USER MOD reduce.3.24.130724 H: found=0, std=0, add=605, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 602 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 80 SER OG : rot -53:sc= 0.537 USER MOD Set 1.2: A 82 LYS NZ :NH3+ 146:sc= 0.87 (180deg=0) USER MOD Set 2.1: A 72 THR OG1 : rot -36:sc= -1.24! USER MOD Set 2.2: A 102 LYS NZ :NH3+ -168:sc= 3.51 (180deg=3.07) USER MOD Set 3.1: A 12 THR OG1 : rot 180:sc= 0.065 USER MOD Set 3.2: A 14 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 1 GLY N :NH3+ 167:sc= 0.138 (180deg=0.1) USER MOD Set 4.2: A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.0083 X(o=-0.0083,f=0) USER MOD Single : A 18 THR OG1 : rot 38:sc= 0.383 USER MOD Single : A 24 SER OG : rot 180:sc= -0.024 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 157:sc= 0.75 (180deg=0.505) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 100:sc= 0.368 USER MOD Single : A 38 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0564) USER MOD Single : A 39 TYR OH : rot 109:sc= 0.548 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0184 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -1.57 K(o=-1.6,f=-2.5) USER MOD Single : A 50 THR OG1 : rot 72:sc= 0.706 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.382 K(o=-0.38,f=-1) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.026 USER MOD Single : A 66 LYS NZ :NH3+ -169:sc=-0.00369 (180deg=-0.128) USER MOD Single : A 68 GLN : amide:sc= 0.134 K(o=0.13,f=-2.6!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 86:sc= 0.175 USER MOD Single : A 75 LYS NZ :NH3+ 167:sc= 0.0189 (180deg=-0.15) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= -1.83! USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.712 3.971 -5.672 1.00 0.00 N ATOM 2 CA GLY A 1 -12.120 5.077 -4.869 1.00 0.00 C ATOM 3 C GLY A 1 -10.609 5.140 -5.001 1.00 0.00 C ATOM 4 O GLY A 1 -10.080 5.805 -5.902 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.701 3.825 -5.386 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.676 4.218 -6.682 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.172 3.097 -5.510 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.550 6.026 -5.189 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.386 4.944 -3.820 1.00 0.00 H new ATOM 7 N SER A 2 -9.910 4.439 -4.114 1.00 0.00 N ATOM 8 CA SER A 2 -8.455 4.416 -4.129 1.00 0.00 C ATOM 9 C SER A 2 -7.937 3.630 -5.332 1.00 0.00 C ATOM 10 O SER A 2 -6.814 3.843 -5.792 1.00 0.00 O ATOM 11 CB SER A 2 -7.926 3.811 -2.831 1.00 0.00 C ATOM 12 OG SER A 2 -8.462 4.486 -1.701 1.00 0.00 O ATOM 0 H SER A 2 -10.331 3.878 -3.374 1.00 0.00 H new ATOM 0 HA SER A 2 -8.095 5.441 -4.213 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.187 2.754 -2.785 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.838 3.872 -2.814 1.00 0.00 H new ATOM 0 HG SER A 2 -8.111 4.081 -0.881 1.00 0.00 H new ATOM 18 N MET A 3 -8.753 2.722 -5.830 1.00 0.00 N ATOM 19 CA MET A 3 -8.401 1.936 -6.995 1.00 0.00 C ATOM 20 C MET A 3 -9.167 2.449 -8.204 1.00 0.00 C ATOM 21 O MET A 3 -10.276 2.969 -8.063 1.00 0.00 O ATOM 22 CB MET A 3 -8.703 0.443 -6.771 1.00 0.00 C ATOM 23 CG MET A 3 -10.189 0.106 -6.642 1.00 0.00 C ATOM 24 SD MET A 3 -10.949 0.819 -5.167 1.00 0.00 S ATOM 25 CE MET A 3 -12.659 0.344 -5.410 1.00 0.00 C ATOM 0 H MET A 3 -9.672 2.510 -5.442 1.00 0.00 H new ATOM 0 HA MET A 3 -7.330 2.038 -7.170 1.00 0.00 H new ATOM 0 HB2 MET A 3 -8.285 -0.127 -7.601 1.00 0.00 H new ATOM 0 HB3 MET A 3 -8.190 0.114 -5.868 1.00 0.00 H new ATOM 0 HG2 MET A 3 -10.716 0.466 -7.526 1.00 0.00 H new ATOM 0 HG3 MET A 3 -10.310 -0.977 -6.619 1.00 0.00 H new ATOM 0 HE1 MET A 3 -13.260 0.712 -4.579 1.00 0.00 H new ATOM 0 HE2 MET A 3 -13.027 0.773 -6.342 1.00 0.00 H new ATOM 0 HE3 MET A 3 -12.732 -0.743 -5.457 1.00 0.00 H new ATOM 35 N SER A 4 -8.582 2.319 -9.377 1.00 0.00 N ATOM 36 CA SER A 4 -9.227 2.778 -10.590 1.00 0.00 C ATOM 37 C SER A 4 -8.583 2.141 -11.816 1.00 0.00 C ATOM 38 O SER A 4 -7.350 2.106 -11.942 1.00 0.00 O ATOM 39 CB SER A 4 -9.154 4.311 -10.685 1.00 0.00 C ATOM 40 OG SER A 4 -9.915 4.802 -11.777 1.00 0.00 O ATOM 0 H SER A 4 -7.663 1.900 -9.516 1.00 0.00 H new ATOM 0 HA SER A 4 -10.274 2.478 -10.557 1.00 0.00 H new ATOM 0 HB2 SER A 4 -9.520 4.752 -9.758 1.00 0.00 H new ATOM 0 HB3 SER A 4 -8.115 4.620 -10.796 1.00 0.00 H new ATOM 0 HG SER A 4 -9.849 5.779 -11.808 1.00 0.00 H new ATOM 46 N SER A 5 -9.414 1.618 -12.698 1.00 0.00 N ATOM 47 CA SER A 5 -8.944 1.034 -13.932 1.00 0.00 C ATOM 48 C SER A 5 -9.095 2.062 -15.047 1.00 0.00 C ATOM 49 O SER A 5 -10.209 2.485 -15.367 1.00 0.00 O ATOM 50 CB SER A 5 -9.738 -0.241 -14.257 1.00 0.00 C ATOM 51 OG SER A 5 -9.121 -0.988 -15.299 1.00 0.00 O ATOM 0 H SER A 5 -10.426 1.588 -12.577 1.00 0.00 H new ATOM 0 HA SER A 5 -7.895 0.756 -13.833 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.818 -0.859 -13.363 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.753 0.026 -14.551 1.00 0.00 H new ATOM 0 HG SER A 5 -9.649 -1.793 -15.481 1.00 0.00 H new ATOM 57 N VAL A 6 -7.981 2.481 -15.612 1.00 0.00 N ATOM 58 CA VAL A 6 -7.993 3.506 -16.640 1.00 0.00 C ATOM 59 C VAL A 6 -8.432 2.961 -18.002 1.00 0.00 C ATOM 60 O VAL A 6 -7.817 2.041 -18.566 1.00 0.00 O ATOM 61 CB VAL A 6 -6.627 4.223 -16.757 1.00 0.00 C ATOM 62 CG1 VAL A 6 -6.406 5.129 -15.554 1.00 0.00 C ATOM 63 CG2 VAL A 6 -5.491 3.219 -16.874 1.00 0.00 C ATOM 0 H VAL A 6 -7.053 2.128 -15.377 1.00 0.00 H new ATOM 0 HA VAL A 6 -8.734 4.240 -16.325 1.00 0.00 H new ATOM 0 HB VAL A 6 -6.638 4.830 -17.663 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -5.442 5.628 -15.647 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -7.199 5.876 -15.510 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -6.419 4.532 -14.642 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -4.543 3.750 -16.955 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -5.476 2.582 -15.990 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -5.639 2.604 -17.762 1.00 0.00 H new ATOM 73 N PHE A 7 -9.494 3.540 -18.523 1.00 0.00 N ATOM 74 CA PHE A 7 -10.051 3.134 -19.796 1.00 0.00 C ATOM 75 C PHE A 7 -9.254 3.738 -20.933 1.00 0.00 C ATOM 76 O PHE A 7 -9.123 4.953 -21.031 1.00 0.00 O ATOM 77 CB PHE A 7 -11.519 3.562 -19.901 1.00 0.00 C ATOM 78 CG PHE A 7 -12.404 2.970 -18.840 1.00 0.00 C ATOM 79 CD1 PHE A 7 -12.595 3.624 -17.633 1.00 0.00 C ATOM 80 CD2 PHE A 7 -13.041 1.759 -19.049 1.00 0.00 C ATOM 81 CE1 PHE A 7 -13.403 3.079 -16.655 1.00 0.00 C ATOM 82 CE2 PHE A 7 -13.853 1.210 -18.074 1.00 0.00 C ATOM 83 CZ PHE A 7 -14.033 1.872 -16.877 1.00 0.00 C ATOM 0 H PHE A 7 -9.996 4.307 -18.075 1.00 0.00 H new ATOM 0 HA PHE A 7 -9.998 2.047 -19.864 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -11.575 4.649 -19.842 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -11.901 3.276 -20.881 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -12.106 4.571 -17.455 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -12.902 1.237 -19.984 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -13.542 3.597 -15.717 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -14.345 0.265 -18.249 1.00 0.00 H new ATOM 0 HZ PHE A 7 -14.667 1.445 -16.114 1.00 0.00 H new ATOM 93 N GLY A 8 -8.697 2.887 -21.769 1.00 0.00 N ATOM 94 CA GLY A 8 -7.923 3.350 -22.905 1.00 0.00 C ATOM 95 C GLY A 8 -6.501 3.750 -22.550 1.00 0.00 C ATOM 96 O GLY A 8 -5.575 3.494 -23.311 1.00 0.00 O ATOM 0 H GLY A 8 -8.765 1.873 -21.685 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -7.893 2.563 -23.658 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -8.430 4.203 -23.356 1.00 0.00 H new ATOM 100 N ALA A 9 -6.334 4.342 -21.387 1.00 0.00 N ATOM 101 CA ALA A 9 -5.033 4.861 -20.961 1.00 0.00 C ATOM 102 C ALA A 9 -4.131 3.779 -20.375 1.00 0.00 C ATOM 103 O ALA A 9 -2.946 4.012 -20.145 1.00 0.00 O ATOM 104 CB ALA A 9 -5.215 5.992 -19.967 1.00 0.00 C ATOM 0 H ALA A 9 -7.083 4.481 -20.709 1.00 0.00 H new ATOM 0 HA ALA A 9 -4.535 5.240 -21.854 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.239 6.367 -19.660 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -5.783 6.797 -20.432 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -5.754 5.625 -19.093 1.00 0.00 H new ATOM 110 N GLY A 10 -4.688 2.604 -20.132 1.00 0.00 N ATOM 111 CA GLY A 10 -3.901 1.505 -19.588 1.00 0.00 C ATOM 112 C GLY A 10 -3.076 0.834 -20.662 1.00 0.00 C ATOM 113 O GLY A 10 -3.240 -0.350 -20.940 1.00 0.00 O ATOM 0 H GLY A 10 -5.670 2.386 -20.300 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.244 1.879 -18.803 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -4.565 0.774 -19.126 1.00 0.00 H new ATOM 117 N CYS A 11 -2.205 1.599 -21.271 1.00 0.00 N ATOM 118 CA CYS A 11 -1.387 1.110 -22.351 1.00 0.00 C ATOM 119 C CYS A 11 -0.097 0.468 -21.828 1.00 0.00 C ATOM 120 O CYS A 11 0.048 0.242 -20.621 1.00 0.00 O ATOM 121 CB CYS A 11 -1.081 2.237 -23.316 1.00 0.00 C ATOM 122 SG CYS A 11 -1.053 1.714 -25.031 1.00 0.00 S ATOM 0 H CYS A 11 -2.044 2.577 -21.032 1.00 0.00 H new ATOM 0 HA CYS A 11 -1.942 0.335 -22.880 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -1.827 3.022 -23.195 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -0.115 2.673 -23.060 1.00 0.00 H new ATOM 127 N THR A 12 0.843 0.191 -22.728 1.00 0.00 N ATOM 128 CA THR A 12 2.068 -0.496 -22.361 1.00 0.00 C ATOM 129 C THR A 12 3.253 -0.007 -23.197 1.00 0.00 C ATOM 130 O THR A 12 3.079 0.523 -24.295 1.00 0.00 O ATOM 131 CB THR A 12 1.911 -2.032 -22.541 1.00 0.00 C ATOM 132 OG1 THR A 12 3.121 -2.708 -22.175 1.00 0.00 O ATOM 133 CG2 THR A 12 1.560 -2.375 -23.987 1.00 0.00 C ATOM 0 H THR A 12 0.775 0.434 -23.716 1.00 0.00 H new ATOM 0 HA THR A 12 2.264 -0.272 -21.312 1.00 0.00 H new ATOM 0 HB THR A 12 1.102 -2.362 -21.890 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.004 -3.674 -22.293 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.455 -3.455 -24.090 1.00 0.00 H new ATOM 0 HG22 THR A 12 0.621 -1.892 -24.258 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.353 -2.023 -24.647 1.00 0.00 H new ATOM 141 N ASP A 13 4.455 -0.202 -22.671 1.00 0.00 N ATOM 142 CA ASP A 13 5.679 0.183 -23.364 1.00 0.00 C ATOM 143 C ASP A 13 6.019 -0.831 -24.447 1.00 0.00 C ATOM 144 O ASP A 13 6.845 -0.577 -25.315 1.00 0.00 O ATOM 145 CB ASP A 13 6.844 0.331 -22.376 1.00 0.00 C ATOM 146 CG ASP A 13 7.164 -0.948 -21.630 1.00 0.00 C ATOM 147 OD1 ASP A 13 6.511 -1.214 -20.598 1.00 0.00 O ATOM 148 OD2 ASP A 13 8.076 -1.680 -22.051 1.00 0.00 O ATOM 0 H ASP A 13 4.610 -0.629 -21.758 1.00 0.00 H new ATOM 0 HA ASP A 13 5.513 1.151 -23.837 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.731 0.659 -22.918 1.00 0.00 H new ATOM 0 HB3 ASP A 13 6.603 1.113 -21.656 1.00 0.00 H new ATOM 153 N THR A 14 5.361 -1.972 -24.403 1.00 0.00 N ATOM 154 CA THR A 14 5.536 -2.993 -25.420 1.00 0.00 C ATOM 155 C THR A 14 4.816 -2.566 -26.711 1.00 0.00 C ATOM 156 O THR A 14 5.008 -3.143 -27.785 1.00 0.00 O ATOM 157 CB THR A 14 4.987 -4.348 -24.913 1.00 0.00 C ATOM 158 OG1 THR A 14 5.615 -4.664 -23.664 1.00 0.00 O ATOM 159 CG2 THR A 14 5.253 -5.471 -25.908 1.00 0.00 C ATOM 0 H THR A 14 4.696 -2.218 -23.670 1.00 0.00 H new ATOM 0 HA THR A 14 6.598 -3.111 -25.633 1.00 0.00 H new ATOM 0 HB THR A 14 3.908 -4.257 -24.791 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.273 -5.521 -23.333 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.853 -6.406 -25.517 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.770 -5.238 -26.857 1.00 0.00 H new ATOM 0 HG23 THR A 14 6.327 -5.573 -26.063 1.00 0.00 H new ATOM 167 N CYS A 15 4.030 -1.516 -26.595 1.00 0.00 N ATOM 168 CA CYS A 15 3.257 -1.004 -27.701 1.00 0.00 C ATOM 169 C CYS A 15 4.054 0.029 -28.498 1.00 0.00 C ATOM 170 O CYS A 15 3.656 0.437 -29.581 1.00 0.00 O ATOM 171 CB CYS A 15 1.995 -0.365 -27.168 1.00 0.00 C ATOM 172 SG CYS A 15 0.738 -0.086 -28.411 1.00 0.00 S ATOM 0 H CYS A 15 3.911 -0.994 -25.727 1.00 0.00 H new ATOM 0 HA CYS A 15 3.010 -1.831 -28.366 1.00 0.00 H new ATOM 0 HB2 CYS A 15 1.582 -1.000 -26.384 1.00 0.00 H new ATOM 0 HB3 CYS A 15 2.251 0.588 -26.704 1.00 0.00 H new ATOM 177 N LYS A 16 5.176 0.446 -27.963 1.00 0.00 N ATOM 178 CA LYS A 16 5.985 1.449 -28.627 1.00 0.00 C ATOM 179 C LYS A 16 7.262 0.850 -29.194 1.00 0.00 C ATOM 180 O LYS A 16 8.235 1.550 -29.452 1.00 0.00 O ATOM 181 CB LYS A 16 6.258 2.625 -27.681 1.00 0.00 C ATOM 182 CG LYS A 16 6.605 2.212 -26.271 1.00 0.00 C ATOM 183 CD LYS A 16 6.547 3.388 -25.310 1.00 0.00 C ATOM 184 CE LYS A 16 7.578 4.450 -25.653 1.00 0.00 C ATOM 185 NZ LYS A 16 7.690 5.478 -24.590 1.00 0.00 N ATOM 0 H LYS A 16 5.551 0.111 -27.075 1.00 0.00 H new ATOM 0 HA LYS A 16 5.427 1.837 -29.479 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.076 3.221 -28.086 1.00 0.00 H new ATOM 0 HB3 LYS A 16 5.378 3.268 -27.654 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.915 1.436 -25.939 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.605 1.778 -26.255 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.550 3.828 -25.334 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.714 3.034 -24.293 1.00 0.00 H new ATOM 0 HE2 LYS A 16 8.549 3.978 -25.805 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.306 4.929 -26.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 8.404 6.183 -24.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 6.771 5.947 -24.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 7.974 5.025 -23.698 1.00 0.00 H new ATOM 199 N GLN A 17 7.227 -0.455 -29.421 1.00 0.00 N ATOM 200 CA GLN A 17 8.359 -1.175 -30.000 1.00 0.00 C ATOM 201 C GLN A 17 8.330 -1.049 -31.518 1.00 0.00 C ATOM 202 O GLN A 17 7.287 -0.728 -32.098 1.00 0.00 O ATOM 203 CB GLN A 17 8.293 -2.660 -29.633 1.00 0.00 C ATOM 204 CG GLN A 17 8.102 -2.938 -28.160 1.00 0.00 C ATOM 205 CD GLN A 17 9.266 -2.488 -27.328 1.00 0.00 C ATOM 206 OE1 GLN A 17 10.211 -3.243 -27.104 1.00 0.00 O ATOM 207 NE2 GLN A 17 9.209 -1.265 -26.858 1.00 0.00 N ATOM 0 H GLN A 17 6.421 -1.044 -29.212 1.00 0.00 H new ATOM 0 HA GLN A 17 9.278 -0.742 -29.604 1.00 0.00 H new ATOM 0 HB2 GLN A 17 7.474 -3.121 -30.185 1.00 0.00 H new ATOM 0 HB3 GLN A 17 9.212 -3.143 -29.964 1.00 0.00 H new ATOM 0 HG2 GLN A 17 7.198 -2.436 -27.814 1.00 0.00 H new ATOM 0 HG3 GLN A 17 7.948 -4.007 -28.014 1.00 0.00 H new ATOM 0 HE21 GLN A 17 8.405 -0.674 -27.070 1.00 0.00 H new ATOM 0 HE22 GLN A 17 9.969 -0.905 -26.281 1.00 0.00 H new ATOM 216 N THR A 18 9.463 -1.309 -32.156 1.00 0.00 N ATOM 217 CA THR A 18 9.556 -1.286 -33.616 1.00 0.00 C ATOM 218 C THR A 18 10.452 -2.431 -34.122 1.00 0.00 C ATOM 219 O THR A 18 11.677 -2.355 -34.018 1.00 0.00 O ATOM 220 CB THR A 18 10.108 0.067 -34.140 1.00 0.00 C ATOM 221 OG1 THR A 18 11.335 0.395 -33.467 1.00 0.00 O ATOM 222 CG2 THR A 18 9.100 1.193 -33.944 1.00 0.00 C ATOM 0 H THR A 18 10.338 -1.540 -31.685 1.00 0.00 H new ATOM 0 HA THR A 18 8.544 -1.416 -34.000 1.00 0.00 H new ATOM 0 HB THR A 18 10.295 -0.042 -35.208 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.862 -0.420 -33.333 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.519 2.126 -34.322 1.00 0.00 H new ATOM 0 HG22 THR A 18 8.184 0.960 -34.487 1.00 0.00 H new ATOM 0 HG23 THR A 18 8.875 1.300 -32.883 1.00 0.00 H new ATOM 230 N PRO A 19 9.855 -3.523 -34.663 1.00 0.00 N ATOM 231 CA PRO A 19 8.391 -3.678 -34.781 1.00 0.00 C ATOM 232 C PRO A 19 7.698 -3.804 -33.425 1.00 0.00 C ATOM 233 O PRO A 19 8.329 -4.161 -32.428 1.00 0.00 O ATOM 234 CB PRO A 19 8.231 -4.973 -35.579 1.00 0.00 C ATOM 235 CG PRO A 19 9.495 -5.726 -35.339 1.00 0.00 C ATOM 236 CD PRO A 19 10.575 -4.691 -35.214 1.00 0.00 C ATOM 0 HA PRO A 19 7.934 -2.808 -35.252 1.00 0.00 H new ATOM 0 HB2 PRO A 19 7.363 -5.540 -35.243 1.00 0.00 H new ATOM 0 HB3 PRO A 19 8.087 -4.769 -36.640 1.00 0.00 H new ATOM 0 HG2 PRO A 19 9.425 -6.328 -34.433 1.00 0.00 H new ATOM 0 HG3 PRO A 19 9.704 -6.411 -36.161 1.00 0.00 H new ATOM 0 HD2 PRO A 19 11.375 -5.021 -34.552 1.00 0.00 H new ATOM 0 HD3 PRO A 19 11.031 -4.466 -36.178 1.00 0.00 H new ATOM 244 N CYS A 20 6.404 -3.502 -33.402 1.00 0.00 N ATOM 245 CA CYS A 20 5.613 -3.513 -32.175 1.00 0.00 C ATOM 246 C CYS A 20 5.705 -4.851 -31.445 1.00 0.00 C ATOM 247 O CYS A 20 5.757 -5.914 -32.069 1.00 0.00 O ATOM 248 CB CYS A 20 4.161 -3.180 -32.482 1.00 0.00 C ATOM 249 SG CYS A 20 3.499 -1.833 -31.482 1.00 0.00 S ATOM 0 H CYS A 20 5.873 -3.243 -34.233 1.00 0.00 H new ATOM 0 HA CYS A 20 6.026 -2.751 -31.514 1.00 0.00 H new ATOM 0 HB2 CYS A 20 4.073 -2.916 -33.536 1.00 0.00 H new ATOM 0 HB3 CYS A 20 3.552 -4.070 -32.325 1.00 0.00 H new ATOM 254 N GLY A 21 5.713 -4.788 -30.121 1.00 0.00 N ATOM 255 CA GLY A 21 5.841 -5.982 -29.320 1.00 0.00 C ATOM 256 C GLY A 21 4.524 -6.687 -29.114 1.00 0.00 C ATOM 257 O GLY A 21 4.493 -7.852 -28.724 1.00 0.00 O ATOM 0 H GLY A 21 5.632 -3.923 -29.587 1.00 0.00 H new ATOM 0 HA2 GLY A 21 6.542 -6.664 -29.801 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.264 -5.721 -28.350 1.00 0.00 H new ATOM 261 N CYS A 22 3.428 -5.997 -29.388 1.00 0.00 N ATOM 262 CA CYS A 22 2.107 -6.589 -29.240 1.00 0.00 C ATOM 263 C CYS A 22 1.760 -7.482 -30.434 1.00 0.00 C ATOM 264 O CYS A 22 0.586 -7.758 -30.707 1.00 0.00 O ATOM 265 CB CYS A 22 1.043 -5.517 -29.069 1.00 0.00 C ATOM 266 SG CYS A 22 1.091 -4.679 -27.477 1.00 0.00 S ATOM 0 H CYS A 22 3.426 -5.030 -29.713 1.00 0.00 H new ATOM 0 HA CYS A 22 2.129 -7.206 -28.342 1.00 0.00 H new ATOM 0 HB2 CYS A 22 1.158 -4.777 -29.861 1.00 0.00 H new ATOM 0 HB3 CYS A 22 0.061 -5.972 -29.198 1.00 0.00 H new ATOM 271 N GLY A 23 2.788 -7.951 -31.129 1.00 0.00 N ATOM 272 CA GLY A 23 2.591 -8.824 -32.264 1.00 0.00 C ATOM 273 C GLY A 23 2.130 -10.197 -31.836 1.00 0.00 C ATOM 274 O GLY A 23 1.807 -11.043 -32.666 1.00 0.00 O ATOM 0 H GLY A 23 3.764 -7.738 -30.922 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.854 -8.386 -32.937 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.523 -8.910 -32.823 1.00 0.00 H new ATOM 278 N SER A 24 2.121 -10.417 -30.533 1.00 0.00 N ATOM 279 CA SER A 24 1.655 -11.654 -29.956 1.00 0.00 C ATOM 280 C SER A 24 1.013 -11.377 -28.603 1.00 0.00 C ATOM 281 O SER A 24 1.571 -11.711 -27.558 1.00 0.00 O ATOM 282 CB SER A 24 2.812 -12.638 -29.793 1.00 0.00 C ATOM 283 OG SER A 24 3.550 -12.765 -31.000 1.00 0.00 O ATOM 0 H SER A 24 2.440 -9.734 -29.846 1.00 0.00 H new ATOM 0 HA SER A 24 0.916 -12.097 -30.623 1.00 0.00 H new ATOM 0 HB2 SER A 24 3.471 -12.299 -28.994 1.00 0.00 H new ATOM 0 HB3 SER A 24 2.425 -13.613 -29.495 1.00 0.00 H new ATOM 0 HG SER A 24 4.286 -13.399 -30.869 1.00 0.00 H new ATOM 289 N GLY A 25 -0.129 -10.716 -28.623 1.00 0.00 N ATOM 290 CA GLY A 25 -0.818 -10.414 -27.398 1.00 0.00 C ATOM 291 C GLY A 25 -0.657 -8.970 -27.013 1.00 0.00 C ATOM 292 O GLY A 25 0.452 -8.442 -27.014 1.00 0.00 O ATOM 0 H GLY A 25 -0.590 -10.383 -29.470 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.877 -10.645 -27.509 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.435 -11.049 -26.599 1.00 0.00 H new ATOM 296 N CYS A 26 -1.754 -8.329 -26.699 1.00 0.00 N ATOM 297 CA CYS A 26 -1.739 -6.934 -26.324 1.00 0.00 C ATOM 298 C CYS A 26 -1.747 -6.768 -24.827 1.00 0.00 C ATOM 299 O CYS A 26 -2.284 -7.602 -24.100 1.00 0.00 O ATOM 300 CB CYS A 26 -2.949 -6.226 -26.901 1.00 0.00 C ATOM 301 SG CYS A 26 -2.974 -6.142 -28.685 1.00 0.00 S ATOM 0 H CYS A 26 -2.681 -8.756 -26.695 1.00 0.00 H new ATOM 0 HA CYS A 26 -0.823 -6.497 -26.722 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -3.850 -6.737 -26.561 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -2.987 -5.213 -26.501 1.00 0.00 H new ATOM 306 N ASN A 27 -1.139 -5.699 -24.371 1.00 0.00 N ATOM 307 CA ASN A 27 -1.167 -5.347 -22.968 1.00 0.00 C ATOM 308 C ASN A 27 -1.705 -3.942 -22.827 1.00 0.00 C ATOM 309 O ASN A 27 -1.684 -3.354 -21.751 1.00 0.00 O ATOM 310 CB ASN A 27 0.220 -5.460 -22.322 1.00 0.00 C ATOM 311 CG ASN A 27 0.749 -6.880 -22.312 1.00 0.00 C ATOM 312 OD1 ASN A 27 1.467 -7.294 -23.221 1.00 0.00 O ATOM 313 ND2 ASN A 27 0.397 -7.639 -21.289 1.00 0.00 N ATOM 0 H ASN A 27 -0.613 -5.051 -24.957 1.00 0.00 H new ATOM 0 HA ASN A 27 -1.817 -6.049 -22.446 1.00 0.00 H new ATOM 0 HB2 ASN A 27 0.920 -4.820 -22.860 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.171 -5.088 -21.299 1.00 0.00 H new ATOM 0 HD21 ASN A 27 0.722 -8.604 -21.234 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.200 -7.260 -20.554 1.00 0.00 H new ATOM 320 N CYS A 28 -2.192 -3.408 -23.940 1.00 0.00 N ATOM 321 CA CYS A 28 -2.772 -2.089 -23.965 1.00 0.00 C ATOM 322 C CYS A 28 -4.291 -2.191 -23.939 1.00 0.00 C ATOM 323 O CYS A 28 -4.846 -3.290 -23.808 1.00 0.00 O ATOM 324 CB CYS A 28 -2.295 -1.307 -25.206 1.00 0.00 C ATOM 325 SG CYS A 28 -2.639 -2.096 -26.807 1.00 0.00 S ATOM 0 H CYS A 28 -2.192 -3.882 -24.843 1.00 0.00 H new ATOM 0 HA CYS A 28 -2.444 -1.543 -23.080 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -2.765 -0.323 -25.197 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -1.220 -1.148 -25.123 1.00 0.00 H new ATOM 330 N LYS A 29 -4.964 -1.065 -24.044 1.00 0.00 N ATOM 331 CA LYS A 29 -6.412 -1.054 -24.040 1.00 0.00 C ATOM 332 C LYS A 29 -6.925 -0.933 -25.469 1.00 0.00 C ATOM 333 O LYS A 29 -6.207 -0.454 -26.346 1.00 0.00 O ATOM 334 CB LYS A 29 -6.943 0.097 -23.181 1.00 0.00 C ATOM 335 CG LYS A 29 -6.349 0.167 -21.768 1.00 0.00 C ATOM 336 CD LYS A 29 -6.542 -1.132 -20.992 1.00 0.00 C ATOM 337 CE LYS A 29 -8.001 -1.369 -20.641 1.00 0.00 C ATOM 338 NZ LYS A 29 -8.440 -0.572 -19.466 1.00 0.00 N ATOM 0 H LYS A 29 -4.532 -0.145 -24.133 1.00 0.00 H new ATOM 0 HA LYS A 29 -6.771 -1.989 -23.609 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.741 1.038 -23.693 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -8.026 0.004 -23.101 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.285 0.393 -21.835 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -6.815 0.987 -21.221 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.171 -1.968 -21.585 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.949 -1.101 -20.078 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.623 -1.117 -21.500 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.155 -2.428 -20.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.473 -0.452 -19.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.173 -1.067 -18.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.982 0.362 -19.489 1.00 0.00 H new ATOM 352 N GLU A 30 -8.164 -1.339 -25.695 1.00 0.00 N ATOM 353 CA GLU A 30 -8.750 -1.326 -27.036 1.00 0.00 C ATOM 354 C GLU A 30 -8.802 0.088 -27.610 1.00 0.00 C ATOM 355 O GLU A 30 -8.638 0.280 -28.813 1.00 0.00 O ATOM 356 CB GLU A 30 -10.162 -1.942 -27.041 1.00 0.00 C ATOM 357 CG GLU A 30 -11.245 -1.083 -26.380 1.00 0.00 C ATOM 358 CD GLU A 30 -11.118 -1.015 -24.875 1.00 0.00 C ATOM 359 OE1 GLU A 30 -11.827 -1.768 -24.184 1.00 0.00 O ATOM 360 OE2 GLU A 30 -10.296 -0.215 -24.374 1.00 0.00 O ATOM 0 H GLU A 30 -8.790 -1.684 -24.967 1.00 0.00 H new ATOM 0 HA GLU A 30 -8.103 -1.934 -27.668 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.453 -2.137 -28.073 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -10.124 -2.906 -26.533 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -11.197 -0.073 -26.788 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -12.225 -1.485 -26.637 1.00 0.00 H new ATOM 367 N ASP A 31 -9.009 1.067 -26.733 1.00 0.00 N ATOM 368 CA ASP A 31 -9.120 2.478 -27.130 1.00 0.00 C ATOM 369 C ASP A 31 -7.882 2.957 -27.893 1.00 0.00 C ATOM 370 O ASP A 31 -7.945 3.934 -28.638 1.00 0.00 O ATOM 371 CB ASP A 31 -9.338 3.357 -25.900 1.00 0.00 C ATOM 372 CG ASP A 31 -9.709 4.780 -26.253 1.00 0.00 C ATOM 373 OD1 ASP A 31 -10.823 4.995 -26.776 1.00 0.00 O ATOM 374 OD2 ASP A 31 -8.906 5.691 -25.988 1.00 0.00 O ATOM 0 H ASP A 31 -9.105 0.911 -25.730 1.00 0.00 H new ATOM 0 HA ASP A 31 -9.978 2.561 -27.798 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -10.126 2.923 -25.285 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -8.430 3.362 -25.298 1.00 0.00 H new ATOM 379 N CYS A 32 -6.766 2.257 -27.711 1.00 0.00 N ATOM 380 CA CYS A 32 -5.523 2.600 -28.383 1.00 0.00 C ATOM 381 C CYS A 32 -5.700 2.592 -29.901 1.00 0.00 C ATOM 382 O CYS A 32 -5.437 3.594 -30.567 1.00 0.00 O ATOM 383 CB CYS A 32 -4.420 1.637 -27.977 1.00 0.00 C ATOM 384 SG CYS A 32 -2.871 1.906 -28.844 1.00 0.00 S ATOM 0 H CYS A 32 -6.700 1.444 -27.099 1.00 0.00 H new ATOM 0 HA CYS A 32 -5.241 3.608 -28.079 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -4.247 1.729 -26.905 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -4.756 0.616 -28.160 1.00 0.00 H new ATOM 389 N ARG A 33 -6.150 1.452 -30.437 1.00 0.00 N ATOM 390 CA ARG A 33 -6.424 1.307 -31.873 1.00 0.00 C ATOM 391 C ARG A 33 -5.160 1.431 -32.713 1.00 0.00 C ATOM 392 O ARG A 33 -5.193 1.968 -33.820 1.00 0.00 O ATOM 393 CB ARG A 33 -7.450 2.343 -32.329 1.00 0.00 C ATOM 394 CG ARG A 33 -8.823 2.175 -31.716 1.00 0.00 C ATOM 395 CD ARG A 33 -9.475 0.881 -32.159 1.00 0.00 C ATOM 396 NE ARG A 33 -9.007 -0.288 -31.412 1.00 0.00 N ATOM 397 CZ ARG A 33 -9.273 -1.551 -31.757 1.00 0.00 C ATOM 398 NH1 ARG A 33 -10.011 -1.807 -32.833 1.00 0.00 N ATOM 399 NH2 ARG A 33 -8.819 -2.560 -31.018 1.00 0.00 N ATOM 0 H ARG A 33 -6.334 0.609 -29.893 1.00 0.00 H new ATOM 0 HA ARG A 33 -6.827 0.305 -32.022 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -7.076 3.338 -32.086 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -7.541 2.293 -33.414 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -8.741 2.189 -30.629 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -9.454 3.017 -31.999 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -10.555 0.969 -32.044 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -9.279 0.728 -33.220 1.00 0.00 H new ATOM 0 HE ARG A 33 -8.443 -0.128 -30.577 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -10.375 -1.039 -33.396 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -10.213 -2.772 -33.095 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.265 -2.371 -30.183 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -9.025 -3.522 -31.287 1.00 0.00 H new ATOM 413 N CYS A 34 -4.068 0.926 -32.204 1.00 0.00 N ATOM 414 CA CYS A 34 -2.803 0.978 -32.915 1.00 0.00 C ATOM 415 C CYS A 34 -2.827 0.026 -34.106 1.00 0.00 C ATOM 416 O CYS A 34 -3.069 -1.158 -33.935 1.00 0.00 O ATOM 417 CB CYS A 34 -1.669 0.598 -31.970 1.00 0.00 C ATOM 418 SG CYS A 34 -0.029 0.984 -32.589 1.00 0.00 S ATOM 0 H CYS A 34 -4.022 0.469 -31.293 1.00 0.00 H new ATOM 0 HA CYS A 34 -2.644 1.992 -33.281 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -1.816 1.112 -31.020 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -1.725 -0.471 -31.766 1.00 0.00 H new ATOM 423 N GLN A 35 -2.569 0.558 -35.318 1.00 0.00 N ATOM 424 CA GLN A 35 -2.560 -0.255 -36.560 1.00 0.00 C ATOM 425 C GLN A 35 -1.725 -1.519 -36.382 1.00 0.00 C ATOM 426 O GLN A 35 -2.081 -2.589 -36.881 1.00 0.00 O ATOM 427 CB GLN A 35 -1.980 0.551 -37.743 1.00 0.00 C ATOM 428 CG GLN A 35 -2.852 1.691 -38.267 1.00 0.00 C ATOM 429 CD GLN A 35 -4.016 1.208 -39.116 1.00 0.00 C ATOM 430 OE1 GLN A 35 -3.891 1.039 -40.330 1.00 0.00 O ATOM 431 NE2 GLN A 35 -5.145 1.001 -38.485 1.00 0.00 N ATOM 0 H GLN A 35 -2.364 1.546 -35.467 1.00 0.00 H new ATOM 0 HA GLN A 35 -3.594 -0.527 -36.771 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -1.019 0.965 -37.438 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -1.784 -0.138 -38.565 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -3.238 2.263 -37.423 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -2.236 2.370 -38.857 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -5.202 1.154 -37.478 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.967 0.687 -39.000 1.00 0.00 H new ATOM 440 N SER A 36 -0.632 -1.377 -35.650 1.00 0.00 N ATOM 441 CA SER A 36 0.319 -2.450 -35.411 1.00 0.00 C ATOM 442 C SER A 36 -0.339 -3.714 -34.834 1.00 0.00 C ATOM 443 O SER A 36 -0.096 -4.825 -35.311 1.00 0.00 O ATOM 444 CB SER A 36 1.400 -1.953 -34.455 1.00 0.00 C ATOM 445 OG SER A 36 1.894 -0.679 -34.864 1.00 0.00 O ATOM 0 H SER A 36 -0.377 -0.499 -35.198 1.00 0.00 H new ATOM 0 HA SER A 36 0.749 -2.728 -36.373 1.00 0.00 H new ATOM 0 HB2 SER A 36 0.995 -1.883 -33.446 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.219 -2.671 -34.421 1.00 0.00 H new ATOM 0 HG SER A 36 1.469 0.024 -34.329 1.00 0.00 H new ATOM 451 N CYS A 37 -1.173 -3.538 -33.833 1.00 0.00 N ATOM 452 CA CYS A 37 -1.789 -4.660 -33.144 1.00 0.00 C ATOM 453 C CYS A 37 -3.305 -4.528 -33.117 1.00 0.00 C ATOM 454 O CYS A 37 -3.978 -5.081 -32.248 1.00 0.00 O ATOM 455 CB CYS A 37 -1.229 -4.734 -31.725 1.00 0.00 C ATOM 456 SG CYS A 37 -0.913 -3.111 -30.980 1.00 0.00 S ATOM 0 H CYS A 37 -1.444 -2.623 -33.473 1.00 0.00 H new ATOM 0 HA CYS A 37 -1.556 -5.580 -33.681 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.930 -5.283 -31.096 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.300 -5.304 -31.740 1.00 0.00 H new ATOM 461 N LYS A 38 -3.840 -3.830 -34.098 1.00 0.00 N ATOM 462 CA LYS A 38 -5.263 -3.597 -34.168 1.00 0.00 C ATOM 463 C LYS A 38 -5.968 -4.836 -34.733 1.00 0.00 C ATOM 464 O LYS A 38 -6.923 -5.340 -34.148 1.00 0.00 O ATOM 465 CB LYS A 38 -5.534 -2.337 -35.008 1.00 0.00 C ATOM 466 CG LYS A 38 -6.942 -1.806 -34.903 1.00 0.00 C ATOM 467 CD LYS A 38 -7.815 -2.403 -35.963 1.00 0.00 C ATOM 468 CE LYS A 38 -7.654 -1.692 -37.299 1.00 0.00 C ATOM 469 NZ LYS A 38 -8.335 -0.374 -37.310 1.00 0.00 N ATOM 0 H LYS A 38 -3.305 -3.413 -34.860 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.666 -3.424 -33.170 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -4.840 -1.555 -34.700 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.320 -2.560 -36.053 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.349 -2.035 -33.918 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -6.934 -0.720 -35.000 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -7.571 -3.459 -36.082 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -8.857 -2.350 -35.647 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.594 -1.555 -37.512 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -8.060 -2.317 -38.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -8.349 0.002 -38.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.311 -0.485 -36.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.824 0.286 -36.690 1.00 0.00 H new ATOM 483 N TYR A 39 -5.473 -5.317 -35.861 1.00 0.00 N ATOM 484 CA TYR A 39 -5.965 -6.541 -36.495 1.00 0.00 C ATOM 485 C TYR A 39 -4.799 -7.256 -37.135 1.00 0.00 C ATOM 486 O TYR A 39 -3.679 -6.732 -37.154 1.00 0.00 O ATOM 487 CB TYR A 39 -7.018 -6.256 -37.582 1.00 0.00 C ATOM 488 CG TYR A 39 -8.413 -5.921 -37.076 1.00 0.00 C ATOM 489 CD1 TYR A 39 -9.117 -4.851 -37.604 1.00 0.00 C ATOM 490 CD2 TYR A 39 -9.022 -6.677 -36.082 1.00 0.00 C ATOM 491 CE1 TYR A 39 -10.385 -4.536 -37.161 1.00 0.00 C ATOM 492 CE2 TYR A 39 -10.294 -6.368 -35.631 1.00 0.00 C ATOM 493 CZ TYR A 39 -10.968 -5.295 -36.176 1.00 0.00 C ATOM 494 OH TYR A 39 -12.232 -4.979 -35.735 1.00 0.00 O ATOM 0 H TYR A 39 -4.712 -4.869 -36.371 1.00 0.00 H new ATOM 0 HA TYR A 39 -6.436 -7.149 -35.722 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -6.665 -5.427 -38.196 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -7.087 -7.128 -38.233 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -8.664 -4.251 -38.379 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -8.496 -7.518 -35.655 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -10.916 -3.697 -37.586 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -10.756 -6.963 -34.857 1.00 0.00 H new ATOM 0 HH TYR A 39 -12.865 -5.662 -36.040 1.00 0.00 H new ATOM 504 N GLY A 40 -5.051 -8.430 -37.667 1.00 0.00 N ATOM 505 CA GLY A 40 -4.015 -9.158 -38.348 1.00 0.00 C ATOM 506 C GLY A 40 -3.737 -8.552 -39.701 1.00 0.00 C ATOM 507 O GLY A 40 -4.601 -8.580 -40.576 1.00 0.00 O ATOM 0 H GLY A 40 -5.958 -8.895 -37.640 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.105 -9.152 -37.748 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.313 -10.200 -38.465 1.00 0.00 H new ATOM 511 N ALA A 41 -2.545 -7.961 -39.849 1.00 0.00 N ATOM 512 CA ALA A 41 -2.111 -7.309 -41.096 1.00 0.00 C ATOM 513 C ALA A 41 -2.942 -6.059 -41.420 1.00 0.00 C ATOM 514 O ALA A 41 -2.782 -5.454 -42.482 1.00 0.00 O ATOM 515 CB ALA A 41 -2.125 -8.294 -42.261 1.00 0.00 C ATOM 0 H ALA A 41 -1.849 -7.920 -39.104 1.00 0.00 H new ATOM 0 HA ALA A 41 -1.085 -6.976 -40.941 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -1.800 -7.787 -43.170 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -1.449 -9.122 -42.046 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -3.136 -8.678 -42.401 1.00 0.00 H new ATOM 521 N GLY A 42 -3.807 -5.664 -40.491 1.00 0.00 N ATOM 522 CA GLY A 42 -4.640 -4.490 -40.700 1.00 0.00 C ATOM 523 C GLY A 42 -5.866 -4.790 -41.544 1.00 0.00 C ATOM 524 O GLY A 42 -6.435 -3.895 -42.177 1.00 0.00 O ATOM 0 H GLY A 42 -3.947 -6.135 -39.597 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.955 -4.096 -39.734 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -4.051 -3.712 -41.185 1.00 0.00 H new ATOM 528 N CYS A 43 -6.272 -6.043 -41.554 1.00 0.00 N ATOM 529 CA CYS A 43 -7.428 -6.467 -42.320 1.00 0.00 C ATOM 530 C CYS A 43 -8.717 -6.202 -41.566 1.00 0.00 C ATOM 531 O CYS A 43 -8.709 -5.630 -40.483 1.00 0.00 O ATOM 532 CB CYS A 43 -7.322 -7.944 -42.630 1.00 0.00 C ATOM 533 SG CYS A 43 -5.819 -8.385 -43.494 1.00 0.00 S ATOM 0 H CYS A 43 -5.814 -6.793 -41.035 1.00 0.00 H new ATOM 0 HA CYS A 43 -7.448 -5.892 -43.246 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -7.375 -8.507 -41.698 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -8.179 -8.243 -43.233 1.00 0.00 H new ATOM 538 N THR A 44 -9.813 -6.618 -42.152 1.00 0.00 N ATOM 539 CA THR A 44 -11.109 -6.473 -41.552 1.00 0.00 C ATOM 540 C THR A 44 -11.603 -7.821 -41.052 1.00 0.00 C ATOM 541 O THR A 44 -11.088 -8.869 -41.463 1.00 0.00 O ATOM 542 CB THR A 44 -12.110 -5.922 -42.580 1.00 0.00 C ATOM 543 OG1 THR A 44 -11.937 -6.607 -43.831 1.00 0.00 O ATOM 544 CG2 THR A 44 -11.909 -4.430 -42.782 1.00 0.00 C ATOM 0 H THR A 44 -9.827 -7.070 -43.066 1.00 0.00 H new ATOM 0 HA THR A 44 -11.028 -5.779 -40.716 1.00 0.00 H new ATOM 0 HB THR A 44 -13.120 -6.086 -42.206 1.00 0.00 H new ATOM 0 HG1 THR A 44 -12.576 -6.257 -44.487 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.628 -4.062 -43.514 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.057 -3.911 -41.835 1.00 0.00 H new ATOM 0 HG23 THR A 44 -10.897 -4.245 -43.143 1.00 0.00 H new ATOM 552 N ASP A 45 -12.598 -7.806 -40.176 1.00 0.00 N ATOM 553 CA ASP A 45 -13.188 -9.047 -39.677 1.00 0.00 C ATOM 554 C ASP A 45 -13.850 -9.797 -40.807 1.00 0.00 C ATOM 555 O ASP A 45 -14.027 -11.001 -40.743 1.00 0.00 O ATOM 556 CB ASP A 45 -14.212 -8.780 -38.573 1.00 0.00 C ATOM 557 CG ASP A 45 -13.576 -8.409 -37.257 1.00 0.00 C ATOM 558 OD1 ASP A 45 -12.903 -9.271 -36.653 1.00 0.00 O ATOM 559 OD2 ASP A 45 -13.769 -7.267 -36.806 1.00 0.00 O ATOM 0 H ASP A 45 -13.014 -6.956 -39.796 1.00 0.00 H new ATOM 0 HA ASP A 45 -12.383 -9.649 -39.256 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -14.877 -7.976 -38.888 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -14.829 -9.668 -38.435 1.00 0.00 H new ATOM 564 N VAL A 46 -14.196 -9.064 -41.859 1.00 0.00 N ATOM 565 CA VAL A 46 -14.826 -9.638 -43.037 1.00 0.00 C ATOM 566 C VAL A 46 -13.872 -10.629 -43.722 1.00 0.00 C ATOM 567 O VAL A 46 -14.299 -11.581 -44.381 1.00 0.00 O ATOM 568 CB VAL A 46 -15.243 -8.534 -44.037 1.00 0.00 C ATOM 569 CG1 VAL A 46 -16.161 -9.095 -45.107 1.00 0.00 C ATOM 570 CG2 VAL A 46 -15.918 -7.381 -43.309 1.00 0.00 C ATOM 0 H VAL A 46 -14.047 -8.057 -41.917 1.00 0.00 H new ATOM 0 HA VAL A 46 -15.722 -10.168 -42.715 1.00 0.00 H new ATOM 0 HB VAL A 46 -14.342 -8.158 -44.522 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -16.441 -8.301 -45.799 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -15.644 -9.885 -45.652 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -17.058 -9.503 -44.640 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -16.204 -6.614 -44.029 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -16.807 -7.746 -42.795 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -15.227 -6.956 -42.581 1.00 0.00 H new ATOM 580 N CYS A 47 -12.582 -10.407 -43.530 1.00 0.00 N ATOM 581 CA CYS A 47 -11.549 -11.267 -44.088 1.00 0.00 C ATOM 582 C CYS A 47 -11.313 -12.471 -43.167 1.00 0.00 C ATOM 583 O CYS A 47 -10.875 -13.534 -43.605 1.00 0.00 O ATOM 584 CB CYS A 47 -10.248 -10.459 -44.250 1.00 0.00 C ATOM 585 SG CYS A 47 -8.857 -11.363 -44.998 1.00 0.00 S ATOM 0 H CYS A 47 -12.220 -9.626 -42.983 1.00 0.00 H new ATOM 0 HA CYS A 47 -11.870 -11.634 -45.063 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -10.459 -9.581 -44.860 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.939 -10.098 -43.269 1.00 0.00 H new ATOM 590 N LYS A 48 -11.644 -12.302 -41.892 1.00 0.00 N ATOM 591 CA LYS A 48 -11.411 -13.338 -40.890 1.00 0.00 C ATOM 592 C LYS A 48 -12.681 -14.144 -40.612 1.00 0.00 C ATOM 593 O LYS A 48 -12.655 -15.091 -39.822 1.00 0.00 O ATOM 594 CB LYS A 48 -10.930 -12.695 -39.586 1.00 0.00 C ATOM 595 CG LYS A 48 -9.833 -11.657 -39.769 1.00 0.00 C ATOM 596 CD LYS A 48 -8.550 -12.268 -40.305 1.00 0.00 C ATOM 597 CE LYS A 48 -7.480 -11.194 -40.514 1.00 0.00 C ATOM 598 NZ LYS A 48 -6.189 -11.770 -40.963 1.00 0.00 N ATOM 0 H LYS A 48 -12.076 -11.454 -41.526 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.651 -14.015 -41.280 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.780 -12.225 -39.091 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.566 -13.478 -38.921 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.178 -10.882 -40.454 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.631 -11.172 -38.814 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.183 -13.022 -39.609 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.751 -12.776 -41.248 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.831 -10.473 -41.252 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.328 -10.648 -39.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.494 -11.007 -41.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.840 -12.439 -40.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.326 -12.269 -41.865 1.00 0.00 H new ATOM 612 N GLN A 49 -13.782 -13.768 -41.272 1.00 0.00 N ATOM 613 CA GLN A 49 -15.096 -14.410 -41.057 1.00 0.00 C ATOM 614 C GLN A 49 -15.006 -15.918 -41.072 1.00 0.00 C ATOM 615 O GLN A 49 -15.467 -16.584 -40.149 1.00 0.00 O ATOM 616 CB GLN A 49 -16.107 -13.939 -42.099 1.00 0.00 C ATOM 617 CG GLN A 49 -16.417 -12.464 -42.016 1.00 0.00 C ATOM 618 CD GLN A 49 -17.350 -11.990 -43.110 1.00 0.00 C ATOM 619 OE1 GLN A 49 -17.375 -12.545 -44.207 1.00 0.00 O ATOM 620 NE2 GLN A 49 -18.116 -10.960 -42.820 1.00 0.00 N ATOM 0 H GLN A 49 -13.795 -13.019 -41.964 1.00 0.00 H new ATOM 0 HA GLN A 49 -15.434 -14.108 -40.066 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -15.723 -14.166 -43.094 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -17.031 -14.504 -41.977 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -16.864 -12.247 -41.046 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -15.486 -11.900 -42.071 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -18.063 -10.529 -41.897 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -18.762 -10.593 -43.518 1.00 0.00 H new ATOM 629 N THR A 50 -14.402 -16.432 -42.113 1.00 0.00 N ATOM 630 CA THR A 50 -14.226 -17.845 -42.305 1.00 0.00 C ATOM 631 C THR A 50 -15.582 -18.534 -42.481 1.00 0.00 C ATOM 632 O THR A 50 -16.274 -18.829 -41.506 1.00 0.00 O ATOM 633 CB THR A 50 -13.472 -18.459 -41.132 1.00 0.00 C ATOM 634 OG1 THR A 50 -12.230 -17.756 -40.933 1.00 0.00 O ATOM 635 CG2 THR A 50 -13.204 -19.933 -41.372 1.00 0.00 C ATOM 0 H THR A 50 -14.011 -15.866 -42.866 1.00 0.00 H new ATOM 0 HA THR A 50 -13.637 -17.995 -43.210 1.00 0.00 H new ATOM 0 HB THR A 50 -14.088 -18.368 -40.237 1.00 0.00 H new ATOM 0 HG1 THR A 50 -12.413 -16.868 -40.562 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.665 -20.348 -40.521 1.00 0.00 H new ATOM 0 HG22 THR A 50 -14.150 -20.460 -41.494 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.604 -20.052 -42.274 1.00 0.00 H new ATOM 643 N PRO A 51 -16.003 -18.766 -43.727 1.00 0.00 N ATOM 644 CA PRO A 51 -15.225 -18.416 -44.928 1.00 0.00 C ATOM 645 C PRO A 51 -15.151 -16.899 -45.146 1.00 0.00 C ATOM 646 O PRO A 51 -15.987 -16.151 -44.640 1.00 0.00 O ATOM 647 CB PRO A 51 -16.003 -19.089 -46.055 1.00 0.00 C ATOM 648 CG PRO A 51 -17.402 -19.175 -45.548 1.00 0.00 C ATOM 649 CD PRO A 51 -17.297 -19.363 -44.059 1.00 0.00 C ATOM 0 HA PRO A 51 -14.187 -18.741 -44.859 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -15.950 -18.507 -46.975 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -15.601 -20.077 -46.279 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -17.959 -18.270 -45.788 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -17.933 -20.008 -46.009 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -18.114 -18.868 -43.534 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -17.334 -20.417 -43.784 1.00 0.00 H new ATOM 657 N CYS A 52 -14.141 -16.455 -45.879 1.00 0.00 N ATOM 658 CA CYS A 52 -13.940 -15.031 -46.117 1.00 0.00 C ATOM 659 C CYS A 52 -15.044 -14.457 -46.994 1.00 0.00 C ATOM 660 O CYS A 52 -15.390 -15.025 -48.035 1.00 0.00 O ATOM 661 CB CYS A 52 -12.580 -14.770 -46.768 1.00 0.00 C ATOM 662 SG CYS A 52 -12.208 -13.016 -47.014 1.00 0.00 S ATOM 0 H CYS A 52 -13.447 -17.059 -46.320 1.00 0.00 H new ATOM 0 HA CYS A 52 -13.970 -14.534 -45.147 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -11.801 -15.213 -46.148 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -12.547 -15.277 -47.732 1.00 0.00 H new ATOM 667 N GLY A 53 -15.590 -13.337 -46.568 1.00 0.00 N ATOM 668 CA GLY A 53 -16.621 -12.677 -47.329 1.00 0.00 C ATOM 669 C GLY A 53 -16.207 -11.286 -47.695 1.00 0.00 C ATOM 670 O GLY A 53 -17.042 -10.434 -48.006 1.00 0.00 O ATOM 0 H GLY A 53 -15.335 -12.868 -45.699 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -16.833 -13.248 -48.233 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -17.543 -12.645 -46.749 1.00 0.00 H new ATOM 674 N CYS A 54 -14.906 -11.051 -47.660 1.00 0.00 N ATOM 675 CA CYS A 54 -14.356 -9.749 -47.955 1.00 0.00 C ATOM 676 C CYS A 54 -14.651 -9.355 -49.398 1.00 0.00 C ATOM 677 O CYS A 54 -15.050 -8.235 -49.668 1.00 0.00 O ATOM 678 CB CYS A 54 -12.858 -9.739 -47.681 1.00 0.00 C ATOM 679 SG CYS A 54 -12.155 -8.099 -47.460 1.00 0.00 S ATOM 0 H CYS A 54 -14.208 -11.757 -47.427 1.00 0.00 H new ATOM 0 HA CYS A 54 -14.829 -9.013 -47.305 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -12.661 -10.329 -46.786 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -12.346 -10.232 -48.508 1.00 0.00 H new ATOM 684 N ALA A 55 -14.493 -10.301 -50.319 1.00 0.00 N ATOM 685 CA ALA A 55 -14.781 -10.043 -51.729 1.00 0.00 C ATOM 686 C ALA A 55 -16.270 -9.805 -51.936 1.00 0.00 C ATOM 687 O ALA A 55 -16.685 -9.199 -52.921 1.00 0.00 O ATOM 688 CB ALA A 55 -14.312 -11.203 -52.590 1.00 0.00 C ATOM 0 H ALA A 55 -14.170 -11.247 -50.118 1.00 0.00 H new ATOM 0 HA ALA A 55 -14.240 -9.145 -52.028 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -14.535 -10.993 -53.636 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -13.237 -11.336 -52.467 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -14.827 -12.114 -52.285 1.00 0.00 H new ATOM 694 N THR A 56 -17.061 -10.282 -50.994 1.00 0.00 N ATOM 695 CA THR A 56 -18.494 -10.134 -51.043 1.00 0.00 C ATOM 696 C THR A 56 -18.914 -8.727 -50.614 1.00 0.00 C ATOM 697 O THR A 56 -19.545 -7.995 -51.378 1.00 0.00 O ATOM 698 CB THR A 56 -19.167 -11.161 -50.113 1.00 0.00 C ATOM 699 OG1 THR A 56 -18.710 -12.482 -50.436 1.00 0.00 O ATOM 700 CG2 THR A 56 -20.681 -11.090 -50.229 1.00 0.00 C ATOM 0 H THR A 56 -16.722 -10.784 -50.173 1.00 0.00 H new ATOM 0 HA THR A 56 -18.811 -10.303 -52.072 1.00 0.00 H new ATOM 0 HB THR A 56 -18.894 -10.925 -49.084 1.00 0.00 H new ATOM 0 HG1 THR A 56 -19.139 -13.131 -49.841 1.00 0.00 H new ATOM 0 HG21 THR A 56 -21.132 -11.825 -49.562 1.00 0.00 H new ATOM 0 HG22 THR A 56 -21.021 -10.092 -49.952 1.00 0.00 H new ATOM 0 HG23 THR A 56 -20.978 -11.302 -51.256 1.00 0.00 H new ATOM 708 N SER A 57 -18.542 -8.351 -49.400 1.00 0.00 N ATOM 709 CA SER A 57 -18.941 -7.072 -48.843 1.00 0.00 C ATOM 710 C SER A 57 -18.074 -5.920 -49.369 1.00 0.00 C ATOM 711 O SER A 57 -18.594 -4.893 -49.809 1.00 0.00 O ATOM 712 CB SER A 57 -18.880 -7.136 -47.322 1.00 0.00 C ATOM 713 OG SER A 57 -19.623 -8.242 -46.831 1.00 0.00 O ATOM 0 H SER A 57 -17.962 -8.918 -48.781 1.00 0.00 H new ATOM 0 HA SER A 57 -19.965 -6.871 -49.159 1.00 0.00 H new ATOM 0 HB2 SER A 57 -17.842 -7.218 -46.999 1.00 0.00 H new ATOM 0 HB3 SER A 57 -19.274 -6.212 -46.899 1.00 0.00 H new ATOM 0 HG SER A 57 -19.568 -8.264 -45.853 1.00 0.00 H new ATOM 719 N GLY A 58 -16.768 -6.100 -49.336 1.00 0.00 N ATOM 720 CA GLY A 58 -15.863 -5.065 -49.785 1.00 0.00 C ATOM 721 C GLY A 58 -14.442 -5.352 -49.359 1.00 0.00 C ATOM 722 O GLY A 58 -14.191 -5.665 -48.195 1.00 0.00 O ATOM 0 H GLY A 58 -16.313 -6.950 -49.004 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -15.910 -4.985 -50.871 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -16.178 -4.103 -49.381 1.00 0.00 H new ATOM 726 N CYS A 59 -13.524 -5.255 -50.292 1.00 0.00 N ATOM 727 CA CYS A 59 -12.130 -5.547 -50.024 1.00 0.00 C ATOM 728 C CYS A 59 -11.446 -4.309 -49.437 1.00 0.00 C ATOM 729 O CYS A 59 -11.287 -3.296 -50.119 1.00 0.00 O ATOM 730 CB CYS A 59 -11.448 -5.980 -51.326 1.00 0.00 C ATOM 731 SG CYS A 59 -9.964 -6.979 -51.105 1.00 0.00 S ATOM 0 H CYS A 59 -13.718 -4.974 -51.253 1.00 0.00 H new ATOM 0 HA CYS A 59 -12.052 -6.357 -49.299 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -12.163 -6.544 -51.924 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.188 -5.089 -51.897 1.00 0.00 H new ATOM 736 N ASN A 60 -11.060 -4.384 -48.164 1.00 0.00 N ATOM 737 CA ASN A 60 -10.452 -3.228 -47.497 1.00 0.00 C ATOM 738 C ASN A 60 -8.968 -3.461 -47.171 1.00 0.00 C ATOM 739 O ASN A 60 -8.292 -2.581 -46.633 1.00 0.00 O ATOM 740 CB ASN A 60 -11.237 -2.860 -46.222 1.00 0.00 C ATOM 741 CG ASN A 60 -10.804 -1.522 -45.623 1.00 0.00 C ATOM 742 OD1 ASN A 60 -10.349 -0.623 -46.335 1.00 0.00 O ATOM 743 ND2 ASN A 60 -10.949 -1.380 -44.315 1.00 0.00 N ATOM 0 H ASN A 60 -11.154 -5.215 -47.581 1.00 0.00 H new ATOM 0 HA ASN A 60 -10.502 -2.391 -48.194 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -12.301 -2.821 -46.455 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -11.102 -3.646 -45.479 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.681 -0.505 -43.864 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -11.329 -2.145 -43.758 1.00 0.00 H new ATOM 750 N CYS A 61 -8.459 -4.631 -47.486 1.00 0.00 N ATOM 751 CA CYS A 61 -7.054 -4.909 -47.243 1.00 0.00 C ATOM 752 C CYS A 61 -6.265 -4.825 -48.545 1.00 0.00 C ATOM 753 O CYS A 61 -6.832 -4.527 -49.607 1.00 0.00 O ATOM 754 CB CYS A 61 -6.870 -6.267 -46.561 1.00 0.00 C ATOM 755 SG CYS A 61 -7.654 -7.640 -47.412 1.00 0.00 S ATOM 0 H CYS A 61 -8.985 -5.398 -47.905 1.00 0.00 H new ATOM 0 HA CYS A 61 -6.665 -4.152 -46.563 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -5.803 -6.473 -46.472 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -7.269 -6.208 -45.548 1.00 0.00 H new ATOM 760 N THR A 62 -4.970 -5.067 -48.471 1.00 0.00 N ATOM 761 CA THR A 62 -4.122 -4.979 -49.634 1.00 0.00 C ATOM 762 C THR A 62 -4.067 -6.306 -50.384 1.00 0.00 C ATOM 763 O THR A 62 -4.343 -7.365 -49.819 1.00 0.00 O ATOM 764 CB THR A 62 -2.704 -4.521 -49.249 1.00 0.00 C ATOM 765 OG1 THR A 62 -2.258 -5.240 -48.088 1.00 0.00 O ATOM 766 CG2 THR A 62 -2.688 -3.027 -48.958 1.00 0.00 C ATOM 0 H THR A 62 -4.485 -5.327 -47.612 1.00 0.00 H new ATOM 0 HA THR A 62 -4.557 -4.233 -50.299 1.00 0.00 H new ATOM 0 HB THR A 62 -2.034 -4.726 -50.084 1.00 0.00 H new ATOM 0 HG1 THR A 62 -1.354 -4.946 -47.848 1.00 0.00 H new ATOM 0 HG21 THR A 62 -1.678 -2.720 -48.687 1.00 0.00 H new ATOM 0 HG22 THR A 62 -3.008 -2.480 -49.845 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.367 -2.810 -48.133 1.00 0.00 H new ATOM 774 N ASP A 63 -3.695 -6.239 -51.654 1.00 0.00 N ATOM 775 CA ASP A 63 -3.639 -7.419 -52.518 1.00 0.00 C ATOM 776 C ASP A 63 -2.443 -8.299 -52.168 1.00 0.00 C ATOM 777 O ASP A 63 -2.282 -9.396 -52.685 1.00 0.00 O ATOM 778 CB ASP A 63 -3.581 -6.985 -53.979 1.00 0.00 C ATOM 779 CG ASP A 63 -3.830 -8.122 -54.934 1.00 0.00 C ATOM 780 OD1 ASP A 63 -4.925 -8.729 -54.869 1.00 0.00 O ATOM 781 OD2 ASP A 63 -2.954 -8.395 -55.785 1.00 0.00 O ATOM 0 H ASP A 63 -3.424 -5.372 -52.117 1.00 0.00 H new ATOM 0 HA ASP A 63 -4.541 -8.010 -52.359 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.321 -6.203 -54.151 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -2.603 -6.550 -54.186 1.00 0.00 H new ATOM 786 N ASP A 64 -1.609 -7.790 -51.284 1.00 0.00 N ATOM 787 CA ASP A 64 -0.449 -8.517 -50.780 1.00 0.00 C ATOM 788 C ASP A 64 -0.887 -9.602 -49.791 1.00 0.00 C ATOM 789 O ASP A 64 -0.091 -10.451 -49.377 1.00 0.00 O ATOM 790 CB ASP A 64 0.521 -7.526 -50.113 1.00 0.00 C ATOM 791 CG ASP A 64 1.690 -8.183 -49.403 1.00 0.00 C ATOM 792 OD1 ASP A 64 1.738 -8.130 -48.159 1.00 0.00 O ATOM 793 OD2 ASP A 64 2.580 -8.729 -50.085 1.00 0.00 O ATOM 0 H ASP A 64 -1.713 -6.855 -50.889 1.00 0.00 H new ATOM 0 HA ASP A 64 0.060 -9.008 -51.609 1.00 0.00 H new ATOM 0 HB2 ASP A 64 0.907 -6.846 -50.872 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.032 -6.921 -49.395 1.00 0.00 H new ATOM 798 N CYS A 65 -2.161 -9.568 -49.422 1.00 0.00 N ATOM 799 CA CYS A 65 -2.722 -10.528 -48.493 1.00 0.00 C ATOM 800 C CYS A 65 -2.678 -11.934 -49.078 1.00 0.00 C ATOM 801 O CYS A 65 -2.868 -12.128 -50.276 1.00 0.00 O ATOM 802 CB CYS A 65 -4.168 -10.157 -48.158 1.00 0.00 C ATOM 803 SG CYS A 65 -4.829 -10.992 -46.700 1.00 0.00 S ATOM 0 H CYS A 65 -2.829 -8.875 -49.759 1.00 0.00 H new ATOM 0 HA CYS A 65 -2.124 -10.508 -47.582 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -4.228 -9.080 -48.004 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -4.799 -10.392 -49.015 1.00 0.00 H new ATOM 808 N LYS A 66 -2.429 -12.910 -48.226 1.00 0.00 N ATOM 809 CA LYS A 66 -2.392 -14.298 -48.645 1.00 0.00 C ATOM 810 C LYS A 66 -3.773 -14.899 -48.604 1.00 0.00 C ATOM 811 O LYS A 66 -3.962 -16.010 -48.095 1.00 0.00 O ATOM 812 CB LYS A 66 -1.495 -15.109 -47.736 1.00 0.00 C ATOM 813 CG LYS A 66 -0.033 -14.799 -47.857 1.00 0.00 C ATOM 814 CD LYS A 66 0.777 -15.819 -47.096 1.00 0.00 C ATOM 815 CE LYS A 66 0.542 -15.734 -45.597 1.00 0.00 C ATOM 816 NZ LYS A 66 1.050 -14.466 -45.021 1.00 0.00 N ATOM 0 H LYS A 66 -2.248 -12.765 -47.233 1.00 0.00 H new ATOM 0 HA LYS A 66 -2.004 -14.322 -49.663 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -1.803 -14.944 -46.703 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -1.647 -16.167 -47.949 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.261 -14.799 -48.907 1.00 0.00 H new ATOM 0 HG3 LYS A 66 0.168 -13.800 -47.469 1.00 0.00 H new ATOM 0 HD2 LYS A 66 0.521 -16.819 -47.446 1.00 0.00 H new ATOM 0 HD3 LYS A 66 1.836 -15.669 -47.305 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.525 -15.822 -45.393 1.00 0.00 H new ATOM 0 HE3 LYS A 66 1.031 -16.576 -45.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 1.040 -14.528 -43.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 2.023 -14.301 -45.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 0.444 -13.678 -45.327 1.00 0.00 H new ATOM 830 N CYS A 67 -4.739 -14.199 -49.117 1.00 0.00 N ATOM 831 CA CYS A 67 -6.060 -14.713 -49.087 1.00 0.00 C ATOM 832 C CYS A 67 -6.637 -14.842 -50.478 1.00 0.00 C ATOM 833 O CYS A 67 -7.148 -13.881 -51.042 1.00 0.00 O ATOM 834 CB CYS A 67 -6.956 -13.878 -48.198 1.00 0.00 C ATOM 835 SG CYS A 67 -8.386 -14.788 -47.605 1.00 0.00 S ATOM 0 H CYS A 67 -4.633 -13.284 -49.554 1.00 0.00 H new ATOM 0 HA CYS A 67 -6.009 -15.714 -48.659 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -6.381 -13.517 -47.345 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -7.292 -13.000 -48.750 1.00 0.00 H new ATOM 840 N GLN A 68 -6.576 -16.050 -51.022 1.00 0.00 N ATOM 841 CA GLN A 68 -7.083 -16.315 -52.366 1.00 0.00 C ATOM 842 C GLN A 68 -8.614 -16.290 -52.390 1.00 0.00 C ATOM 843 O GLN A 68 -9.235 -16.599 -53.406 1.00 0.00 O ATOM 844 CB GLN A 68 -6.572 -17.669 -52.890 1.00 0.00 C ATOM 845 CG GLN A 68 -5.082 -17.909 -52.671 1.00 0.00 C ATOM 846 CD GLN A 68 -4.802 -18.697 -51.403 1.00 0.00 C ATOM 847 OE1 GLN A 68 -4.640 -18.128 -50.324 1.00 0.00 O ATOM 848 NE2 GLN A 68 -4.746 -20.004 -51.529 1.00 0.00 N ATOM 0 H GLN A 68 -6.180 -16.865 -50.554 1.00 0.00 H new ATOM 0 HA GLN A 68 -6.712 -15.525 -53.019 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -7.131 -18.468 -52.403 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -6.785 -17.736 -53.957 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -4.674 -18.446 -53.527 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -4.566 -16.950 -52.621 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -4.886 -20.435 -52.443 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -4.562 -20.588 -50.713 1.00 0.00 H new ATOM 857 N SER A 69 -9.212 -15.939 -51.263 1.00 0.00 N ATOM 858 CA SER A 69 -10.645 -15.845 -51.161 1.00 0.00 C ATOM 859 C SER A 69 -11.125 -14.444 -51.557 1.00 0.00 C ATOM 860 O SER A 69 -12.210 -14.291 -52.118 1.00 0.00 O ATOM 861 CB SER A 69 -11.089 -16.175 -49.741 1.00 0.00 C ATOM 862 OG SER A 69 -10.557 -17.423 -49.319 1.00 0.00 O ATOM 0 H SER A 69 -8.714 -15.714 -50.402 1.00 0.00 H new ATOM 0 HA SER A 69 -11.090 -16.565 -51.848 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.762 -15.388 -49.062 1.00 0.00 H new ATOM 0 HB3 SER A 69 -12.178 -16.205 -49.694 1.00 0.00 H new ATOM 0 HG SER A 69 -10.854 -17.613 -48.405 1.00 0.00 H new ATOM 868 N CYS A 70 -10.314 -13.423 -51.271 1.00 0.00 N ATOM 869 CA CYS A 70 -10.694 -12.057 -51.606 1.00 0.00 C ATOM 870 C CYS A 70 -9.683 -11.390 -52.535 1.00 0.00 C ATOM 871 O CYS A 70 -10.072 -10.696 -53.481 1.00 0.00 O ATOM 872 CB CYS A 70 -10.893 -11.213 -50.344 1.00 0.00 C ATOM 873 SG CYS A 70 -9.394 -10.950 -49.376 1.00 0.00 S ATOM 0 H CYS A 70 -9.406 -13.517 -50.816 1.00 0.00 H new ATOM 0 HA CYS A 70 -11.643 -12.117 -52.139 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -11.300 -10.243 -50.631 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -11.638 -11.697 -49.712 1.00 0.00 H new ATOM 878 N SER A 71 -8.393 -11.610 -52.274 1.00 0.00 N ATOM 879 CA SER A 71 -7.330 -11.014 -53.072 1.00 0.00 C ATOM 880 C SER A 71 -7.483 -11.391 -54.543 1.00 0.00 C ATOM 881 O SER A 71 -8.022 -12.458 -54.869 1.00 0.00 O ATOM 882 CB SER A 71 -5.965 -11.450 -52.539 1.00 0.00 C ATOM 883 OG SER A 71 -5.869 -11.201 -51.142 1.00 0.00 O ATOM 0 H SER A 71 -8.062 -12.201 -51.511 1.00 0.00 H new ATOM 0 HA SER A 71 -7.402 -9.929 -52.994 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.814 -12.511 -52.736 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.175 -10.913 -53.064 1.00 0.00 H new ATOM 0 HG SER A 71 -6.241 -11.961 -50.648 1.00 0.00 H new ATOM 889 N THR A 72 -7.021 -10.517 -55.424 1.00 0.00 N ATOM 890 CA THR A 72 -7.165 -10.734 -56.847 1.00 0.00 C ATOM 891 C THR A 72 -6.451 -12.005 -57.287 1.00 0.00 C ATOM 892 O THR A 72 -5.273 -12.222 -56.968 1.00 0.00 O ATOM 893 CB THR A 72 -6.664 -9.530 -57.662 1.00 0.00 C ATOM 894 OG1 THR A 72 -5.301 -9.262 -57.345 1.00 0.00 O ATOM 895 CG2 THR A 72 -7.498 -8.295 -57.365 1.00 0.00 C ATOM 0 H THR A 72 -6.543 -9.651 -55.174 1.00 0.00 H new ATOM 0 HA THR A 72 -8.231 -10.851 -57.043 1.00 0.00 H new ATOM 0 HB THR A 72 -6.756 -9.773 -58.721 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.145 -9.441 -56.394 1.00 0.00 H new ATOM 0 HG21 THR A 72 -7.126 -7.455 -57.952 1.00 0.00 H new ATOM 0 HG22 THR A 72 -8.539 -8.488 -57.625 1.00 0.00 H new ATOM 0 HG23 THR A 72 -7.428 -8.055 -56.304 1.00 0.00 H new ATOM 903 N ALA A 73 -7.171 -12.841 -58.004 1.00 0.00 N ATOM 904 CA ALA A 73 -6.654 -14.114 -58.451 1.00 0.00 C ATOM 905 C ALA A 73 -5.840 -13.969 -59.728 1.00 0.00 C ATOM 906 O ALA A 73 -5.985 -12.989 -60.466 1.00 0.00 O ATOM 907 CB ALA A 73 -7.803 -15.087 -58.659 1.00 0.00 C ATOM 0 H ALA A 73 -8.132 -12.656 -58.293 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.986 -14.502 -57.682 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -7.411 -16.046 -58.996 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -8.339 -15.224 -57.720 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.485 -14.689 -59.411 1.00 0.00 H new ATOM 913 N CYS A 74 -4.979 -14.947 -59.973 1.00 0.00 N ATOM 914 CA CYS A 74 -4.149 -14.976 -61.168 1.00 0.00 C ATOM 915 C CYS A 74 -5.022 -15.226 -62.388 1.00 0.00 C ATOM 916 O CYS A 74 -6.061 -15.890 -62.291 1.00 0.00 O ATOM 917 CB CYS A 74 -3.103 -16.086 -61.046 1.00 0.00 C ATOM 918 SG CYS A 74 -1.782 -16.023 -62.281 1.00 0.00 S ATOM 0 H CYS A 74 -4.837 -15.742 -59.349 1.00 0.00 H new ATOM 0 HA CYS A 74 -3.641 -14.018 -61.277 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -2.656 -16.037 -60.053 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -3.606 -17.050 -61.122 1.00 0.00 H new ATOM 923 N LYS A 75 -4.610 -14.708 -63.525 1.00 0.00 N ATOM 924 CA LYS A 75 -5.375 -14.872 -64.752 1.00 0.00 C ATOM 925 C LYS A 75 -4.796 -15.979 -65.610 1.00 0.00 C ATOM 926 O LYS A 75 -5.295 -16.258 -66.701 1.00 0.00 O ATOM 927 CB LYS A 75 -5.417 -13.565 -65.539 1.00 0.00 C ATOM 928 CG LYS A 75 -6.157 -12.451 -64.830 1.00 0.00 C ATOM 929 CD LYS A 75 -7.654 -12.719 -64.767 1.00 0.00 C ATOM 930 CE LYS A 75 -8.349 -11.688 -63.891 1.00 0.00 C ATOM 931 NZ LYS A 75 -8.080 -10.297 -64.342 1.00 0.00 N ATOM 0 H LYS A 75 -3.750 -14.169 -63.630 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.393 -15.148 -64.476 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.396 -13.240 -65.741 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.890 -13.747 -66.504 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -5.765 -12.340 -63.819 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -5.978 -11.508 -65.347 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -8.076 -12.693 -65.772 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.833 -13.719 -64.372 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -9.424 -11.870 -63.901 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -8.015 -11.805 -62.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -8.736 -9.645 -63.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -7.101 -10.038 -64.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -8.214 -10.234 -65.371 1.00 0.00 H new ATOM 945 N CYS A 76 -3.757 -16.604 -65.120 1.00 0.00 N ATOM 946 CA CYS A 76 -3.113 -17.680 -65.834 1.00 0.00 C ATOM 947 C CYS A 76 -3.892 -18.981 -65.686 1.00 0.00 C ATOM 948 O CYS A 76 -4.898 -19.034 -64.972 1.00 0.00 O ATOM 949 CB CYS A 76 -1.692 -17.837 -65.340 1.00 0.00 C ATOM 950 SG CYS A 76 -0.671 -16.404 -65.685 1.00 0.00 S ATOM 0 H CYS A 76 -3.333 -16.384 -64.219 1.00 0.00 H new ATOM 0 HA CYS A 76 -3.092 -17.435 -66.896 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -1.704 -18.018 -64.265 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -1.246 -18.716 -65.806 1.00 0.00 H new ATOM 955 N ALA A 77 -3.429 -20.026 -66.355 1.00 0.00 N ATOM 956 CA ALA A 77 -4.105 -21.314 -66.328 1.00 0.00 C ATOM 957 C ALA A 77 -3.131 -22.437 -66.606 1.00 0.00 C ATOM 958 O ALA A 77 -1.942 -22.192 -66.826 1.00 0.00 O ATOM 959 CB ALA A 77 -5.210 -21.343 -67.359 1.00 0.00 C ATOM 0 H ALA A 77 -2.584 -20.007 -66.926 1.00 0.00 H new ATOM 0 HA ALA A 77 -4.530 -21.453 -65.334 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -5.709 -22.312 -67.330 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.932 -20.556 -67.141 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -4.787 -21.182 -68.351 1.00 0.00 H new ATOM 965 N ALA A 78 -3.639 -23.661 -66.605 1.00 0.00 N ATOM 966 CA ALA A 78 -2.835 -24.837 -66.884 1.00 0.00 C ATOM 967 C ALA A 78 -2.254 -24.773 -68.289 1.00 0.00 C ATOM 968 O ALA A 78 -2.939 -25.053 -69.281 1.00 0.00 O ATOM 969 CB ALA A 78 -3.666 -26.099 -66.707 1.00 0.00 C ATOM 0 H ALA A 78 -4.619 -23.864 -66.411 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.007 -24.863 -66.175 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.050 -26.973 -66.920 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.031 -26.153 -65.681 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.513 -26.076 -67.393 1.00 0.00 H new ATOM 975 N GLY A 79 -1.009 -24.363 -68.367 1.00 0.00 N ATOM 976 CA GLY A 79 -0.332 -24.271 -69.638 1.00 0.00 C ATOM 977 C GLY A 79 -0.389 -22.876 -70.211 1.00 0.00 C ATOM 978 O GLY A 79 -0.186 -22.680 -71.408 1.00 0.00 O ATOM 0 H GLY A 79 -0.444 -24.088 -67.563 1.00 0.00 H new ATOM 0 HA2 GLY A 79 0.709 -24.570 -69.516 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -0.785 -24.970 -70.341 1.00 0.00 H new ATOM 982 N SER A 80 -0.679 -21.907 -69.366 1.00 0.00 N ATOM 983 CA SER A 80 -0.758 -20.529 -69.793 1.00 0.00 C ATOM 984 C SER A 80 -0.268 -19.597 -68.695 1.00 0.00 C ATOM 985 O SER A 80 -0.962 -19.376 -67.715 1.00 0.00 O ATOM 986 CB SER A 80 -2.202 -20.172 -70.179 1.00 0.00 C ATOM 987 OG SER A 80 -2.302 -18.831 -70.649 1.00 0.00 O ATOM 0 H SER A 80 -0.865 -22.053 -68.374 1.00 0.00 H new ATOM 0 HA SER A 80 -0.117 -20.405 -70.666 1.00 0.00 H new ATOM 0 HB2 SER A 80 -2.553 -20.856 -70.952 1.00 0.00 H new ATOM 0 HB3 SER A 80 -2.854 -20.305 -69.316 1.00 0.00 H new ATOM 0 HG SER A 80 -1.901 -18.224 -69.993 1.00 0.00 H new ATOM 993 N CYS A 81 0.941 -19.092 -68.855 1.00 0.00 N ATOM 994 CA CYS A 81 1.511 -18.126 -67.927 1.00 0.00 C ATOM 995 C CYS A 81 1.957 -16.893 -68.708 1.00 0.00 C ATOM 996 O CYS A 81 3.043 -16.876 -69.298 1.00 0.00 O ATOM 997 CB CYS A 81 2.701 -18.747 -67.167 1.00 0.00 C ATOM 998 SG CYS A 81 3.507 -17.647 -65.961 1.00 0.00 S ATOM 0 H CYS A 81 1.557 -19.338 -69.630 1.00 0.00 H new ATOM 0 HA CYS A 81 0.759 -17.837 -67.193 1.00 0.00 H new ATOM 0 HB2 CYS A 81 2.353 -19.639 -66.646 1.00 0.00 H new ATOM 0 HB3 CYS A 81 3.446 -19.072 -67.893 1.00 0.00 H new ATOM 1003 N LYS A 82 1.107 -15.872 -68.744 1.00 0.00 N ATOM 1004 CA LYS A 82 1.417 -14.670 -69.509 1.00 0.00 C ATOM 1005 C LYS A 82 2.061 -13.597 -68.651 1.00 0.00 C ATOM 1006 O LYS A 82 2.833 -12.781 -69.155 1.00 0.00 O ATOM 1007 CB LYS A 82 0.186 -14.107 -70.236 1.00 0.00 C ATOM 1008 CG LYS A 82 -0.990 -13.770 -69.337 1.00 0.00 C ATOM 1009 CD LYS A 82 -1.975 -14.920 -69.237 1.00 0.00 C ATOM 1010 CE LYS A 82 -2.667 -15.192 -70.567 1.00 0.00 C ATOM 1011 NZ LYS A 82 -3.663 -16.291 -70.467 1.00 0.00 N ATOM 0 H LYS A 82 0.210 -15.852 -68.259 1.00 0.00 H new ATOM 0 HA LYS A 82 2.140 -14.976 -70.266 1.00 0.00 H new ATOM 0 HB2 LYS A 82 0.481 -13.207 -70.776 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.141 -14.833 -70.981 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.625 -13.517 -68.342 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.500 -12.888 -69.723 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -1.452 -15.819 -68.909 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.724 -14.692 -68.478 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.164 -14.284 -70.909 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -1.920 -15.448 -71.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.461 -16.095 -71.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.216 -17.190 -70.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.009 -16.358 -69.489 1.00 0.00 H new ATOM 1025 N CYS A 83 1.758 -13.593 -67.358 1.00 0.00 N ATOM 1026 CA CYS A 83 2.352 -12.615 -66.459 1.00 0.00 C ATOM 1027 C CYS A 83 3.850 -12.875 -66.329 1.00 0.00 C ATOM 1028 O CYS A 83 4.633 -11.964 -66.032 1.00 0.00 O ATOM 1029 CB CYS A 83 1.679 -12.663 -65.089 1.00 0.00 C ATOM 1030 SG CYS A 83 1.835 -14.247 -64.257 1.00 0.00 S ATOM 0 H CYS A 83 1.113 -14.247 -66.915 1.00 0.00 H new ATOM 0 HA CYS A 83 2.201 -11.619 -66.875 1.00 0.00 H new ATOM 0 HB2 CYS A 83 2.110 -11.887 -64.456 1.00 0.00 H new ATOM 0 HB3 CYS A 83 0.621 -12.428 -65.206 1.00 0.00 H new ATOM 1035 N GLY A 84 4.238 -14.129 -66.563 1.00 0.00 N ATOM 1036 CA GLY A 84 5.632 -14.501 -66.526 1.00 0.00 C ATOM 1037 C GLY A 84 6.162 -14.600 -65.125 1.00 0.00 C ATOM 1038 O GLY A 84 7.317 -14.258 -64.867 1.00 0.00 O ATOM 0 H GLY A 84 3.600 -14.895 -66.779 1.00 0.00 H new ATOM 0 HA2 GLY A 84 5.763 -15.459 -67.029 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.216 -13.767 -67.081 1.00 0.00 H new ATOM 1042 N LYS A 85 5.327 -15.058 -64.213 1.00 0.00 N ATOM 1043 CA LYS A 85 5.727 -15.190 -62.825 1.00 0.00 C ATOM 1044 C LYS A 85 5.954 -16.647 -62.447 1.00 0.00 C ATOM 1045 O LYS A 85 6.407 -16.949 -61.340 1.00 0.00 O ATOM 1046 CB LYS A 85 4.694 -14.540 -61.907 1.00 0.00 C ATOM 1047 CG LYS A 85 4.513 -13.046 -62.160 1.00 0.00 C ATOM 1048 CD LYS A 85 5.821 -12.279 -61.970 1.00 0.00 C ATOM 1049 CE LYS A 85 6.278 -12.317 -60.517 1.00 0.00 C ATOM 1050 NZ LYS A 85 7.561 -11.602 -60.316 1.00 0.00 N ATOM 0 H LYS A 85 4.368 -15.345 -64.408 1.00 0.00 H new ATOM 0 HA LYS A 85 6.676 -14.669 -62.698 1.00 0.00 H new ATOM 0 HB2 LYS A 85 3.735 -15.042 -62.038 1.00 0.00 H new ATOM 0 HB3 LYS A 85 4.994 -14.692 -60.870 1.00 0.00 H new ATOM 0 HG2 LYS A 85 4.144 -12.891 -63.174 1.00 0.00 H new ATOM 0 HG3 LYS A 85 3.757 -12.651 -61.481 1.00 0.00 H new ATOM 0 HD2 LYS A 85 6.593 -12.709 -62.608 1.00 0.00 H new ATOM 0 HD3 LYS A 85 5.687 -11.244 -62.285 1.00 0.00 H new ATOM 0 HE2 LYS A 85 5.511 -11.869 -59.885 1.00 0.00 H new ATOM 0 HE3 LYS A 85 6.388 -13.354 -60.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 7.834 -11.653 -59.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 8.300 -12.044 -60.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 7.451 -10.606 -60.594 1.00 0.00 H new ATOM 1064 N GLY A 86 5.655 -17.545 -63.371 1.00 0.00 N ATOM 1065 CA GLY A 86 5.874 -18.958 -63.127 1.00 0.00 C ATOM 1066 C GLY A 86 4.683 -19.626 -62.477 1.00 0.00 C ATOM 1067 O GLY A 86 4.828 -20.629 -61.775 1.00 0.00 O ATOM 0 H GLY A 86 5.264 -17.323 -64.287 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.095 -19.456 -64.071 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.749 -19.082 -62.489 1.00 0.00 H new ATOM 1071 N CYS A 87 3.516 -19.074 -62.700 1.00 0.00 N ATOM 1072 CA CYS A 87 2.299 -19.619 -62.153 1.00 0.00 C ATOM 1073 C CYS A 87 1.351 -20.020 -63.269 1.00 0.00 C ATOM 1074 O CYS A 87 1.280 -19.367 -64.302 1.00 0.00 O ATOM 1075 CB CYS A 87 1.638 -18.600 -61.225 1.00 0.00 C ATOM 1076 SG CYS A 87 1.723 -16.901 -61.829 1.00 0.00 S ATOM 0 H CYS A 87 3.383 -18.235 -63.265 1.00 0.00 H new ATOM 0 HA CYS A 87 2.541 -20.510 -61.574 1.00 0.00 H new ATOM 0 HB2 CYS A 87 0.592 -18.874 -61.086 1.00 0.00 H new ATOM 0 HB3 CYS A 87 2.114 -18.652 -60.246 1.00 0.00 H new ATOM 1081 N THR A 88 0.652 -21.113 -63.074 1.00 0.00 N ATOM 1082 CA THR A 88 -0.295 -21.575 -64.056 1.00 0.00 C ATOM 1083 C THR A 88 -1.687 -21.702 -63.452 1.00 0.00 C ATOM 1084 O THR A 88 -2.231 -22.798 -63.316 1.00 0.00 O ATOM 1085 CB THR A 88 0.147 -22.913 -64.683 1.00 0.00 C ATOM 1086 OG1 THR A 88 0.688 -23.773 -63.668 1.00 0.00 O ATOM 1087 CG2 THR A 88 1.194 -22.680 -65.763 1.00 0.00 C ATOM 0 H THR A 88 0.723 -21.699 -62.242 1.00 0.00 H new ATOM 0 HA THR A 88 -0.330 -20.830 -64.851 1.00 0.00 H new ATOM 0 HB THR A 88 -0.725 -23.386 -65.135 1.00 0.00 H new ATOM 0 HG1 THR A 88 0.965 -24.622 -64.072 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.493 -23.636 -66.193 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.776 -22.046 -66.545 1.00 0.00 H new ATOM 0 HG23 THR A 88 2.065 -22.191 -65.326 1.00 0.00 H new ATOM 1095 N GLY A 89 -2.242 -20.571 -63.066 1.00 0.00 N ATOM 1096 CA GLY A 89 -3.555 -20.555 -62.480 1.00 0.00 C ATOM 1097 C GLY A 89 -3.522 -20.066 -61.054 1.00 0.00 C ATOM 1098 O GLY A 89 -2.496 -20.170 -60.392 1.00 0.00 O ATOM 0 H GLY A 89 -1.800 -19.655 -63.150 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.209 -19.913 -63.070 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.980 -21.558 -62.511 1.00 0.00 H new ATOM 1102 N PRO A 90 -4.637 -19.532 -60.552 1.00 0.00 N ATOM 1103 CA PRO A 90 -4.730 -18.990 -59.185 1.00 0.00 C ATOM 1104 C PRO A 90 -4.438 -20.037 -58.121 1.00 0.00 C ATOM 1105 O PRO A 90 -3.855 -19.736 -57.082 1.00 0.00 O ATOM 1106 CB PRO A 90 -6.184 -18.529 -59.079 1.00 0.00 C ATOM 1107 CG PRO A 90 -6.896 -19.247 -60.170 1.00 0.00 C ATOM 1108 CD PRO A 90 -5.904 -19.405 -61.274 1.00 0.00 C ATOM 0 HA PRO A 90 -4.000 -18.198 -59.018 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -6.606 -18.774 -58.104 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -6.265 -17.449 -59.199 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -7.257 -20.217 -59.828 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.766 -18.683 -60.505 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -6.113 -20.284 -61.883 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -5.904 -18.545 -61.944 1.00 0.00 H new ATOM 1116 N ASP A 91 -4.827 -21.266 -58.395 1.00 0.00 N ATOM 1117 CA ASP A 91 -4.616 -22.360 -57.459 1.00 0.00 C ATOM 1118 C ASP A 91 -3.145 -22.733 -57.395 1.00 0.00 C ATOM 1119 O ASP A 91 -2.690 -23.358 -56.440 1.00 0.00 O ATOM 1120 CB ASP A 91 -5.458 -23.572 -57.849 1.00 0.00 C ATOM 1121 CG ASP A 91 -6.942 -23.290 -57.772 1.00 0.00 C ATOM 1122 OD1 ASP A 91 -7.495 -23.277 -56.653 1.00 0.00 O ATOM 1123 OD2 ASP A 91 -7.564 -23.068 -58.831 1.00 0.00 O ATOM 0 H ASP A 91 -5.293 -21.536 -59.261 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.930 -22.028 -56.470 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.201 -23.879 -58.863 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.215 -24.407 -57.192 1.00 0.00 H new ATOM 1128 N SER A 92 -2.406 -22.336 -58.414 1.00 0.00 N ATOM 1129 CA SER A 92 -0.988 -22.597 -58.476 1.00 0.00 C ATOM 1130 C SER A 92 -0.191 -21.322 -58.195 1.00 0.00 C ATOM 1131 O SER A 92 1.028 -21.364 -58.029 1.00 0.00 O ATOM 1132 CB SER A 92 -0.625 -23.140 -59.850 1.00 0.00 C ATOM 1133 OG SER A 92 -1.388 -24.295 -60.159 1.00 0.00 O ATOM 0 H SER A 92 -2.774 -21.826 -59.217 1.00 0.00 H new ATOM 0 HA SER A 92 -0.737 -23.336 -57.715 1.00 0.00 H new ATOM 0 HB2 SER A 92 -0.798 -22.373 -60.605 1.00 0.00 H new ATOM 0 HB3 SER A 92 0.437 -23.383 -59.880 1.00 0.00 H new ATOM 0 HG SER A 92 -1.138 -24.624 -61.047 1.00 0.00 H new ATOM 1139 N CYS A 93 -0.887 -20.194 -58.154 1.00 0.00 N ATOM 1140 CA CYS A 93 -0.252 -18.914 -57.909 1.00 0.00 C ATOM 1141 C CYS A 93 0.253 -18.829 -56.485 1.00 0.00 C ATOM 1142 O CYS A 93 -0.439 -19.212 -55.537 1.00 0.00 O ATOM 1143 CB CYS A 93 -1.214 -17.761 -58.198 1.00 0.00 C ATOM 1144 SG CYS A 93 -0.502 -16.118 -57.934 1.00 0.00 S ATOM 0 H CYS A 93 -1.897 -20.144 -58.289 1.00 0.00 H new ATOM 0 HA CYS A 93 0.599 -18.830 -58.585 1.00 0.00 H new ATOM 0 HB2 CYS A 93 -1.554 -17.836 -59.231 1.00 0.00 H new ATOM 0 HB3 CYS A 93 -2.094 -17.869 -57.564 1.00 0.00 H new ATOM 1149 N LYS A 94 1.459 -18.340 -56.343 1.00 0.00 N ATOM 1150 CA LYS A 94 2.091 -18.200 -55.052 1.00 0.00 C ATOM 1151 C LYS A 94 2.554 -16.769 -54.865 1.00 0.00 C ATOM 1152 O LYS A 94 3.298 -16.452 -53.936 1.00 0.00 O ATOM 1153 CB LYS A 94 3.275 -19.160 -54.956 1.00 0.00 C ATOM 1154 CG LYS A 94 4.284 -18.986 -56.075 1.00 0.00 C ATOM 1155 CD LYS A 94 5.348 -20.060 -56.040 1.00 0.00 C ATOM 1156 CE LYS A 94 6.350 -19.870 -57.158 1.00 0.00 C ATOM 1157 NZ LYS A 94 7.361 -20.951 -57.188 1.00 0.00 N ATOM 0 H LYS A 94 2.035 -18.025 -57.124 1.00 0.00 H new ATOM 0 HA LYS A 94 1.376 -18.443 -54.266 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.776 -19.013 -53.999 1.00 0.00 H new ATOM 0 HB3 LYS A 94 2.904 -20.185 -54.967 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.770 -19.014 -57.036 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.753 -18.006 -55.993 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.862 -20.036 -55.079 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.882 -21.041 -56.128 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.826 -19.838 -58.113 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.850 -18.909 -57.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.027 -20.782 -57.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 7.880 -20.966 -56.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.887 -21.866 -57.330 1.00 0.00 H new ATOM 1171 N CYS A 95 2.101 -15.910 -55.752 1.00 0.00 N ATOM 1172 CA CYS A 95 2.470 -14.519 -55.729 1.00 0.00 C ATOM 1173 C CYS A 95 1.447 -13.716 -54.946 1.00 0.00 C ATOM 1174 O CYS A 95 0.257 -14.027 -54.961 1.00 0.00 O ATOM 1175 CB CYS A 95 2.585 -13.995 -57.156 1.00 0.00 C ATOM 1176 SG CYS A 95 3.752 -14.927 -58.183 1.00 0.00 S ATOM 0 H CYS A 95 1.465 -16.161 -56.509 1.00 0.00 H new ATOM 0 HA CYS A 95 3.436 -14.413 -55.236 1.00 0.00 H new ATOM 0 HB2 CYS A 95 1.601 -14.022 -57.624 1.00 0.00 H new ATOM 0 HB3 CYS A 95 2.895 -12.950 -57.126 1.00 0.00 H new ATOM 1181 N ASP A 96 1.914 -12.699 -54.249 1.00 0.00 N ATOM 1182 CA ASP A 96 1.037 -11.858 -53.454 1.00 0.00 C ATOM 1183 C ASP A 96 0.354 -10.833 -54.347 1.00 0.00 C ATOM 1184 O ASP A 96 -0.780 -11.020 -54.764 1.00 0.00 O ATOM 1185 CB ASP A 96 1.818 -11.151 -52.332 1.00 0.00 C ATOM 1186 CG ASP A 96 2.703 -12.086 -51.538 1.00 0.00 C ATOM 1187 OD1 ASP A 96 2.194 -12.784 -50.639 1.00 0.00 O ATOM 1188 OD2 ASP A 96 3.929 -12.109 -51.801 1.00 0.00 O ATOM 0 H ASP A 96 2.898 -12.433 -54.216 1.00 0.00 H new ATOM 0 HA ASP A 96 0.280 -12.491 -52.991 1.00 0.00 H new ATOM 0 HB2 ASP A 96 2.432 -10.363 -52.767 1.00 0.00 H new ATOM 0 HB3 ASP A 96 1.112 -10.668 -51.656 1.00 0.00 H new ATOM 1193 N ARG A 97 1.068 -9.763 -54.661 1.00 0.00 N ATOM 1194 CA ARG A 97 0.548 -8.711 -55.526 1.00 0.00 C ATOM 1195 C ARG A 97 1.545 -8.386 -56.628 1.00 0.00 C ATOM 1196 O ARG A 97 1.440 -7.358 -57.295 1.00 0.00 O ATOM 1197 CB ARG A 97 0.238 -7.458 -54.710 1.00 0.00 C ATOM 1198 CG ARG A 97 1.378 -7.016 -53.820 1.00 0.00 C ATOM 1199 CD ARG A 97 1.019 -5.775 -53.031 1.00 0.00 C ATOM 1200 NE ARG A 97 1.030 -4.573 -53.852 1.00 0.00 N ATOM 1201 CZ ARG A 97 1.170 -3.342 -53.362 1.00 0.00 C ATOM 1202 NH1 ARG A 97 1.260 -3.153 -52.050 1.00 0.00 N ATOM 1203 NH2 ARG A 97 1.206 -2.302 -54.181 1.00 0.00 N ATOM 0 H ARG A 97 2.018 -9.598 -54.327 1.00 0.00 H new ATOM 0 HA ARG A 97 -0.374 -9.067 -55.986 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -0.016 -6.645 -55.391 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.641 -7.645 -54.094 1.00 0.00 H new ATOM 0 HG2 ARG A 97 1.638 -7.822 -53.134 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.260 -6.818 -54.429 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.030 -5.901 -52.590 1.00 0.00 H new ATOM 0 HD3 ARG A 97 1.723 -5.655 -52.207 1.00 0.00 H new ATOM 0 HE ARG A 97 0.924 -4.679 -54.861 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.222 -3.951 -51.416 1.00 0.00 H new ATOM 0 HH12 ARG A 97 1.367 -2.210 -51.677 1.00 0.00 H new ATOM 0 HH21 ARG A 97 1.126 -2.443 -55.188 1.00 0.00 H new ATOM 0 HH22 ARG A 97 1.313 -1.360 -53.805 1.00 0.00 H new ATOM 1217 N SER A 98 2.497 -9.287 -56.827 1.00 0.00 N ATOM 1218 CA SER A 98 3.547 -9.105 -57.820 1.00 0.00 C ATOM 1219 C SER A 98 3.026 -9.315 -59.246 1.00 0.00 C ATOM 1220 O SER A 98 3.677 -8.935 -60.215 1.00 0.00 O ATOM 1221 CB SER A 98 4.704 -10.048 -57.517 1.00 0.00 C ATOM 1222 OG SER A 98 4.221 -11.322 -57.132 1.00 0.00 O ATOM 0 H SER A 98 2.563 -10.162 -56.307 1.00 0.00 H new ATOM 0 HA SER A 98 3.899 -8.075 -57.762 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.341 -10.145 -58.396 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.321 -9.631 -56.721 1.00 0.00 H new ATOM 0 HG SER A 98 4.978 -11.915 -56.943 1.00 0.00 H new ATOM 1228 N CYS A 99 1.861 -9.931 -59.362 1.00 0.00 N ATOM 1229 CA CYS A 99 1.227 -10.134 -60.655 1.00 0.00 C ATOM 1230 C CYS A 99 0.666 -8.821 -61.184 1.00 0.00 C ATOM 1231 O CYS A 99 0.105 -8.029 -60.427 1.00 0.00 O ATOM 1232 CB CYS A 99 0.092 -11.145 -60.532 1.00 0.00 C ATOM 1233 SG CYS A 99 0.599 -12.869 -60.475 1.00 0.00 S ATOM 0 H CYS A 99 1.332 -10.301 -58.572 1.00 0.00 H new ATOM 0 HA CYS A 99 1.980 -10.511 -61.347 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -0.476 -10.921 -59.629 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -0.585 -11.010 -61.376 1.00 0.00 H new ATOM 1238 N SER A 100 0.820 -8.584 -62.472 1.00 0.00 N ATOM 1239 CA SER A 100 0.276 -7.384 -63.076 1.00 0.00 C ATOM 1240 C SER A 100 -1.103 -7.676 -63.665 1.00 0.00 C ATOM 1241 O SER A 100 -1.864 -6.766 -63.991 1.00 0.00 O ATOM 1242 CB SER A 100 1.218 -6.844 -64.154 1.00 0.00 C ATOM 1243 OG SER A 100 0.778 -5.583 -64.635 1.00 0.00 O ATOM 0 H SER A 100 1.314 -9.202 -63.116 1.00 0.00 H new ATOM 0 HA SER A 100 0.175 -6.621 -62.304 1.00 0.00 H new ATOM 0 HB2 SER A 100 2.225 -6.750 -63.747 1.00 0.00 H new ATOM 0 HB3 SER A 100 1.273 -7.552 -64.981 1.00 0.00 H new ATOM 0 HG SER A 100 1.398 -5.260 -65.321 1.00 0.00 H new ATOM 1249 N CYS A 101 -1.425 -8.957 -63.781 1.00 0.00 N ATOM 1250 CA CYS A 101 -2.706 -9.379 -64.321 1.00 0.00 C ATOM 1251 C CYS A 101 -3.767 -9.415 -63.220 1.00 0.00 C ATOM 1252 O CYS A 101 -4.910 -9.819 -63.455 1.00 0.00 O ATOM 1253 CB CYS A 101 -2.567 -10.755 -64.973 1.00 0.00 C ATOM 1254 SG CYS A 101 -1.869 -12.009 -63.884 1.00 0.00 S ATOM 0 H CYS A 101 -0.812 -9.724 -63.506 1.00 0.00 H new ATOM 0 HA CYS A 101 -3.023 -8.660 -65.076 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -3.548 -11.087 -65.312 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -1.938 -10.665 -65.858 1.00 0.00 H new ATOM 1259 N LYS A 102 -3.378 -8.980 -62.019 1.00 0.00 N ATOM 1260 CA LYS A 102 -4.282 -8.955 -60.871 1.00 0.00 C ATOM 1261 C LYS A 102 -5.564 -8.190 -61.194 1.00 0.00 C ATOM 1262 O LYS A 102 -5.511 -6.928 -61.204 1.00 0.00 O ATOM 1263 CB LYS A 102 -3.600 -8.323 -59.647 1.00 0.00 C ATOM 1264 CG LYS A 102 -2.448 -9.135 -59.055 1.00 0.00 C ATOM 1265 CD LYS A 102 -2.804 -10.608 -58.928 1.00 0.00 C ATOM 1266 CE LYS A 102 -2.128 -11.263 -57.733 1.00 0.00 C ATOM 1267 NZ LYS A 102 -2.824 -10.938 -56.459 1.00 0.00 N ATOM 0 H LYS A 102 -2.438 -8.639 -61.818 1.00 0.00 H new ATOM 0 HA LYS A 102 -4.539 -9.988 -60.639 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -3.224 -7.339 -59.928 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -4.351 -8.168 -58.872 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.565 -9.027 -59.685 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.189 -8.737 -58.074 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.885 -10.712 -58.833 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.512 -11.130 -59.839 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -2.111 -12.344 -57.872 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -1.091 -10.932 -57.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.230 -11.226 -55.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.999 -9.914 -56.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -3.730 -11.446 -56.419 1.00 0.00 H new TER 1281 LYS A 102 HETATM 1282 CD CD A 200 1.394 -15.209 -59.631 1.00 0.00 CD HETATM 1283 CD CD A 201 1.802 -16.139 -64.519 1.00 0.00 CD HETATM 1284 CD CD A 202 -0.287 -13.769 -62.749 1.00 0.00 CD HETATM 1285 CD CD A 203 -6.800 -9.601 -45.653 1.00 0.00 CD HETATM 1286 CD CD A 204 -9.670 -12.518 -47.259 1.00 0.00 CD HETATM 1287 CD CD A 205 -9.771 -8.404 -48.837 1.00 0.00 CD HETATM 1288 CD CD A 206 -1.457 0.365 -27.279 1.00 0.00 CD HETATM 1289 CD CD A 207 0.858 -1.015 -30.862 1.00 0.00 CD HETATM 1290 CD CD A 208 -1.372 -4.003 -28.461 1.00 0.00 CD