USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=23 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 76 THR OG1 : rot 107:sc= 1.12 USER MOD Set 1.2: A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 48 THR OG1 : rot -134:sc= 1.15 USER MOD Set 2.2: A 52 THR OG1 : rot -36:sc= 1.82 USER MOD Set 3.1: A 45 GLN : amide:sc= 0.966 K(o=2.2,f=-3.1!) USER MOD Set 3.2: A 46 THR OG1 : rot -101:sc= 1.23 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -110:sc= 0.685 (180deg=-1.02) USER MOD Single : A 16 CYS SG : rot 23:sc= -4.87! USER MOD Single : A 17 MET CE :methyl 180:sc= -4.45! (180deg=-4.45!) USER MOD Single : A 18 LYS NZ :NH3+ -142:sc= 1.05 (180deg=-0.558!) USER MOD Single : A 26 ASN : amide:sc= 0.234 K(o=0.23,f=-0.32) USER MOD Single : A 29 ASN :FLIP amide:sc=-0.00579 F(o=-0.89,f=-0.0058) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 MET CE :methyl 173:sc= -0.1 (180deg=-0.123) USER MOD Single : A 39 MET CE :methyl -151:sc= -7.13! (180deg=-14.1!) USER MOD Single : A 41 THR OG1 : rot 77:sc= 1.24 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot -30:sc= 1 USER MOD Single : A 49 LYS NZ :NH3+ -171:sc= 1.15 (180deg=1.09) USER MOD Single : A 56 MET CE :methyl -101:sc= -0.514 (180deg=-3.81!) USER MOD Single : A 57 LYS NZ :NH3+ 173:sc= 1.3 (180deg=1.17) USER MOD Single : A 63 LYS NZ :NH3+ 163:sc= 0.966 (180deg=0.791) USER MOD Single : A 66 LYS NZ :NH3+ -170:sc= 1.23 (180deg=1.13) USER MOD Single : A 67 LYS NZ :NH3+ 139:sc= 1.66 (180deg=1.24) USER MOD Single : A 68 ASN :FLIP amide:sc= -0.0538 F(o=-0.94,f=-0.054) USER MOD Single : A 78 CYS SG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 31.342 -43.969 -11.860 1.00 0.00 N ATOM 2 CA ALA A 1 30.583 -43.099 -10.944 1.00 0.00 C ATOM 3 C ALA A 1 30.177 -41.770 -11.591 1.00 0.00 C ATOM 4 O ALA A 1 30.985 -41.095 -12.230 1.00 0.00 O ATOM 5 CB ALA A 1 31.342 -42.838 -9.644 1.00 0.00 C ATOM 0 H1 ALA A 1 31.591 -44.853 -11.372 1.00 0.00 H new ATOM 0 H2 ALA A 1 30.760 -44.186 -12.695 1.00 0.00 H new ATOM 0 H3 ALA A 1 32.211 -43.483 -12.160 1.00 0.00 H new ATOM 0 HA ALA A 1 29.670 -43.646 -10.708 1.00 0.00 H new ATOM 0 HB1 ALA A 1 30.746 -42.193 -8.998 1.00 0.00 H new ATOM 0 HB2 ALA A 1 31.531 -43.784 -9.137 1.00 0.00 H new ATOM 0 HB3 ALA A 1 32.291 -42.351 -9.868 1.00 0.00 H new ATOM 13 N ALA A 2 28.912 -41.390 -11.433 1.00 0.00 N ATOM 14 CA ALA A 2 28.467 -40.117 -12.015 1.00 0.00 C ATOM 15 C ALA A 2 27.307 -39.500 -11.217 1.00 0.00 C ATOM 16 O ALA A 2 26.271 -40.137 -11.020 1.00 0.00 O ATOM 17 CB ALA A 2 28.057 -40.256 -13.484 1.00 0.00 C ATOM 0 H ALA A 2 28.199 -41.917 -10.929 1.00 0.00 H new ATOM 0 HA ALA A 2 29.328 -39.451 -11.962 1.00 0.00 H new ATOM 0 HB1 ALA A 2 27.737 -39.287 -13.866 1.00 0.00 H new ATOM 0 HB2 ALA A 2 28.906 -40.613 -14.067 1.00 0.00 H new ATOM 0 HB3 ALA A 2 27.236 -40.968 -13.567 1.00 0.00 H new ATOM 23 N PRO A 3 27.441 -38.239 -10.780 1.00 0.00 N ATOM 24 CA PRO A 3 26.336 -37.625 -10.035 1.00 0.00 C ATOM 25 C PRO A 3 25.346 -36.952 -10.991 1.00 0.00 C ATOM 26 O PRO A 3 25.627 -35.917 -11.596 1.00 0.00 O ATOM 27 CB PRO A 3 26.992 -36.607 -9.097 1.00 0.00 C ATOM 28 CG PRO A 3 28.501 -36.658 -9.342 1.00 0.00 C ATOM 29 CD PRO A 3 28.761 -37.753 -10.374 1.00 0.00 C ATOM 0 HA PRO A 3 25.760 -38.363 -9.476 1.00 0.00 H new ATOM 0 HB2 PRO A 3 26.607 -35.606 -9.289 1.00 0.00 H new ATOM 0 HB3 PRO A 3 26.765 -36.842 -8.057 1.00 0.00 H new ATOM 0 HG2 PRO A 3 28.863 -35.696 -9.704 1.00 0.00 H new ATOM 0 HG3 PRO A 3 29.033 -36.871 -8.415 1.00 0.00 H new ATOM 0 HD2 PRO A 3 29.314 -37.362 -11.228 1.00 0.00 H new ATOM 0 HD3 PRO A 3 29.360 -38.558 -9.948 1.00 0.00 H new ATOM 37 N LYS A 4 24.164 -37.541 -11.116 1.00 0.00 N ATOM 38 CA LYS A 4 23.161 -36.948 -12.011 1.00 0.00 C ATOM 39 C LYS A 4 22.291 -35.909 -11.292 1.00 0.00 C ATOM 40 O LYS A 4 21.175 -36.190 -10.854 1.00 0.00 O ATOM 41 CB LYS A 4 22.284 -38.020 -12.675 1.00 0.00 C ATOM 42 CG LYS A 4 23.072 -38.845 -13.699 1.00 0.00 C ATOM 43 CD LYS A 4 22.201 -39.975 -14.253 1.00 0.00 C ATOM 44 CE LYS A 4 22.984 -40.832 -15.247 1.00 0.00 C ATOM 45 NZ LYS A 4 22.177 -42.003 -15.630 1.00 0.00 N ATOM 0 H LYS A 4 23.877 -38.393 -10.635 1.00 0.00 H new ATOM 0 HA LYS A 4 23.715 -36.432 -12.796 1.00 0.00 H new ATOM 0 HB2 LYS A 4 21.877 -38.682 -11.910 1.00 0.00 H new ATOM 0 HB3 LYS A 4 21.437 -37.543 -13.167 1.00 0.00 H new ATOM 0 HG2 LYS A 4 23.408 -38.203 -14.513 1.00 0.00 H new ATOM 0 HG3 LYS A 4 23.965 -39.260 -13.232 1.00 0.00 H new ATOM 0 HD2 LYS A 4 21.842 -40.598 -13.434 1.00 0.00 H new ATOM 0 HD3 LYS A 4 21.322 -39.555 -14.742 1.00 0.00 H new ATOM 0 HE2 LYS A 4 23.234 -40.245 -16.131 1.00 0.00 H new ATOM 0 HE3 LYS A 4 23.925 -41.156 -14.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 22.710 -42.586 -16.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 21.959 -42.567 -14.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 21.291 -41.685 -16.071 1.00 0.00 H new ATOM 59 N ALA A 5 22.809 -34.690 -11.173 1.00 0.00 N ATOM 60 CA ALA A 5 22.051 -33.661 -10.449 1.00 0.00 C ATOM 61 C ALA A 5 22.552 -32.240 -10.752 1.00 0.00 C ATOM 62 O ALA A 5 23.555 -32.038 -11.436 1.00 0.00 O ATOM 63 CB ALA A 5 22.045 -33.914 -8.936 1.00 0.00 C ATOM 0 H ALA A 5 23.710 -34.393 -11.548 1.00 0.00 H new ATOM 0 HA ALA A 5 21.026 -33.733 -10.811 1.00 0.00 H new ATOM 0 HB1 ALA A 5 21.474 -33.130 -8.438 1.00 0.00 H new ATOM 0 HB2 ALA A 5 21.588 -34.882 -8.731 1.00 0.00 H new ATOM 0 HB3 ALA A 5 23.069 -33.910 -8.562 1.00 0.00 H new ATOM 69 N ARG A 6 21.827 -31.244 -10.240 1.00 0.00 N ATOM 70 CA ARG A 6 22.246 -29.842 -10.432 1.00 0.00 C ATOM 71 C ARG A 6 21.991 -29.323 -11.854 1.00 0.00 C ATOM 72 O ARG A 6 20.986 -28.659 -12.113 1.00 0.00 O ATOM 73 CB ARG A 6 23.667 -29.525 -9.924 1.00 0.00 C ATOM 74 CG ARG A 6 23.773 -29.722 -8.405 1.00 0.00 C ATOM 75 CD ARG A 6 25.145 -29.290 -7.873 1.00 0.00 C ATOM 76 NE ARG A 6 26.144 -30.350 -8.091 1.00 0.00 N ATOM 77 CZ ARG A 6 26.473 -31.162 -7.088 1.00 0.00 C ATOM 78 NH1 ARG A 6 25.628 -31.394 -6.100 1.00 0.00 N ATOM 79 NH2 ARG A 6 27.643 -31.765 -7.096 1.00 0.00 N ATOM 0 H ARG A 6 20.969 -31.368 -9.703 1.00 0.00 H new ATOM 0 HA ARG A 6 21.585 -29.273 -9.778 1.00 0.00 H new ATOM 0 HB2 ARG A 6 24.388 -30.169 -10.428 1.00 0.00 H new ATOM 0 HB3 ARG A 6 23.926 -28.497 -10.179 1.00 0.00 H new ATOM 0 HG2 ARG A 6 22.992 -29.147 -7.908 1.00 0.00 H new ATOM 0 HG3 ARG A 6 23.601 -30.770 -8.161 1.00 0.00 H new ATOM 0 HD2 ARG A 6 25.463 -28.375 -8.373 1.00 0.00 H new ATOM 0 HD3 ARG A 6 25.074 -29.064 -6.809 1.00 0.00 H new ATOM 0 HE ARG A 6 26.582 -30.462 -9.006 1.00 0.00 H new ATOM 0 HH11 ARG A 6 24.710 -30.949 -6.099 1.00 0.00 H new ATOM 0 HH12 ARG A 6 25.893 -32.018 -5.338 1.00 0.00 H new ATOM 0 HH21 ARG A 6 28.292 -31.609 -7.867 1.00 0.00 H new ATOM 0 HH22 ARG A 6 27.901 -32.388 -6.331 1.00 0.00 H new ATOM 93 N ALA A 7 22.899 -29.603 -12.784 1.00 0.00 N ATOM 94 CA ALA A 7 22.710 -29.079 -14.143 1.00 0.00 C ATOM 95 C ALA A 7 23.353 -29.964 -15.213 1.00 0.00 C ATOM 96 O ALA A 7 24.521 -29.802 -15.571 1.00 0.00 O ATOM 97 CB ALA A 7 23.212 -27.639 -14.276 1.00 0.00 C ATOM 0 H ALA A 7 23.739 -30.163 -12.639 1.00 0.00 H new ATOM 0 HA ALA A 7 21.633 -29.086 -14.314 1.00 0.00 H new ATOM 0 HB1 ALA A 7 23.053 -27.291 -15.297 1.00 0.00 H new ATOM 0 HB2 ALA A 7 22.665 -26.998 -13.585 1.00 0.00 H new ATOM 0 HB3 ALA A 7 24.276 -27.601 -14.041 1.00 0.00 H new ATOM 103 N LEU A 8 22.583 -30.916 -15.728 1.00 0.00 N ATOM 104 CA LEU A 8 23.129 -31.767 -16.790 1.00 0.00 C ATOM 105 C LEU A 8 22.728 -31.317 -18.200 1.00 0.00 C ATOM 106 O LEU A 8 22.000 -30.343 -18.391 1.00 0.00 O ATOM 107 CB LEU A 8 22.710 -33.225 -16.566 1.00 0.00 C ATOM 108 CG LEU A 8 23.908 -34.167 -16.487 1.00 0.00 C ATOM 109 CD1 LEU A 8 23.400 -35.502 -15.967 1.00 0.00 C ATOM 110 CD2 LEU A 8 24.564 -34.351 -17.863 1.00 0.00 C ATOM 0 H LEU A 8 21.623 -31.117 -15.448 1.00 0.00 H new ATOM 0 HA LEU A 8 24.214 -31.675 -16.731 1.00 0.00 H new ATOM 0 HB2 LEU A 8 22.133 -33.297 -15.644 1.00 0.00 H new ATOM 0 HB3 LEU A 8 22.055 -33.541 -17.378 1.00 0.00 H new ATOM 0 HG LEU A 8 24.666 -33.750 -15.824 1.00 0.00 H new ATOM 0 HD11 LEU A 8 24.230 -36.205 -15.896 1.00 0.00 H new ATOM 0 HD12 LEU A 8 22.957 -35.364 -14.981 1.00 0.00 H new ATOM 0 HD13 LEU A 8 22.648 -35.896 -16.650 1.00 0.00 H new ATOM 0 HD21 LEU A 8 25.414 -35.027 -17.773 1.00 0.00 H new ATOM 0 HD22 LEU A 8 23.838 -34.771 -18.559 1.00 0.00 H new ATOM 0 HD23 LEU A 8 24.906 -33.385 -18.235 1.00 0.00 H new ATOM 122 N GLY A 9 23.186 -32.062 -19.200 1.00 0.00 N ATOM 123 CA GLY A 9 22.838 -31.705 -20.571 1.00 0.00 C ATOM 124 C GLY A 9 23.617 -32.552 -21.582 1.00 0.00 C ATOM 125 O GLY A 9 24.844 -32.483 -21.651 1.00 0.00 O ATOM 0 H GLY A 9 23.777 -32.887 -19.096 1.00 0.00 H new ATOM 0 HA2 GLY A 9 21.768 -31.844 -20.725 1.00 0.00 H new ATOM 0 HA3 GLY A 9 23.049 -30.649 -20.739 1.00 0.00 H new ATOM 129 N PRO A 10 22.915 -33.326 -22.418 1.00 0.00 N ATOM 130 CA PRO A 10 23.549 -33.874 -23.625 1.00 0.00 C ATOM 131 C PRO A 10 23.724 -32.714 -24.628 1.00 0.00 C ATOM 132 O PRO A 10 24.640 -32.682 -25.450 1.00 0.00 O ATOM 133 CB PRO A 10 22.572 -34.952 -24.108 1.00 0.00 C ATOM 134 CG PRO A 10 21.436 -35.049 -23.073 1.00 0.00 C ATOM 135 CD PRO A 10 21.712 -34.019 -21.974 1.00 0.00 C ATOM 0 HA PRO A 10 24.537 -34.310 -23.477 1.00 0.00 H new ATOM 0 HB2 PRO A 10 22.174 -34.696 -25.090 1.00 0.00 H new ATOM 0 HB3 PRO A 10 23.080 -35.911 -24.210 1.00 0.00 H new ATOM 0 HG2 PRO A 10 20.473 -34.855 -23.545 1.00 0.00 H new ATOM 0 HG3 PRO A 10 21.388 -36.053 -22.652 1.00 0.00 H new ATOM 0 HD2 PRO A 10 20.876 -33.329 -21.858 1.00 0.00 H new ATOM 0 HD3 PRO A 10 21.865 -34.500 -21.008 1.00 0.00 H new ATOM 143 N GLU A 11 22.791 -31.769 -24.536 1.00 0.00 N ATOM 144 CA GLU A 11 22.981 -30.438 -25.086 1.00 0.00 C ATOM 145 C GLU A 11 24.136 -29.650 -24.458 1.00 0.00 C ATOM 146 O GLU A 11 24.105 -28.424 -24.381 1.00 0.00 O ATOM 147 CB GLU A 11 21.639 -29.701 -25.000 1.00 0.00 C ATOM 148 CG GLU A 11 20.794 -30.021 -26.232 1.00 0.00 C ATOM 149 CD GLU A 11 20.715 -28.836 -27.183 1.00 0.00 C ATOM 150 OE1 GLU A 11 19.825 -27.977 -27.006 1.00 0.00 O ATOM 151 OE2 GLU A 11 21.542 -28.762 -28.117 1.00 0.00 O ATOM 0 H GLU A 11 21.889 -31.907 -24.080 1.00 0.00 H new ATOM 0 HA GLU A 11 23.292 -30.535 -26.126 1.00 0.00 H new ATOM 0 HB2 GLU A 11 21.108 -29.998 -24.096 1.00 0.00 H new ATOM 0 HB3 GLU A 11 21.807 -28.626 -24.932 1.00 0.00 H new ATOM 0 HG2 GLU A 11 21.220 -30.878 -26.753 1.00 0.00 H new ATOM 0 HG3 GLU A 11 19.789 -30.305 -25.920 1.00 0.00 H new ATOM 158 N GLU A 12 25.103 -30.347 -23.865 1.00 0.00 N ATOM 159 CA GLU A 12 26.386 -29.681 -23.570 1.00 0.00 C ATOM 160 C GLU A 12 26.886 -28.829 -24.766 1.00 0.00 C ATOM 161 O GLU A 12 27.630 -27.859 -24.608 1.00 0.00 O ATOM 162 CB GLU A 12 27.470 -30.668 -23.115 1.00 0.00 C ATOM 163 CG GLU A 12 28.663 -29.931 -22.497 1.00 0.00 C ATOM 164 CD GLU A 12 29.749 -30.900 -22.059 1.00 0.00 C ATOM 165 OE1 GLU A 12 29.516 -31.683 -21.115 1.00 0.00 O ATOM 166 OE2 GLU A 12 30.847 -30.875 -22.654 1.00 0.00 O ATOM 0 H GLU A 12 25.039 -31.326 -23.587 1.00 0.00 H new ATOM 0 HA GLU A 12 26.190 -29.007 -22.736 1.00 0.00 H new ATOM 0 HB2 GLU A 12 27.051 -31.363 -22.387 1.00 0.00 H new ATOM 0 HB3 GLU A 12 27.806 -31.261 -23.965 1.00 0.00 H new ATOM 0 HG2 GLU A 12 29.072 -29.227 -23.222 1.00 0.00 H new ATOM 0 HG3 GLU A 12 28.327 -29.347 -21.640 1.00 0.00 H new ATOM 173 N LYS A 13 26.477 -29.206 -25.981 1.00 0.00 N ATOM 174 CA LYS A 13 26.659 -28.292 -27.111 1.00 0.00 C ATOM 175 C LYS A 13 26.003 -26.915 -26.855 1.00 0.00 C ATOM 176 O LYS A 13 26.597 -25.852 -27.056 1.00 0.00 O ATOM 177 CB LYS A 13 26.143 -28.901 -28.430 1.00 0.00 C ATOM 178 CG LYS A 13 26.572 -28.102 -29.676 1.00 0.00 C ATOM 179 CD LYS A 13 25.575 -26.994 -30.060 1.00 0.00 C ATOM 180 CE LYS A 13 24.158 -27.535 -30.298 1.00 0.00 C ATOM 181 NZ LYS A 13 23.270 -27.124 -29.191 1.00 0.00 N ATOM 0 H LYS A 13 26.036 -30.099 -26.203 1.00 0.00 H new ATOM 0 HA LYS A 13 27.733 -28.135 -27.210 1.00 0.00 H new ATOM 0 HB2 LYS A 13 26.509 -29.924 -28.518 1.00 0.00 H new ATOM 0 HB3 LYS A 13 25.055 -28.954 -28.397 1.00 0.00 H new ATOM 0 HG2 LYS A 13 27.549 -27.655 -29.494 1.00 0.00 H new ATOM 0 HG3 LYS A 13 26.686 -28.786 -30.517 1.00 0.00 H new ATOM 0 HD2 LYS A 13 25.546 -26.245 -29.268 1.00 0.00 H new ATOM 0 HD3 LYS A 13 25.925 -26.491 -30.962 1.00 0.00 H new ATOM 0 HE2 LYS A 13 23.770 -27.160 -31.245 1.00 0.00 H new ATOM 0 HE3 LYS A 13 24.182 -28.622 -30.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 23.022 -27.956 -28.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 23.759 -26.426 -28.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 22.403 -26.700 -29.580 1.00 0.00 H new ATOM 195 N ASP A 14 24.743 -26.946 -26.428 1.00 0.00 N ATOM 196 CA ASP A 14 24.112 -25.717 -25.935 1.00 0.00 C ATOM 197 C ASP A 14 24.922 -25.020 -24.830 1.00 0.00 C ATOM 198 O ASP A 14 25.047 -23.800 -24.820 1.00 0.00 O ATOM 199 CB ASP A 14 22.661 -25.941 -25.482 1.00 0.00 C ATOM 200 CG ASP A 14 21.859 -24.645 -25.483 1.00 0.00 C ATOM 201 OD1 ASP A 14 21.719 -24.021 -26.557 1.00 0.00 O ATOM 202 OD2 ASP A 14 21.365 -24.241 -24.408 1.00 0.00 O ATOM 0 H ASP A 14 24.152 -27.777 -26.411 1.00 0.00 H new ATOM 0 HA ASP A 14 24.096 -25.045 -26.793 1.00 0.00 H new ATOM 0 HB2 ASP A 14 22.182 -26.665 -26.142 1.00 0.00 H new ATOM 0 HB3 ASP A 14 22.656 -26.371 -24.480 1.00 0.00 H new ATOM 207 N GLU A 15 25.495 -25.799 -23.912 1.00 0.00 N ATOM 208 CA GLU A 15 26.339 -25.201 -22.865 1.00 0.00 C ATOM 209 C GLU A 15 27.465 -24.333 -23.413 1.00 0.00 C ATOM 210 O GLU A 15 27.659 -23.193 -22.990 1.00 0.00 O ATOM 211 CB GLU A 15 26.964 -26.258 -21.930 1.00 0.00 C ATOM 212 CG GLU A 15 26.039 -26.608 -20.755 1.00 0.00 C ATOM 213 CD GLU A 15 26.126 -25.574 -19.642 1.00 0.00 C ATOM 214 OE1 GLU A 15 25.458 -24.522 -19.741 1.00 0.00 O ATOM 215 OE2 GLU A 15 26.859 -25.812 -18.658 1.00 0.00 O ATOM 0 H GLU A 15 25.399 -26.813 -23.866 1.00 0.00 H new ATOM 0 HA GLU A 15 25.650 -24.571 -22.303 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.183 -27.161 -22.500 1.00 0.00 H new ATOM 0 HB3 GLU A 15 27.913 -25.885 -21.545 1.00 0.00 H new ATOM 0 HG2 GLU A 15 25.010 -26.675 -21.109 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.306 -27.589 -20.362 1.00 0.00 H new ATOM 222 N CYS A 16 28.215 -24.866 -24.367 1.00 0.00 N ATOM 223 CA CYS A 16 29.358 -24.087 -24.870 1.00 0.00 C ATOM 224 C CYS A 16 28.844 -22.888 -25.701 1.00 0.00 C ATOM 225 O CYS A 16 29.451 -21.816 -25.652 1.00 0.00 O ATOM 226 CB CYS A 16 30.155 -25.061 -25.750 1.00 0.00 C ATOM 227 SG CYS A 16 29.061 -26.179 -26.673 1.00 0.00 S ATOM 0 H CYS A 16 28.074 -25.781 -24.794 1.00 0.00 H new ATOM 0 HA CYS A 16 29.974 -23.681 -24.067 1.00 0.00 H new ATOM 0 HB2 CYS A 16 30.773 -24.498 -26.449 1.00 0.00 H new ATOM 0 HB3 CYS A 16 30.831 -25.646 -25.126 1.00 0.00 H new ATOM 0 HG CYS A 16 27.882 -25.642 -26.780 1.00 0.00 H new ATOM 233 N MET A 17 27.740 -23.009 -26.462 1.00 0.00 N ATOM 234 CA MET A 17 27.230 -21.784 -27.127 1.00 0.00 C ATOM 235 C MET A 17 26.460 -20.856 -26.155 1.00 0.00 C ATOM 236 O MET A 17 26.206 -19.687 -26.451 1.00 0.00 O ATOM 237 CB MET A 17 26.525 -21.968 -28.487 1.00 0.00 C ATOM 238 CG MET A 17 26.857 -20.800 -29.449 1.00 0.00 C ATOM 239 SD MET A 17 27.567 -21.402 -31.005 1.00 0.00 S ATOM 240 CE MET A 17 29.233 -20.662 -30.961 1.00 0.00 C ATOM 0 H MET A 17 27.215 -23.868 -26.628 1.00 0.00 H new ATOM 0 HA MET A 17 28.144 -21.267 -27.418 1.00 0.00 H new ATOM 0 HB2 MET A 17 26.834 -22.912 -28.936 1.00 0.00 H new ATOM 0 HB3 MET A 17 25.447 -22.024 -28.337 1.00 0.00 H new ATOM 0 HG2 MET A 17 25.951 -20.230 -29.657 1.00 0.00 H new ATOM 0 HG3 MET A 17 27.558 -20.119 -28.967 1.00 0.00 H new ATOM 0 HE1 MET A 17 29.782 -20.949 -31.858 1.00 0.00 H new ATOM 0 HE2 MET A 17 29.148 -19.576 -30.919 1.00 0.00 H new ATOM 0 HE3 MET A 17 29.766 -21.018 -30.079 1.00 0.00 H new ATOM 250 N LYS A 18 26.144 -21.355 -24.959 1.00 0.00 N ATOM 251 CA LYS A 18 25.549 -20.492 -23.940 1.00 0.00 C ATOM 252 C LYS A 18 26.597 -19.617 -23.254 1.00 0.00 C ATOM 253 O LYS A 18 26.400 -18.420 -23.055 1.00 0.00 O ATOM 254 CB LYS A 18 24.787 -21.311 -22.892 1.00 0.00 C ATOM 255 CG LYS A 18 23.528 -20.597 -22.395 1.00 0.00 C ATOM 256 CD LYS A 18 22.276 -21.329 -22.890 1.00 0.00 C ATOM 257 CE LYS A 18 21.888 -20.881 -24.299 1.00 0.00 C ATOM 258 NZ LYS A 18 20.794 -21.728 -24.805 1.00 0.00 N ATOM 0 H LYS A 18 26.285 -22.325 -24.677 1.00 0.00 H new ATOM 0 HA LYS A 18 24.844 -19.839 -24.455 1.00 0.00 H new ATOM 0 HB2 LYS A 18 24.510 -22.275 -23.319 1.00 0.00 H new ATOM 0 HB3 LYS A 18 25.444 -21.514 -22.046 1.00 0.00 H new ATOM 0 HG2 LYS A 18 23.529 -20.558 -21.306 1.00 0.00 H new ATOM 0 HG3 LYS A 18 23.521 -19.567 -22.751 1.00 0.00 H new ATOM 0 HD2 LYS A 18 22.456 -22.404 -22.885 1.00 0.00 H new ATOM 0 HD3 LYS A 18 21.448 -21.141 -22.206 1.00 0.00 H new ATOM 0 HE2 LYS A 18 21.576 -19.837 -24.286 1.00 0.00 H new ATOM 0 HE3 LYS A 18 22.750 -20.948 -24.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 20.937 -21.911 -25.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 20.786 -22.630 -24.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 19.885 -21.241 -24.666 1.00 0.00 H new ATOM 272 N ILE A 19 27.719 -20.217 -22.863 1.00 0.00 N ATOM 273 CA ILE A 19 28.839 -19.377 -22.425 1.00 0.00 C ATOM 274 C ILE A 19 29.369 -18.493 -23.564 1.00 0.00 C ATOM 275 O ILE A 19 29.957 -17.440 -23.335 1.00 0.00 O ATOM 276 CB ILE A 19 29.969 -20.130 -21.720 1.00 0.00 C ATOM 277 CG1 ILE A 19 30.939 -19.101 -21.128 1.00 0.00 C ATOM 278 CG2 ILE A 19 30.643 -21.124 -22.667 1.00 0.00 C ATOM 279 CD1 ILE A 19 31.754 -19.628 -19.951 1.00 0.00 C ATOM 0 H ILE A 19 27.878 -21.224 -22.838 1.00 0.00 H new ATOM 0 HA ILE A 19 28.415 -18.729 -21.658 1.00 0.00 H new ATOM 0 HB ILE A 19 29.575 -20.735 -20.903 1.00 0.00 H new ATOM 0 HG12 ILE A 19 31.621 -18.767 -21.910 1.00 0.00 H new ATOM 0 HG13 ILE A 19 30.374 -18.227 -20.804 1.00 0.00 H new ATOM 0 HG21 ILE A 19 31.442 -21.645 -22.139 1.00 0.00 H new ATOM 0 HG22 ILE A 19 29.908 -21.848 -23.018 1.00 0.00 H new ATOM 0 HG23 ILE A 19 31.060 -20.588 -23.520 1.00 0.00 H new ATOM 0 HD11 ILE A 19 32.417 -18.843 -19.587 1.00 0.00 H new ATOM 0 HD12 ILE A 19 31.081 -19.935 -19.151 1.00 0.00 H new ATOM 0 HD13 ILE A 19 32.348 -20.483 -20.274 1.00 0.00 H new ATOM 291 N PHE A 20 29.227 -18.952 -24.801 1.00 0.00 N ATOM 292 CA PHE A 20 29.438 -18.033 -25.925 1.00 0.00 C ATOM 293 C PHE A 20 28.525 -16.811 -25.768 1.00 0.00 C ATOM 294 O PHE A 20 28.970 -15.675 -25.816 1.00 0.00 O ATOM 295 CB PHE A 20 29.233 -18.677 -27.313 1.00 0.00 C ATOM 296 CG PHE A 20 29.958 -17.913 -28.416 1.00 0.00 C ATOM 297 CD1 PHE A 20 29.421 -16.768 -28.906 1.00 0.00 C ATOM 298 CD2 PHE A 20 31.247 -18.210 -28.714 1.00 0.00 C ATOM 299 CE1 PHE A 20 30.229 -15.828 -29.460 1.00 0.00 C ATOM 300 CE2 PHE A 20 32.080 -17.226 -29.132 1.00 0.00 C ATOM 301 CZ PHE A 20 31.572 -16.015 -29.464 1.00 0.00 C ATOM 0 H PHE A 20 28.978 -19.909 -25.051 1.00 0.00 H new ATOM 0 HA PHE A 20 30.486 -17.736 -25.888 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.591 -19.706 -27.290 1.00 0.00 H new ATOM 0 HB3 PHE A 20 28.168 -18.715 -27.540 1.00 0.00 H new ATOM 0 HD1 PHE A 20 28.355 -16.605 -28.856 1.00 0.00 H new ATOM 0 HD2 PHE A 20 31.607 -19.224 -28.619 1.00 0.00 H new ATOM 0 HE1 PHE A 20 29.804 -14.936 -29.895 1.00 0.00 H new ATOM 0 HE2 PHE A 20 33.143 -17.406 -29.200 1.00 0.00 H new ATOM 0 HZ PHE A 20 32.233 -15.203 -29.730 1.00 0.00 H new ATOM 311 N ASP A 21 27.254 -17.048 -25.473 1.00 0.00 N ATOM 312 CA ASP A 21 26.347 -15.920 -25.195 1.00 0.00 C ATOM 313 C ASP A 21 26.772 -15.049 -24.000 1.00 0.00 C ATOM 314 O ASP A 21 26.694 -13.821 -24.042 1.00 0.00 O ATOM 315 CB ASP A 21 24.905 -16.408 -25.028 1.00 0.00 C ATOM 316 CG ASP A 21 23.885 -15.314 -25.317 1.00 0.00 C ATOM 317 OD1 ASP A 21 23.471 -15.172 -26.488 1.00 0.00 O ATOM 318 OD2 ASP A 21 23.481 -14.603 -24.372 1.00 0.00 O ATOM 0 H ASP A 21 26.829 -17.974 -25.418 1.00 0.00 H new ATOM 0 HA ASP A 21 26.410 -15.271 -26.069 1.00 0.00 H new ATOM 0 HB2 ASP A 21 24.730 -17.251 -25.697 1.00 0.00 H new ATOM 0 HB3 ASP A 21 24.763 -16.774 -24.011 1.00 0.00 H new ATOM 323 N ILE A 22 27.237 -15.685 -22.930 1.00 0.00 N ATOM 324 CA ILE A 22 27.714 -14.881 -21.776 1.00 0.00 C ATOM 325 C ILE A 22 29.044 -14.163 -22.076 1.00 0.00 C ATOM 326 O ILE A 22 29.178 -12.953 -21.894 1.00 0.00 O ATOM 327 CB ILE A 22 27.812 -15.607 -20.400 1.00 0.00 C ATOM 328 CG1 ILE A 22 26.465 -16.183 -19.930 1.00 0.00 C ATOM 329 CG2 ILE A 22 28.293 -14.616 -19.334 1.00 0.00 C ATOM 330 CD1 ILE A 22 26.695 -17.376 -18.999 1.00 0.00 C ATOM 0 H ILE A 22 27.299 -16.697 -22.823 1.00 0.00 H new ATOM 0 HA ILE A 22 26.907 -14.159 -21.657 1.00 0.00 H new ATOM 0 HB ILE A 22 28.511 -16.433 -20.532 1.00 0.00 H new ATOM 0 HG12 ILE A 22 25.893 -15.413 -19.412 1.00 0.00 H new ATOM 0 HG13 ILE A 22 25.874 -16.494 -20.791 1.00 0.00 H new ATOM 0 HG21 ILE A 22 28.362 -15.122 -18.371 1.00 0.00 H new ATOM 0 HG22 ILE A 22 29.274 -14.230 -19.612 1.00 0.00 H new ATOM 0 HG23 ILE A 22 27.586 -13.790 -19.260 1.00 0.00 H new ATOM 0 HD11 ILE A 22 25.734 -17.774 -18.674 1.00 0.00 H new ATOM 0 HD12 ILE A 22 27.248 -18.151 -19.530 1.00 0.00 H new ATOM 0 HD13 ILE A 22 27.267 -17.054 -18.129 1.00 0.00 H new ATOM 342 N PHE A 23 30.040 -14.922 -22.512 1.00 0.00 N ATOM 343 CA PHE A 23 31.361 -14.314 -22.746 1.00 0.00 C ATOM 344 C PHE A 23 31.463 -13.552 -24.075 1.00 0.00 C ATOM 345 O PHE A 23 32.398 -12.777 -24.278 1.00 0.00 O ATOM 346 CB PHE A 23 32.506 -15.327 -22.649 1.00 0.00 C ATOM 347 CG PHE A 23 32.840 -15.688 -21.202 1.00 0.00 C ATOM 348 CD1 PHE A 23 31.852 -16.099 -20.372 1.00 0.00 C ATOM 349 CD2 PHE A 23 34.087 -15.492 -20.697 1.00 0.00 C ATOM 350 CE1 PHE A 23 32.030 -16.082 -19.031 1.00 0.00 C ATOM 351 CE2 PHE A 23 34.275 -15.475 -19.354 1.00 0.00 C ATOM 352 CZ PHE A 23 33.238 -15.744 -18.522 1.00 0.00 C ATOM 0 H PHE A 23 29.975 -15.921 -22.707 1.00 0.00 H new ATOM 0 HA PHE A 23 31.465 -13.589 -21.939 1.00 0.00 H new ATOM 0 HB2 PHE A 23 32.235 -16.232 -23.193 1.00 0.00 H new ATOM 0 HB3 PHE A 23 33.393 -14.917 -23.133 1.00 0.00 H new ATOM 0 HD1 PHE A 23 30.915 -16.443 -20.784 1.00 0.00 H new ATOM 0 HD2 PHE A 23 34.925 -15.350 -21.363 1.00 0.00 H new ATOM 0 HE1 PHE A 23 31.214 -16.336 -18.371 1.00 0.00 H new ATOM 0 HE2 PHE A 23 35.249 -15.248 -18.947 1.00 0.00 H new ATOM 0 HZ PHE A 23 33.376 -15.688 -17.452 1.00 0.00 H new ATOM 362 N ASP A 24 30.540 -13.782 -25.013 1.00 0.00 N ATOM 363 CA ASP A 24 30.516 -12.911 -26.186 1.00 0.00 C ATOM 364 C ASP A 24 30.072 -11.491 -25.785 1.00 0.00 C ATOM 365 O ASP A 24 30.457 -10.500 -26.395 1.00 0.00 O ATOM 366 CB ASP A 24 29.717 -13.433 -27.394 1.00 0.00 C ATOM 367 CG ASP A 24 28.267 -12.954 -27.459 1.00 0.00 C ATOM 368 OD1 ASP A 24 28.040 -11.741 -27.658 1.00 0.00 O ATOM 369 OD2 ASP A 24 27.352 -13.796 -27.360 1.00 0.00 O ATOM 0 H ASP A 24 29.837 -14.521 -24.989 1.00 0.00 H new ATOM 0 HA ASP A 24 31.544 -12.893 -26.548 1.00 0.00 H new ATOM 0 HB2 ASP A 24 30.227 -13.128 -28.308 1.00 0.00 H new ATOM 0 HB3 ASP A 24 29.724 -14.523 -27.373 1.00 0.00 H new ATOM 374 N ARG A 25 29.202 -11.408 -24.775 1.00 0.00 N ATOM 375 CA ARG A 25 28.901 -10.097 -24.166 1.00 0.00 C ATOM 376 C ARG A 25 27.925 -9.234 -24.972 1.00 0.00 C ATOM 377 O ARG A 25 28.136 -8.039 -25.162 1.00 0.00 O ATOM 378 CB ARG A 25 30.161 -9.305 -23.765 1.00 0.00 C ATOM 379 CG ARG A 25 31.256 -10.232 -23.220 1.00 0.00 C ATOM 380 CD ARG A 25 31.742 -9.772 -21.851 1.00 0.00 C ATOM 381 NE ARG A 25 32.541 -10.824 -21.202 1.00 0.00 N ATOM 382 CZ ARG A 25 33.786 -11.071 -21.603 1.00 0.00 C ATOM 383 NH1 ARG A 25 34.425 -10.237 -22.403 1.00 0.00 N ATOM 384 NH2 ARG A 25 34.396 -12.157 -21.181 1.00 0.00 N ATOM 0 H ARG A 25 28.705 -12.200 -24.368 1.00 0.00 H new ATOM 0 HA ARG A 25 28.379 -10.354 -23.244 1.00 0.00 H new ATOM 0 HB2 ARG A 25 30.541 -8.760 -24.630 1.00 0.00 H new ATOM 0 HB3 ARG A 25 29.901 -8.563 -23.010 1.00 0.00 H new ATOM 0 HG2 ARG A 25 30.871 -11.249 -23.148 1.00 0.00 H new ATOM 0 HG3 ARG A 25 32.094 -10.256 -23.916 1.00 0.00 H new ATOM 0 HD2 ARG A 25 32.341 -8.867 -21.957 1.00 0.00 H new ATOM 0 HD3 ARG A 25 30.888 -9.517 -21.223 1.00 0.00 H new ATOM 0 HE ARG A 25 32.138 -11.368 -20.439 1.00 0.00 H new ATOM 0 HH11 ARG A 25 33.965 -9.386 -22.725 1.00 0.00 H new ATOM 0 HH12 ARG A 25 35.379 -10.444 -22.699 1.00 0.00 H new ATOM 0 HH21 ARG A 25 33.915 -12.801 -20.553 1.00 0.00 H new ATOM 0 HH22 ARG A 25 35.350 -12.356 -21.482 1.00 0.00 H new ATOM 398 N ASN A 26 26.862 -9.859 -25.472 1.00 0.00 N ATOM 399 CA ASN A 26 25.826 -9.083 -26.183 1.00 0.00 C ATOM 400 C ASN A 26 26.199 -8.976 -27.653 1.00 0.00 C ATOM 401 O ASN A 26 25.487 -9.433 -28.547 1.00 0.00 O ATOM 402 CB ASN A 26 25.381 -7.765 -25.497 1.00 0.00 C ATOM 403 CG ASN A 26 25.657 -6.481 -26.299 1.00 0.00 C ATOM 404 OD1 ASN A 26 24.828 -6.038 -27.089 1.00 0.00 O ATOM 405 ND2 ASN A 26 26.796 -5.844 -26.080 1.00 0.00 N ATOM 0 H ASN A 26 26.689 -10.862 -25.408 1.00 0.00 H new ATOM 0 HA ASN A 26 24.892 -9.642 -26.122 1.00 0.00 H new ATOM 0 HB2 ASN A 26 24.312 -7.824 -25.293 1.00 0.00 H new ATOM 0 HB3 ASN A 26 25.885 -7.688 -24.534 1.00 0.00 H new ATOM 0 HD21 ASN A 26 26.995 -4.972 -26.571 1.00 0.00 H new ATOM 0 HD22 ASN A 26 27.475 -6.225 -25.421 1.00 0.00 H new ATOM 412 N ALA A 27 27.338 -8.358 -27.889 1.00 0.00 N ATOM 413 CA ALA A 27 27.953 -8.482 -29.205 1.00 0.00 C ATOM 414 C ALA A 27 29.444 -8.129 -29.186 1.00 0.00 C ATOM 415 O ALA A 27 29.890 -7.150 -29.786 1.00 0.00 O ATOM 416 CB ALA A 27 27.227 -7.715 -30.310 1.00 0.00 C ATOM 0 H ALA A 27 27.846 -7.783 -27.217 1.00 0.00 H new ATOM 0 HA ALA A 27 27.854 -9.539 -29.453 1.00 0.00 H new ATOM 0 HB1 ALA A 27 27.748 -7.860 -31.256 1.00 0.00 H new ATOM 0 HB2 ALA A 27 26.205 -8.084 -30.398 1.00 0.00 H new ATOM 0 HB3 ALA A 27 27.209 -6.653 -30.064 1.00 0.00 H new ATOM 422 N GLU A 28 30.215 -8.930 -28.468 1.00 0.00 N ATOM 423 CA GLU A 28 31.666 -8.728 -28.460 1.00 0.00 C ATOM 424 C GLU A 28 32.383 -9.875 -29.179 1.00 0.00 C ATOM 425 O GLU A 28 33.288 -9.658 -29.987 1.00 0.00 O ATOM 426 CB GLU A 28 32.203 -8.241 -27.095 1.00 0.00 C ATOM 427 CG GLU A 28 33.137 -9.229 -26.385 1.00 0.00 C ATOM 428 CD GLU A 28 34.001 -8.512 -25.357 1.00 0.00 C ATOM 429 OE1 GLU A 28 33.550 -8.344 -24.203 1.00 0.00 O ATOM 430 OE2 GLU A 28 35.139 -8.121 -25.694 1.00 0.00 O ATOM 0 H GLU A 28 29.880 -9.706 -27.897 1.00 0.00 H new ATOM 0 HA GLU A 28 31.929 -7.867 -29.075 1.00 0.00 H new ATOM 0 HB2 GLU A 28 32.735 -7.301 -27.243 1.00 0.00 H new ATOM 0 HB3 GLU A 28 31.357 -8.028 -26.442 1.00 0.00 H new ATOM 0 HG2 GLU A 28 32.549 -10.005 -25.895 1.00 0.00 H new ATOM 0 HG3 GLU A 28 33.773 -9.726 -27.118 1.00 0.00 H new ATOM 437 N ASN A 29 31.947 -11.102 -28.913 1.00 0.00 N ATOM 438 CA ASN A 29 32.315 -12.215 -29.802 1.00 0.00 C ATOM 439 C ASN A 29 33.817 -12.472 -29.959 1.00 0.00 C ATOM 440 O ASN A 29 34.270 -12.887 -31.024 1.00 0.00 O ATOM 441 CB ASN A 29 31.621 -12.095 -31.173 1.00 0.00 C ATOM 442 CG ASN A 29 30.128 -12.418 -31.115 1.00 0.00 C ATOM 443 OD1 ASN A 29 29.376 -11.701 -30.298 1.00 0.00 O flip ATOM 444 ND2 ASN A 29 29.640 -13.303 -31.816 1.00 0.00 N flip ATOM 0 H ASN A 29 31.358 -11.354 -28.119 1.00 0.00 H new ATOM 0 HA ASN A 29 31.943 -13.101 -29.287 1.00 0.00 H new ATOM 0 HB2 ASN A 29 31.754 -11.083 -31.554 1.00 0.00 H new ATOM 0 HB3 ASN A 29 32.106 -12.768 -31.880 1.00 0.00 H new ATOM 0 HD21 ASN A 29 30.236 -13.846 -32.441 1.00 0.00 H new ATOM 0 HD22 ASN A 29 28.639 -13.494 -31.773 1.00 0.00 H new ATOM 451 N ILE A 30 34.597 -12.214 -28.917 1.00 0.00 N ATOM 452 CA ILE A 30 36.003 -12.650 -28.933 1.00 0.00 C ATOM 453 C ILE A 30 36.474 -12.933 -27.499 1.00 0.00 C ATOM 454 O ILE A 30 36.632 -12.028 -26.679 1.00 0.00 O ATOM 455 CB ILE A 30 37.007 -11.747 -29.687 1.00 0.00 C ATOM 456 CG1 ILE A 30 37.088 -10.354 -29.020 1.00 0.00 C ATOM 457 CG2 ILE A 30 36.669 -11.621 -31.179 1.00 0.00 C ATOM 458 CD1 ILE A 30 37.739 -9.297 -29.919 1.00 0.00 C ATOM 0 H ILE A 30 34.302 -11.723 -28.073 1.00 0.00 H new ATOM 0 HA ILE A 30 36.002 -13.561 -29.532 1.00 0.00 H new ATOM 0 HB ILE A 30 37.985 -12.224 -29.623 1.00 0.00 H new ATOM 0 HG12 ILE A 30 36.083 -10.026 -28.752 1.00 0.00 H new ATOM 0 HG13 ILE A 30 37.655 -10.434 -28.093 1.00 0.00 H new ATOM 0 HG21 ILE A 30 37.402 -10.977 -31.665 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.689 -12.608 -31.641 1.00 0.00 H new ATOM 0 HG23 ILE A 30 35.675 -11.188 -31.292 1.00 0.00 H new ATOM 0 HD11 ILE A 30 37.767 -8.341 -29.396 1.00 0.00 H new ATOM 0 HD12 ILE A 30 38.755 -9.605 -30.166 1.00 0.00 H new ATOM 0 HD13 ILE A 30 37.159 -9.192 -30.836 1.00 0.00 H new ATOM 470 N ALA A 31 36.693 -14.205 -27.186 1.00 0.00 N ATOM 471 CA ALA A 31 37.084 -14.555 -25.813 1.00 0.00 C ATOM 472 C ALA A 31 38.500 -15.156 -25.751 1.00 0.00 C ATOM 473 O ALA A 31 38.755 -16.202 -26.345 1.00 0.00 O ATOM 474 CB ALA A 31 36.090 -15.524 -25.188 1.00 0.00 C ATOM 0 H ALA A 31 36.612 -14.990 -27.832 1.00 0.00 H new ATOM 0 HA ALA A 31 37.083 -13.626 -25.244 1.00 0.00 H new ATOM 0 HB1 ALA A 31 36.406 -15.765 -24.173 1.00 0.00 H new ATOM 0 HB2 ALA A 31 35.102 -15.065 -25.162 1.00 0.00 H new ATOM 0 HB3 ALA A 31 36.050 -16.437 -25.781 1.00 0.00 H new ATOM 480 N PRO A 32 39.419 -14.590 -24.956 1.00 0.00 N ATOM 481 CA PRO A 32 40.821 -15.019 -25.061 1.00 0.00 C ATOM 482 C PRO A 32 41.131 -16.214 -24.134 1.00 0.00 C ATOM 483 O PRO A 32 40.241 -16.838 -23.554 1.00 0.00 O ATOM 484 CB PRO A 32 41.616 -13.756 -24.687 1.00 0.00 C ATOM 485 CG PRO A 32 40.631 -12.796 -24.015 1.00 0.00 C ATOM 486 CD PRO A 32 39.240 -13.223 -24.467 1.00 0.00 C ATOM 0 HA PRO A 32 41.078 -15.387 -26.054 1.00 0.00 H new ATOM 0 HB2 PRO A 32 42.437 -14.001 -24.013 1.00 0.00 H new ATOM 0 HB3 PRO A 32 42.056 -13.300 -25.574 1.00 0.00 H new ATOM 0 HG2 PRO A 32 40.719 -12.846 -22.930 1.00 0.00 H new ATOM 0 HG3 PRO A 32 40.834 -11.765 -24.305 1.00 0.00 H new ATOM 0 HD2 PRO A 32 38.526 -13.186 -23.644 1.00 0.00 H new ATOM 0 HD3 PRO A 32 38.858 -12.568 -25.250 1.00 0.00 H new ATOM 494 N VAL A 33 42.412 -16.563 -24.030 1.00 0.00 N ATOM 495 CA VAL A 33 42.814 -17.654 -23.094 1.00 0.00 C ATOM 496 C VAL A 33 42.284 -17.463 -21.665 1.00 0.00 C ATOM 497 O VAL A 33 41.685 -18.365 -21.075 1.00 0.00 O ATOM 498 CB VAL A 33 44.341 -17.874 -23.014 1.00 0.00 C ATOM 499 CG1 VAL A 33 44.793 -18.915 -24.034 1.00 0.00 C ATOM 500 CG2 VAL A 33 45.125 -16.569 -23.206 1.00 0.00 C ATOM 0 H VAL A 33 43.176 -16.136 -24.553 1.00 0.00 H new ATOM 0 HA VAL A 33 42.351 -18.537 -23.534 1.00 0.00 H new ATOM 0 HB VAL A 33 44.556 -18.243 -22.011 1.00 0.00 H new ATOM 0 HG11 VAL A 33 45.872 -19.053 -23.959 1.00 0.00 H new ATOM 0 HG12 VAL A 33 44.291 -19.862 -23.834 1.00 0.00 H new ATOM 0 HG13 VAL A 33 44.540 -18.575 -25.038 1.00 0.00 H new ATOM 0 HG21 VAL A 33 46.194 -16.774 -23.142 1.00 0.00 H new ATOM 0 HG22 VAL A 33 44.895 -16.147 -24.184 1.00 0.00 H new ATOM 0 HG23 VAL A 33 44.844 -15.858 -22.429 1.00 0.00 H new ATOM 510 N SER A 34 42.561 -16.303 -21.079 1.00 0.00 N ATOM 511 CA SER A 34 42.028 -16.030 -19.734 1.00 0.00 C ATOM 512 C SER A 34 40.518 -16.290 -19.630 1.00 0.00 C ATOM 513 O SER A 34 40.022 -16.814 -18.632 1.00 0.00 O ATOM 514 CB SER A 34 42.369 -14.618 -19.242 1.00 0.00 C ATOM 515 OG SER A 34 41.793 -13.644 -20.105 1.00 0.00 O ATOM 0 H SER A 34 43.127 -15.559 -21.487 1.00 0.00 H new ATOM 0 HA SER A 34 42.528 -16.740 -19.075 1.00 0.00 H new ATOM 0 HB2 SER A 34 41.998 -14.479 -18.226 1.00 0.00 H new ATOM 0 HB3 SER A 34 43.451 -14.489 -19.207 1.00 0.00 H new ATOM 0 HG SER A 34 42.016 -12.747 -19.780 1.00 0.00 H new ATOM 521 N ASP A 35 39.789 -15.929 -20.684 1.00 0.00 N ATOM 522 CA ASP A 35 38.377 -16.303 -20.747 1.00 0.00 C ATOM 523 C ASP A 35 38.165 -17.833 -20.730 1.00 0.00 C ATOM 524 O ASP A 35 37.284 -18.317 -20.031 1.00 0.00 O ATOM 525 CB ASP A 35 37.648 -15.626 -21.915 1.00 0.00 C ATOM 526 CG ASP A 35 37.317 -14.161 -21.631 1.00 0.00 C ATOM 527 OD1 ASP A 35 38.009 -13.526 -20.804 1.00 0.00 O ATOM 528 OD2 ASP A 35 36.374 -13.631 -22.257 1.00 0.00 O ATOM 0 H ASP A 35 40.136 -15.396 -21.481 1.00 0.00 H new ATOM 0 HA ASP A 35 37.920 -15.924 -19.833 1.00 0.00 H new ATOM 0 HB2 ASP A 35 38.267 -15.688 -22.810 1.00 0.00 H new ATOM 0 HB3 ASP A 35 36.727 -16.168 -22.127 1.00 0.00 H new ATOM 533 N THR A 36 38.979 -18.619 -21.451 1.00 0.00 N ATOM 534 CA THR A 36 38.853 -20.089 -21.345 1.00 0.00 C ATOM 535 C THR A 36 39.014 -20.591 -19.889 1.00 0.00 C ATOM 536 O THR A 36 38.313 -21.512 -19.461 1.00 0.00 O ATOM 537 CB THR A 36 39.749 -20.859 -22.352 1.00 0.00 C ATOM 538 OG1 THR A 36 39.421 -20.453 -23.673 1.00 0.00 O ATOM 539 CG2 THR A 36 39.558 -22.379 -22.263 1.00 0.00 C ATOM 0 H THR A 36 39.702 -18.286 -22.088 1.00 0.00 H new ATOM 0 HA THR A 36 37.829 -20.321 -21.639 1.00 0.00 H new ATOM 0 HB THR A 36 40.785 -20.627 -22.104 1.00 0.00 H new ATOM 0 HG1 THR A 36 39.985 -20.935 -24.313 1.00 0.00 H new ATOM 0 HG21 THR A 36 40.207 -22.870 -22.988 1.00 0.00 H new ATOM 0 HG22 THR A 36 39.812 -22.719 -21.259 1.00 0.00 H new ATOM 0 HG23 THR A 36 38.519 -22.628 -22.479 1.00 0.00 H new ATOM 547 N MET A 37 39.885 -19.952 -19.094 1.00 0.00 N ATOM 548 CA MET A 37 39.978 -20.347 -17.680 1.00 0.00 C ATOM 549 C MET A 37 38.734 -19.961 -16.868 1.00 0.00 C ATOM 550 O MET A 37 38.132 -20.799 -16.192 1.00 0.00 O ATOM 551 CB MET A 37 41.233 -19.800 -16.998 1.00 0.00 C ATOM 552 CG MET A 37 42.511 -20.396 -17.587 1.00 0.00 C ATOM 553 SD MET A 37 42.980 -19.486 -19.064 1.00 0.00 S ATOM 554 CE MET A 37 43.050 -20.853 -20.227 1.00 0.00 C ATOM 0 H MET A 37 40.506 -19.197 -19.385 1.00 0.00 H new ATOM 0 HA MET A 37 40.044 -21.435 -17.697 1.00 0.00 H new ATOM 0 HB2 MET A 37 41.258 -18.715 -17.101 1.00 0.00 H new ATOM 0 HB3 MET A 37 41.190 -20.018 -15.931 1.00 0.00 H new ATOM 0 HG2 MET A 37 43.315 -20.355 -16.852 1.00 0.00 H new ATOM 0 HG3 MET A 37 42.355 -21.447 -17.830 1.00 0.00 H new ATOM 0 HE1 MET A 37 43.206 -20.466 -21.234 1.00 0.00 H new ATOM 0 HE2 MET A 37 43.874 -21.516 -19.961 1.00 0.00 H new ATOM 0 HE3 MET A 37 42.112 -21.408 -20.193 1.00 0.00 H new ATOM 564 N ASP A 38 38.362 -18.681 -16.901 1.00 0.00 N ATOM 565 CA ASP A 38 37.090 -18.280 -16.265 1.00 0.00 C ATOM 566 C ASP A 38 35.890 -19.088 -16.767 1.00 0.00 C ATOM 567 O ASP A 38 34.943 -19.375 -16.031 1.00 0.00 O ATOM 568 CB ASP A 38 36.767 -16.798 -16.469 1.00 0.00 C ATOM 569 CG ASP A 38 37.785 -15.888 -15.798 1.00 0.00 C ATOM 570 OD1 ASP A 38 37.842 -15.869 -14.549 1.00 0.00 O ATOM 571 OD2 ASP A 38 38.530 -15.186 -16.514 1.00 0.00 O ATOM 0 H ASP A 38 38.891 -17.927 -17.339 1.00 0.00 H new ATOM 0 HA ASP A 38 37.249 -18.481 -15.206 1.00 0.00 H new ATOM 0 HB2 ASP A 38 36.735 -16.579 -17.536 1.00 0.00 H new ATOM 0 HB3 ASP A 38 35.775 -16.586 -16.070 1.00 0.00 H new ATOM 576 N MET A 39 35.938 -19.457 -18.038 1.00 0.00 N ATOM 577 CA MET A 39 34.844 -20.207 -18.627 1.00 0.00 C ATOM 578 C MET A 39 34.677 -21.596 -18.028 1.00 0.00 C ATOM 579 O MET A 39 33.628 -21.928 -17.477 1.00 0.00 O ATOM 580 CB MET A 39 35.025 -20.303 -20.141 1.00 0.00 C ATOM 581 CG MET A 39 34.734 -18.974 -20.847 1.00 0.00 C ATOM 582 SD MET A 39 35.811 -18.800 -22.280 1.00 0.00 S ATOM 583 CE MET A 39 34.806 -17.678 -23.264 1.00 0.00 C ATOM 0 H MET A 39 36.711 -19.252 -18.672 1.00 0.00 H new ATOM 0 HA MET A 39 33.931 -19.658 -18.398 1.00 0.00 H new ATOM 0 HB2 MET A 39 36.046 -20.614 -20.364 1.00 0.00 H new ATOM 0 HB3 MET A 39 34.363 -21.074 -20.536 1.00 0.00 H new ATOM 0 HG2 MET A 39 33.690 -18.937 -21.158 1.00 0.00 H new ATOM 0 HG3 MET A 39 34.891 -18.143 -20.159 1.00 0.00 H new ATOM 0 HE1 MET A 39 35.006 -17.844 -24.323 1.00 0.00 H new ATOM 0 HE2 MET A 39 33.751 -17.861 -23.060 1.00 0.00 H new ATOM 0 HE3 MET A 39 35.052 -16.648 -23.006 1.00 0.00 H new ATOM 593 N LEU A 40 35.704 -22.429 -18.129 1.00 0.00 N ATOM 594 CA LEU A 40 35.582 -23.766 -17.544 1.00 0.00 C ATOM 595 C LEU A 40 35.434 -23.756 -16.020 1.00 0.00 C ATOM 596 O LEU A 40 34.703 -24.563 -15.449 1.00 0.00 O ATOM 597 CB LEU A 40 36.692 -24.707 -18.022 1.00 0.00 C ATOM 598 CG LEU A 40 36.555 -25.006 -19.524 1.00 0.00 C ATOM 599 CD1 LEU A 40 37.804 -25.722 -20.032 1.00 0.00 C ATOM 600 CD2 LEU A 40 35.328 -25.880 -19.780 1.00 0.00 C ATOM 0 H LEU A 40 36.592 -22.222 -18.586 1.00 0.00 H new ATOM 0 HA LEU A 40 34.641 -24.169 -17.919 1.00 0.00 H new ATOM 0 HB2 LEU A 40 37.665 -24.257 -17.825 1.00 0.00 H new ATOM 0 HB3 LEU A 40 36.652 -25.638 -17.457 1.00 0.00 H new ATOM 0 HG LEU A 40 36.439 -24.062 -20.056 1.00 0.00 H new ATOM 0 HD11 LEU A 40 37.697 -25.929 -21.097 1.00 0.00 H new ATOM 0 HD12 LEU A 40 38.677 -25.089 -19.872 1.00 0.00 H new ATOM 0 HD13 LEU A 40 37.931 -26.660 -19.491 1.00 0.00 H new ATOM 0 HD21 LEU A 40 35.243 -26.084 -20.847 1.00 0.00 H new ATOM 0 HD22 LEU A 40 35.431 -26.820 -19.238 1.00 0.00 H new ATOM 0 HD23 LEU A 40 34.433 -25.360 -19.438 1.00 0.00 H new ATOM 612 N THR A 41 36.071 -22.798 -15.357 1.00 0.00 N ATOM 613 CA THR A 41 35.900 -22.698 -13.901 1.00 0.00 C ATOM 614 C THR A 41 34.457 -22.365 -13.485 1.00 0.00 C ATOM 615 O THR A 41 33.932 -22.915 -12.515 1.00 0.00 O ATOM 616 CB THR A 41 36.881 -21.701 -13.264 1.00 0.00 C ATOM 617 OG1 THR A 41 38.176 -21.886 -13.819 1.00 0.00 O ATOM 618 CG2 THR A 41 36.964 -21.901 -11.748 1.00 0.00 C ATOM 0 H THR A 41 36.688 -22.102 -15.777 1.00 0.00 H new ATOM 0 HA THR A 41 36.129 -23.693 -13.519 1.00 0.00 H new ATOM 0 HB THR A 41 36.519 -20.694 -13.469 1.00 0.00 H new ATOM 0 HG1 THR A 41 38.211 -21.479 -14.710 1.00 0.00 H new ATOM 0 HG21 THR A 41 37.665 -21.182 -11.324 1.00 0.00 H new ATOM 0 HG22 THR A 41 35.979 -21.750 -11.307 1.00 0.00 H new ATOM 0 HG23 THR A 41 37.307 -22.913 -11.533 1.00 0.00 H new ATOM 626 N LYS A 42 33.805 -21.462 -14.217 1.00 0.00 N ATOM 627 CA LYS A 42 32.451 -21.059 -13.817 1.00 0.00 C ATOM 628 C LYS A 42 31.316 -21.782 -14.551 1.00 0.00 C ATOM 629 O LYS A 42 30.301 -22.134 -13.948 1.00 0.00 O ATOM 630 CB LYS A 42 32.271 -19.534 -13.881 1.00 0.00 C ATOM 631 CG LYS A 42 31.094 -19.061 -13.017 1.00 0.00 C ATOM 632 CD LYS A 42 30.868 -17.552 -13.175 1.00 0.00 C ATOM 633 CE LYS A 42 29.947 -17.245 -14.359 1.00 0.00 C ATOM 634 NZ LYS A 42 28.537 -17.445 -13.972 1.00 0.00 N ATOM 0 H LYS A 42 34.170 -21.010 -15.056 1.00 0.00 H new ATOM 0 HA LYS A 42 32.366 -21.381 -12.779 1.00 0.00 H new ATOM 0 HB2 LYS A 42 33.186 -19.046 -13.546 1.00 0.00 H new ATOM 0 HB3 LYS A 42 32.108 -19.231 -14.915 1.00 0.00 H new ATOM 0 HG2 LYS A 42 30.190 -19.600 -13.301 1.00 0.00 H new ATOM 0 HG3 LYS A 42 31.289 -19.296 -11.971 1.00 0.00 H new ATOM 0 HD2 LYS A 42 30.433 -17.150 -12.260 1.00 0.00 H new ATOM 0 HD3 LYS A 42 31.826 -17.052 -13.318 1.00 0.00 H new ATOM 0 HE2 LYS A 42 30.099 -16.218 -14.691 1.00 0.00 H new ATOM 0 HE3 LYS A 42 30.196 -17.892 -15.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 27.921 -17.234 -14.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 28.395 -18.432 -13.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 28.300 -16.810 -13.183 1.00 0.00 H new ATOM 648 N LEU A 43 31.442 -21.968 -15.861 1.00 0.00 N ATOM 649 CA LEU A 43 30.359 -22.623 -16.589 1.00 0.00 C ATOM 650 C LEU A 43 30.160 -24.098 -16.174 1.00 0.00 C ATOM 651 O LEU A 43 29.061 -24.644 -16.293 1.00 0.00 O ATOM 652 CB LEU A 43 30.490 -22.321 -18.102 1.00 0.00 C ATOM 653 CG LEU A 43 30.219 -23.499 -19.048 1.00 0.00 C ATOM 654 CD1 LEU A 43 28.960 -23.238 -19.868 1.00 0.00 C ATOM 655 CD2 LEU A 43 31.380 -23.675 -20.020 1.00 0.00 C ATOM 0 H LEU A 43 32.247 -21.689 -16.422 1.00 0.00 H new ATOM 0 HA LEU A 43 29.399 -22.195 -16.300 1.00 0.00 H new ATOM 0 HB2 LEU A 43 29.802 -21.514 -18.352 1.00 0.00 H new ATOM 0 HB3 LEU A 43 31.498 -21.952 -18.293 1.00 0.00 H new ATOM 0 HG LEU A 43 30.096 -24.395 -18.439 1.00 0.00 H new ATOM 0 HD11 LEU A 43 28.779 -24.081 -20.535 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.109 -23.116 -19.198 1.00 0.00 H new ATOM 0 HD13 LEU A 43 29.091 -22.331 -20.458 1.00 0.00 H new ATOM 0 HD21 LEU A 43 31.174 -24.514 -20.685 1.00 0.00 H new ATOM 0 HD22 LEU A 43 31.502 -22.766 -20.610 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.295 -23.871 -19.462 1.00 0.00 H new ATOM 667 N GLY A 44 31.207 -24.748 -15.659 1.00 0.00 N ATOM 668 CA GLY A 44 31.022 -26.130 -15.203 1.00 0.00 C ATOM 669 C GLY A 44 32.167 -26.530 -14.284 1.00 0.00 C ATOM 670 O GLY A 44 32.103 -26.372 -13.065 1.00 0.00 O ATOM 0 H GLY A 44 32.146 -24.366 -15.550 1.00 0.00 H new ATOM 0 HA2 GLY A 44 30.072 -26.224 -14.677 1.00 0.00 H new ATOM 0 HA3 GLY A 44 30.980 -26.802 -16.060 1.00 0.00 H new ATOM 674 N GLN A 45 33.226 -27.057 -14.880 1.00 0.00 N ATOM 675 CA GLN A 45 34.398 -27.405 -14.066 1.00 0.00 C ATOM 676 C GLN A 45 35.652 -27.551 -14.941 1.00 0.00 C ATOM 677 O GLN A 45 36.446 -26.619 -15.072 1.00 0.00 O ATOM 678 CB GLN A 45 34.172 -28.623 -13.147 1.00 0.00 C ATOM 679 CG GLN A 45 35.173 -28.646 -11.981 1.00 0.00 C ATOM 680 CD GLN A 45 35.926 -29.970 -11.915 1.00 0.00 C ATOM 681 OE1 GLN A 45 36.846 -30.229 -12.689 1.00 0.00 O ATOM 682 NE2 GLN A 45 35.546 -30.825 -10.986 1.00 0.00 N ATOM 0 H GLN A 45 33.307 -27.249 -15.878 1.00 0.00 H new ATOM 0 HA GLN A 45 34.563 -26.570 -13.385 1.00 0.00 H new ATOM 0 HB2 GLN A 45 33.156 -28.599 -12.754 1.00 0.00 H new ATOM 0 HB3 GLN A 45 34.268 -29.540 -13.728 1.00 0.00 H new ATOM 0 HG2 GLN A 45 35.884 -27.828 -12.095 1.00 0.00 H new ATOM 0 HG3 GLN A 45 34.644 -28.480 -11.043 1.00 0.00 H new ATOM 0 HE21 GLN A 45 34.780 -30.587 -10.356 1.00 0.00 H new ATOM 0 HE22 GLN A 45 36.018 -31.725 -10.897 1.00 0.00 H new ATOM 691 N THR A 46 35.828 -28.714 -15.565 1.00 0.00 N ATOM 692 CA THR A 46 36.980 -28.890 -16.451 1.00 0.00 C ATOM 693 C THR A 46 36.639 -29.948 -17.567 1.00 0.00 C ATOM 694 O THR A 46 35.514 -30.451 -17.589 1.00 0.00 O ATOM 695 CB THR A 46 38.249 -29.373 -15.713 1.00 0.00 C ATOM 696 OG1 THR A 46 37.943 -30.536 -14.956 1.00 0.00 O ATOM 697 CG2 THR A 46 38.803 -28.300 -14.774 1.00 0.00 C ATOM 0 H THR A 46 35.213 -29.523 -15.480 1.00 0.00 H new ATOM 0 HA THR A 46 37.187 -27.908 -16.876 1.00 0.00 H new ATOM 0 HB THR A 46 39.007 -29.593 -16.465 1.00 0.00 H new ATOM 0 HG1 THR A 46 37.817 -30.290 -14.016 1.00 0.00 H new ATOM 0 HG21 THR A 46 39.695 -28.679 -14.274 1.00 0.00 H new ATOM 0 HG22 THR A 46 39.060 -27.410 -15.349 1.00 0.00 H new ATOM 0 HG23 THR A 46 38.050 -28.045 -14.028 1.00 0.00 H new ATOM 705 N TYR A 47 37.546 -30.319 -18.504 1.00 0.00 N ATOM 706 CA TYR A 47 37.298 -31.595 -19.205 1.00 0.00 C ATOM 707 C TYR A 47 38.159 -32.724 -18.611 1.00 0.00 C ATOM 708 O TYR A 47 37.779 -33.347 -17.618 1.00 0.00 O ATOM 709 CB TYR A 47 37.419 -31.468 -20.733 1.00 0.00 C ATOM 710 CG TYR A 47 36.151 -30.896 -21.361 1.00 0.00 C ATOM 711 CD1 TYR A 47 35.046 -31.675 -21.494 1.00 0.00 C ATOM 712 CD2 TYR A 47 36.088 -29.579 -21.694 1.00 0.00 C ATOM 713 CE1 TYR A 47 33.844 -31.104 -21.776 1.00 0.00 C ATOM 714 CE2 TYR A 47 34.888 -29.014 -22.000 1.00 0.00 C ATOM 715 CZ TYR A 47 33.769 -29.776 -22.035 1.00 0.00 C ATOM 716 OH TYR A 47 32.577 -29.217 -22.408 1.00 0.00 O ATOM 0 H TYR A 47 38.384 -29.804 -18.773 1.00 0.00 H new ATOM 0 HA TYR A 47 36.257 -31.870 -19.033 1.00 0.00 H new ATOM 0 HB2 TYR A 47 38.266 -30.827 -20.978 1.00 0.00 H new ATOM 0 HB3 TYR A 47 37.626 -32.448 -21.163 1.00 0.00 H new ATOM 0 HD1 TYR A 47 35.122 -32.746 -21.376 1.00 0.00 H new ATOM 0 HD2 TYR A 47 36.988 -28.983 -21.716 1.00 0.00 H new ATOM 0 HE1 TYR A 47 32.950 -31.709 -21.793 1.00 0.00 H new ATOM 0 HE2 TYR A 47 34.828 -27.957 -22.215 1.00 0.00 H new ATOM 0 HH TYR A 47 32.041 -29.881 -22.891 1.00 0.00 H new ATOM 726 N THR A 48 39.331 -32.989 -19.192 1.00 0.00 N ATOM 727 CA THR A 48 40.199 -34.013 -18.595 1.00 0.00 C ATOM 728 C THR A 48 41.381 -33.368 -17.855 1.00 0.00 C ATOM 729 O THR A 48 41.237 -32.909 -16.722 1.00 0.00 O ATOM 730 CB THR A 48 40.627 -35.104 -19.596 1.00 0.00 C ATOM 731 OG1 THR A 48 41.251 -34.503 -20.722 1.00 0.00 O ATOM 732 CG2 THR A 48 39.418 -35.910 -20.071 1.00 0.00 C ATOM 0 H THR A 48 39.691 -32.537 -20.033 1.00 0.00 H new ATOM 0 HA THR A 48 39.607 -34.544 -17.850 1.00 0.00 H new ATOM 0 HB THR A 48 41.325 -35.773 -19.093 1.00 0.00 H new ATOM 0 HG1 THR A 48 40.898 -34.903 -21.544 1.00 0.00 H new ATOM 0 HG21 THR A 48 39.744 -36.674 -20.777 1.00 0.00 H new ATOM 0 HG22 THR A 48 38.940 -36.387 -19.215 1.00 0.00 H new ATOM 0 HG23 THR A 48 38.707 -35.245 -20.560 1.00 0.00 H new ATOM 740 N LYS A 49 42.558 -33.326 -18.478 1.00 0.00 N ATOM 741 CA LYS A 49 43.690 -32.676 -17.805 1.00 0.00 C ATOM 742 C LYS A 49 44.795 -32.229 -18.769 1.00 0.00 C ATOM 743 O LYS A 49 45.055 -31.036 -18.916 1.00 0.00 O ATOM 744 CB LYS A 49 44.250 -33.512 -16.639 1.00 0.00 C ATOM 745 CG LYS A 49 45.065 -32.658 -15.655 1.00 0.00 C ATOM 746 CD LYS A 49 46.554 -32.633 -16.021 1.00 0.00 C ATOM 747 CE LYS A 49 47.330 -31.672 -15.116 1.00 0.00 C ATOM 748 NZ LYS A 49 47.045 -30.271 -15.487 1.00 0.00 N ATOM 0 H LYS A 49 42.753 -33.712 -19.402 1.00 0.00 H new ATOM 0 HA LYS A 49 43.278 -31.765 -17.372 1.00 0.00 H new ATOM 0 HB2 LYS A 49 43.427 -33.990 -16.108 1.00 0.00 H new ATOM 0 HB3 LYS A 49 44.880 -34.309 -17.034 1.00 0.00 H new ATOM 0 HG2 LYS A 49 44.675 -31.640 -15.648 1.00 0.00 H new ATOM 0 HG3 LYS A 49 44.945 -33.052 -14.646 1.00 0.00 H new ATOM 0 HD2 LYS A 49 46.970 -33.637 -15.932 1.00 0.00 H new ATOM 0 HD3 LYS A 49 46.670 -32.331 -17.062 1.00 0.00 H new ATOM 0 HE2 LYS A 49 47.056 -31.842 -14.075 1.00 0.00 H new ATOM 0 HE3 LYS A 49 48.399 -31.867 -15.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 47.689 -29.638 -14.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 47.184 -30.148 -16.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 46.061 -30.040 -15.241 1.00 0.00 H new ATOM 762 N ARG A 50 45.470 -33.181 -19.411 1.00 0.00 N ATOM 763 CA ARG A 50 46.599 -32.808 -20.280 1.00 0.00 C ATOM 764 C ARG A 50 46.175 -32.418 -21.703 1.00 0.00 C ATOM 765 O ARG A 50 46.573 -31.376 -22.233 1.00 0.00 O ATOM 766 CB ARG A 50 47.679 -33.905 -20.302 1.00 0.00 C ATOM 767 CG ARG A 50 48.949 -33.467 -21.044 1.00 0.00 C ATOM 768 CD ARG A 50 49.818 -32.540 -20.185 1.00 0.00 C ATOM 769 NE ARG A 50 50.235 -31.377 -20.979 1.00 0.00 N ATOM 770 CZ ARG A 50 50.162 -30.168 -20.440 1.00 0.00 C ATOM 771 NH1 ARG A 50 50.494 -29.972 -19.178 1.00 0.00 N ATOM 772 NH2 ARG A 50 49.774 -29.148 -21.173 1.00 0.00 N ATOM 0 H ARG A 50 45.271 -34.180 -19.355 1.00 0.00 H new ATOM 0 HA ARG A 50 47.030 -31.910 -19.837 1.00 0.00 H new ATOM 0 HB2 ARG A 50 47.936 -34.177 -19.278 1.00 0.00 H new ATOM 0 HB3 ARG A 50 47.275 -34.799 -20.777 1.00 0.00 H new ATOM 0 HG2 ARG A 50 49.526 -34.347 -21.328 1.00 0.00 H new ATOM 0 HG3 ARG A 50 48.673 -32.956 -21.966 1.00 0.00 H new ATOM 0 HD2 ARG A 50 49.260 -32.212 -19.308 1.00 0.00 H new ATOM 0 HD3 ARG A 50 50.694 -33.079 -19.823 1.00 0.00 H new ATOM 0 HE ARG A 50 50.576 -31.498 -21.933 1.00 0.00 H new ATOM 0 HH11 ARG A 50 50.811 -30.755 -18.606 1.00 0.00 H new ATOM 0 HH12 ARG A 50 50.434 -29.037 -18.774 1.00 0.00 H new ATOM 0 HH21 ARG A 50 49.530 -29.288 -22.153 1.00 0.00 H new ATOM 0 HH22 ARG A 50 49.717 -28.217 -20.761 1.00 0.00 H new ATOM 786 N GLU A 51 45.368 -33.255 -22.337 1.00 0.00 N ATOM 787 CA GLU A 51 44.934 -32.933 -23.701 1.00 0.00 C ATOM 788 C GLU A 51 43.877 -31.806 -23.738 1.00 0.00 C ATOM 789 O GLU A 51 43.902 -30.932 -24.611 1.00 0.00 O ATOM 790 CB GLU A 51 44.553 -34.191 -24.496 1.00 0.00 C ATOM 791 CG GLU A 51 45.787 -34.892 -25.092 1.00 0.00 C ATOM 792 CD GLU A 51 46.714 -35.468 -24.026 1.00 0.00 C ATOM 793 OE1 GLU A 51 46.319 -36.437 -23.343 1.00 0.00 O ATOM 794 OE2 GLU A 51 47.846 -34.958 -23.875 1.00 0.00 O ATOM 0 H GLU A 51 45.008 -34.130 -21.955 1.00 0.00 H new ATOM 0 HA GLU A 51 45.793 -32.515 -24.225 1.00 0.00 H new ATOM 0 HB2 GLU A 51 44.021 -34.885 -23.844 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.868 -33.919 -25.299 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.459 -35.694 -25.753 1.00 0.00 H new ATOM 0 HG3 GLU A 51 46.342 -34.181 -25.704 1.00 0.00 H new ATOM 801 N THR A 52 42.957 -31.772 -22.772 1.00 0.00 N ATOM 802 CA THR A 52 42.118 -30.576 -22.690 1.00 0.00 C ATOM 803 C THR A 52 42.933 -29.344 -22.219 1.00 0.00 C ATOM 804 O THR A 52 42.535 -28.198 -22.408 1.00 0.00 O ATOM 805 CB THR A 52 40.830 -30.713 -21.874 1.00 0.00 C ATOM 806 OG1 THR A 52 40.384 -32.064 -21.897 1.00 0.00 O ATOM 807 CG2 THR A 52 39.736 -29.839 -22.482 1.00 0.00 C ATOM 0 H THR A 52 42.780 -32.501 -22.081 1.00 0.00 H new ATOM 0 HA THR A 52 41.780 -30.429 -23.716 1.00 0.00 H new ATOM 0 HB THR A 52 41.034 -30.402 -20.849 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.567 -32.454 -22.777 1.00 0.00 H new ATOM 0 HG21 THR A 52 38.822 -29.941 -21.897 1.00 0.00 H new ATOM 0 HG22 THR A 52 40.057 -28.797 -22.476 1.00 0.00 H new ATOM 0 HG23 THR A 52 39.547 -30.154 -23.508 1.00 0.00 H new ATOM 815 N GLU A 53 44.065 -29.577 -21.552 1.00 0.00 N ATOM 816 CA GLU A 53 45.039 -28.476 -21.390 1.00 0.00 C ATOM 817 C GLU A 53 45.463 -27.940 -22.770 1.00 0.00 C ATOM 818 O GLU A 53 45.630 -26.737 -22.968 1.00 0.00 O ATOM 819 CB GLU A 53 46.305 -28.842 -20.596 1.00 0.00 C ATOM 820 CG GLU A 53 46.355 -28.151 -19.227 1.00 0.00 C ATOM 821 CD GLU A 53 47.746 -28.246 -18.622 1.00 0.00 C ATOM 822 OE1 GLU A 53 48.641 -27.482 -19.048 1.00 0.00 O ATOM 823 OE2 GLU A 53 47.959 -29.095 -17.730 1.00 0.00 O ATOM 0 H GLU A 53 44.330 -30.468 -21.131 1.00 0.00 H new ATOM 0 HA GLU A 53 44.515 -27.720 -20.806 1.00 0.00 H new ATOM 0 HB2 GLU A 53 46.344 -29.922 -20.457 1.00 0.00 H new ATOM 0 HB3 GLU A 53 47.186 -28.563 -21.173 1.00 0.00 H new ATOM 0 HG2 GLU A 53 46.071 -27.104 -19.333 1.00 0.00 H new ATOM 0 HG3 GLU A 53 45.630 -28.612 -18.556 1.00 0.00 H new ATOM 830 N ALA A 54 45.663 -28.858 -23.724 1.00 0.00 N ATOM 831 CA ALA A 54 45.824 -28.431 -25.128 1.00 0.00 C ATOM 832 C ALA A 54 44.700 -27.492 -25.573 1.00 0.00 C ATOM 833 O ALA A 54 44.949 -26.447 -26.173 1.00 0.00 O ATOM 834 CB ALA A 54 45.918 -29.596 -26.124 1.00 0.00 C ATOM 0 H ALA A 54 45.717 -29.864 -23.565 1.00 0.00 H new ATOM 0 HA ALA A 54 46.777 -27.902 -25.142 1.00 0.00 H new ATOM 0 HB1 ALA A 54 46.035 -29.203 -27.134 1.00 0.00 H new ATOM 0 HB2 ALA A 54 46.777 -30.219 -25.875 1.00 0.00 H new ATOM 0 HB3 ALA A 54 45.009 -30.194 -26.071 1.00 0.00 H new ATOM 840 N ILE A 55 43.452 -27.864 -25.267 1.00 0.00 N ATOM 841 CA ILE A 55 42.331 -26.904 -25.497 1.00 0.00 C ATOM 842 C ILE A 55 42.695 -25.508 -24.955 1.00 0.00 C ATOM 843 O ILE A 55 42.745 -24.499 -25.668 1.00 0.00 O ATOM 844 CB ILE A 55 40.957 -27.262 -24.833 1.00 0.00 C ATOM 845 CG1 ILE A 55 40.250 -28.418 -25.479 1.00 0.00 C ATOM 846 CG2 ILE A 55 40.031 -26.079 -24.868 1.00 0.00 C ATOM 847 CD1 ILE A 55 38.824 -28.695 -24.975 1.00 0.00 C ATOM 0 H ILE A 55 43.185 -28.769 -24.880 1.00 0.00 H new ATOM 0 HA ILE A 55 42.203 -26.944 -26.579 1.00 0.00 H new ATOM 0 HB ILE A 55 41.203 -27.548 -23.810 1.00 0.00 H new ATOM 0 HG12 ILE A 55 40.207 -28.239 -26.553 1.00 0.00 H new ATOM 0 HG13 ILE A 55 40.849 -29.316 -25.329 1.00 0.00 H new ATOM 0 HG21 ILE A 55 39.082 -26.346 -24.403 1.00 0.00 H new ATOM 0 HG22 ILE A 55 40.481 -25.249 -24.324 1.00 0.00 H new ATOM 0 HG23 ILE A 55 39.857 -25.783 -25.903 1.00 0.00 H new ATOM 0 HD11 ILE A 55 38.409 -29.550 -25.509 1.00 0.00 H new ATOM 0 HD12 ILE A 55 38.851 -28.913 -23.907 1.00 0.00 H new ATOM 0 HD13 ILE A 55 38.199 -27.819 -25.151 1.00 0.00 H new ATOM 859 N MET A 56 42.925 -25.495 -23.652 1.00 0.00 N ATOM 860 CA MET A 56 43.137 -24.236 -22.933 1.00 0.00 C ATOM 861 C MET A 56 44.334 -23.414 -23.412 1.00 0.00 C ATOM 862 O MET A 56 44.342 -22.187 -23.340 1.00 0.00 O ATOM 863 CB MET A 56 43.239 -24.530 -21.432 1.00 0.00 C ATOM 864 CG MET A 56 41.938 -25.158 -20.920 1.00 0.00 C ATOM 865 SD MET A 56 42.295 -26.432 -19.696 1.00 0.00 S ATOM 866 CE MET A 56 40.824 -27.466 -19.900 1.00 0.00 C ATOM 0 H MET A 56 42.971 -26.331 -23.069 1.00 0.00 H new ATOM 0 HA MET A 56 42.273 -23.607 -23.148 1.00 0.00 H new ATOM 0 HB2 MET A 56 44.074 -25.204 -21.243 1.00 0.00 H new ATOM 0 HB3 MET A 56 43.444 -23.608 -20.888 1.00 0.00 H new ATOM 0 HG2 MET A 56 41.304 -24.389 -20.479 1.00 0.00 H new ATOM 0 HG3 MET A 56 41.383 -25.590 -21.753 1.00 0.00 H new ATOM 0 HE1 MET A 56 40.116 -27.254 -19.099 1.00 0.00 H new ATOM 0 HE2 MET A 56 40.359 -27.251 -20.862 1.00 0.00 H new ATOM 0 HE3 MET A 56 41.110 -28.517 -19.862 1.00 0.00 H new ATOM 876 N LYS A 57 45.359 -24.101 -23.889 1.00 0.00 N ATOM 877 CA LYS A 57 46.531 -23.385 -24.406 1.00 0.00 C ATOM 878 C LYS A 57 46.383 -22.962 -25.879 1.00 0.00 C ATOM 879 O LYS A 57 46.914 -21.932 -26.298 1.00 0.00 O ATOM 880 CB LYS A 57 47.834 -24.176 -24.189 1.00 0.00 C ATOM 881 CG LYS A 57 48.518 -23.820 -22.858 1.00 0.00 C ATOM 882 CD LYS A 57 47.717 -24.321 -21.650 1.00 0.00 C ATOM 883 CE LYS A 57 48.435 -23.996 -20.336 1.00 0.00 C ATOM 884 NZ LYS A 57 49.422 -25.044 -20.012 1.00 0.00 N ATOM 0 H LYS A 57 45.413 -25.119 -23.933 1.00 0.00 H new ATOM 0 HA LYS A 57 46.592 -22.467 -23.821 1.00 0.00 H new ATOM 0 HB2 LYS A 57 47.616 -25.244 -24.209 1.00 0.00 H new ATOM 0 HB3 LYS A 57 48.520 -23.976 -25.012 1.00 0.00 H new ATOM 0 HG2 LYS A 57 49.517 -24.255 -22.836 1.00 0.00 H new ATOM 0 HG3 LYS A 57 48.639 -22.739 -22.790 1.00 0.00 H new ATOM 0 HD2 LYS A 57 46.728 -23.862 -21.650 1.00 0.00 H new ATOM 0 HD3 LYS A 57 47.569 -25.398 -21.730 1.00 0.00 H new ATOM 0 HE2 LYS A 57 48.935 -23.031 -20.417 1.00 0.00 H new ATOM 0 HE3 LYS A 57 47.707 -23.912 -19.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 49.981 -24.751 -19.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 48.927 -25.933 -19.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 50.055 -25.188 -20.824 1.00 0.00 H new ATOM 898 N GLU A 58 45.646 -23.738 -26.671 1.00 0.00 N ATOM 899 CA GLU A 58 45.504 -23.392 -28.097 1.00 0.00 C ATOM 900 C GLU A 58 44.440 -22.314 -28.403 1.00 0.00 C ATOM 901 O GLU A 58 44.457 -21.705 -29.472 1.00 0.00 O ATOM 902 CB GLU A 58 45.323 -24.637 -28.979 1.00 0.00 C ATOM 903 CG GLU A 58 43.917 -25.241 -28.853 1.00 0.00 C ATOM 904 CD GLU A 58 43.834 -26.595 -29.539 1.00 0.00 C ATOM 905 OE1 GLU A 58 44.143 -27.620 -28.892 1.00 0.00 O ATOM 906 OE2 GLU A 58 43.456 -26.643 -30.728 1.00 0.00 O ATOM 0 H GLU A 58 45.153 -24.580 -26.373 1.00 0.00 H new ATOM 0 HA GLU A 58 46.455 -22.927 -28.358 1.00 0.00 H new ATOM 0 HB2 GLU A 58 45.511 -24.373 -30.020 1.00 0.00 H new ATOM 0 HB3 GLU A 58 46.064 -25.387 -28.702 1.00 0.00 H new ATOM 0 HG2 GLU A 58 43.658 -25.348 -27.800 1.00 0.00 H new ATOM 0 HG3 GLU A 58 43.187 -24.562 -29.293 1.00 0.00 H new ATOM 913 N ALA A 59 43.504 -22.086 -27.476 1.00 0.00 N ATOM 914 CA ALA A 59 42.516 -21.014 -27.693 1.00 0.00 C ATOM 915 C ALA A 59 43.152 -19.695 -28.163 1.00 0.00 C ATOM 916 O ALA A 59 42.829 -19.176 -29.231 1.00 0.00 O ATOM 917 CB ALA A 59 41.638 -20.791 -26.458 1.00 0.00 C ATOM 0 H ALA A 59 43.406 -22.603 -26.602 1.00 0.00 H new ATOM 0 HA ALA A 59 41.876 -21.360 -28.505 1.00 0.00 H new ATOM 0 HB1 ALA A 59 40.923 -19.993 -26.659 1.00 0.00 H new ATOM 0 HB2 ALA A 59 41.100 -21.709 -26.223 1.00 0.00 H new ATOM 0 HB3 ALA A 59 42.265 -20.512 -25.611 1.00 0.00 H new ATOM 923 N ARG A 60 44.059 -19.143 -27.358 1.00 0.00 N ATOM 924 CA ARG A 60 44.883 -18.008 -27.874 1.00 0.00 C ATOM 925 C ARG A 60 45.576 -18.390 -29.198 1.00 0.00 C ATOM 926 O ARG A 60 45.043 -18.161 -30.282 1.00 0.00 O ATOM 927 CB ARG A 60 45.918 -17.479 -26.860 1.00 0.00 C ATOM 928 CG ARG A 60 46.651 -16.234 -27.395 1.00 0.00 C ATOM 929 CD ARG A 60 47.004 -15.244 -26.280 1.00 0.00 C ATOM 930 NE ARG A 60 48.063 -15.790 -25.416 1.00 0.00 N ATOM 931 CZ ARG A 60 48.566 -15.034 -24.447 1.00 0.00 C ATOM 932 NH1 ARG A 60 48.671 -13.726 -24.596 1.00 0.00 N ATOM 933 NH2 ARG A 60 48.987 -15.596 -23.333 1.00 0.00 N ATOM 0 H ARG A 60 44.250 -19.429 -26.398 1.00 0.00 H new ATOM 0 HA ARG A 60 44.183 -17.191 -28.051 1.00 0.00 H new ATOM 0 HB2 ARG A 60 45.418 -17.233 -25.923 1.00 0.00 H new ATOM 0 HB3 ARG A 60 46.643 -18.262 -26.638 1.00 0.00 H new ATOM 0 HG2 ARG A 60 47.563 -16.543 -27.906 1.00 0.00 H new ATOM 0 HG3 ARG A 60 46.025 -15.736 -28.135 1.00 0.00 H new ATOM 0 HD2 ARG A 60 47.333 -14.301 -26.715 1.00 0.00 H new ATOM 0 HD3 ARG A 60 46.117 -15.028 -25.684 1.00 0.00 H new ATOM 0 HE ARG A 60 48.407 -16.739 -25.560 1.00 0.00 H new ATOM 0 HH11 ARG A 60 48.364 -13.285 -25.463 1.00 0.00 H new ATOM 0 HH12 ARG A 60 49.059 -13.157 -23.844 1.00 0.00 H new ATOM 0 HH21 ARG A 60 48.926 -16.608 -23.217 1.00 0.00 H new ATOM 0 HH22 ARG A 60 49.374 -15.020 -22.586 1.00 0.00 H new ATOM 947 N GLY A 61 46.790 -18.929 -29.120 1.00 0.00 N ATOM 948 CA GLY A 61 47.419 -19.417 -30.333 1.00 0.00 C ATOM 949 C GLY A 61 48.915 -19.647 -30.070 1.00 0.00 C ATOM 950 O GLY A 61 49.338 -19.785 -28.920 1.00 0.00 O ATOM 0 H GLY A 61 47.336 -19.035 -28.265 1.00 0.00 H new ATOM 0 HA2 GLY A 61 46.947 -20.346 -30.653 1.00 0.00 H new ATOM 0 HA3 GLY A 61 47.286 -18.697 -31.141 1.00 0.00 H new ATOM 954 N PRO A 62 49.748 -19.651 -31.114 1.00 0.00 N ATOM 955 CA PRO A 62 51.178 -19.889 -30.874 1.00 0.00 C ATOM 956 C PRO A 62 51.915 -18.558 -30.644 1.00 0.00 C ATOM 957 O PRO A 62 52.373 -18.259 -29.540 1.00 0.00 O ATOM 958 CB PRO A 62 51.676 -20.636 -32.118 1.00 0.00 C ATOM 959 CG PRO A 62 50.488 -20.791 -33.073 1.00 0.00 C ATOM 960 CD PRO A 62 49.274 -20.145 -32.408 1.00 0.00 C ATOM 0 HA PRO A 62 51.363 -20.477 -29.975 1.00 0.00 H new ATOM 0 HB2 PRO A 62 52.484 -20.084 -32.598 1.00 0.00 H new ATOM 0 HB3 PRO A 62 52.076 -21.612 -31.844 1.00 0.00 H new ATOM 0 HG2 PRO A 62 50.700 -20.313 -34.029 1.00 0.00 H new ATOM 0 HG3 PRO A 62 50.297 -21.844 -33.279 1.00 0.00 H new ATOM 0 HD2 PRO A 62 48.880 -19.332 -33.017 1.00 0.00 H new ATOM 0 HD3 PRO A 62 48.467 -20.867 -32.280 1.00 0.00 H new ATOM 968 N LYS A 63 52.027 -17.755 -31.696 1.00 0.00 N ATOM 969 CA LYS A 63 52.651 -16.423 -31.532 1.00 0.00 C ATOM 970 C LYS A 63 51.657 -15.291 -31.805 1.00 0.00 C ATOM 971 O LYS A 63 52.008 -14.173 -32.183 1.00 0.00 O ATOM 972 CB LYS A 63 53.856 -16.260 -32.456 1.00 0.00 C ATOM 973 CG LYS A 63 55.078 -15.625 -31.766 1.00 0.00 C ATOM 974 CD LYS A 63 55.064 -14.092 -31.864 1.00 0.00 C ATOM 975 CE LYS A 63 54.623 -13.447 -30.547 1.00 0.00 C ATOM 976 NZ LYS A 63 54.341 -12.014 -30.760 1.00 0.00 N ATOM 0 H LYS A 63 51.712 -17.978 -32.640 1.00 0.00 H new ATOM 0 HA LYS A 63 52.978 -16.360 -30.494 1.00 0.00 H new ATOM 0 HB2 LYS A 63 54.137 -17.237 -32.849 1.00 0.00 H new ATOM 0 HB3 LYS A 63 53.569 -15.644 -33.309 1.00 0.00 H new ATOM 0 HG2 LYS A 63 55.096 -15.921 -30.717 1.00 0.00 H new ATOM 0 HG3 LYS A 63 55.991 -16.009 -32.221 1.00 0.00 H new ATOM 0 HD2 LYS A 63 56.059 -13.735 -32.130 1.00 0.00 H new ATOM 0 HD3 LYS A 63 54.391 -13.784 -32.664 1.00 0.00 H new ATOM 0 HE2 LYS A 63 53.734 -13.949 -30.166 1.00 0.00 H new ATOM 0 HE3 LYS A 63 55.403 -13.565 -29.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 53.779 -11.649 -29.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 55.237 -11.489 -30.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 53.808 -11.893 -31.645 1.00 0.00 H new ATOM 990 N GLY A 64 50.397 -15.613 -31.600 1.00 0.00 N ATOM 991 CA GLY A 64 49.335 -14.658 -31.915 1.00 0.00 C ATOM 992 C GLY A 64 49.423 -13.393 -31.034 1.00 0.00 C ATOM 993 O GLY A 64 48.923 -12.341 -31.429 1.00 0.00 O ATOM 0 H GLY A 64 50.079 -16.507 -31.225 1.00 0.00 H new ATOM 0 HA2 GLY A 64 49.400 -14.375 -32.966 1.00 0.00 H new ATOM 0 HA3 GLY A 64 48.364 -15.133 -31.773 1.00 0.00 H new ATOM 997 N ASP A 65 49.991 -13.504 -29.815 1.00 0.00 N ATOM 998 CA ASP A 65 50.293 -12.232 -29.034 1.00 0.00 C ATOM 999 C ASP A 65 49.061 -11.796 -28.235 1.00 0.00 C ATOM 1000 O ASP A 65 49.079 -11.704 -27.006 1.00 0.00 O ATOM 1001 CB ASP A 65 50.806 -11.114 -29.958 1.00 0.00 C ATOM 1002 CG ASP A 65 51.642 -10.079 -29.216 1.00 0.00 C ATOM 1003 OD1 ASP A 65 52.873 -10.273 -29.105 1.00 0.00 O ATOM 1004 OD2 ASP A 65 51.076 -9.067 -28.748 1.00 0.00 O ATOM 0 H ASP A 65 50.243 -14.379 -29.356 1.00 0.00 H new ATOM 0 HA ASP A 65 51.094 -12.443 -28.326 1.00 0.00 H new ATOM 0 HB2 ASP A 65 51.403 -11.553 -30.757 1.00 0.00 H new ATOM 0 HB3 ASP A 65 49.957 -10.619 -30.430 1.00 0.00 H new ATOM 1009 N LYS A 66 47.971 -11.563 -28.956 1.00 0.00 N ATOM 1010 CA LYS A 66 46.738 -11.113 -28.293 1.00 0.00 C ATOM 1011 C LYS A 66 45.495 -11.717 -28.966 1.00 0.00 C ATOM 1012 O LYS A 66 44.465 -11.060 -29.126 1.00 0.00 O ATOM 1013 CB LYS A 66 46.630 -9.576 -28.240 1.00 0.00 C ATOM 1014 CG LYS A 66 47.690 -8.959 -27.317 1.00 0.00 C ATOM 1015 CD LYS A 66 47.581 -7.429 -27.278 1.00 0.00 C ATOM 1016 CE LYS A 66 48.322 -6.772 -28.448 1.00 0.00 C ATOM 1017 NZ LYS A 66 49.781 -6.815 -28.224 1.00 0.00 N ATOM 0 H LYS A 66 47.907 -11.672 -29.968 1.00 0.00 H new ATOM 0 HA LYS A 66 46.786 -11.472 -27.265 1.00 0.00 H new ATOM 0 HB2 LYS A 66 46.743 -9.169 -29.245 1.00 0.00 H new ATOM 0 HB3 LYS A 66 45.637 -9.294 -27.891 1.00 0.00 H new ATOM 0 HG2 LYS A 66 47.574 -9.359 -26.310 1.00 0.00 H new ATOM 0 HG3 LYS A 66 48.684 -9.245 -27.661 1.00 0.00 H new ATOM 0 HD2 LYS A 66 46.531 -7.139 -27.305 1.00 0.00 H new ATOM 0 HD3 LYS A 66 47.989 -7.060 -26.337 1.00 0.00 H new ATOM 0 HE2 LYS A 66 48.075 -7.286 -29.377 1.00 0.00 H new ATOM 0 HE3 LYS A 66 47.995 -5.738 -28.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 50.259 -6.223 -28.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 49.997 -6.457 -27.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 50.117 -7.796 -28.310 1.00 0.00 H new ATOM 1031 N LYS A 67 45.578 -12.989 -29.350 1.00 0.00 N ATOM 1032 CA LYS A 67 44.453 -13.593 -30.074 1.00 0.00 C ATOM 1033 C LYS A 67 43.342 -14.065 -29.140 1.00 0.00 C ATOM 1034 O LYS A 67 43.580 -14.677 -28.096 1.00 0.00 O ATOM 1035 CB LYS A 67 44.893 -14.732 -31.014 1.00 0.00 C ATOM 1036 CG LYS A 67 43.708 -15.316 -31.803 1.00 0.00 C ATOM 1037 CD LYS A 67 44.169 -16.387 -32.800 1.00 0.00 C ATOM 1038 CE LYS A 67 43.008 -17.309 -33.200 1.00 0.00 C ATOM 1039 NZ LYS A 67 42.861 -18.407 -32.223 1.00 0.00 N ATOM 0 H LYS A 67 46.375 -13.603 -29.183 1.00 0.00 H new ATOM 0 HA LYS A 67 44.047 -12.794 -30.695 1.00 0.00 H new ATOM 0 HB2 LYS A 67 45.644 -14.358 -31.710 1.00 0.00 H new ATOM 0 HB3 LYS A 67 45.365 -15.522 -30.430 1.00 0.00 H new ATOM 0 HG2 LYS A 67 42.986 -15.749 -31.110 1.00 0.00 H new ATOM 0 HG3 LYS A 67 43.196 -14.516 -32.338 1.00 0.00 H new ATOM 0 HD2 LYS A 67 44.579 -15.908 -33.689 1.00 0.00 H new ATOM 0 HD3 LYS A 67 44.971 -16.978 -32.358 1.00 0.00 H new ATOM 0 HE2 LYS A 67 42.082 -16.736 -33.254 1.00 0.00 H new ATOM 0 HE3 LYS A 67 43.187 -17.720 -34.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 41.851 -18.573 -32.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 43.289 -19.273 -32.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 43.339 -18.149 -31.336 1.00 0.00 H new ATOM 1053 N ASN A 68 42.112 -13.771 -29.529 1.00 0.00 N ATOM 1054 CA ASN A 68 40.972 -14.282 -28.755 1.00 0.00 C ATOM 1055 C ASN A 68 40.090 -15.169 -29.619 1.00 0.00 C ATOM 1056 O ASN A 68 40.067 -15.056 -30.847 1.00 0.00 O ATOM 1057 CB ASN A 68 40.089 -13.222 -28.060 1.00 0.00 C ATOM 1058 CG ASN A 68 40.469 -11.769 -28.359 1.00 0.00 C ATOM 1059 OD1 ASN A 68 40.435 -11.388 -29.623 1.00 0.00 O flip ATOM 1060 ND2 ASN A 68 40.772 -10.987 -27.461 1.00 0.00 N flip ATOM 0 H ASN A 68 41.873 -13.204 -30.343 1.00 0.00 H new ATOM 0 HA ASN A 68 41.442 -14.845 -27.949 1.00 0.00 H new ATOM 0 HB2 ASN A 68 39.053 -13.380 -28.360 1.00 0.00 H new ATOM 0 HB3 ASN A 68 40.137 -13.380 -26.983 1.00 0.00 H new ATOM 0 HD21 ASN A 68 40.791 -11.306 -26.492 1.00 0.00 H new ATOM 0 HD22 ASN A 68 41.004 -10.019 -27.684 1.00 0.00 H new ATOM 1067 N ILE A 69 39.329 -16.047 -28.979 1.00 0.00 N ATOM 1068 CA ILE A 69 38.465 -16.915 -29.773 1.00 0.00 C ATOM 1069 C ILE A 69 37.045 -16.385 -29.889 1.00 0.00 C ATOM 1070 O ILE A 69 36.264 -16.310 -28.940 1.00 0.00 O ATOM 1071 CB ILE A 69 38.515 -18.401 -29.453 1.00 0.00 C ATOM 1072 CG1 ILE A 69 37.680 -18.783 -28.218 1.00 0.00 C ATOM 1073 CG2 ILE A 69 39.973 -18.848 -29.293 1.00 0.00 C ATOM 1074 CD1 ILE A 69 37.820 -20.269 -27.873 1.00 0.00 C ATOM 0 H ILE A 69 39.289 -16.176 -27.968 1.00 0.00 H new ATOM 0 HA ILE A 69 38.917 -16.866 -30.764 1.00 0.00 H new ATOM 0 HB ILE A 69 38.062 -18.928 -30.293 1.00 0.00 H new ATOM 0 HG12 ILE A 69 37.995 -18.181 -27.366 1.00 0.00 H new ATOM 0 HG13 ILE A 69 36.631 -18.550 -28.402 1.00 0.00 H new ATOM 0 HG21 ILE A 69 40.004 -19.913 -29.064 1.00 0.00 H new ATOM 0 HG22 ILE A 69 40.515 -18.660 -30.220 1.00 0.00 H new ATOM 0 HG23 ILE A 69 40.438 -18.289 -28.481 1.00 0.00 H new ATOM 0 HD11 ILE A 69 37.215 -20.497 -26.995 1.00 0.00 H new ATOM 0 HD12 ILE A 69 37.480 -20.872 -28.715 1.00 0.00 H new ATOM 0 HD13 ILE A 69 38.865 -20.497 -27.663 1.00 0.00 H new ATOM 1086 N GLY A 70 36.747 -15.996 -31.105 1.00 0.00 N ATOM 1087 CA GLY A 70 35.445 -15.387 -31.371 1.00 0.00 C ATOM 1088 C GLY A 70 34.361 -16.408 -31.723 1.00 0.00 C ATOM 1089 O GLY A 70 34.430 -17.571 -31.328 1.00 0.00 O ATOM 0 H GLY A 70 37.363 -16.082 -31.914 1.00 0.00 H new ATOM 0 HA2 GLY A 70 35.130 -14.821 -30.494 1.00 0.00 H new ATOM 0 HA3 GLY A 70 35.545 -14.676 -32.191 1.00 0.00 H new ATOM 1093 N PRO A 71 33.311 -15.928 -32.413 1.00 0.00 N ATOM 1094 CA PRO A 71 32.091 -16.735 -32.615 1.00 0.00 C ATOM 1095 C PRO A 71 32.278 -18.257 -32.647 1.00 0.00 C ATOM 1096 O PRO A 71 31.697 -18.981 -31.838 1.00 0.00 O ATOM 1097 CB PRO A 71 31.491 -16.224 -33.934 1.00 0.00 C ATOM 1098 CG PRO A 71 32.355 -15.059 -34.423 1.00 0.00 C ATOM 1099 CD PRO A 71 33.540 -14.941 -33.470 1.00 0.00 C ATOM 0 HA PRO A 71 31.441 -16.603 -31.750 1.00 0.00 H new ATOM 0 HB2 PRO A 71 31.469 -17.021 -34.677 1.00 0.00 H new ATOM 0 HB3 PRO A 71 30.461 -15.899 -33.784 1.00 0.00 H new ATOM 0 HG2 PRO A 71 32.698 -15.237 -35.442 1.00 0.00 H new ATOM 0 HG3 PRO A 71 31.780 -14.133 -34.437 1.00 0.00 H new ATOM 0 HD2 PRO A 71 34.478 -15.136 -33.989 1.00 0.00 H new ATOM 0 HD3 PRO A 71 33.608 -13.935 -33.056 1.00 0.00 H new ATOM 1107 N GLU A 72 33.096 -18.756 -33.563 1.00 0.00 N ATOM 1108 CA GLU A 72 33.095 -20.208 -33.793 1.00 0.00 C ATOM 1109 C GLU A 72 34.207 -21.044 -33.130 1.00 0.00 C ATOM 1110 O GLU A 72 33.936 -22.154 -32.681 1.00 0.00 O ATOM 1111 CB GLU A 72 32.921 -20.563 -35.272 1.00 0.00 C ATOM 1112 CG GLU A 72 31.533 -21.151 -35.569 1.00 0.00 C ATOM 1113 CD GLU A 72 31.366 -22.535 -34.949 1.00 0.00 C ATOM 1114 OE1 GLU A 72 32.186 -23.432 -35.244 1.00 0.00 O ATOM 1115 OE2 GLU A 72 30.415 -22.729 -34.162 1.00 0.00 O ATOM 0 H GLU A 72 33.742 -18.215 -34.138 1.00 0.00 H new ATOM 0 HA GLU A 72 32.208 -20.519 -33.240 1.00 0.00 H new ATOM 0 HB2 GLU A 72 33.073 -19.670 -35.878 1.00 0.00 H new ATOM 0 HB3 GLU A 72 33.688 -21.281 -35.564 1.00 0.00 H new ATOM 0 HG2 GLU A 72 30.764 -20.483 -35.182 1.00 0.00 H new ATOM 0 HG3 GLU A 72 31.387 -21.215 -36.647 1.00 0.00 H new ATOM 1122 N GLU A 73 35.464 -20.583 -33.099 1.00 0.00 N ATOM 1123 CA GLU A 73 36.520 -21.404 -32.461 1.00 0.00 C ATOM 1124 C GLU A 73 36.127 -21.960 -31.082 1.00 0.00 C ATOM 1125 O GLU A 73 36.522 -23.057 -30.696 1.00 0.00 O ATOM 1126 CB GLU A 73 37.880 -20.678 -32.446 1.00 0.00 C ATOM 1127 CG GLU A 73 38.951 -21.346 -31.550 1.00 0.00 C ATOM 1128 CD GLU A 73 40.356 -20.942 -31.990 1.00 0.00 C ATOM 1129 OE1 GLU A 73 40.571 -19.755 -32.324 1.00 0.00 O ATOM 1130 OE2 GLU A 73 41.255 -21.809 -31.997 1.00 0.00 O ATOM 0 H GLU A 73 35.773 -19.691 -33.486 1.00 0.00 H new ATOM 0 HA GLU A 73 36.634 -22.285 -33.093 1.00 0.00 H new ATOM 0 HB2 GLU A 73 38.260 -20.623 -33.466 1.00 0.00 H new ATOM 0 HB3 GLU A 73 37.728 -19.653 -32.107 1.00 0.00 H new ATOM 0 HG2 GLU A 73 38.794 -21.057 -30.511 1.00 0.00 H new ATOM 0 HG3 GLU A 73 38.848 -22.430 -31.599 1.00 0.00 H new ATOM 1137 N TRP A 74 35.295 -21.224 -30.362 1.00 0.00 N ATOM 1138 CA TRP A 74 34.809 -21.727 -29.077 1.00 0.00 C ATOM 1139 C TRP A 74 33.825 -22.914 -29.208 1.00 0.00 C ATOM 1140 O TRP A 74 33.975 -23.929 -28.524 1.00 0.00 O ATOM 1141 CB TRP A 74 34.353 -20.510 -28.240 1.00 0.00 C ATOM 1142 CG TRP A 74 33.633 -20.801 -26.933 1.00 0.00 C ATOM 1143 CD1 TRP A 74 32.393 -20.180 -26.738 1.00 0.00 C ATOM 1144 CD2 TRP A 74 34.324 -20.642 -25.758 1.00 0.00 C ATOM 1145 NE1 TRP A 74 32.313 -19.574 -25.472 1.00 0.00 N ATOM 1146 CE2 TRP A 74 33.496 -19.970 -24.852 1.00 0.00 C ATOM 1147 CE3 TRP A 74 35.235 -21.561 -25.300 1.00 0.00 C ATOM 1148 CZ2 TRP A 74 33.479 -20.388 -23.560 1.00 0.00 C ATOM 1149 CZ3 TRP A 74 35.339 -21.752 -23.957 1.00 0.00 C ATOM 1150 CH2 TRP A 74 34.323 -21.365 -23.155 1.00 0.00 C ATOM 0 H TRP A 74 34.948 -20.303 -30.630 1.00 0.00 H new ATOM 0 HA TRP A 74 35.607 -22.212 -28.515 1.00 0.00 H new ATOM 0 HB2 TRP A 74 35.232 -19.905 -28.015 1.00 0.00 H new ATOM 0 HB3 TRP A 74 33.696 -19.900 -28.860 1.00 0.00 H new ATOM 0 HD1 TRP A 74 31.598 -20.168 -27.469 1.00 0.00 H new ATOM 0 HE1 TRP A 74 31.568 -18.986 -25.098 1.00 0.00 H new ATOM 0 HE3 TRP A 74 35.853 -22.118 -25.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 32.792 -19.941 -22.856 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 36.223 -22.208 -23.537 1.00 0.00 H new ATOM 0 HH2 TRP A 74 34.185 -21.835 -22.192 1.00 0.00 H new ATOM 1161 N LEU A 75 32.881 -22.850 -30.152 1.00 0.00 N ATOM 1162 CA LEU A 75 32.000 -24.022 -30.380 1.00 0.00 C ATOM 1163 C LEU A 75 32.652 -25.137 -31.189 1.00 0.00 C ATOM 1164 O LEU A 75 32.469 -26.311 -30.880 1.00 0.00 O ATOM 1165 CB LEU A 75 30.636 -23.671 -31.000 1.00 0.00 C ATOM 1166 CG LEU A 75 29.455 -23.843 -30.032 1.00 0.00 C ATOM 1167 CD1 LEU A 75 29.035 -25.315 -29.872 1.00 0.00 C ATOM 1168 CD2 LEU A 75 29.781 -23.243 -28.670 1.00 0.00 C ATOM 0 H LEU A 75 32.703 -22.044 -30.751 1.00 0.00 H new ATOM 0 HA LEU A 75 31.825 -24.393 -29.370 1.00 0.00 H new ATOM 0 HB2 LEU A 75 30.660 -22.639 -31.350 1.00 0.00 H new ATOM 0 HB3 LEU A 75 30.472 -24.300 -31.875 1.00 0.00 H new ATOM 0 HG LEU A 75 28.612 -23.308 -30.469 1.00 0.00 H new ATOM 0 HD11 LEU A 75 28.197 -25.381 -29.178 1.00 0.00 H new ATOM 0 HD12 LEU A 75 28.736 -25.715 -30.841 1.00 0.00 H new ATOM 0 HD13 LEU A 75 29.874 -25.893 -29.484 1.00 0.00 H new ATOM 0 HD21 LEU A 75 28.931 -23.376 -28.001 1.00 0.00 H new ATOM 0 HD22 LEU A 75 30.654 -23.744 -28.251 1.00 0.00 H new ATOM 0 HD23 LEU A 75 29.991 -22.179 -28.782 1.00 0.00 H new ATOM 1180 N THR A 76 33.355 -24.815 -32.268 1.00 0.00 N ATOM 1181 CA THR A 76 34.062 -25.890 -32.978 1.00 0.00 C ATOM 1182 C THR A 76 35.139 -26.551 -32.115 1.00 0.00 C ATOM 1183 O THR A 76 35.338 -27.765 -32.174 1.00 0.00 O ATOM 1184 CB THR A 76 34.631 -25.532 -34.357 1.00 0.00 C ATOM 1185 OG1 THR A 76 33.570 -25.441 -35.302 1.00 0.00 O ATOM 1186 CG2 THR A 76 35.421 -24.225 -34.348 1.00 0.00 C ATOM 0 H THR A 76 33.454 -23.878 -32.659 1.00 0.00 H new ATOM 0 HA THR A 76 33.265 -26.606 -33.177 1.00 0.00 H new ATOM 0 HB THR A 76 35.324 -26.326 -34.636 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.408 -24.500 -35.522 1.00 0.00 H new ATOM 0 HG21 THR A 76 35.800 -24.022 -35.350 1.00 0.00 H new ATOM 0 HG22 THR A 76 34.771 -23.409 -34.034 1.00 0.00 H new ATOM 0 HG23 THR A 76 36.257 -24.310 -33.654 1.00 0.00 H new ATOM 1194 N LEU A 77 35.851 -25.774 -31.301 1.00 0.00 N ATOM 1195 CA LEU A 77 36.775 -26.407 -30.371 1.00 0.00 C ATOM 1196 C LEU A 77 36.052 -27.303 -29.354 1.00 0.00 C ATOM 1197 O LEU A 77 36.464 -28.436 -29.105 1.00 0.00 O ATOM 1198 CB LEU A 77 37.689 -25.402 -29.673 1.00 0.00 C ATOM 1199 CG LEU A 77 38.716 -26.119 -28.800 1.00 0.00 C ATOM 1200 CD1 LEU A 77 40.041 -25.392 -28.834 1.00 0.00 C ATOM 1201 CD2 LEU A 77 38.247 -26.157 -27.359 1.00 0.00 C ATOM 0 H LEU A 77 35.810 -24.755 -31.266 1.00 0.00 H new ATOM 0 HA LEU A 77 37.414 -27.050 -30.977 1.00 0.00 H new ATOM 0 HB2 LEU A 77 38.200 -24.791 -30.417 1.00 0.00 H new ATOM 0 HB3 LEU A 77 37.093 -24.726 -29.060 1.00 0.00 H new ATOM 0 HG LEU A 77 38.831 -27.130 -29.189 1.00 0.00 H new ATOM 0 HD11 LEU A 77 40.761 -25.917 -28.206 1.00 0.00 H new ATOM 0 HD12 LEU A 77 40.411 -25.357 -29.859 1.00 0.00 H new ATOM 0 HD13 LEU A 77 39.908 -24.376 -28.462 1.00 0.00 H new ATOM 0 HD21 LEU A 77 38.989 -26.671 -26.748 1.00 0.00 H new ATOM 0 HD22 LEU A 77 38.117 -25.139 -26.992 1.00 0.00 H new ATOM 0 HD23 LEU A 77 37.297 -26.688 -27.299 1.00 0.00 H new ATOM 1213 N CYS A 78 34.950 -26.819 -28.780 1.00 0.00 N ATOM 1214 CA CYS A 78 34.243 -27.655 -27.795 1.00 0.00 C ATOM 1215 C CYS A 78 33.523 -28.827 -28.496 1.00 0.00 C ATOM 1216 O CYS A 78 33.416 -29.915 -27.936 1.00 0.00 O ATOM 1217 CB CYS A 78 33.206 -26.684 -27.205 1.00 0.00 C ATOM 1218 SG CYS A 78 33.911 -25.870 -25.737 1.00 0.00 S ATOM 0 H CYS A 78 34.540 -25.903 -28.962 1.00 0.00 H new ATOM 0 HA CYS A 78 34.907 -28.097 -27.052 1.00 0.00 H new ATOM 0 HB2 CYS A 78 32.925 -25.938 -27.949 1.00 0.00 H new ATOM 0 HB3 CYS A 78 32.298 -27.223 -26.935 1.00 0.00 H new ATOM 0 HG CYS A 78 33.038 -25.047 -25.236 1.00 0.00 H new ATOM 1224 N SER A 79 33.042 -28.637 -29.725 1.00 0.00 N ATOM 1225 CA SER A 79 32.414 -29.764 -30.432 1.00 0.00 C ATOM 1226 C SER A 79 33.425 -30.841 -30.856 1.00 0.00 C ATOM 1227 O SER A 79 33.182 -32.037 -30.695 1.00 0.00 O ATOM 1228 CB SER A 79 31.586 -29.305 -31.635 1.00 0.00 C ATOM 1229 OG SER A 79 30.868 -30.404 -32.182 1.00 0.00 O ATOM 0 H SER A 79 33.069 -27.756 -30.238 1.00 0.00 H new ATOM 0 HA SER A 79 31.737 -30.218 -29.709 1.00 0.00 H new ATOM 0 HB2 SER A 79 30.891 -28.522 -31.331 1.00 0.00 H new ATOM 0 HB3 SER A 79 32.240 -28.874 -32.393 1.00 0.00 H new ATOM 0 HG SER A 79 30.340 -30.100 -32.950 1.00 0.00 H new ATOM 1235 N LYS A 80 34.562 -30.422 -31.411 1.00 0.00 N ATOM 1236 CA LYS A 80 35.588 -31.398 -31.792 1.00 0.00 C ATOM 1237 C LYS A 80 36.257 -32.077 -30.589 1.00 0.00 C ATOM 1238 O LYS A 80 36.764 -33.194 -30.695 1.00 0.00 O ATOM 1239 CB LYS A 80 36.634 -30.805 -32.752 1.00 0.00 C ATOM 1240 CG LYS A 80 36.144 -30.788 -34.209 1.00 0.00 C ATOM 1241 CD LYS A 80 35.269 -29.563 -34.496 1.00 0.00 C ATOM 1242 CE LYS A 80 34.522 -29.718 -35.819 1.00 0.00 C ATOM 1243 NZ LYS A 80 33.932 -28.426 -36.218 1.00 0.00 N ATOM 0 H LYS A 80 34.794 -29.447 -31.603 1.00 0.00 H new ATOM 0 HA LYS A 80 35.053 -32.180 -32.331 1.00 0.00 H new ATOM 0 HB2 LYS A 80 36.876 -29.789 -32.440 1.00 0.00 H new ATOM 0 HB3 LYS A 80 37.554 -31.386 -32.687 1.00 0.00 H new ATOM 0 HG2 LYS A 80 37.002 -30.789 -34.882 1.00 0.00 H new ATOM 0 HG3 LYS A 80 35.577 -31.696 -34.414 1.00 0.00 H new ATOM 0 HD2 LYS A 80 34.554 -29.425 -33.685 1.00 0.00 H new ATOM 0 HD3 LYS A 80 35.890 -28.668 -34.528 1.00 0.00 H new ATOM 0 HE2 LYS A 80 35.204 -30.070 -36.593 1.00 0.00 H new ATOM 0 HE3 LYS A 80 33.739 -30.470 -35.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 33.425 -28.539 -37.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 33.267 -28.107 -35.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 34.687 -27.720 -36.332 1.00 0.00 H new ATOM 1257 N TRP A 81 36.268 -31.409 -29.437 1.00 0.00 N ATOM 1258 CA TRP A 81 36.779 -32.078 -28.234 1.00 0.00 C ATOM 1259 C TRP A 81 35.754 -33.019 -27.599 1.00 0.00 C ATOM 1260 O TRP A 81 36.065 -34.136 -27.187 1.00 0.00 O ATOM 1261 CB TRP A 81 37.282 -31.095 -27.159 1.00 0.00 C ATOM 1262 CG TRP A 81 38.774 -31.177 -27.021 1.00 0.00 C ATOM 1263 CD1 TRP A 81 39.682 -30.489 -27.809 1.00 0.00 C ATOM 1264 CD2 TRP A 81 39.391 -32.265 -26.512 1.00 0.00 C ATOM 1265 NE1 TRP A 81 40.953 -31.093 -27.704 1.00 0.00 N ATOM 1266 CE2 TRP A 81 40.721 -32.225 -26.902 1.00 0.00 C ATOM 1267 CE3 TRP A 81 39.039 -32.785 -25.305 1.00 0.00 C ATOM 1268 CZ2 TRP A 81 41.666 -32.723 -26.064 1.00 0.00 C ATOM 1269 CZ3 TRP A 81 39.975 -33.416 -24.563 1.00 0.00 C ATOM 1270 CH2 TRP A 81 41.280 -33.379 -24.932 1.00 0.00 C ATOM 0 H TRP A 81 35.946 -30.450 -29.307 1.00 0.00 H new ATOM 0 HA TRP A 81 37.626 -32.663 -28.593 1.00 0.00 H new ATOM 0 HB2 TRP A 81 36.992 -30.078 -27.425 1.00 0.00 H new ATOM 0 HB3 TRP A 81 36.810 -31.322 -26.203 1.00 0.00 H new ATOM 0 HD1 TRP A 81 39.452 -29.623 -28.412 1.00 0.00 H new ATOM 0 HE1 TRP A 81 41.834 -30.782 -28.114 1.00 0.00 H new ATOM 0 HE3 TRP A 81 38.025 -32.694 -24.945 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 42.715 -32.601 -26.292 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 39.683 -33.952 -23.672 1.00 0.00 H new ATOM 0 HH2 TRP A 81 42.021 -33.874 -24.323 1.00 0.00 H new ATOM 1281 N VAL A 82 34.519 -32.555 -27.524 1.00 0.00 N ATOM 1282 CA VAL A 82 33.482 -33.343 -26.831 1.00 0.00 C ATOM 1283 C VAL A 82 32.879 -34.488 -27.679 1.00 0.00 C ATOM 1284 O VAL A 82 32.237 -35.391 -27.142 1.00 0.00 O ATOM 1285 CB VAL A 82 32.390 -32.431 -26.225 1.00 0.00 C ATOM 1286 CG1 VAL A 82 31.317 -33.242 -25.490 1.00 0.00 C ATOM 1287 CG2 VAL A 82 33.010 -31.442 -25.232 1.00 0.00 C ATOM 0 H VAL A 82 34.204 -31.668 -27.916 1.00 0.00 H new ATOM 0 HA VAL A 82 33.996 -33.845 -26.012 1.00 0.00 H new ATOM 0 HB VAL A 82 31.927 -31.897 -27.055 1.00 0.00 H new ATOM 0 HG11 VAL A 82 30.568 -32.566 -25.078 1.00 0.00 H new ATOM 0 HG12 VAL A 82 30.840 -33.931 -26.187 1.00 0.00 H new ATOM 0 HG13 VAL A 82 31.779 -33.807 -24.681 1.00 0.00 H new ATOM 0 HG21 VAL A 82 32.228 -30.807 -24.814 1.00 0.00 H new ATOM 0 HG22 VAL A 82 33.499 -31.992 -24.428 1.00 0.00 H new ATOM 0 HG23 VAL A 82 33.744 -30.822 -25.746 1.00 0.00 H new ATOM 1297 N ARG A 83 33.115 -34.492 -28.994 1.00 0.00 N ATOM 1298 CA ARG A 83 32.512 -35.550 -29.827 1.00 0.00 C ATOM 1299 C ARG A 83 32.815 -36.984 -29.345 1.00 0.00 C ATOM 1300 O ARG A 83 31.937 -37.679 -28.838 1.00 0.00 O ATOM 1301 CB ARG A 83 32.807 -35.373 -31.330 1.00 0.00 C ATOM 1302 CG ARG A 83 34.295 -35.107 -31.608 1.00 0.00 C ATOM 1303 CD ARG A 83 34.750 -35.720 -32.935 1.00 0.00 C ATOM 1304 NE ARG A 83 36.212 -35.881 -32.918 1.00 0.00 N ATOM 1305 CZ ARG A 83 36.794 -36.667 -33.818 1.00 0.00 C ATOM 1306 NH1 ARG A 83 36.263 -36.837 -35.015 1.00 0.00 N ATOM 1307 NH2 ARG A 83 37.922 -37.277 -33.517 1.00 0.00 N ATOM 0 H ARG A 83 33.690 -33.812 -29.492 1.00 0.00 H new ATOM 0 HA ARG A 83 31.438 -35.418 -29.695 1.00 0.00 H new ATOM 0 HB2 ARG A 83 32.494 -36.269 -31.867 1.00 0.00 H new ATOM 0 HB3 ARG A 83 32.214 -34.545 -31.719 1.00 0.00 H new ATOM 0 HG2 ARG A 83 34.474 -34.032 -31.625 1.00 0.00 H new ATOM 0 HG3 ARG A 83 34.894 -35.517 -30.795 1.00 0.00 H new ATOM 0 HD2 ARG A 83 34.268 -36.686 -33.088 1.00 0.00 H new ATOM 0 HD3 ARG A 83 34.452 -35.080 -33.766 1.00 0.00 H new ATOM 0 HE ARG A 83 36.775 -35.393 -32.221 1.00 0.00 H new ATOM 0 HH11 ARG A 83 35.394 -36.362 -35.260 1.00 0.00 H new ATOM 0 HH12 ARG A 83 36.722 -37.443 -35.695 1.00 0.00 H new ATOM 0 HH21 ARG A 83 38.344 -37.145 -32.598 1.00 0.00 H new ATOM 0 HH22 ARG A 83 38.374 -37.882 -34.203 1.00 0.00 H new ATOM 1321 N GLN A 84 34.054 -37.436 -29.516 1.00 0.00 N ATOM 1322 CA GLN A 84 34.397 -38.790 -29.047 1.00 0.00 C ATOM 1323 C GLN A 84 35.916 -39.002 -28.987 1.00 0.00 C ATOM 1324 O GLN A 84 36.473 -39.912 -29.603 1.00 0.00 O ATOM 1325 CB GLN A 84 33.701 -39.912 -29.839 1.00 0.00 C ATOM 1326 CG GLN A 84 33.939 -39.790 -31.351 1.00 0.00 C ATOM 1327 CD GLN A 84 33.110 -40.807 -32.120 1.00 0.00 C ATOM 1328 OE1 GLN A 84 33.493 -41.963 -32.283 1.00 0.00 O ATOM 1329 NE2 GLN A 84 31.961 -40.386 -32.610 1.00 0.00 N ATOM 0 H GLN A 84 34.814 -36.917 -29.956 1.00 0.00 H new ATOM 0 HA GLN A 84 34.007 -38.857 -28.031 1.00 0.00 H new ATOM 0 HB2 GLN A 84 34.066 -40.879 -29.493 1.00 0.00 H new ATOM 0 HB3 GLN A 84 32.630 -39.885 -29.638 1.00 0.00 H new ATOM 0 HG2 GLN A 84 33.684 -38.783 -31.682 1.00 0.00 H new ATOM 0 HG3 GLN A 84 34.997 -39.939 -31.569 1.00 0.00 H new ATOM 0 HE21 GLN A 84 31.666 -39.421 -32.461 1.00 0.00 H new ATOM 0 HE22 GLN A 84 31.367 -41.025 -33.138 1.00 0.00 H new ATOM 1338 N ASP A 85 36.592 -38.154 -28.221 1.00 0.00 N ATOM 1339 CA ASP A 85 38.057 -38.253 -28.145 1.00 0.00 C ATOM 1340 C ASP A 85 38.545 -38.530 -26.718 1.00 0.00 C ATOM 1341 O ASP A 85 38.981 -39.637 -26.396 1.00 0.00 O ATOM 1342 CB ASP A 85 38.756 -37.025 -28.751 1.00 0.00 C ATOM 1343 CG ASP A 85 38.450 -36.878 -30.240 1.00 0.00 C ATOM 1344 OD1 ASP A 85 39.113 -37.542 -31.067 1.00 0.00 O ATOM 1345 OD2 ASP A 85 37.542 -36.095 -30.590 1.00 0.00 O ATOM 0 H ASP A 85 36.174 -37.412 -27.659 1.00 0.00 H new ATOM 0 HA ASP A 85 38.337 -39.113 -28.753 1.00 0.00 H new ATOM 0 HB2 ASP A 85 38.436 -36.127 -28.223 1.00 0.00 H new ATOM 0 HB3 ASP A 85 39.833 -37.112 -28.608 1.00 0.00 H new ATOM 1350 N ASP A 86 38.472 -37.520 -25.854 1.00 0.00 N ATOM 1351 CA ASP A 86 38.927 -37.723 -24.473 1.00 0.00 C ATOM 1352 C ASP A 86 37.936 -36.984 -23.564 1.00 0.00 C ATOM 1353 O ASP A 86 37.300 -37.638 -22.707 1.00 0.00 O ATOM 1354 CB ASP A 86 40.294 -37.022 -24.510 1.00 0.00 C ATOM 1355 CG ASP A 86 40.995 -37.052 -23.158 1.00 0.00 C ATOM 1356 OD1 ASP A 86 41.250 -38.158 -22.635 1.00 0.00 O ATOM 1357 OD2 ASP A 86 41.308 -35.969 -22.617 1.00 0.00 O ATOM 1358 OXT ASP A 86 37.790 -35.748 -23.701 1.00 0.00 O ATOM 0 H ASP A 86 38.118 -36.588 -26.068 1.00 0.00 H new ATOM 0 HA ASP A 86 38.990 -38.751 -24.117 1.00 0.00 H new ATOM 0 HB2 ASP A 86 40.927 -37.503 -25.256 1.00 0.00 H new ATOM 0 HB3 ASP A 86 40.161 -35.987 -24.825 1.00 0.00 H new TER 1363 ASP A 86