 -16.920 1.00 0.00 O ATOM 652 CB LEU A 43 31.716 -24.354 -18.840 1.00 0.00 C ATOM 653 CG LEU A 43 31.147 -24.025 -20.224 1.00 0.00 C ATOM 654 CD1 LEU A 43 30.556 -22.632 -20.364 1.00 0.00 C ATOM 655 CD2 LEU A 43 32.245 -24.102 -21.290 1.00 0.00 C ATOM 0 H LEU A 43 31.847 -22.343 -17.413 1.00 0.00 H new ATOM 0 HA LEU A 43 29.724 -23.891 -18.039 1.00 0.00 H new ATOM 0 HB2 LEU A 43 32.610 -23.752 -18.674 1.00 0.00 H new ATOM 0 HB3 LEU A 43 32.028 -25.398 -18.826 1.00 0.00 H new ATOM 0 HG LEU A 43 30.355 -24.763 -20.355 1.00 0.00 H new ATOM 0 HD11 LEU A 43 30.180 -22.496 -21.378 1.00 0.00 H new ATOM 0 HD12 LEU A 43 29.737 -22.511 -19.655 1.00 0.00 H new ATOM 0 HD13 LEU A 43 31.326 -21.888 -20.160 1.00 0.00 H new ATOM 0 HD21 LEU A 43 31.822 -23.865 -22.266 1.00 0.00 H new ATOM 0 HD22 LEU A 43 33.033 -23.387 -21.053 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.663 -25.109 -21.310 1.00 0.00 H new ATOM 667 N GLY A 44 31.570 -25.640 -15.965 1.00 0.00 N ATOM 668 CA GLY A 44 31.493 -26.848 -15.128 1.00 0.00 C ATOM 669 C GLY A 44 31.818 -28.120 -15.922 1.00 0.00 C ATOM 670 O GLY A 44 31.402 -29.222 -15.563 1.00 0.00 O ATOM 0 H GLY A 44 32.396 -25.058 -15.825 1.00 0.00 H new ATOM 0 HA2 GLY A 44 32.187 -26.755 -14.293 1.00 0.00 H new ATOM 0 HA3 GLY A 44 30.493 -26.932 -14.703 1.00 0.00 H new ATOM 674 N GLN A 45 32.597 -27.975 -16.987 1.00 0.00 N ATOM 675 CA GLN A 45 32.908 -29.148 -17.809 1.00 0.00 C ATOM 676 C GLN A 45 34.201 -29.835 -17.362 1.00 0.00 C ATOM 677 O GLN A 45 34.177 -30.887 -16.723 1.00 0.00 O ATOM 678 CB GLN A 45 32.971 -28.815 -19.310 1.00 0.00 C ATOM 679 CG GLN A 45 31.608 -28.393 -19.877 1.00 0.00 C ATOM 680 CD GLN A 45 30.761 -29.600 -20.264 1.00 0.00 C ATOM 681 OE1 GLN A 45 31.199 -30.493 -20.987 1.00 0.00 O ATOM 682 NE2 GLN A 45 29.524 -29.622 -19.808 1.00 0.00 N ATOM 0 H GLN A 45 33.013 -27.097 -17.297 1.00 0.00 H new ATOM 0 HA GLN A 45 32.083 -29.844 -17.659 1.00 0.00 H new ATOM 0 HB2 GLN A 45 33.692 -28.013 -19.471 1.00 0.00 H new ATOM 0 HB3 GLN A 45 33.335 -29.685 -19.857 1.00 0.00 H new ATOM 0 HG2 GLN A 45 31.075 -27.796 -19.137 1.00 0.00 H new ATOM 0 HG3 GLN A 45 31.758 -27.758 -20.750 1.00 0.00 H new ATOM 0 HE21 GLN A 45 29.187 -28.867 -19.210 1.00 0.00 H new ATOM 0 HE22 GLN A 45 28.904 -30.394 -20.053 1.00 0.00 H new ATOM 691 N THR A 46 35.341 -29.203 -17.657 1.00 0.00 N ATOM 692 CA THR A 46 36.631 -29.859 -17.391 1.00 0.00 C ATOM 693 C THR A 46 36.769 -31.173 -18.243 1.00 0.00 C ATOM 694 O THR A 46 35.767 -31.858 -18.458 1.00 0.00 O ATOM 695 CB THR A 46 36.913 -30.110 -15.893 1.00 0.00 C ATOM 696 OG1 THR A 46 36.308 -31.332 -15.500 1.00 0.00 O ATOM 697 CG2 THR A 46 36.367 -28.983 -15.009 1.00 0.00 C ATOM 0 H THR A 46 35.402 -28.271 -18.066 1.00 0.00 H new ATOM 0 HA THR A 46 37.403 -29.156 -17.705 1.00 0.00 H new ATOM 0 HB THR A 46 37.994 -30.151 -15.763 1.00 0.00 H new ATOM 0 HG1 THR A 46 35.420 -31.403 -15.908 1.00 0.00 H new ATOM 0 HG21 THR A 46 36.588 -29.201 -13.964 1.00 0.00 H new ATOM 0 HG22 THR A 46 36.836 -28.040 -15.290 1.00 0.00 H new ATOM 0 HG23 THR A 46 35.288 -28.905 -15.143 1.00 0.00 H new ATOM 705 N TYR A 47 37.955 -31.575 -18.746 1.00 0.00 N ATOM 706 CA TYR A 47 37.910 -32.610 -19.781 1.00 0.00 C ATOM 707 C TYR A 47 38.806 -33.824 -19.456 1.00 0.00 C ATOM 708 O TYR A 47 38.520 -34.581 -18.528 1.00 0.00 O ATOM 709 CB TYR A 47 38.129 -32.014 -21.171 1.00 0.00 C ATOM 710 CG TYR A 47 36.887 -31.291 -21.702 1.00 0.00 C ATOM 711 CD1 TYR A 47 35.837 -32.003 -22.189 1.00 0.00 C ATOM 712 CD2 TYR A 47 36.823 -29.933 -21.686 1.00 0.00 C ATOM 713 CE1 TYR A 47 34.656 -31.378 -22.448 1.00 0.00 C ATOM 714 CE2 TYR A 47 35.651 -29.304 -21.979 1.00 0.00 C ATOM 715 CZ TYR A 47 34.565 -30.031 -22.336 1.00 0.00 C ATOM 716 OH TYR A 47 33.369 -29.404 -22.570 1.00 0.00 O ATOM 0 H TYR A 47 38.877 -31.231 -18.478 1.00 0.00 H new ATOM 0 HA TYR A 47 36.902 -33.024 -19.791 1.00 0.00 H new ATOM 0 HB2 TYR A 47 38.965 -31.315 -21.136 1.00 0.00 H new ATOM 0 HB3 TYR A 47 38.407 -32.808 -21.864 1.00 0.00 H new ATOM 0 HD1 TYR A 47 35.939 -33.063 -22.370 1.00 0.00 H new ATOM 0 HD2 TYR A 47 37.701 -29.353 -21.441 1.00 0.00 H new ATOM 0 HE1 TYR A 47 33.792 -31.955 -22.743 1.00 0.00 H new ATOM 0 HE2 TYR A 47 35.588 -28.227 -21.927 1.00 0.00 H new ATOM 0 HH TYR A 47 32.669 -29.820 -22.025 1.00 0.00 H new ATOM 726 N THR A 48 39.897 -34.022 -20.202 1.00 0.00 N ATOM 727 CA THR A 48 40.724 -35.219 -19.961 1.00 0.00 C ATOM 728 C THR A 48 42.023 -34.889 -19.210 1.00 0.00 C ATOM 729 O THR A 48 42.057 -34.904 -17.980 1.00 0.00 O ATOM 730 CB THR A 48 40.968 -36.057 -21.235 1.00 0.00 C ATOM 731 OG1 THR A 48 41.488 -35.230 -22.267 1.00 0.00 O ATOM 732 CG2 THR A 48 39.668 -36.698 -21.728 1.00 0.00 C ATOM 0 H THR A 48 40.222 -33.404 -20.946 1.00 0.00 H new ATOM 0 HA THR A 48 40.139 -35.859 -19.301 1.00 0.00 H new ATOM 0 HB THR A 48 41.682 -36.843 -20.987 1.00 0.00 H new ATOM 0 HG1 THR A 48 41.030 -34.364 -22.254 1.00 0.00 H new ATOM 0 HG21 THR A 48 39.868 -37.282 -22.626 1.00 0.00 H new ATOM 0 HG22 THR A 48 39.267 -37.351 -20.952 1.00 0.00 H new ATOM 0 HG23 THR A 48 38.942 -35.918 -21.957 1.00 0.00 H new ATOM 740 N LYS A 49 43.105 -34.590 -19.932 1.00 0.00 N ATOM 741 CA LYS A 49 44.368 -34.309 -19.232 1.00 0.00 C ATOM 742 C LYS A 49 45.345 -33.449 -20.056 1.00 0.00 C ATOM 743 O LYS A 49 45.387 -32.228 -19.904 1.00 0.00 O ATOM 744 CB LYS A 49 45.012 -35.589 -18.661 1.00 0.00 C ATOM 745 CG LYS A 49 46.296 -35.310 -17.863 1.00 0.00 C ATOM 746 CD LYS A 49 46.015 -34.580 -16.541 1.00 0.00 C ATOM 747 CE LYS A 49 46.916 -33.350 -16.382 1.00 0.00 C ATOM 748 NZ LYS A 49 46.378 -32.213 -17.156 1.00 0.00 N ATOM 0 H LYS A 49 43.140 -34.536 -20.950 1.00 0.00 H new ATOM 0 HA LYS A 49 44.109 -33.689 -18.374 1.00 0.00 H new ATOM 0 HB2 LYS A 49 44.293 -36.095 -18.017 1.00 0.00 H new ATOM 0 HB3 LYS A 49 45.241 -36.271 -19.480 1.00 0.00 H new ATOM 0 HG2 LYS A 49 46.803 -36.252 -17.654 1.00 0.00 H new ATOM 0 HG3 LYS A 49 46.975 -34.710 -18.469 1.00 0.00 H new ATOM 0 HD2 LYS A 49 44.969 -34.274 -16.507 1.00 0.00 H new ATOM 0 HD3 LYS A 49 46.175 -35.261 -15.706 1.00 0.00 H new ATOM 0 HE2 LYS A 49 46.989 -33.079 -15.329 1.00 0.00 H new ATOM 0 HE3 LYS A 49 47.925 -33.584 -16.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 47.079 -31.912 -17.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 45.503 -32.504 -17.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 46.172 -31.422 -16.513 1.00 0.00 H new ATOM 762 N ARG A 50 46.169 -34.074 -20.895 1.00 0.00 N ATOM 763 CA ARG A 50 47.180 -33.286 -21.632 1.00 0.00 C ATOM 764 C ARG A 50 46.667 -32.698 -22.955 1.00 0.00 C ATOM 765 O ARG A 50 47.037 -31.593 -23.355 1.00 0.00 O ATOM 766 CB ARG A 50 48.464 -34.083 -21.898 1.00 0.00 C ATOM 767 CG ARG A 50 49.229 -34.403 -20.604 1.00 0.00 C ATOM 768 CD ARG A 50 50.564 -33.655 -20.535 1.00 0.00 C ATOM 769 NE ARG A 50 50.343 -32.265 -20.104 1.00 0.00 N ATOM 770 CZ ARG A 50 51.319 -31.612 -19.483 1.00 0.00 C ATOM 771 NH1 ARG A 50 52.587 -31.909 -19.712 1.00 0.00 N ATOM 772 NH2 ARG A 50 51.020 -30.640 -18.646 1.00 0.00 N ATOM 0 H ARG A 50 46.168 -35.077 -21.083 1.00 0.00 H new ATOM 0 HA ARG A 50 47.405 -32.454 -20.965 1.00 0.00 H new ATOM 0 HB2 ARG A 50 48.213 -35.013 -22.409 1.00 0.00 H new ATOM 0 HB3 ARG A 50 49.109 -33.515 -22.568 1.00 0.00 H new ATOM 0 HG2 ARG A 50 48.617 -34.134 -19.743 1.00 0.00 H new ATOM 0 HG3 ARG A 50 49.410 -35.476 -20.544 1.00 0.00 H new ATOM 0 HD2 ARG A 50 51.236 -34.157 -19.839 1.00 0.00 H new ATOM 0 HD3 ARG A 50 51.048 -33.669 -21.511 1.00 0.00 H new ATOM 0 HE ARG A 50 49.449 -31.807 -20.281 1.00 0.00 H new ATOM 0 HH11 ARG A 50 52.826 -32.648 -20.373 1.00 0.00 H new ATOM 0 HH12 ARG A 50 53.326 -31.399 -19.228 1.00 0.00 H new ATOM 0 HH21 ARG A 50 50.045 -30.393 -18.478 1.00 0.00 H new ATOM 0 HH22 ARG A 50 51.764 -30.134 -18.165 1.00 0.00 H new ATOM 786 N GLU A 51 45.839 -33.453 -23.660 1.00 0.00 N ATOM 787 CA GLU A 51 45.318 -32.959 -24.943 1.00 0.00 C ATOM 788 C GLU A 51 44.185 -31.910 -24.784 1.00 0.00 C ATOM 789 O GLU A 51 44.093 -30.939 -25.543 1.00 0.00 O ATOM 790 CB GLU A 51 45.008 -34.101 -25.942 1.00 0.00 C ATOM 791 CG GLU A 51 44.933 -35.515 -25.315 1.00 0.00 C ATOM 792 CD GLU A 51 43.876 -35.660 -24.217 1.00 0.00 C ATOM 793 OE1 GLU A 51 42.711 -35.978 -24.537 1.00 0.00 O ATOM 794 OE2 GLU A 51 44.218 -35.490 -23.026 1.00 0.00 O ATOM 0 H GLU A 51 45.516 -34.381 -23.386 1.00 0.00 H new ATOM 0 HA GLU A 51 46.129 -32.399 -25.408 1.00 0.00 H new ATOM 0 HB2 GLU A 51 44.059 -33.887 -26.433 1.00 0.00 H new ATOM 0 HB3 GLU A 51 45.774 -34.104 -26.717 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.724 -36.239 -26.103 1.00 0.00 H new ATOM 0 HG3 GLU A 51 45.909 -35.768 -24.900 1.00 0.00 H new ATOM 801 N THR A 52 43.330 -32.058 -23.774 1.00 0.00 N ATOM 802 CA THR A 52 42.412 -30.947 -23.470 1.00 0.00 C ATOM 803 C THR A 52 43.193 -29.758 -22.855 1.00 0.00 C ATOM 804 O THR A 52 42.803 -28.597 -22.965 1.00 0.00 O ATOM 805 CB THR A 52 41.170 -31.332 -22.647 1.00 0.00 C ATOM 806 OG1 THR A 52 41.245 -32.690 -22.263 1.00 0.00 O ATOM 807 CG2 THR A 52 39.862 -31.156 -23.446 1.00 0.00 C ATOM 0 H THR A 52 43.248 -32.882 -23.179 1.00 0.00 H new ATOM 0 HA THR A 52 41.990 -30.634 -24.425 1.00 0.00 H new ATOM 0 HB THR A 52 41.156 -30.670 -21.781 1.00 0.00 H new ATOM 0 HG1 THR A 52 41.953 -32.802 -21.595 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.014 -31.440 -22.823 1.00 0.00 H new ATOM 0 HG22 THR A 52 39.757 -30.114 -23.748 1.00 0.00 H new ATOM 0 HG23 THR A 52 39.889 -31.789 -24.333 1.00 0.00 H new ATOM 815 N GLU A 53 44.314 -30.051 -22.196 1.00 0.00 N ATOM 816 CA GLU A 53 45.292 -28.978 -21.914 1.00 0.00 C ATOM 817 C GLU A 53 45.675 -28.233 -23.209 1.00 0.00 C ATOM 818 O GLU A 53 45.851 -27.014 -23.228 1.00 0.00 O ATOM 819 CB GLU A 53 46.571 -29.486 -21.227 1.00 0.00 C ATOM 820 CG GLU A 53 46.636 -29.119 -19.742 1.00 0.00 C ATOM 821 CD GLU A 53 47.987 -29.514 -19.161 1.00 0.00 C ATOM 822 OE1 GLU A 53 48.971 -28.771 -19.368 1.00 0.00 O ATOM 823 OE2 GLU A 53 48.079 -30.580 -18.514 1.00 0.00 O ATOM 0 H GLU A 53 44.569 -30.978 -21.856 1.00 0.00 H new ATOM 0 HA GLU A 53 44.795 -28.298 -21.221 1.00 0.00 H new ATOM 0 HB2 GLU A 53 46.627 -30.570 -21.331 1.00 0.00 H new ATOM 0 HB3 GLU A 53 47.440 -29.071 -21.737 1.00 0.00 H new ATOM 0 HG2 GLU A 53 46.478 -28.048 -19.617 1.00 0.00 H new ATOM 0 HG3 GLU A 53 45.837 -29.625 -19.200 1.00 0.00 H new ATOM 830 N ALA A 54 45.828 -28.994 -24.298 1.00 0.00 N ATOM 831 CA ALA A 54 45.948 -28.368 -25.625 1.00 0.00 C ATOM 832 C ALA A 54 44.798 -27.406 -25.919 1.00 0.00 C ATOM 833 O ALA A 54 45.013 -26.314 -26.441 1.00 0.00 O ATOM 834 CB ALA A 54 46.012 -29.375 -26.774 1.00 0.00 C ATOM 0 H ALA A 54 45.871 -30.013 -24.294 1.00 0.00 H new ATOM 0 HA ALA A 54 46.893 -27.827 -25.574 1.00 0.00 H new ATOM 0 HB1 ALA A 54 46.100 -28.842 -27.721 1.00 0.00 H new ATOM 0 HB2 ALA A 54 46.878 -30.024 -26.641 1.00 0.00 H new ATOM 0 HB3 ALA A 54 45.104 -29.978 -26.780 1.00 0.00 H new ATOM 840 N ILE A 55 43.561 -27.819 -25.612 1.00 0.00 N ATOM 841 CA ILE A 55 42.444 -26.842 -25.691 1.00 0.00 C ATOM 842 C ILE A 55 42.844 -25.520 -25.001 1.00 0.00 C ATOM 843 O ILE A 55 42.861 -24.439 -25.602 1.00 0.00 O ATOM 844 CB ILE A 55 41.110 -27.223 -24.985 1.00 0.00 C ATOM 845 CG1 ILE A 55 40.349 -28.388 -25.550 1.00 0.00 C ATOM 846 CG2 ILE A 55 40.183 -26.020 -25.009 1.00 0.00 C ATOM 847 CD1 ILE A 55 39.069 -28.670 -24.763 1.00 0.00 C ATOM 0 H ILE A 55 43.306 -28.763 -25.322 1.00 0.00 H new ATOM 0 HA ILE A 55 42.271 -26.790 -26.766 1.00 0.00 H new ATOM 0 HB ILE A 55 41.417 -27.532 -23.986 1.00 0.00 H new ATOM 0 HG12 ILE A 55 40.098 -28.187 -26.591 1.00 0.00 H new ATOM 0 HG13 ILE A 55 40.983 -29.274 -25.541 1.00 0.00 H new ATOM 0 HG21 ILE A 55 39.244 -26.274 -24.517 1.00 0.00 H new ATOM 0 HG22 ILE A 55 40.653 -25.188 -24.485 1.00 0.00 H new ATOM 0 HG23 ILE A 55 39.985 -25.734 -26.042 1.00 0.00 H new ATOM 0 HD11 ILE A 55 38.550 -29.520 -25.206 1.00 0.00 H new ATOM 0 HD12 ILE A 55 39.321 -28.898 -23.727 1.00 0.00 H new ATOM 0 HD13 ILE A 55 38.422 -27.793 -24.794 1.00 0.00 H new ATOM 859 N MET A 56 43.128 -25.638 -23.704 1.00 0.00 N ATOM 860 CA MET A 56 43.351 -24.437 -22.884 1.00 0.00 C ATOM 861 C MET A 56 44.515 -23.556 -23.376 1.00 0.00 C ATOM 862 O MET A 56 44.536 -22.346 -23.149 1.00 0.00 O ATOM 863 CB MET A 56 43.483 -24.742 -21.374 1.00 0.00 C ATOM 864 CG MET A 56 42.854 -26.082 -20.939 1.00 0.00 C ATOM 865 SD MET A 56 41.110 -26.161 -21.408 1.00 0.00 S ATOM 866 CE MET A 56 40.656 -27.766 -20.693 1.00 0.00 C ATOM 0 H MET A 56 43.209 -26.524 -23.205 1.00 0.00 H new ATOM 0 HA MET A 56 42.440 -23.853 -23.016 1.00 0.00 H new ATOM 0 HB2 MET A 56 44.540 -24.747 -21.107 1.00 0.00 H new ATOM 0 HB3 MET A 56 43.016 -23.935 -20.810 1.00 0.00 H new ATOM 0 HG2 MET A 56 43.396 -26.908 -21.399 1.00 0.00 H new ATOM 0 HG3 MET A 56 42.950 -26.199 -19.860 1.00 0.00 H new ATOM 0 HE1 MET A 56 39.803 -28.177 -21.233 1.00 0.00 H new ATOM 0 HE2 MET A 56 41.500 -28.451 -20.772 1.00 0.00 H new ATOM 0 HE3 MET A 56 40.392 -27.635 -19.644 1.00 0.00 H new ATOM 876 N LYS A 57 45.481 -24.158 -24.068 1.00 0.00 N ATOM 877 CA LYS A 57 46.592 -23.362 -24.606 1.00 0.00 C ATOM 878 C LYS A 57 46.304 -22.782 -26.001 1.00 0.00 C ATOM 879 O LYS A 57 46.660 -21.641 -26.300 1.00 0.00 O ATOM 880 CB LYS A 57 47.907 -24.151 -24.625 1.00 0.00 C ATOM 881 CG LYS A 57 48.424 -24.396 -23.203 1.00 0.00 C ATOM 882 CD LYS A 57 49.094 -25.766 -23.095 1.00 0.00 C ATOM 883 CE LYS A 57 49.319 -26.137 -21.631 1.00 0.00 C ATOM 884 NZ LYS A 57 49.901 -27.487 -21.538 1.00 0.00 N ATOM 0 H LYS A 57 45.523 -25.158 -24.267 1.00 0.00 H new ATOM 0 HA LYS A 57 46.699 -22.521 -23.921 1.00 0.00 H new ATOM 0 HB2 LYS A 57 47.755 -25.105 -25.129 1.00 0.00 H new ATOM 0 HB3 LYS A 57 48.655 -23.603 -25.198 1.00 0.00 H new ATOM 0 HG2 LYS A 57 49.135 -23.616 -22.931 1.00 0.00 H new ATOM 0 HG3 LYS A 57 47.597 -24.334 -22.495 1.00 0.00 H new ATOM 0 HD2 LYS A 57 48.472 -26.521 -23.576 1.00 0.00 H new ATOM 0 HD3 LYS A 57 50.047 -25.754 -23.624 1.00 0.00 H new ATOM 0 HE2 LYS A 57 49.984 -25.412 -21.161 1.00 0.00 H new ATOM 0 HE3 LYS A 57 48.374 -26.101 -21.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 49.787 -27.848 -20.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 49.415 -28.121 -22.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 50.913 -27.446 -21.776 1.00 0.00 H new ATOM 898 N GLU A 58 45.669 -23.570 -26.869 1.00 0.00 N ATOM 899 CA GLU A 58 45.377 -23.070 -28.226 1.00 0.00 C ATOM 900 C GLU A 58 44.279 -21.984 -28.294 1.00 0.00 C ATOM 901 O GLU A 58 44.149 -21.279 -29.295 1.00 0.00 O ATOM 902 CB GLU A 58 45.106 -24.218 -29.212 1.00 0.00 C ATOM 903 CG GLU A 58 43.685 -24.779 -29.068 1.00 0.00 C ATOM 904 CD GLU A 58 43.526 -26.098 -29.813 1.00 0.00 C ATOM 905 OE1 GLU A 58 43.876 -26.162 -31.011 1.00 0.00 O ATOM 906 OE2 GLU A 58 43.042 -27.077 -29.204 1.00 0.00 O ATOM 0 H GLU A 58 45.355 -24.521 -26.676 1.00 0.00 H new ATOM 0 HA GLU A 58 46.290 -22.562 -28.537 1.00 0.00 H new ATOM 0 HB2 GLU A 58 45.253 -23.862 -30.232 1.00 0.00 H new ATOM 0 HB3 GLU A 58 45.829 -25.016 -29.046 1.00 0.00 H new ATOM 0 HG2 GLU A 58 43.456 -24.927 -28.012 1.00 0.00 H new ATOM 0 HG3 GLU A 58 42.966 -24.055 -29.451 1.00 0.00 H new ATOM 913 N ALA A 59 43.468 -21.865 -27.239 1.00 0.00 N ATOM 914 CA ALA A 59 42.497 -20.760 -27.200 1.00 0.00 C ATOM 915 C ALA A 59 43.066 -19.339 -27.405 1.00 0.00 C ATOM 916 O ALA A 59 42.310 -18.374 -27.509 1.00 0.00 O ATOM 917 CB ALA A 59 41.670 -20.815 -25.913 1.00 0.00 C ATOM 0 H ALA A 59 43.458 -22.488 -26.432 1.00 0.00 H new ATOM 0 HA ALA A 59 41.870 -20.931 -28.075 1.00 0.00 H new ATOM 0 HB1 ALA A 59 40.958 -19.990 -25.903 1.00 0.00 H new ATOM 0 HB2 ALA A 59 41.130 -21.761 -25.867 1.00 0.00 H new ATOM 0 HB3 ALA A 59 42.332 -20.733 -25.051 1.00 0.00 H new ATOM 923 N ARG A 60 44.390 -19.174 -27.431 1.00 0.00 N ATOM 924 CA ARG A 60 44.918 -17.849 -27.796 1.00 0.00 C ATOM 925 C ARG A 60 44.895 -17.598 -29.322 1.00 0.00 C ATOM 926 O ARG A 60 45.929 -17.494 -29.982 1.00 0.00 O ATOM 927 CB ARG A 60 46.257 -17.555 -27.078 1.00 0.00 C ATOM 928 CG ARG A 60 47.158 -16.491 -27.735 1.00 0.00 C ATOM 929 CD ARG A 60 46.438 -15.151 -27.931 1.00 0.00 C ATOM 930 NE ARG A 60 47.356 -14.170 -28.535 1.00 0.00 N ATOM 931 CZ ARG A 60 47.332 -13.963 -29.849 1.00 0.00 C ATOM 932 NH1 ARG A 60 46.952 -14.916 -30.677 1.00 0.00 N ATOM 933 NH2 ARG A 60 47.716 -12.800 -30.333 1.00 0.00 N ATOM 0 H ARG A 60 45.084 -19.890 -27.219 1.00 0.00 H new ATOM 0 HA ARG A 60 44.236 -17.089 -27.415 1.00 0.00 H new ATOM 0 HB2 ARG A 60 46.037 -17.237 -26.059 1.00 0.00 H new ATOM 0 HB3 ARG A 60 46.820 -18.486 -27.007 1.00 0.00 H new ATOM 0 HG2 ARG A 60 48.043 -16.337 -27.117 1.00 0.00 H new ATOM 0 HG3 ARG A 60 47.504 -16.859 -28.701 1.00 0.00 H new ATOM 0 HD2 ARG A 60 45.566 -15.287 -28.571 1.00 0.00 H new ATOM 0 HD3 ARG A 60 46.075 -14.780 -26.972 1.00 0.00 H new ATOM 0 HE ARG A 60 48.008 -13.651 -27.947 1.00 0.00 H new ATOM 0 HH11 ARG A 60 46.671 -15.826 -30.312 1.00 0.00 H new ATOM 0 HH12 ARG A 60 46.939 -14.743 -31.682 1.00 0.00 H new ATOM 0 HH21 ARG A 60 48.030 -12.063 -29.701 1.00 0.00 H new ATOM 0 HH22 ARG A 60 47.700 -12.636 -31.340 1.00 0.00 H new ATOM 947 N GLY A 61 43.694 -17.535 -29.903 1.00 0.00 N ATOM 948 CA GLY A 61 43.607 -16.990 -31.263 1.00 0.00 C ATOM 949 C GLY A 61 43.642 -18.062 -32.363 1.00 0.00 C ATOM 950 O GLY A 61 44.440 -18.999 -32.315 1.00 0.00 O ATOM 0 H GLY A 61 42.814 -17.835 -29.484 1.00 0.00 H new ATOM 0 HA2 GLY A 61 42.685 -16.417 -31.356 1.00 0.00 H new ATOM 0 HA3 GLY A 61 44.432 -16.295 -31.419 1.00 0.00 H new ATOM 954 N PRO A 62 42.820 -17.891 -33.411 1.00 0.00 N ATOM 955 CA PRO A 62 42.952 -18.765 -34.584 1.00 0.00 C ATOM 956 C PRO A 62 43.913 -18.084 -35.571 1.00 0.00 C ATOM 957 O PRO A 62 45.044 -18.526 -35.769 1.00 0.00 O ATOM 958 CB PRO A 62 41.530 -18.922 -35.140 1.00 0.00 C ATOM 959 CG PRO A 62 40.624 -17.980 -34.343 1.00 0.00 C ATOM 960 CD PRO A 62 41.451 -17.427 -33.183 1.00 0.00 C ATOM 0 HA PRO A 62 43.364 -19.751 -34.367 1.00 0.00 H new ATOM 0 HB2 PRO A 62 41.503 -18.675 -36.201 1.00 0.00 H new ATOM 0 HB3 PRO A 62 41.191 -19.954 -35.044 1.00 0.00 H new ATOM 0 HG2 PRO A 62 40.260 -17.170 -34.976 1.00 0.00 H new ATOM 0 HG3 PRO A 62 39.748 -18.512 -33.971 1.00 0.00 H new ATOM 0 HD2 PRO A 62 41.407 -16.338 -33.156 1.00 0.00 H new ATOM 0 HD3 PRO A 62 41.071 -17.786 -32.226 1.00 0.00 H new ATOM 968 N LYS A 63 43.463 -16.994 -36.196 1.00 0.00 N ATOM 969 CA LYS A 63 44.439 -16.110 -36.858 1.00 0.00 C ATOM 970 C LYS A 63 45.197 -15.304 -35.791 1.00 0.00 C ATOM 971 O LYS A 63 46.417 -15.148 -35.840 1.00 0.00 O ATOM 972 CB LYS A 63 43.842 -15.233 -37.978 1.00 0.00 C ATOM 973 CG LYS A 63 44.931 -14.635 -38.874 1.00 0.00 C ATOM 974 CD LYS A 63 44.327 -13.601 -39.832 1.00 0.00 C ATOM 975 CE LYS A 63 45.404 -12.686 -40.421 1.00 0.00 C ATOM 976 NZ LYS A 63 45.697 -11.587 -39.480 1.00 0.00 N ATOM 0 H LYS A 63 42.486 -16.708 -36.261 1.00 0.00 H new ATOM 0 HA LYS A 63 45.150 -16.741 -37.392 1.00 0.00 H new ATOM 0 HB2 LYS A 63 43.161 -15.831 -38.584 1.00 0.00 H new ATOM 0 HB3 LYS A 63 43.253 -14.429 -37.536 1.00 0.00 H new ATOM 0 HG2 LYS A 63 45.699 -14.166 -38.260 1.00 0.00 H new ATOM 0 HG3 LYS A 63 45.418 -15.427 -39.443 1.00 0.00 H new ATOM 0 HD2 LYS A 63 43.802 -14.113 -40.638 1.00 0.00 H new ATOM 0 HD3 LYS A 63 43.588 -13.000 -39.302 1.00 0.00 H new ATOM 0 HE2 LYS A 63 46.310 -13.258 -40.620 1.00 0.00 H new ATOM 0 HE3 LYS A 63 45.067 -12.280 -41.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 45.776 -10.693 -40.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 44.929 -11.513 -38.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 46.593 -11.780 -38.988 1.00 0.00 H new ATOM 990 N GLY A 64 44.454 -14.806 -34.804 1.00 0.00 N ATOM 991 CA GLY A 64 45.112 -14.278 -33.601 1.00 0.00 C ATOM 992 C GLY A 64 45.875 -12.968 -33.821 1.00 0.00 C ATOM 993 O GLY A 64 46.894 -12.723 -33.172 1.00 0.00 O ATOM 0 H GLY A 64 43.435 -14.755 -34.805 1.00 0.00 H new ATOM 0 HA2 GLY A 64 44.359 -14.120 -32.829 1.00 0.00 H new ATOM 0 HA3 GLY A 64 45.805 -15.029 -33.221 1.00 0.00 H new ATOM 997 N ASP A 65 45.398 -12.106 -34.716 1.00 0.00 N ATOM 998 CA ASP A 65 46.007 -10.770 -34.803 1.00 0.00 C ATOM 999 C ASP A 65 45.686 -9.921 -33.564 1.00 0.00 C ATOM 1000 O ASP A 65 46.499 -9.112 -33.115 1.00 0.00 O ATOM 1001 CB ASP A 65 45.676 -10.017 -36.102 1.00 0.00 C ATOM 1002 CG ASP A 65 44.217 -10.164 -36.517 1.00 0.00 C ATOM 1003 OD1 ASP A 65 43.343 -9.528 -35.888 1.00 0.00 O ATOM 1004 OD2 ASP A 65 43.940 -10.908 -37.483 1.00 0.00 O ATOM 0 H ASP A 65 44.631 -12.288 -35.364 1.00 0.00 H new ATOM 0 HA ASP A 65 47.083 -10.942 -34.830 1.00 0.00 H new ATOM 0 HB2 ASP A 65 45.907 -8.960 -35.972 1.00 0.00 H new ATOM 0 HB3 ASP A 65 46.316 -10.387 -36.903 1.00 0.00 H new ATOM 1009 N LYS A 66 44.495 -10.113 -32.997 1.00 0.00 N ATOM 1010 CA LYS A 66 44.186 -9.412 -31.750 1.00 0.00 C ATOM 1011 C LYS A 66 44.676 -10.199 -30.523 1.00 0.00 C ATOM 1012 O LYS A 66 45.777 -9.963 -30.023 1.00 0.00 O ATOM 1013 CB LYS A 66 42.703 -8.993 -31.639 1.00 0.00 C ATOM 1014 CG LYS A 66 42.517 -7.471 -31.759 1.00 0.00 C ATOM 1015 CD LYS A 66 42.785 -6.976 -33.185 1.00 0.00 C ATOM 1016 CE LYS A 66 41.574 -7.216 -34.094 1.00 0.00 C ATOM 1017 NZ LYS A 66 42.018 -7.316 -35.496 1.00 0.00 N ATOM 0 H LYS A 66 43.759 -10.718 -33.359 1.00 0.00 H new ATOM 0 HA LYS A 66 44.745 -8.477 -31.773 1.00 0.00 H new ATOM 0 HB2 LYS A 66 42.128 -9.490 -32.420 1.00 0.00 H new ATOM 0 HB3 LYS A 66 42.302 -9.332 -30.684 1.00 0.00 H new ATOM 0 HG2 LYS A 66 41.501 -7.205 -31.467 1.00 0.00 H new ATOM 0 HG3 LYS A 66 43.191 -6.967 -31.066 1.00 0.00 H new ATOM 0 HD2 LYS A 66 43.022 -5.912 -33.165 1.00 0.00 H new ATOM 0 HD3 LYS A 66 43.656 -7.489 -33.593 1.00 0.00 H new ATOM 0 HE2 LYS A 66 41.061 -8.131 -33.799 1.00 0.00 H new ATOM 0 HE3 LYS A 66 40.859 -6.401 -33.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 41.256 -6.992 -36.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 42.860 -6.722 -35.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 42.252 -8.305 -35.716 1.00 0.00 H new ATOM 1031 N LYS A 67 43.890 -11.173 -30.055 1.00 0.00 N ATOM 1032 CA LYS A 67 44.280 -11.879 -28.817 1.00 0.00 C ATOM 1033 C LYS A 67 43.302 -12.979 -28.360 1.00 0.00 C ATOM 1034 O LYS A 67 43.524 -13.615 -27.330 1.00 0.00 O ATOM 1035 CB LYS A 67 44.456 -10.890 -27.639 1.00 0.00 C ATOM 1036 CG LYS A 67 45.699 -11.188 -26.795 1.00 0.00 C ATOM 1037 CD LYS A 67 45.883 -10.100 -25.732 1.00 0.00 C ATOM 1038 CE LYS A 67 47.146 -10.342 -24.905 1.00 0.00 C ATOM 1039 NZ LYS A 67 47.362 -9.212 -23.981 1.00 0.00 N ATOM 0 H LYS A 67 43.019 -11.485 -30.485 1.00 0.00 H new ATOM 0 HA LYS A 67 45.221 -12.362 -29.080 1.00 0.00 H new ATOM 0 HB2 LYS A 67 44.523 -9.875 -28.030 1.00 0.00 H new ATOM 0 HB3 LYS A 67 43.572 -10.929 -27.002 1.00 0.00 H new ATOM 0 HG2 LYS A 67 45.599 -12.162 -26.317 1.00 0.00 H new ATOM 0 HG3 LYS A 67 46.580 -11.236 -27.435 1.00 0.00 H new ATOM 0 HD2 LYS A 67 45.942 -9.124 -26.214 1.00 0.00 H new ATOM 0 HD3 LYS A 67 45.014 -10.079 -25.075 1.00 0.00 H new ATOM 0 HE2 LYS A 67 47.051 -11.271 -24.342 1.00 0.00 H new ATOM 0 HE3 LYS A 67 48.007 -10.455 -25.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 48.222 -9.381 -23.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 47.471 -8.333 -24.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 46.545 -9.124 -23.343 1.00 0.00 H new ATOM 1053 N ASN A 68 42.223 -13.232 -29.104 1.00 0.00 N ATOM 1054 CA ASN A 68 41.140 -14.016 -28.503 1.00 0.00 C ATOM 1055 C ASN A 68 40.421 -14.892 -29.523 1.00 0.00 C ATOM 1056 O ASN A 68 40.622 -14.770 -30.733 1.00 0.00 O ATOM 1057 CB ASN A 68 40.097 -13.153 -27.766 1.00 0.00 C ATOM 1058 CG ASN A 68 40.525 -11.711 -27.455 1.00 0.00 C ATOM 1059 OD1 ASN A 68 40.633 -11.304 -26.301 1.00 0.00 O ATOM 1060 ND2 ASN A 68 40.751 -10.913 -28.479 1.00 0.00 N ATOM 0 H ASN A 68 42.077 -12.927 -30.066 1.00 0.00 H new ATOM 0 HA ASN A 68 41.639 -14.650 -27.770 1.00 0.00 H new ATOM 0 HB2 ASN A 68 39.189 -13.121 -28.368 1.00 0.00 H new ATOM 0 HB3 ASN A 68 39.841 -13.647 -26.828 1.00 0.00 H new ATOM 0 HD21 ASN A 68 41.020 -9.942 -28.319 1.00 0.00 H new ATOM 0 HD22 ASN A 68 40.657 -11.266 -29.431 1.00 0.00 H new ATOM 1067 N ILE A 69 39.564 -15.789 -29.037 1.00 0.00 N ATOM 1068 CA ILE A 69 38.761 -16.566 -29.985 1.00 0.00 C ATOM 1069 C ILE A 69 37.334 -16.053 -30.088 1.00 0.00 C ATOM 1070 O ILE A 69 36.552 -16.029 -29.137 1.00 0.00 O ATOM 1071 CB ILE A 69 38.794 -18.085 -29.837 1.00 0.00 C ATOM 1072 CG1 ILE A 69 38.087 -18.585 -28.566 1.00 0.00 C ATOM 1073 CG2 ILE A 69 40.242 -18.570 -29.854 1.00 0.00 C ATOM 1074 CD1 ILE A 69 38.177 -20.108 -28.439 1.00 0.00 C ATOM 0 H ILE A 69 39.410 -15.991 -28.049 1.00 0.00 H new ATOM 0 HA ILE A 69 39.276 -16.388 -30.929 1.00 0.00 H new ATOM 0 HB ILE A 69 38.245 -18.500 -30.682 1.00 0.00 H new ATOM 0 HG12 ILE A 69 38.537 -18.118 -27.690 1.00 0.00 H new ATOM 0 HG13 ILE A 69 37.040 -18.281 -28.587 1.00 0.00 H new ATOM 0 HG21 ILE A 69 40.264 -19.655 -29.748 1.00 0.00 H new ATOM 0 HG22 ILE A 69 40.709 -18.288 -30.798 1.00 0.00 H new ATOM 0 HG23 ILE A 69 40.788 -18.114 -29.028 1.00 0.00 H new ATOM 0 HD11 ILE A 69 37.667 -20.428 -27.530 1.00 0.00 H new ATOM 0 HD12 ILE A 69 37.704 -20.574 -29.304 1.00 0.00 H new ATOM 0 HD13 ILE A 69 39.224 -20.408 -28.393 1.00 0.00 H new ATOM 1086 N GLY A 70 37.013 -15.657 -31.295 1.00 0.00 N ATOM 1087 CA GLY A 70 35.693 -15.061 -31.535 1.00 0.00 C ATOM 1088 C GLY A 70 34.634 -16.092 -31.968 1.00 0.00 C ATOM 1089 O GLY A 70 34.707 -17.268 -31.612 1.00 0.00 O ATOM 0 H GLY A 70 37.617 -15.727 -32.114 1.00 0.00 H new ATOM 0 HA2 GLY A 70 35.356 -14.562 -30.626 1.00 0.00 H new ATOM 0 HA3 GLY A 70 35.782 -14.295 -32.305 1.00 0.00 H new ATOM 1093 N PRO A 71 33.596 -15.607 -32.667 1.00 0.00 N ATOM 1094 CA PRO A 71 32.394 -16.420 -32.955 1.00 0.00 C ATOM 1095 C PRO A 71 32.534 -17.955 -32.988 1.00 0.00 C ATOM 1096 O PRO A 71 31.865 -18.661 -32.234 1.00 0.00 O ATOM 1097 CB PRO A 71 31.883 -15.893 -34.304 1.00 0.00 C ATOM 1098 CG PRO A 71 32.710 -14.659 -34.670 1.00 0.00 C ATOM 1099 CD PRO A 71 33.819 -14.529 -33.631 1.00 0.00 C ATOM 0 HA PRO A 71 31.713 -16.297 -32.113 1.00 0.00 H new ATOM 0 HB2 PRO A 71 31.979 -16.659 -35.074 1.00 0.00 H new ATOM 0 HB3 PRO A 71 30.825 -15.638 -34.238 1.00 0.00 H new ATOM 0 HG2 PRO A 71 33.131 -14.762 -35.670 1.00 0.00 H new ATOM 0 HG3 PRO A 71 32.085 -13.766 -34.678 1.00 0.00 H new ATOM 0 HD2 PRO A 71 34.801 -14.618 -34.095 1.00 0.00 H new ATOM 0 HD3 PRO A 71 33.784 -13.555 -33.143 1.00 0.00 H new ATOM 1107 N GLU A 72 33.367 -18.491 -33.872 1.00 0.00 N ATOM 1108 CA GLU A 72 33.236 -19.929 -34.178 1.00 0.00 C ATOM 1109 C GLU A 72 34.154 -20.916 -33.430 1.00 0.00 C ATOM 1110 O GLU A 72 33.696 -21.970 -32.978 1.00 0.00 O ATOM 1111 CB GLU A 72 33.190 -20.195 -35.685 1.00 0.00 C ATOM 1112 CG GLU A 72 34.555 -19.996 -36.355 1.00 0.00 C ATOM 1113 CD GLU A 72 34.413 -19.919 -37.866 1.00 0.00 C ATOM 1114 OE1 GLU A 72 34.207 -18.805 -38.394 1.00 0.00 O ATOM 1115 OE2 GLU A 72 34.507 -20.971 -38.533 1.00 0.00 O ATOM 0 H GLU A 72 34.105 -17.994 -34.371 1.00 0.00 H new ATOM 0 HA GLU A 72 32.265 -20.167 -33.745 1.00 0.00 H new ATOM 0 HB2 GLU A 72 32.847 -21.215 -35.861 1.00 0.00 H new ATOM 0 HB3 GLU A 72 32.461 -19.529 -36.147 1.00 0.00 H new ATOM 0 HG2 GLU A 72 35.017 -19.082 -35.982 1.00 0.00 H new ATOM 0 HG3 GLU A 72 35.218 -20.820 -36.090 1.00 0.00 H new ATOM 1122 N GLU A 73 35.450 -20.611 -33.322 1.00 0.00 N ATOM 1123 CA GLU A 73 36.372 -21.580 -32.697 1.00 0.00 C ATOM 1124 C GLU A 73 35.901 -22.107 -31.336 1.00 0.00 C ATOM 1125 O GLU A 73 36.063 -23.281 -31.016 1.00 0.00 O ATOM 1126 CB GLU A 73 37.813 -21.031 -32.616 1.00 0.00 C ATOM 1127 CG GLU A 73 38.756 -21.917 -31.775 1.00 0.00 C ATOM 1128 CD GLU A 73 39.382 -23.017 -32.623 1.00 0.00 C ATOM 1129 OE1 GLU A 73 38.690 -24.011 -32.935 1.00 0.00 O ATOM 1130 OE2 GLU A 73 40.571 -22.890 -32.986 1.00 0.00 O ATOM 0 H GLU A 73 35.877 -19.742 -33.642 1.00 0.00 H new ATOM 0 HA GLU A 73 36.370 -22.442 -33.364 1.00 0.00 H new ATOM 0 HB2 GLU A 73 38.216 -20.938 -33.624 1.00 0.00 H new ATOM 0 HB3 GLU A 73 37.789 -20.029 -32.188 1.00 0.00 H new ATOM 0 HG2 GLU A 73 39.541 -21.302 -31.336 1.00 0.00 H new ATOM 0 HG3 GLU A 73 38.201 -22.362 -30.950 1.00 0.00 H new ATOM 1137 N TRP A 74 35.300 -21.248 -30.537 1.00 0.00 N ATOM 1138 CA TRP A 74 34.886 -21.666 -29.203 1.00 0.00 C ATOM 1139 C TRP A 74 33.857 -22.818 -29.193 1.00 0.00 C ATOM 1140 O TRP A 74 34.053 -23.822 -28.501 1.00 0.00 O ATOM 1141 CB TRP A 74 34.542 -20.373 -28.436 1.00 0.00 C ATOM 1142 CG TRP A 74 34.138 -20.498 -26.976 1.00 0.00 C ATOM 1143 CD1 TRP A 74 32.906 -19.928 -26.654 1.00 0.00 C ATOM 1144 CD2 TRP A 74 35.035 -20.013 -26.048 1.00 0.00 C ATOM 1145 NE1 TRP A 74 33.029 -18.992 -25.621 1.00 0.00 N ATOM 1146 CE2 TRP A 74 34.375 -19.066 -25.259 1.00 0.00 C ATOM 1147 CE3 TRP A 74 35.968 -20.826 -25.471 1.00 0.00 C ATOM 1148 CZ2 TRP A 74 34.763 -18.883 -23.965 1.00 0.00 C ATOM 1149 CZ3 TRP A 74 36.321 -20.627 -24.175 1.00 0.00 C ATOM 1150 CH2 TRP A 74 35.709 -19.686 -23.427 1.00 0.00 C ATOM 0 H TRP A 74 35.089 -20.279 -30.775 1.00 0.00 H new ATOM 0 HA TRP A 74 35.686 -22.168 -28.659 1.00 0.00 H new ATOM 0 HB2 TRP A 74 35.408 -19.713 -28.488 1.00 0.00 H new ATOM 0 HB3 TRP A 74 33.730 -19.876 -28.966 1.00 0.00 H new ATOM 0 HD1 TRP A 74 31.975 -20.178 -27.141 1.00 0.00 H new ATOM 0 HE1 TRP A 74 32.304 -18.394 -25.225 1.00 0.00 H new ATOM 0 HE3 TRP A 74 36.422 -21.622 -26.042 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 34.316 -18.099 -23.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 37.102 -21.230 -23.737 1.00 0.00 H new ATOM 0 HH2 TRP A 74 35.977 -19.573 -22.387 1.00 0.00 H new ATOM 1161 N LEU A 75 32.824 -22.757 -30.041 1.00 0.00 N ATOM 1162 CA LEU A 75 31.934 -23.937 -30.142 1.00 0.00 C ATOM 1163 C LEU A 75 32.566 -25.097 -30.908 1.00 0.00 C ATOM 1164 O LEU A 75 32.500 -26.232 -30.450 1.00 0.00 O ATOM 1165 CB LEU A 75 30.529 -23.696 -30.712 1.00 0.00 C ATOM 1166 CG LEU A 75 29.428 -24.444 -29.921 1.00 0.00 C ATOM 1167 CD1 LEU A 75 28.102 -24.251 -30.594 1.00 0.00 C ATOM 1168 CD2 LEU A 75 29.556 -25.972 -29.894 1.00 0.00 C ATOM 0 H LEU A 75 32.586 -21.963 -30.635 1.00 0.00 H new ATOM 0 HA LEU A 75 31.804 -24.190 -29.090 1.00 0.00 H new ATOM 0 HB2 LEU A 75 30.316 -22.627 -30.702 1.00 0.00 H new ATOM 0 HB3 LEU A 75 30.504 -24.016 -31.754 1.00 0.00 H new ATOM 0 HG LEU A 75 29.524 -24.034 -28.916 1.00 0.00 H new ATOM 0 HD11 LEU A 75 27.330 -24.779 -30.034 1.00 0.00 H new ATOM 0 HD12 LEU A 75 27.863 -23.188 -30.628 1.00 0.00 H new ATOM 0 HD13 LEU A 75 28.148 -24.646 -31.609 1.00 0.00 H new ATOM 0 HD21 LEU A 75 28.736 -26.396 -29.315 1.00 0.00 H new ATOM 0 HD22 LEU A 75 29.518 -26.358 -30.913 1.00 0.00 H new ATOM 0 HD23 LEU A 75 30.505 -26.250 -29.436 1.00 0.00 H new ATOM 1180 N THR A 76 33.130 -24.873 -32.099 1.00 0.00 N ATOM 1181 CA THR A 76 33.744 -26.023 -32.787 1.00 0.00 C ATOM 1182 C THR A 76 34.827 -26.700 -31.946 1.00 0.00 C ATOM 1183 O THR A 76 34.901 -27.927 -31.880 1.00 0.00 O ATOM 1184 CB THR A 76 34.245 -25.765 -34.207 1.00 0.00 C ATOM 1185 OG1 THR A 76 33.146 -25.448 -35.049 1.00 0.00 O ATOM 1186 CG2 THR A 76 35.269 -24.633 -34.279 1.00 0.00 C ATOM 0 H THR A 76 33.178 -23.976 -32.583 1.00 0.00 H new ATOM 0 HA THR A 76 32.905 -26.709 -32.905 1.00 0.00 H new ATOM 0 HB THR A 76 34.740 -26.677 -34.539 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.469 -25.281 -35.959 1.00 0.00 H new ATOM 0 HG21 THR A 76 35.588 -24.496 -35.312 1.00 0.00 H new ATOM 0 HG22 THR A 76 34.818 -23.711 -33.913 1.00 0.00 H new ATOM 0 HG23 THR A 76 36.132 -24.884 -33.663 1.00 0.00 H new ATOM 1194 N LEU A 77 35.672 -25.909 -31.295 1.00 0.00 N ATOM 1195 CA LEU A 77 36.631 -26.494 -30.369 1.00 0.00 C ATOM 1196 C LEU A 77 35.963 -27.337 -29.285 1.00 0.00 C ATOM 1197 O LEU A 77 36.311 -28.502 -29.084 1.00 0.00 O ATOM 1198 CB LEU A 77 37.546 -25.424 -29.767 1.00 0.00 C ATOM 1199 CG LEU A 77 38.635 -26.047 -28.893 1.00 0.00 C ATOM 1200 CD1 LEU A 77 39.929 -25.265 -29.049 1.00 0.00 C ATOM 1201 CD2 LEU A 77 38.208 -26.022 -27.430 1.00 0.00 C ATOM 0 H LEU A 77 35.714 -24.894 -31.386 1.00 0.00 H new ATOM 0 HA LEU A 77 37.251 -27.177 -30.950 1.00 0.00 H new ATOM 0 HB2 LEU A 77 38.007 -24.845 -30.567 1.00 0.00 H new ATOM 0 HB3 LEU A 77 36.953 -24.729 -29.172 1.00 0.00 H new ATOM 0 HG LEU A 77 38.790 -27.079 -29.207 1.00 0.00 H new ATOM 0 HD11 LEU A 77 40.702 -25.713 -28.424 1.00 0.00 H new ATOM 0 HD12 LEU A 77 40.246 -25.290 -30.092 1.00 0.00 H new ATOM 0 HD13 LEU A 77 39.769 -24.231 -28.743 1.00 0.00 H new ATOM 0 HD21 LEU A 77 38.990 -26.468 -26.815 1.00 0.00 H new ATOM 0 HD22 LEU A 77 38.043 -24.991 -27.117 1.00 0.00 H new ATOM 0 HD23 LEU A 77 37.285 -26.589 -27.311 1.00 0.00 H new ATOM 1213 N CYS A 78 34.953 -26.780 -28.616 1.00 0.00 N ATOM 1214 CA CYS A 78 34.347 -27.536 -27.518 1.00 0.00 C ATOM 1215 C CYS A 78 33.517 -28.711 -28.064 1.00 0.00 C ATOM 1216 O CYS A 78 33.547 -29.793 -27.485 1.00 0.00 O ATOM 1217 CB CYS A 78 33.427 -26.505 -26.846 1.00 0.00 C ATOM 1218 SG CYS A 78 34.378 -25.559 -25.614 1.00 0.00 S ATOM 0 H CYS A 78 34.554 -25.859 -28.799 1.00 0.00 H new ATOM 0 HA CYS A 78 35.083 -27.967 -26.840 1.00 0.00 H new ATOM 0 HB2 CYS A 78 33.009 -25.832 -27.594 1.00 0.00 H new ATOM 0 HB3 CYS A 78 32.588 -27.008 -26.366 1.00 0.00 H new ATOM 0 HG CYS A 78 34.728 -24.414 -26.121 1.00 0.00 H new ATOM 1224 N SER A 79 32.798 -28.545 -29.180 1.00 0.00 N ATOM 1225 CA SER A 79 32.024 -29.684 -29.701 1.00 0.00 C ATOM 1226 C SER A 79 32.903 -30.861 -30.146 1.00 0.00 C ATOM 1227 O SER A 79 32.697 -32.003 -29.727 1.00 0.00 O ATOM 1228 CB SER A 79 31.064 -29.274 -30.820 1.00 0.00 C ATOM 1229 OG SER A 79 30.047 -30.257 -30.968 1.00 0.00 O ATOM 0 H SER A 79 32.733 -27.681 -29.719 1.00 0.00 H new ATOM 0 HA SER A 79 31.428 -30.031 -28.857 1.00 0.00 H new ATOM 0 HB2 SER A 79 30.617 -28.307 -30.591 1.00 0.00 H new ATOM 0 HB3 SER A 79 31.610 -29.159 -31.756 1.00 0.00 H new ATOM 0 HG SER A 79 30.446 -31.151 -30.918 1.00 0.00 H new ATOM 1235 N LYS A 80 33.906 -30.590 -30.980 1.00 0.00 N ATOM 1236 CA LYS A 80 34.770 -31.685 -31.429 1.00 0.00 C ATOM 1237 C LYS A 80 35.694 -32.255 -30.340 1.00 0.00 C ATOM 1238 O LYS A 80 36.179 -33.381 -30.456 1.00 0.00 O ATOM 1239 CB LYS A 80 35.525 -31.355 -32.725 1.00 0.00 C ATOM 1240 CG LYS A 80 36.652 -30.341 -32.499 1.00 0.00 C ATOM 1241 CD LYS A 80 36.845 -29.465 -33.737 1.00 0.00 C ATOM 1242 CE LYS A 80 37.986 -28.476 -33.511 1.00 0.00 C ATOM 1243 NZ LYS A 80 38.175 -27.629 -34.701 1.00 0.00 N ATOM 0 H LYS A 80 34.136 -29.666 -31.346 1.00 0.00 H new ATOM 0 HA LYS A 80 34.080 -32.496 -31.663 1.00 0.00 H new ATOM 0 HB2 LYS A 80 35.942 -32.271 -33.143 1.00 0.00 H new ATOM 0 HB3 LYS A 80 34.825 -30.959 -33.460 1.00 0.00 H new ATOM 0 HG2 LYS A 80 36.418 -29.716 -31.637 1.00 0.00 H new ATOM 0 HG3 LYS A 80 37.580 -30.865 -32.270 1.00 0.00 H new ATOM 0 HD2 LYS A 80 37.062 -30.090 -34.603 1.00 0.00 H new ATOM 0 HD3 LYS A 80 35.924 -28.925 -33.956 1.00 0.00 H new ATOM 0 HE2 LYS A 80 37.769 -27.852 -32.644 1.00 0.00 H new ATOM 0 HE3 LYS A 80 38.907 -29.017 -33.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 38.954 -26.962 -34.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 38.403 -28.227 -35.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 37.301 -27.099 -34.892 1.00 0.00 H new ATOM 1257 N TRP A 81 35.946 -31.501 -29.269 1.00 0.00 N ATOM 1258 CA TRP A 81 36.706 -32.091 -28.165 1.00 0.00 C ATOM 1259 C TRP A 81 35.846 -32.997 -27.286 1.00 0.00 C ATOM 1260 O TRP A 81 36.207 -34.130 -26.963 1.00 0.00 O ATOM 1261 CB TRP A 81 37.390 -31.039 -27.271 1.00 0.00 C ATOM 1262 CG TRP A 81 38.889 -31.145 -27.362 1.00 0.00 C ATOM 1263 CD1 TRP A 81 39.666 -30.374 -28.209 1.00 0.00 C ATOM 1264 CD2 TRP A 81 39.530 -32.322 -27.166 1.00 0.00 C ATOM 1265 NE1 TRP A 81 40.863 -31.054 -28.516 1.00 0.00 N ATOM 1266 CE2 TRP A 81 40.764 -32.255 -27.794 1.00 0.00 C ATOM 1267 CE3 TRP A 81 39.357 -33.063 -26.042 1.00 0.00 C ATOM 1268 CZ2 TRP A 81 41.837 -32.807 -27.171 1.00 0.00 C ATOM 1269 CZ3 TRP A 81 40.405 -33.748 -25.539 1.00 0.00 C ATOM 1270 CH2 TRP A 81 41.646 -33.560 -26.049 1.00 0.00 C ATOM 0 H TRP A 81 35.654 -30.532 -29.142 1.00 0.00 H new ATOM 0 HA TRP A 81 37.478 -32.687 -28.651 1.00 0.00 H new ATOM 0 HB2 TRP A 81 37.074 -30.040 -27.572 1.00 0.00 H new ATOM 0 HB3 TRP A 81 37.074 -31.175 -26.237 1.00 0.00 H new ATOM 0 HD1 TRP A 81 39.396 -29.396 -28.580 1.00 0.00 H new ATOM 0 HE1 TRP A 81 41.624 -30.745 -29.121 1.00 0.00 H new ATOM 0 HE3 TRP A 81 38.393 -33.104 -25.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 42.832 -32.651 -27.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 40.254 -34.447 -24.729 1.00 0.00 H new ATOM 0 HH2 TRP A 81 42.496 -34.013 -25.561 1.00 0.00 H new ATOM 1281 N VAL A 82 34.704 -32.469 -26.887 1.00 0.00 N ATOM 1282 CA VAL A 82 33.813 -33.230 -25.998 1.00 0.00 C ATOM 1283 C VAL A 82 33.228 -34.501 -26.640 1.00 0.00 C ATOM 1284 O VAL A 82 33.237 -35.573 -26.036 1.00 0.00 O ATOM 1285 CB VAL A 82 32.734 -32.330 -25.366 1.00 0.00 C ATOM 1286 CG1 VAL A 82 31.770 -31.795 -26.427 1.00 0.00 C ATOM 1287 CG2 VAL A 82 31.942 -33.091 -24.296 1.00 0.00 C ATOM 0 H VAL A 82 34.368 -31.542 -27.149 1.00 0.00 H new ATOM 0 HA VAL A 82 34.443 -33.596 -25.187 1.00 0.00 H new ATOM 0 HB VAL A 82 33.247 -31.489 -24.899 1.00 0.00 H new ATOM 0 HG11 VAL A 82 31.020 -31.163 -25.951 1.00 0.00 H new ATOM 0 HG12 VAL A 82 32.325 -31.210 -27.161 1.00 0.00 H new ATOM 0 HG13 VAL A 82 31.278 -32.630 -26.926 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.187 -32.433 -23.866 1.00 0.00 H new ATOM 0 HG22 VAL A 82 31.455 -33.955 -24.749 1.00 0.00 H new ATOM 0 HG23 VAL A 82 32.620 -33.427 -23.512 1.00 0.00 H new ATOM 1297 N ARG A 83 32.729 -34.397 -27.870 1.00 0.00 N ATOM 1298 CA ARG A 83 32.158 -35.593 -28.509 1.00 0.00 C ATOM 1299 C ARG A 83 33.171 -36.392 -29.342 1.00 0.00 C ATOM 1300 O ARG A 83 33.029 -37.601 -29.517 1.00 0.00 O ATOM 1301 CB ARG A 83 30.934 -35.272 -29.382 1.00 0.00 C ATOM 1302 CG ARG A 83 30.076 -36.525 -29.631 1.00 0.00 C ATOM 1303 CD ARG A 83 28.575 -36.218 -29.553 1.00 0.00 C ATOM 1304 NE ARG A 83 28.197 -35.823 -28.185 1.00 0.00 N ATOM 1305 CZ ARG A 83 28.033 -36.754 -27.251 1.00 0.00 C ATOM 1306 NH1 ARG A 83 27.609 -37.964 -27.569 1.00 0.00 N ATOM 1307 NH2 ARG A 83 28.265 -36.456 -25.988 1.00 0.00 N ATOM 0 H ARG A 83 32.704 -33.543 -28.427 1.00 0.00 H new ATOM 0 HA ARG A 83 31.846 -36.215 -27.670 1.00 0.00 H new ATOM 0 HB2 ARG A 83 30.329 -34.506 -28.896 1.00 0.00 H new ATOM 0 HB3 ARG A 83 31.264 -34.860 -30.336 1.00 0.00 H new ATOM 0 HG2 ARG A 83 30.311 -36.936 -30.613 1.00 0.00 H new ATOM 0 HG3 ARG A 83 30.328 -37.289 -28.896 1.00 0.00 H new ATOM 0 HD2 ARG A 83 28.325 -35.418 -30.250 1.00 0.00 H new ATOM 0 HD3 ARG A 83 28.003 -37.095 -29.855 1.00 0.00 H new ATOM 0 HE ARG A 83 28.062 -34.838 -27.956 1.00 0.00 H new ATOM 0 HH11 ARG A 83 27.403 -38.193 -28.541 1.00 0.00 H new ATOM 0 HH12 ARG A 83 27.487 -38.669 -26.842 1.00 0.00 H new ATOM 0 HH21 ARG A 83 28.568 -35.516 -25.733 1.00 0.00 H new ATOM 0 HH22 ARG A 83 28.141 -37.165 -25.266 1.00 0.00 H new ATOM 1321 N GLN A 84 34.185 -35.713 -29.876 1.00 0.00 N ATOM 1322 CA GLN A 84 35.112 -36.381 -30.814 1.00 0.00 C ATOM 1323 C GLN A 84 34.449 -36.759 -32.156 1.00 0.00 C ATOM 1324 O GLN A 84 34.957 -37.588 -32.912 1.00 0.00 O ATOM 1325 CB GLN A 84 35.876 -37.576 -30.205 1.00 0.00 C ATOM 1326 CG GLN A 84 36.702 -37.175 -28.974 1.00 0.00 C ATOM 1327 CD GLN A 84 37.962 -36.403 -29.358 1.00 0.00 C ATOM 1328 OE1 GLN A 84 38.620 -36.685 -30.359 1.00 0.00 O ATOM 1329 NE2 GLN A 84 38.322 -35.428 -28.548 1.00 0.00 N ATOM 0 H GLN A 84 34.390 -34.731 -29.689 1.00 0.00 H new ATOM 0 HA GLN A 84 35.864 -35.622 -31.028 1.00 0.00 H new ATOM 0 HB2 GLN A 84 35.165 -38.354 -29.925 1.00 0.00 H new ATOM 0 HB3 GLN A 84 36.537 -38.004 -30.959 1.00 0.00 H new ATOM 0 HG2 GLN A 84 36.090 -36.564 -28.310 1.00 0.00 H new ATOM 0 HG3 GLN A 84 36.980 -38.070 -28.417 1.00 0.00 H new ATOM 0 HE21 GLN A 84 37.759 -35.215 -27.725 1.00 0.00 H new ATOM 0 HE22 GLN A 84 39.164 -34.887 -28.744 1.00 0.00 H new ATOM 1338 N ASP A 85 33.331 -36.108 -32.473 1.00 0.00 N ATOM 1339 CA ASP A 85 32.633 -36.416 -33.732 1.00 0.00 C ATOM 1340 C ASP A 85 32.001 -35.150 -34.327 1.00 0.00 C ATOM 1341 O ASP A 85 32.439 -34.643 -35.360 1.00 0.00 O ATOM 1342 CB ASP A 85 31.585 -37.535 -33.590 1.00 0.00 C ATOM 1343 CG ASP A 85 32.224 -38.913 -33.458 1.00 0.00 C ATOM 1344 OD1 ASP A 85 32.742 -39.436 -34.468 1.00 0.00 O ATOM 1345 OD2 ASP A 85 32.195 -39.484 -32.346 1.00 0.00 O ATOM 0 H ASP A 85 32.895 -35.385 -31.900 1.00 0.00 H new ATOM 0 HA ASP A 85 33.391 -36.793 -34.419 1.00 0.00 H new ATOM 0 HB2 ASP A 85 30.964 -37.340 -32.716 1.00 0.00 H new ATOM 0 HB3 ASP A 85 30.926 -37.524 -34.458 1.00 0.00 H new ATOM 1350 N ASP A 86 30.967 -34.630 -33.668 1.00 0.00 N ATOM 1351 CA ASP A 86 30.356 -33.382 -34.150 1.00 0.00 C ATOM 1352 C ASP A 86 30.637 -32.298 -33.103 1.00 0.00 C ATOM 1353 O ASP A 86 31.167 -31.228 -33.474 1.00 0.00 O ATOM 1354 CB ASP A 86 28.862 -33.750 -34.152 1.00 0.00 C ATOM 1355 CG ASP A 86 28.013 -32.598 -34.678 1.00 0.00 C ATOM 1356 OD1 ASP A 86 28.116 -32.272 -35.881 1.00 0.00 O ATOM 1357 OD2 ASP A 86 27.241 -32.011 -33.889 1.00 0.00 O ATOM 1358 OXT ASP A 86 30.323 -32.505 -31.909 1.00 0.00 O ATOM 0 H ASP A 86 30.544 -35.030 -32.831 1.00 0.00 H new ATOM 0 HA ASP A 86 30.712 -33.018 -35.114 1.00 0.00 H new ATOM 0 HB2 ASP A 86 28.703 -34.634 -34.769 1.00 0.00 H new ATOM 0 HB3 ASP A 86 28.546 -34.006 -33.141 1.00 0.00 H new TER 1363 ASP A 86