USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 782 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 71 SER OG : rot 83:sc= -2.92 USER MOD Set 1.2: A 92 SER OG : rot 180:sc= -1.49! USER MOD Set 2.1: A 12 LYS NZ :NH3+ 160:sc= 0.576 (180deg=-0.737) USER MOD Set 2.2: A 25 ASN : amide:sc= 0.479 K(o=1.1,f=-4!) USER MOD Single : A 1 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 1 GLN N :NH3+ 168:sc= 0 (180deg=-0.178) USER MOD Single : A 7 LYS NZ :NH3+ -134:sc= -1.94! (180deg=-3.56!) USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 15 THR OG1 : rot -45:sc= 0.542 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN :FLIP amide:sc= 0.7 F(o=-4.6!,f=0.7) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 93:sc= -1.59 USER MOD Single : A 27 ASN : amide:sc= -0.0294 K(o=-0.029,f=-1.5!) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -11:sc= 0.259 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc=-0.000822 X(o=-0.00082,f=-0.34) USER MOD Single : A 36 ASN : amide:sc=-0.00708 X(o=-0.0071,f=-0.092) USER MOD Single : A 46 ASN : amide:sc= -6.92! C(o=-6.9!,f=-14!) USER MOD Single : A 49 ASN : amide:sc= -0.0155 X(o=-0.016,f=-0.19) USER MOD Single : A 51 THR OG1 : rot -58:sc= -1.32 USER MOD Single : A 54 THR OG1 : rot -105:sc= 0.00157 USER MOD Single : A 57 HIS : no HD1:sc= -3.98! C(o=-4!,f=-4.6!) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 144:sc= 1.24 USER MOD Single : A 66 HIS : no HD1:sc= -12.2! C(o=-12!,f=-16!) USER MOD Single : A 67 MET CE :methyl 143:sc= -0.336 (180deg=-3.38!) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.339 K(o=-0.34,f=-2.2!) USER MOD Single : A 78 MET CE :methyl -173:sc= -14.5! (180deg=-15.4!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -179:sc= -0.14 (180deg=-0.14) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 MET CE :methyl 165:sc= -10.9! (180deg=-12.5!) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -9.89! C(o=-9.9!,f=-13!) USER MOD Single : A 105 SER OG : rot -3:sc= 0.952 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 5.732 -9.340 -5.088 1.00 0.00 N ATOM 2 CA GLN A 1 5.426 -7.924 -5.112 1.00 0.00 C ATOM 3 C GLN A 1 5.600 -7.334 -3.719 1.00 0.00 C ATOM 4 O GLN A 1 4.808 -6.496 -3.295 1.00 0.00 O ATOM 5 CB GLN A 1 3.999 -7.722 -5.611 1.00 0.00 C ATOM 6 CG GLN A 1 4.022 -7.395 -7.102 1.00 0.00 C ATOM 7 CD GLN A 1 4.020 -5.890 -7.327 1.00 0.00 C ATOM 8 OE1 GLN A 1 5.016 -5.219 -7.066 1.00 0.00 O ATOM 9 NE2 GLN A 1 2.895 -5.358 -7.813 1.00 0.00 N ATOM 0 H1 GLN A 1 5.421 -9.778 -5.979 1.00 0.00 H new ATOM 0 H2 GLN A 1 6.758 -9.472 -4.978 1.00 0.00 H new ATOM 0 H3 GLN A 1 5.238 -9.789 -4.291 1.00 0.00 H new ATOM 0 HA GLN A 1 6.110 -7.412 -5.789 1.00 0.00 H new ATOM 0 HB2 GLN A 1 3.410 -8.622 -5.434 1.00 0.00 H new ATOM 0 HB3 GLN A 1 3.520 -6.914 -5.058 1.00 0.00 H new ATOM 0 HG2 GLN A 1 4.907 -7.834 -7.561 1.00 0.00 H new ATOM 0 HG3 GLN A 1 3.155 -7.841 -7.590 1.00 0.00 H new ATOM 0 HE21 GLN A 1 2.094 -5.956 -8.014 1.00 0.00 H new ATOM 0 HE22 GLN A 1 2.838 -4.354 -7.983 1.00 0.00 H new ATOM 20 N LEU A 2 6.640 -7.776 -3.009 1.00 0.00 N ATOM 21 CA LEU A 2 6.913 -7.291 -1.670 1.00 0.00 C ATOM 22 C LEU A 2 6.841 -5.771 -1.647 1.00 0.00 C ATOM 23 O LEU A 2 6.969 -5.125 -2.685 1.00 0.00 O ATOM 24 CB LEU A 2 8.290 -7.774 -1.226 1.00 0.00 C ATOM 25 CG LEU A 2 8.346 -9.297 -1.309 1.00 0.00 C ATOM 26 CD1 LEU A 2 9.554 -9.806 -0.527 1.00 0.00 C ATOM 27 CD2 LEU A 2 7.070 -9.886 -0.715 1.00 0.00 C ATOM 0 H LEU A 2 7.305 -8.472 -3.348 1.00 0.00 H new ATOM 0 HA LEU A 2 6.166 -7.680 -0.979 1.00 0.00 H new ATOM 0 HB2 LEU A 2 9.062 -7.336 -1.858 1.00 0.00 H new ATOM 0 HB3 LEU A 2 8.490 -7.447 -0.206 1.00 0.00 H new ATOM 0 HG LEU A 2 8.435 -9.601 -2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 2 9.594 -10.894 -0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 2 10.466 -9.386 -0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 2 9.466 -9.503 0.516 1.00 0.00 H new ATOM 0 HD21 LEU A 2 7.110 -10.974 -0.774 1.00 0.00 H new ATOM 0 HD22 LEU A 2 6.980 -9.582 0.328 1.00 0.00 H new ATOM 0 HD23 LEU A 2 6.207 -9.523 -1.274 1.00 0.00 H new ATOM 39 N PRO A 3 6.637 -5.200 -0.457 1.00 0.00 N ATOM 40 CA PRO A 3 6.543 -3.772 -0.243 1.00 0.00 C ATOM 41 C PRO A 3 7.921 -3.143 -0.387 1.00 0.00 C ATOM 42 O PRO A 3 8.054 -1.922 -0.349 1.00 0.00 O ATOM 43 CB PRO A 3 6.020 -3.624 1.185 1.00 0.00 C ATOM 44 CG PRO A 3 6.572 -4.870 1.877 1.00 0.00 C ATOM 45 CD PRO A 3 6.482 -5.930 0.783 1.00 0.00 C ATOM 0 HA PRO A 3 5.890 -3.277 -0.962 1.00 0.00 H new ATOM 0 HB2 PRO A 3 6.379 -2.708 1.654 1.00 0.00 H new ATOM 0 HB3 PRO A 3 4.931 -3.593 1.216 1.00 0.00 H new ATOM 0 HG2 PRO A 3 7.598 -4.724 2.216 1.00 0.00 H new ATOM 0 HG3 PRO A 3 5.983 -5.141 2.753 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.261 -6.683 0.898 1.00 0.00 H new ATOM 0 HD3 PRO A 3 5.526 -6.453 0.817 1.00 0.00 H new ATOM 53 N ARG A 4 8.947 -3.980 -0.550 1.00 0.00 N ATOM 54 CA ARG A 4 10.308 -3.504 -0.696 1.00 0.00 C ATOM 55 C ARG A 4 10.924 -4.082 -1.962 1.00 0.00 C ATOM 56 O ARG A 4 10.940 -5.296 -2.149 1.00 0.00 O ATOM 57 CB ARG A 4 11.120 -3.904 0.532 1.00 0.00 C ATOM 58 CG ARG A 4 12.312 -2.963 0.683 1.00 0.00 C ATOM 59 CD ARG A 4 11.909 -1.767 1.542 1.00 0.00 C ATOM 60 NE ARG A 4 10.454 -1.657 1.642 1.00 0.00 N ATOM 61 CZ ARG A 4 9.818 -0.480 1.714 1.00 0.00 C ATOM 62 NH1 ARG A 4 10.518 0.662 1.694 1.00 0.00 N ATOM 63 NH2 ARG A 4 8.482 -0.444 1.803 1.00 0.00 N ATOM 0 H ARG A 4 8.852 -4.995 -0.583 1.00 0.00 H new ATOM 0 HA ARG A 4 10.310 -2.417 -0.779 1.00 0.00 H new ATOM 0 HB2 ARG A 4 10.495 -3.862 1.424 1.00 0.00 H new ATOM 0 HB3 ARG A 4 11.466 -4.933 0.433 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.149 -3.489 1.143 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.648 -2.624 -0.297 1.00 0.00 H new ATOM 0 HD2 ARG A 4 12.338 -1.870 2.539 1.00 0.00 H new ATOM 0 HD3 ARG A 4 12.317 -0.852 1.112 1.00 0.00 H new ATOM 0 HE ARG A 4 9.900 -2.513 1.658 1.00 0.00 H new ATOM 0 HH11 ARG A 4 11.535 0.635 1.624 1.00 0.00 H new ATOM 0 HH12 ARG A 4 10.034 1.558 1.749 1.00 0.00 H new ATOM 0 HH21 ARG A 4 7.948 -1.313 1.816 1.00 0.00 H new ATOM 0 HH22 ARG A 4 7.998 0.452 1.858 1.00 0.00 H new ATOM 77 N LEU A 5 11.433 -3.207 -2.833 1.00 0.00 N ATOM 78 CA LEU A 5 12.049 -3.634 -4.074 1.00 0.00 C ATOM 79 C LEU A 5 13.342 -2.864 -4.301 1.00 0.00 C ATOM 80 O LEU A 5 13.388 -1.652 -4.104 1.00 0.00 O ATOM 81 CB LEU A 5 11.075 -3.405 -5.227 1.00 0.00 C ATOM 82 CG LEU A 5 10.203 -4.645 -5.408 1.00 0.00 C ATOM 83 CD1 LEU A 5 8.783 -4.219 -5.771 1.00 0.00 C ATOM 84 CD2 LEU A 5 10.776 -5.511 -6.526 1.00 0.00 C ATOM 0 H LEU A 5 11.426 -2.197 -2.693 1.00 0.00 H new ATOM 0 HA LEU A 5 12.287 -4.696 -4.020 1.00 0.00 H new ATOM 0 HB2 LEU A 5 10.451 -2.535 -5.023 1.00 0.00 H new ATOM 0 HB3 LEU A 5 11.624 -3.196 -6.145 1.00 0.00 H new ATOM 0 HG LEU A 5 10.185 -5.216 -4.480 1.00 0.00 H new ATOM 0 HD11 LEU A 5 8.160 -5.104 -5.900 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.373 -3.600 -4.973 1.00 0.00 H new ATOM 0 HD13 LEU A 5 8.800 -3.648 -6.700 1.00 0.00 H new ATOM 0 HD21 LEU A 5 10.154 -6.396 -6.656 1.00 0.00 H new ATOM 0 HD22 LEU A 5 10.794 -4.941 -7.455 1.00 0.00 H new ATOM 0 HD23 LEU A 5 11.790 -5.815 -6.267 1.00 0.00 H new ATOM 96 N CYS A 6 14.394 -3.573 -4.716 1.00 0.00 N ATOM 97 CA CYS A 6 15.681 -2.956 -4.968 1.00 0.00 C ATOM 98 C CYS A 6 16.391 -3.689 -6.098 1.00 0.00 C ATOM 99 O CYS A 6 16.049 -4.826 -6.414 1.00 0.00 O ATOM 100 CB CYS A 6 16.518 -2.989 -3.692 1.00 0.00 C ATOM 101 SG CYS A 6 15.650 -2.375 -2.228 1.00 0.00 S ATOM 0 H CYS A 6 14.371 -4.579 -4.883 1.00 0.00 H new ATOM 0 HA CYS A 6 15.539 -1.918 -5.267 1.00 0.00 H new ATOM 0 HB2 CYS A 6 16.841 -4.014 -3.508 1.00 0.00 H new ATOM 0 HB3 CYS A 6 17.418 -2.394 -3.845 1.00 0.00 H new ATOM 106 N LYS A 7 17.380 -3.033 -6.707 1.00 0.00 N ATOM 107 CA LYS A 7 18.131 -3.626 -7.797 1.00 0.00 C ATOM 108 C LYS A 7 19.223 -4.531 -7.243 1.00 0.00 C ATOM 109 O LYS A 7 20.072 -4.085 -6.474 1.00 0.00 O ATOM 110 CB LYS A 7 18.733 -2.520 -8.659 1.00 0.00 C ATOM 111 CG LYS A 7 18.166 -2.613 -10.073 1.00 0.00 C ATOM 112 CD LYS A 7 18.456 -1.317 -10.825 1.00 0.00 C ATOM 113 CE LYS A 7 17.159 -0.773 -11.418 1.00 0.00 C ATOM 114 NZ LYS A 7 17.403 -0.125 -12.716 1.00 0.00 N ATOM 0 H LYS A 7 17.675 -2.089 -6.458 1.00 0.00 H new ATOM 0 HA LYS A 7 17.466 -4.230 -8.414 1.00 0.00 H new ATOM 0 HB2 LYS A 7 18.507 -1.545 -8.228 1.00 0.00 H new ATOM 0 HB3 LYS A 7 19.819 -2.614 -8.684 1.00 0.00 H new ATOM 0 HG2 LYS A 7 18.610 -3.458 -10.599 1.00 0.00 H new ATOM 0 HG3 LYS A 7 17.091 -2.791 -10.034 1.00 0.00 H new ATOM 0 HD2 LYS A 7 18.896 -0.583 -10.150 1.00 0.00 H new ATOM 0 HD3 LYS A 7 19.183 -1.498 -11.617 1.00 0.00 H new ATOM 0 HE2 LYS A 7 16.443 -1.585 -11.542 1.00 0.00 H new ATOM 0 HE3 LYS A 7 16.712 -0.057 -10.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 16.906 0.788 -12.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 18.424 0.033 -12.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.053 -0.737 -13.481 1.00 0.00 H new ATOM 128 N PHE A 8 19.198 -5.806 -7.637 1.00 0.00 N ATOM 129 CA PHE A 8 20.182 -6.765 -7.179 1.00 0.00 C ATOM 130 C PHE A 8 20.963 -7.310 -8.366 1.00 0.00 C ATOM 131 O PHE A 8 20.693 -8.412 -8.837 1.00 0.00 O ATOM 132 CB PHE A 8 19.481 -7.893 -6.428 1.00 0.00 C ATOM 133 CG PHE A 8 20.357 -8.570 -5.401 1.00 0.00 C ATOM 134 CD1 PHE A 8 21.315 -9.507 -5.806 1.00 0.00 C ATOM 135 CD2 PHE A 8 20.213 -8.258 -4.043 1.00 0.00 C ATOM 136 CE1 PHE A 8 22.129 -10.132 -4.854 1.00 0.00 C ATOM 137 CE2 PHE A 8 21.027 -8.883 -3.092 1.00 0.00 C ATOM 138 CZ PHE A 8 21.985 -9.820 -3.497 1.00 0.00 C ATOM 0 H PHE A 8 18.501 -6.191 -8.275 1.00 0.00 H new ATOM 0 HA PHE A 8 20.883 -6.277 -6.502 1.00 0.00 H new ATOM 0 HB2 PHE A 8 18.596 -7.494 -5.932 1.00 0.00 H new ATOM 0 HB3 PHE A 8 19.136 -8.637 -7.146 1.00 0.00 H new ATOM 0 HD1 PHE A 8 21.426 -9.748 -6.853 1.00 0.00 H new ATOM 0 HD2 PHE A 8 19.474 -7.535 -3.730 1.00 0.00 H new ATOM 0 HE1 PHE A 8 22.868 -10.855 -5.166 1.00 0.00 H new ATOM 0 HE2 PHE A 8 20.916 -8.642 -2.045 1.00 0.00 H new ATOM 0 HZ PHE A 8 22.613 -10.302 -2.762 1.00 0.00 H new ATOM 148 N CYS A 9 21.936 -6.533 -8.849 1.00 0.00 N ATOM 149 CA CYS A 9 22.750 -6.940 -9.977 1.00 0.00 C ATOM 150 C CYS A 9 24.220 -6.940 -9.577 1.00 0.00 C ATOM 151 O CYS A 9 24.631 -6.162 -8.719 1.00 0.00 O ATOM 152 CB CYS A 9 22.509 -5.991 -11.147 1.00 0.00 C ATOM 153 SG CYS A 9 23.971 -5.703 -12.176 1.00 0.00 S ATOM 0 H CYS A 9 22.173 -5.617 -8.469 1.00 0.00 H new ATOM 0 HA CYS A 9 22.476 -7.949 -10.283 1.00 0.00 H new ATOM 0 HB2 CYS A 9 21.712 -6.395 -11.771 1.00 0.00 H new ATOM 0 HB3 CYS A 9 22.156 -5.035 -10.759 1.00 0.00 H new ATOM 158 N ASP A 10 25.010 -7.815 -10.202 1.00 0.00 N ATOM 159 CA ASP A 10 26.426 -7.913 -9.908 1.00 0.00 C ATOM 160 C ASP A 10 27.145 -6.676 -10.427 1.00 0.00 C ATOM 161 O ASP A 10 26.581 -5.907 -11.202 1.00 0.00 O ATOM 162 CB ASP A 10 26.991 -9.177 -10.548 1.00 0.00 C ATOM 163 CG ASP A 10 26.024 -9.744 -11.577 1.00 0.00 C ATOM 164 OD1 ASP A 10 25.088 -10.452 -11.147 1.00 0.00 O ATOM 165 OD2 ASP A 10 26.240 -9.461 -12.775 1.00 0.00 O ATOM 0 H ASP A 10 24.684 -8.465 -10.917 1.00 0.00 H new ATOM 0 HA ASP A 10 26.576 -7.971 -8.830 1.00 0.00 H new ATOM 0 HB2 ASP A 10 27.945 -8.953 -11.025 1.00 0.00 H new ATOM 0 HB3 ASP A 10 27.187 -9.923 -9.778 1.00 0.00 H new ATOM 170 N VAL A 11 28.395 -6.485 -9.996 1.00 0.00 N ATOM 171 CA VAL A 11 29.183 -5.345 -10.418 1.00 0.00 C ATOM 172 C VAL A 11 29.726 -5.585 -11.820 1.00 0.00 C ATOM 173 O VAL A 11 30.549 -6.474 -12.025 1.00 0.00 O ATOM 174 CB VAL A 11 30.322 -5.121 -9.427 1.00 0.00 C ATOM 175 CG1 VAL A 11 30.515 -6.377 -8.581 1.00 0.00 C ATOM 176 CG2 VAL A 11 31.608 -4.820 -10.191 1.00 0.00 C ATOM 0 H VAL A 11 28.876 -7.113 -9.353 1.00 0.00 H new ATOM 0 HA VAL A 11 28.558 -4.452 -10.440 1.00 0.00 H new ATOM 0 HB VAL A 11 30.079 -4.280 -8.778 1.00 0.00 H new ATOM 0 HG11 VAL A 11 31.328 -6.217 -7.873 1.00 0.00 H new ATOM 0 HG12 VAL A 11 29.596 -6.593 -8.036 1.00 0.00 H new ATOM 0 HG13 VAL A 11 30.758 -7.219 -9.229 1.00 0.00 H new ATOM 0 HG21 VAL A 11 32.422 -4.660 -9.484 1.00 0.00 H new ATOM 0 HG22 VAL A 11 31.851 -5.661 -10.840 1.00 0.00 H new ATOM 0 HG23 VAL A 11 31.471 -3.923 -10.795 1.00 0.00 H new ATOM 186 N LYS A 12 29.263 -4.787 -12.785 1.00 0.00 N ATOM 187 CA LYS A 12 29.704 -4.917 -14.159 1.00 0.00 C ATOM 188 C LYS A 12 30.165 -3.565 -14.685 1.00 0.00 C ATOM 189 O LYS A 12 29.825 -2.528 -14.120 1.00 0.00 O ATOM 190 CB LYS A 12 28.563 -5.468 -15.009 1.00 0.00 C ATOM 191 CG LYS A 12 27.236 -5.235 -14.292 1.00 0.00 C ATOM 192 CD LYS A 12 26.089 -5.355 -15.290 1.00 0.00 C ATOM 193 CE LYS A 12 25.731 -3.971 -15.823 1.00 0.00 C ATOM 194 NZ LYS A 12 26.506 -3.654 -17.032 1.00 0.00 N ATOM 0 H LYS A 12 28.581 -4.044 -12.631 1.00 0.00 H new ATOM 0 HA LYS A 12 30.545 -5.609 -14.210 1.00 0.00 H new ATOM 0 HB2 LYS A 12 28.553 -4.980 -15.983 1.00 0.00 H new ATOM 0 HB3 LYS A 12 28.710 -6.533 -15.188 1.00 0.00 H new ATOM 0 HG2 LYS A 12 27.112 -5.963 -13.490 1.00 0.00 H new ATOM 0 HG3 LYS A 12 27.229 -4.247 -13.831 1.00 0.00 H new ATOM 0 HD2 LYS A 12 26.376 -6.010 -16.113 1.00 0.00 H new ATOM 0 HD3 LYS A 12 25.221 -5.807 -14.810 1.00 0.00 H new ATOM 0 HE2 LYS A 12 24.665 -3.929 -16.049 1.00 0.00 H new ATOM 0 HE3 LYS A 12 25.924 -3.221 -15.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 26.030 -2.896 -17.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 27.460 -3.341 -16.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 26.577 -4.501 -17.631 1.00 0.00 H new ATOM 208 N ALA A 13 30.940 -3.581 -15.772 1.00 0.00 N ATOM 209 CA ALA A 13 31.444 -2.360 -16.368 1.00 0.00 C ATOM 210 C ALA A 13 30.287 -1.416 -16.667 1.00 0.00 C ATOM 211 O ALA A 13 29.458 -1.701 -17.527 1.00 0.00 O ATOM 212 CB ALA A 13 32.211 -2.697 -17.644 1.00 0.00 C ATOM 0 H ALA A 13 31.228 -4.433 -16.252 1.00 0.00 H new ATOM 0 HA ALA A 13 32.121 -1.864 -15.673 1.00 0.00 H new ATOM 0 HB1 ALA A 13 32.591 -1.779 -18.093 1.00 0.00 H new ATOM 0 HB2 ALA A 13 33.046 -3.356 -17.404 1.00 0.00 H new ATOM 0 HB3 ALA A 13 31.545 -3.197 -18.347 1.00 0.00 H new ATOM 218 N THR A 14 30.233 -0.291 -15.951 1.00 0.00 N ATOM 219 CA THR A 14 29.179 0.685 -16.146 1.00 0.00 C ATOM 220 C THR A 14 29.732 1.909 -16.863 1.00 0.00 C ATOM 221 O THR A 14 30.878 2.296 -16.645 1.00 0.00 O ATOM 222 CB THR A 14 28.590 1.071 -14.793 1.00 0.00 C ATOM 223 OG1 THR A 14 27.552 2.007 -14.983 1.00 0.00 O ATOM 224 CG2 THR A 14 29.679 1.688 -13.920 1.00 0.00 C ATOM 0 H THR A 14 30.912 -0.040 -15.232 1.00 0.00 H new ATOM 0 HA THR A 14 28.390 0.255 -16.763 1.00 0.00 H new ATOM 0 HB THR A 14 28.193 0.182 -14.303 1.00 0.00 H new ATOM 0 HG1 THR A 14 27.172 2.254 -14.114 1.00 0.00 H new ATOM 0 HG21 THR A 14 29.258 1.964 -12.953 1.00 0.00 H new ATOM 0 HG22 THR A 14 30.481 0.965 -13.773 1.00 0.00 H new ATOM 0 HG23 THR A 14 30.077 2.577 -14.409 1.00 0.00 H new ATOM 232 N THR A 15 28.910 2.519 -17.719 1.00 0.00 N ATOM 233 CA THR A 15 29.320 3.694 -18.461 1.00 0.00 C ATOM 234 C THR A 15 28.746 4.945 -17.810 1.00 0.00 C ATOM 235 O THR A 15 28.625 5.985 -18.453 1.00 0.00 O ATOM 236 CB THR A 15 28.848 3.573 -19.907 1.00 0.00 C ATOM 237 OG1 THR A 15 29.444 4.588 -20.682 1.00 0.00 O ATOM 238 CG2 THR A 15 27.330 3.717 -19.960 1.00 0.00 C ATOM 0 H THR A 15 27.956 2.212 -17.910 1.00 0.00 H new ATOM 0 HA THR A 15 30.407 3.771 -18.452 1.00 0.00 H new ATOM 0 HB THR A 15 29.134 2.599 -20.303 1.00 0.00 H new ATOM 0 HG1 THR A 15 29.397 5.439 -20.199 1.00 0.00 H new ATOM 0 HG21 THR A 15 26.992 3.631 -20.993 1.00 0.00 H new ATOM 0 HG22 THR A 15 26.869 2.932 -19.361 1.00 0.00 H new ATOM 0 HG23 THR A 15 27.043 4.691 -19.565 1.00 0.00 H new ATOM 246 N CYS A 16 28.391 4.839 -16.527 1.00 0.00 N ATOM 247 CA CYS A 16 27.832 5.956 -15.793 1.00 0.00 C ATOM 248 C CYS A 16 28.955 6.796 -15.200 1.00 0.00 C ATOM 249 O CYS A 16 29.906 6.257 -14.638 1.00 0.00 O ATOM 250 CB CYS A 16 26.911 5.434 -14.695 1.00 0.00 C ATOM 251 SG CYS A 16 25.260 6.175 -14.706 1.00 0.00 S ATOM 0 H CYS A 16 28.485 3.983 -15.981 1.00 0.00 H new ATOM 0 HA CYS A 16 27.251 6.584 -16.468 1.00 0.00 H new ATOM 0 HB2 CYS A 16 26.814 4.353 -14.800 1.00 0.00 H new ATOM 0 HB3 CYS A 16 27.375 5.620 -13.727 1.00 0.00 H new ATOM 256 N SER A 17 28.844 8.120 -15.328 1.00 0.00 N ATOM 257 CA SER A 17 29.848 9.024 -14.804 1.00 0.00 C ATOM 258 C SER A 17 29.306 9.743 -13.577 1.00 0.00 C ATOM 259 O SER A 17 28.111 9.687 -13.297 1.00 0.00 O ATOM 260 CB SER A 17 30.243 10.026 -15.886 1.00 0.00 C ATOM 261 OG SER A 17 31.179 9.432 -16.756 1.00 0.00 O ATOM 0 H SER A 17 28.063 8.583 -15.793 1.00 0.00 H new ATOM 0 HA SER A 17 30.732 8.459 -14.509 1.00 0.00 H new ATOM 0 HB2 SER A 17 29.361 10.342 -16.444 1.00 0.00 H new ATOM 0 HB3 SER A 17 30.670 10.920 -15.431 1.00 0.00 H new ATOM 0 HG SER A 17 31.432 10.074 -17.452 1.00 0.00 H new ATOM 267 N ASN A 18 30.191 10.421 -12.842 1.00 0.00 N ATOM 268 CA ASN A 18 29.799 11.146 -11.651 1.00 0.00 C ATOM 269 C ASN A 18 28.927 12.335 -12.032 1.00 0.00 C ATOM 270 O ASN A 18 29.322 13.484 -11.850 1.00 0.00 O ATOM 271 CB ASN A 18 31.046 11.609 -10.904 1.00 0.00 C ATOM 272 CG ASN A 18 31.997 12.344 -11.838 1.00 0.00 C ATOM 273 OD1 ASN A 18 32.573 11.619 -12.800 1.00 0.00 O flip ATOM 274 ND2 ASN A 18 32.208 13.546 -11.692 1.00 0.00 N flip ATOM 0 H ASN A 18 31.186 10.477 -13.060 1.00 0.00 H new ATOM 0 HA ASN A 18 29.221 10.492 -10.998 1.00 0.00 H new ATOM 0 HB2 ASN A 18 30.760 12.264 -10.081 1.00 0.00 H new ATOM 0 HB3 ASN A 18 31.553 10.749 -10.466 1.00 0.00 H new ATOM 0 HD21 ASN A 18 31.744 14.058 -10.942 1.00 0.00 H new ATOM 0 HD22 ASN A 18 32.847 14.032 -12.321 1.00 0.00 H new ATOM 281 N GLN A 19 27.732 12.053 -12.561 1.00 0.00 N ATOM 282 CA GLN A 19 26.811 13.097 -12.964 1.00 0.00 C ATOM 283 C GLN A 19 25.726 13.263 -11.910 1.00 0.00 C ATOM 284 O GLN A 19 25.425 12.328 -11.171 1.00 0.00 O ATOM 285 CB GLN A 19 26.202 12.739 -14.316 1.00 0.00 C ATOM 286 CG GLN A 19 27.168 11.848 -15.091 1.00 0.00 C ATOM 287 CD GLN A 19 27.038 12.081 -16.589 1.00 0.00 C ATOM 288 OE1 GLN A 19 27.585 13.045 -17.120 1.00 0.00 O ATOM 289 NE2 GLN A 19 26.310 11.193 -17.272 1.00 0.00 N ATOM 0 H GLN A 19 27.388 11.105 -12.716 1.00 0.00 H new ATOM 0 HA GLN A 19 27.344 14.043 -13.058 1.00 0.00 H new ATOM 0 HB2 GLN A 19 25.251 12.225 -14.174 1.00 0.00 H new ATOM 0 HB3 GLN A 19 25.992 13.646 -14.884 1.00 0.00 H new ATOM 0 HG2 GLN A 19 28.191 12.052 -14.775 1.00 0.00 H new ATOM 0 HG3 GLN A 19 26.967 10.801 -14.863 1.00 0.00 H new ATOM 0 HE21 GLN A 19 25.875 10.409 -16.786 1.00 0.00 H new ATOM 0 HE22 GLN A 19 26.189 11.299 -18.279 1.00 0.00 H new ATOM 298 N ASP A 20 25.137 14.459 -11.842 1.00 0.00 N ATOM 299 CA ASP A 20 24.090 14.742 -10.881 1.00 0.00 C ATOM 300 C ASP A 20 23.117 13.574 -10.821 1.00 0.00 C ATOM 301 O ASP A 20 22.556 13.283 -9.767 1.00 0.00 O ATOM 302 CB ASP A 20 23.370 16.028 -11.278 1.00 0.00 C ATOM 303 CG ASP A 20 23.082 16.050 -12.772 1.00 0.00 C ATOM 304 OD1 ASP A 20 22.137 15.339 -13.177 1.00 0.00 O ATOM 305 OD2 ASP A 20 23.810 16.778 -13.480 1.00 0.00 O ATOM 0 H ASP A 20 25.375 15.245 -12.448 1.00 0.00 H new ATOM 0 HA ASP A 20 24.525 14.877 -9.891 1.00 0.00 H new ATOM 0 HB2 ASP A 20 22.436 16.113 -10.722 1.00 0.00 H new ATOM 0 HB3 ASP A 20 23.981 16.890 -11.009 1.00 0.00 H new ATOM 310 N GLN A 21 22.915 12.904 -11.959 1.00 0.00 N ATOM 311 CA GLN A 21 22.009 11.775 -12.030 1.00 0.00 C ATOM 312 C GLN A 21 22.596 10.699 -12.932 1.00 0.00 C ATOM 313 O GLN A 21 22.969 10.975 -14.071 1.00 0.00 O ATOM 314 CB GLN A 21 20.656 12.243 -12.556 1.00 0.00 C ATOM 315 CG GLN A 21 19.575 11.249 -12.140 1.00 0.00 C ATOM 316 CD GLN A 21 18.851 10.691 -13.357 1.00 0.00 C ATOM 317 OE1 GLN A 21 19.317 9.736 -13.976 1.00 0.00 O ATOM 318 NE2 GLN A 21 17.710 11.292 -13.701 1.00 0.00 N ATOM 0 H GLN A 21 23.373 13.132 -12.842 1.00 0.00 H new ATOM 0 HA GLN A 21 21.870 11.351 -11.035 1.00 0.00 H new ATOM 0 HB2 GLN A 21 20.424 13.233 -12.164 1.00 0.00 H new ATOM 0 HB3 GLN A 21 20.687 12.330 -13.642 1.00 0.00 H new ATOM 0 HG2 GLN A 21 20.024 10.433 -11.574 1.00 0.00 H new ATOM 0 HG3 GLN A 21 18.860 11.739 -11.480 1.00 0.00 H new ATOM 0 HE21 GLN A 21 17.365 12.081 -13.155 1.00 0.00 H new ATOM 0 HE22 GLN A 21 17.183 10.962 -14.510 1.00 0.00 H new ATOM 327 N CYS A 22 22.676 9.468 -12.421 1.00 0.00 N ATOM 328 CA CYS A 22 23.216 8.358 -13.179 1.00 0.00 C ATOM 329 C CYS A 22 22.366 7.116 -12.947 1.00 0.00 C ATOM 330 O CYS A 22 21.549 7.081 -12.031 1.00 0.00 O ATOM 331 CB CYS A 22 24.661 8.110 -12.759 1.00 0.00 C ATOM 332 SG CYS A 22 25.848 8.194 -14.124 1.00 0.00 S ATOM 0 H CYS A 22 22.369 9.223 -11.479 1.00 0.00 H new ATOM 0 HA CYS A 22 23.198 8.595 -14.243 1.00 0.00 H new ATOM 0 HB2 CYS A 22 24.940 8.844 -12.003 1.00 0.00 H new ATOM 0 HB3 CYS A 22 24.729 7.128 -12.291 1.00 0.00 H new ATOM 337 N THR A 23 22.561 6.093 -13.783 1.00 0.00 N ATOM 338 CA THR A 23 21.813 4.858 -13.663 1.00 0.00 C ATOM 339 C THR A 23 22.745 3.722 -13.269 1.00 0.00 C ATOM 340 O THR A 23 23.958 3.821 -13.443 1.00 0.00 O ATOM 341 CB THR A 23 21.119 4.554 -14.987 1.00 0.00 C ATOM 342 OG1 THR A 23 20.371 5.676 -15.396 1.00 0.00 O ATOM 343 CG2 THR A 23 20.187 3.358 -14.811 1.00 0.00 C ATOM 0 H THR A 23 23.234 6.105 -14.549 1.00 0.00 H new ATOM 0 HA THR A 23 21.056 4.963 -12.886 1.00 0.00 H new ATOM 0 HB THR A 23 21.869 4.323 -15.744 1.00 0.00 H new ATOM 0 HG1 THR A 23 19.927 5.480 -16.247 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.691 3.141 -15.757 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.765 2.489 -14.497 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.438 3.589 -14.053 1.00 0.00 H new ATOM 351 N SER A 24 22.175 2.640 -12.736 1.00 0.00 N ATOM 352 CA SER A 24 22.956 1.491 -12.321 1.00 0.00 C ATOM 353 C SER A 24 23.267 0.616 -13.527 1.00 0.00 C ATOM 354 O SER A 24 24.218 -0.162 -13.504 1.00 0.00 O ATOM 355 CB SER A 24 22.180 0.704 -11.268 1.00 0.00 C ATOM 356 OG SER A 24 20.893 0.403 -11.760 1.00 0.00 O ATOM 0 H SER A 24 21.171 2.543 -12.584 1.00 0.00 H new ATOM 0 HA SER A 24 23.898 1.824 -11.886 1.00 0.00 H new ATOM 0 HB2 SER A 24 22.711 -0.215 -11.021 1.00 0.00 H new ATOM 0 HB3 SER A 24 22.103 1.284 -10.348 1.00 0.00 H new ATOM 0 HG SER A 24 20.904 -0.478 -12.188 1.00 0.00 H new ATOM 362 N ASN A 25 22.462 0.747 -14.584 1.00 0.00 N ATOM 363 CA ASN A 25 22.657 -0.029 -15.792 1.00 0.00 C ATOM 364 C ASN A 25 22.251 -1.476 -15.550 1.00 0.00 C ATOM 365 O ASN A 25 22.155 -2.263 -16.489 1.00 0.00 O ATOM 366 CB ASN A 25 24.120 0.057 -16.219 1.00 0.00 C ATOM 367 CG ASN A 25 24.281 -0.329 -17.683 1.00 0.00 C ATOM 368 OD1 ASN A 25 24.962 -1.303 -17.998 1.00 0.00 O ATOM 369 ND2 ASN A 25 23.653 0.436 -18.577 1.00 0.00 N ATOM 0 H ASN A 25 21.669 1.388 -14.619 1.00 0.00 H new ATOM 0 HA ASN A 25 22.033 0.373 -16.590 1.00 0.00 H new ATOM 0 HB2 ASN A 25 24.490 1.070 -16.063 1.00 0.00 H new ATOM 0 HB3 ASN A 25 24.724 -0.602 -15.596 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.726 0.223 -19.572 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.099 1.234 -18.266 1.00 0.00 H new ATOM 376 N CYS A 26 22.011 -1.824 -14.284 1.00 0.00 N ATOM 377 CA CYS A 26 21.616 -3.171 -13.923 1.00 0.00 C ATOM 378 C CYS A 26 20.145 -3.381 -14.250 1.00 0.00 C ATOM 379 O CYS A 26 19.407 -2.418 -14.449 1.00 0.00 O ATOM 380 CB CYS A 26 21.877 -3.395 -12.436 1.00 0.00 C ATOM 381 SG CYS A 26 23.628 -3.568 -12.014 1.00 0.00 S ATOM 0 H CYS A 26 22.086 -1.183 -13.495 1.00 0.00 H new ATOM 0 HA CYS A 26 22.201 -3.892 -14.494 1.00 0.00 H new ATOM 0 HB2 CYS A 26 21.459 -2.559 -11.874 1.00 0.00 H new ATOM 0 HB3 CYS A 26 21.346 -4.291 -12.115 1.00 0.00 H new ATOM 386 N ASN A 27 19.718 -4.645 -14.306 1.00 0.00 N ATOM 387 CA ASN A 27 18.339 -4.972 -14.607 1.00 0.00 C ATOM 388 C ASN A 27 17.876 -6.127 -13.731 1.00 0.00 C ATOM 389 O ASN A 27 17.543 -7.198 -14.234 1.00 0.00 O ATOM 390 CB ASN A 27 18.216 -5.333 -16.085 1.00 0.00 C ATOM 391 CG ASN A 27 19.421 -6.138 -16.550 1.00 0.00 C ATOM 392 OD1 ASN A 27 19.890 -7.024 -15.840 1.00 0.00 O ATOM 393 ND2 ASN A 27 19.920 -5.828 -17.750 1.00 0.00 N ATOM 0 H ASN A 27 20.317 -5.455 -14.145 1.00 0.00 H new ATOM 0 HA ASN A 27 17.704 -4.110 -14.400 1.00 0.00 H new ATOM 0 HB2 ASN A 27 17.305 -5.908 -16.248 1.00 0.00 H new ATOM 0 HB3 ASN A 27 18.130 -4.424 -16.680 1.00 0.00 H new ATOM 0 HD21 ASN A 27 20.726 -6.336 -18.114 1.00 0.00 H new ATOM 0 HD22 ASN A 27 19.495 -5.083 -18.302 1.00 0.00 H new ATOM 400 N ILE A 28 17.857 -5.907 -12.414 1.00 0.00 N ATOM 401 CA ILE A 28 17.434 -6.924 -11.472 1.00 0.00 C ATOM 402 C ILE A 28 16.443 -6.328 -10.482 1.00 0.00 C ATOM 403 O ILE A 28 16.568 -5.168 -10.097 1.00 0.00 O ATOM 404 CB ILE A 28 18.655 -7.483 -10.747 1.00 0.00 C ATOM 405 CG1 ILE A 28 19.615 -8.095 -11.764 1.00 0.00 C ATOM 406 CG2 ILE A 28 18.210 -8.556 -9.757 1.00 0.00 C ATOM 407 CD1 ILE A 28 19.058 -9.430 -12.250 1.00 0.00 C ATOM 0 H ILE A 28 18.133 -5.025 -11.982 1.00 0.00 H new ATOM 0 HA ILE A 28 16.941 -7.737 -12.004 1.00 0.00 H new ATOM 0 HB ILE A 28 19.159 -6.679 -10.210 1.00 0.00 H new ATOM 0 HG12 ILE A 28 19.750 -7.417 -12.607 1.00 0.00 H new ATOM 0 HG13 ILE A 28 20.596 -8.241 -11.312 1.00 0.00 H new ATOM 0 HG21 ILE A 28 19.081 -8.956 -9.238 1.00 0.00 H new ATOM 0 HG22 ILE A 28 17.524 -8.119 -9.031 1.00 0.00 H new ATOM 0 HG23 ILE A 28 17.706 -9.360 -10.294 1.00 0.00 H new ATOM 0 HD11 ILE A 28 19.743 -9.867 -12.976 1.00 0.00 H new ATOM 0 HD12 ILE A 28 18.946 -10.107 -11.403 1.00 0.00 H new ATOM 0 HD13 ILE A 28 18.087 -9.270 -12.718 1.00 0.00 H new ATOM 419 N THR A 29 15.457 -7.127 -10.068 1.00 0.00 N ATOM 420 CA THR A 29 14.454 -6.672 -9.126 1.00 0.00 C ATOM 421 C THR A 29 14.410 -7.606 -7.925 1.00 0.00 C ATOM 422 O THR A 29 13.845 -8.696 -8.001 1.00 0.00 O ATOM 423 CB THR A 29 13.096 -6.617 -9.818 1.00 0.00 C ATOM 424 OG1 THR A 29 13.248 -6.068 -11.108 1.00 0.00 O ATOM 425 CG2 THR A 29 12.144 -5.744 -9.003 1.00 0.00 C ATOM 0 H THR A 29 15.339 -8.092 -10.376 1.00 0.00 H new ATOM 0 HA THR A 29 14.709 -5.673 -8.773 1.00 0.00 H new ATOM 0 HB THR A 29 12.688 -7.625 -9.897 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.376 -6.034 -11.554 1.00 0.00 H new ATOM 0 HG21 THR A 29 11.173 -5.704 -9.497 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.026 -6.167 -8.005 1.00 0.00 H new ATOM 0 HG23 THR A 29 12.552 -4.736 -8.924 1.00 0.00 H new ATOM 433 N SER A 30 15.009 -7.176 -6.813 1.00 0.00 N ATOM 434 CA SER A 30 15.034 -7.972 -5.602 1.00 0.00 C ATOM 435 C SER A 30 14.038 -7.413 -4.595 1.00 0.00 C ATOM 436 O SER A 30 14.010 -6.209 -4.349 1.00 0.00 O ATOM 437 CB SER A 30 16.447 -7.972 -5.024 1.00 0.00 C ATOM 438 OG SER A 30 16.860 -6.644 -4.794 1.00 0.00 O ATOM 0 H SER A 30 15.483 -6.276 -6.734 1.00 0.00 H new ATOM 0 HA SER A 30 14.749 -8.999 -5.831 1.00 0.00 H new ATOM 0 HB2 SER A 30 16.471 -8.538 -4.093 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.134 -8.464 -5.713 1.00 0.00 H new ATOM 0 HG SER A 30 16.228 -6.027 -5.218 1.00 0.00 H new ATOM 444 N ILE A 31 13.222 -8.293 -4.011 1.00 0.00 N ATOM 445 CA ILE A 31 12.232 -7.889 -3.034 1.00 0.00 C ATOM 446 C ILE A 31 12.771 -8.119 -1.629 1.00 0.00 C ATOM 447 O ILE A 31 13.373 -9.155 -1.356 1.00 0.00 O ATOM 448 CB ILE A 31 10.945 -8.678 -3.257 1.00 0.00 C ATOM 449 CG1 ILE A 31 11.288 -10.127 -3.590 1.00 0.00 C ATOM 450 CG2 ILE A 31 10.163 -8.061 -4.414 1.00 0.00 C ATOM 451 CD1 ILE A 31 10.043 -10.838 -4.115 1.00 0.00 C ATOM 0 H ILE A 31 13.235 -9.294 -4.205 1.00 0.00 H new ATOM 0 HA ILE A 31 12.014 -6.827 -3.149 1.00 0.00 H new ATOM 0 HB ILE A 31 10.339 -8.647 -2.352 1.00 0.00 H new ATOM 0 HG12 ILE A 31 12.081 -10.162 -4.337 1.00 0.00 H new ATOM 0 HG13 ILE A 31 11.663 -10.636 -2.702 1.00 0.00 H new ATOM 0 HG21 ILE A 31 9.244 -8.625 -4.573 1.00 0.00 H new ATOM 0 HG22 ILE A 31 9.918 -7.026 -4.176 1.00 0.00 H new ATOM 0 HG23 ILE A 31 10.769 -8.091 -5.320 1.00 0.00 H new ATOM 0 HD11 ILE A 31 10.288 -11.873 -4.353 1.00 0.00 H new ATOM 0 HD12 ILE A 31 9.263 -10.816 -3.354 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.688 -10.334 -5.014 1.00 0.00 H new ATOM 463 N CYS A 32 12.553 -7.150 -0.737 1.00 0.00 N ATOM 464 CA CYS A 32 13.017 -7.251 0.632 1.00 0.00 C ATOM 465 C CYS A 32 11.849 -7.055 1.587 1.00 0.00 C ATOM 466 O CYS A 32 11.762 -6.032 2.264 1.00 0.00 O ATOM 467 CB CYS A 32 14.101 -6.207 0.880 1.00 0.00 C ATOM 468 SG CYS A 32 15.313 -6.073 -0.457 1.00 0.00 S ATOM 0 H CYS A 32 12.055 -6.286 -0.948 1.00 0.00 H new ATOM 0 HA CYS A 32 13.440 -8.241 0.805 1.00 0.00 H new ATOM 0 HB2 CYS A 32 13.629 -5.236 1.027 1.00 0.00 H new ATOM 0 HB3 CYS A 32 14.622 -6.452 1.806 1.00 0.00 H new ATOM 473 N GLU A 33 10.947 -8.038 1.641 1.00 0.00 N ATOM 474 CA GLU A 33 9.792 -7.966 2.513 1.00 0.00 C ATOM 475 C GLU A 33 10.230 -8.073 3.966 1.00 0.00 C ATOM 476 O GLU A 33 9.417 -7.929 4.877 1.00 0.00 O ATOM 477 CB GLU A 33 8.818 -9.087 2.158 1.00 0.00 C ATOM 478 CG GLU A 33 7.767 -9.213 3.257 1.00 0.00 C ATOM 479 CD GLU A 33 6.600 -10.075 2.795 1.00 0.00 C ATOM 480 OE1 GLU A 33 5.649 -9.489 2.233 1.00 0.00 O ATOM 481 OE2 GLU A 33 6.680 -11.303 3.013 1.00 0.00 O ATOM 0 H GLU A 33 11.002 -8.892 1.086 1.00 0.00 H new ATOM 0 HA GLU A 33 9.290 -7.008 2.378 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.337 -8.877 1.202 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.356 -10.028 2.044 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.217 -9.650 4.148 1.00 0.00 H new ATOM 0 HG3 GLU A 33 7.406 -8.223 3.536 1.00 0.00 H new ATOM 488 N LYS A 34 11.524 -8.326 4.182 1.00 0.00 N ATOM 489 CA LYS A 34 12.063 -8.451 5.521 1.00 0.00 C ATOM 490 C LYS A 34 12.214 -7.071 6.149 1.00 0.00 C ATOM 491 O LYS A 34 12.482 -6.955 7.342 1.00 0.00 O ATOM 492 CB LYS A 34 13.409 -9.167 5.462 1.00 0.00 C ATOM 493 CG LYS A 34 13.689 -9.836 6.804 1.00 0.00 C ATOM 494 CD LYS A 34 13.796 -11.347 6.608 1.00 0.00 C ATOM 495 CE LYS A 34 14.429 -11.977 7.844 1.00 0.00 C ATOM 496 NZ LYS A 34 13.981 -13.368 8.016 1.00 0.00 N ATOM 0 H LYS A 34 12.212 -8.447 3.439 1.00 0.00 H new ATOM 0 HA LYS A 34 11.381 -9.036 6.138 1.00 0.00 H new ATOM 0 HB2 LYS A 34 13.402 -9.912 4.667 1.00 0.00 H new ATOM 0 HB3 LYS A 34 14.201 -8.456 5.226 1.00 0.00 H new ATOM 0 HG2 LYS A 34 14.614 -9.448 7.230 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.891 -9.606 7.510 1.00 0.00 H new ATOM 0 HD2 LYS A 34 12.808 -11.773 6.436 1.00 0.00 H new ATOM 0 HD3 LYS A 34 14.397 -11.568 5.726 1.00 0.00 H new ATOM 0 HE2 LYS A 34 15.515 -11.950 7.755 1.00 0.00 H new ATOM 0 HE3 LYS A 34 14.167 -11.395 8.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.426 -13.774 8.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 12.947 -13.389 8.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 14.253 -13.926 7.182 1.00 0.00 H new ATOM 510 N ASN A 35 12.040 -6.025 5.338 1.00 0.00 N ATOM 511 CA ASN A 35 12.157 -4.662 5.817 1.00 0.00 C ATOM 512 C ASN A 35 13.584 -4.394 6.276 1.00 0.00 C ATOM 513 O ASN A 35 14.057 -3.262 6.214 1.00 0.00 O ATOM 514 CB ASN A 35 11.171 -4.440 6.961 1.00 0.00 C ATOM 515 CG ASN A 35 11.009 -2.956 7.257 1.00 0.00 C ATOM 516 OD1 ASN A 35 11.895 -2.338 7.843 1.00 0.00 O ATOM 517 ND2 ASN A 35 9.873 -2.385 6.849 1.00 0.00 N ATOM 0 H ASN A 35 11.817 -6.105 4.346 1.00 0.00 H new ATOM 0 HA ASN A 35 11.921 -3.968 5.010 1.00 0.00 H new ATOM 0 HB2 ASN A 35 10.204 -4.871 6.702 1.00 0.00 H new ATOM 0 HB3 ASN A 35 11.521 -4.957 7.854 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.711 -1.393 7.020 1.00 0.00 H new ATOM 0 HD22 ASN A 35 9.167 -2.941 6.366 1.00 0.00 H new ATOM 524 N ASN A 36 14.269 -5.443 6.738 1.00 0.00 N ATOM 525 CA ASN A 36 15.635 -5.316 7.202 1.00 0.00 C ATOM 526 C ASN A 36 16.589 -5.306 6.016 1.00 0.00 C ATOM 527 O ASN A 36 17.774 -5.594 6.164 1.00 0.00 O ATOM 528 CB ASN A 36 15.959 -6.471 8.146 1.00 0.00 C ATOM 529 CG ASN A 36 17.046 -6.077 9.136 1.00 0.00 C ATOM 530 OD1 ASN A 36 16.886 -5.115 9.885 1.00 0.00 O ATOM 531 ND2 ASN A 36 18.153 -6.823 9.139 1.00 0.00 N ATOM 0 H ASN A 36 13.891 -6.388 6.797 1.00 0.00 H new ATOM 0 HA ASN A 36 15.752 -4.376 7.742 1.00 0.00 H new ATOM 0 HB2 ASN A 36 15.060 -6.767 8.686 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.284 -7.337 7.569 1.00 0.00 H new ATOM 0 HD21 ASN A 36 18.914 -6.604 9.783 1.00 0.00 H new ATOM 0 HD22 ASN A 36 18.238 -7.612 8.498 1.00 0.00 H new ATOM 538 N GLU A 37 16.066 -4.972 4.834 1.00 0.00 N ATOM 539 CA GLU A 37 16.872 -4.924 3.630 1.00 0.00 C ATOM 540 C GLU A 37 16.514 -3.691 2.814 1.00 0.00 C ATOM 541 O GLU A 37 15.349 -3.476 2.485 1.00 0.00 O ATOM 542 CB GLU A 37 16.644 -6.196 2.817 1.00 0.00 C ATOM 543 CG GLU A 37 17.923 -7.027 2.805 1.00 0.00 C ATOM 544 CD GLU A 37 17.606 -8.513 2.878 1.00 0.00 C ATOM 545 OE1 GLU A 37 16.848 -8.977 1.998 1.00 0.00 O ATOM 546 OE2 GLU A 37 18.126 -9.160 3.813 1.00 0.00 O ATOM 0 H GLU A 37 15.085 -4.732 4.693 1.00 0.00 H new ATOM 0 HA GLU A 37 17.927 -4.861 3.897 1.00 0.00 H new ATOM 0 HB2 GLU A 37 15.826 -6.774 3.247 1.00 0.00 H new ATOM 0 HB3 GLU A 37 16.353 -5.942 1.798 1.00 0.00 H new ATOM 0 HG2 GLU A 37 18.490 -6.816 1.898 1.00 0.00 H new ATOM 0 HG3 GLU A 37 18.553 -6.744 3.648 1.00 0.00 H new ATOM 553 N VAL A 38 17.522 -2.879 2.486 1.00 0.00 N ATOM 554 CA VAL A 38 17.312 -1.674 1.711 1.00 0.00 C ATOM 555 C VAL A 38 18.049 -1.780 0.382 1.00 0.00 C ATOM 556 O VAL A 38 18.846 -2.694 0.185 1.00 0.00 O ATOM 557 CB VAL A 38 17.801 -0.467 2.505 1.00 0.00 C ATOM 558 CG1 VAL A 38 17.024 0.775 2.077 1.00 0.00 C ATOM 559 CG2 VAL A 38 17.582 -0.716 3.994 1.00 0.00 C ATOM 0 H VAL A 38 18.493 -3.044 2.751 1.00 0.00 H new ATOM 0 HA VAL A 38 16.249 -1.550 1.506 1.00 0.00 H new ATOM 0 HB VAL A 38 18.863 -0.313 2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 38 17.374 1.637 2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 38 17.181 0.953 1.013 1.00 0.00 H new ATOM 0 HG13 VAL A 38 15.961 0.623 2.267 1.00 0.00 H new ATOM 0 HG21 VAL A 38 17.931 0.146 4.562 1.00 0.00 H new ATOM 0 HG22 VAL A 38 16.520 -0.870 4.185 1.00 0.00 H new ATOM 0 HG23 VAL A 38 18.138 -1.602 4.300 1.00 0.00 H new ATOM 569 N CYS A 39 17.779 -0.842 -0.528 1.00 0.00 N ATOM 570 CA CYS A 39 18.416 -0.835 -1.830 1.00 0.00 C ATOM 571 C CYS A 39 19.713 -0.043 -1.764 1.00 0.00 C ATOM 572 O CYS A 39 19.711 1.126 -1.385 1.00 0.00 O ATOM 573 CB CYS A 39 17.464 -0.229 -2.858 1.00 0.00 C ATOM 574 SG CYS A 39 15.713 -0.507 -2.493 1.00 0.00 S ATOM 0 H CYS A 39 17.120 -0.078 -0.379 1.00 0.00 H new ATOM 0 HA CYS A 39 18.651 -1.856 -2.130 1.00 0.00 H new ATOM 0 HB2 CYS A 39 17.646 0.844 -2.919 1.00 0.00 H new ATOM 0 HB3 CYS A 39 17.691 -0.647 -3.839 1.00 0.00 H new ATOM 579 N ALA A 40 20.825 -0.683 -2.134 1.00 0.00 N ATOM 580 CA ALA A 40 22.122 -0.037 -2.112 1.00 0.00 C ATOM 581 C ALA A 40 22.793 -0.184 -3.471 1.00 0.00 C ATOM 582 O ALA A 40 22.854 -1.281 -4.020 1.00 0.00 O ATOM 583 CB ALA A 40 22.982 -0.658 -1.016 1.00 0.00 C ATOM 0 H ALA A 40 20.844 -1.652 -2.452 1.00 0.00 H new ATOM 0 HA ALA A 40 22.000 1.025 -1.900 1.00 0.00 H new ATOM 0 HB1 ALA A 40 23.957 -0.172 -1.000 1.00 0.00 H new ATOM 0 HB2 ALA A 40 22.494 -0.524 -0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 40 23.110 -1.722 -1.213 1.00 0.00 H new ATOM 589 N ALA A 41 23.296 0.928 -4.012 1.00 0.00 N ATOM 590 CA ALA A 41 23.957 0.919 -5.302 1.00 0.00 C ATOM 591 C ALA A 41 25.296 1.635 -5.200 1.00 0.00 C ATOM 592 O ALA A 41 25.341 2.841 -4.966 1.00 0.00 O ATOM 593 CB ALA A 41 23.061 1.592 -6.337 1.00 0.00 C ATOM 0 H ALA A 41 23.254 1.845 -3.568 1.00 0.00 H new ATOM 0 HA ALA A 41 24.140 -0.109 -5.614 1.00 0.00 H new ATOM 0 HB1 ALA A 41 23.558 1.586 -7.307 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.118 1.051 -6.409 1.00 0.00 H new ATOM 0 HB3 ALA A 41 22.867 2.621 -6.036 1.00 0.00 H new ATOM 599 N VAL A 42 26.389 0.889 -5.376 1.00 0.00 N ATOM 600 CA VAL A 42 27.721 1.454 -5.303 1.00 0.00 C ATOM 601 C VAL A 42 28.356 1.456 -6.687 1.00 0.00 C ATOM 602 O VAL A 42 28.540 0.401 -7.290 1.00 0.00 O ATOM 603 CB VAL A 42 28.564 0.644 -4.323 1.00 0.00 C ATOM 604 CG1 VAL A 42 28.285 -0.844 -4.520 1.00 0.00 C ATOM 605 CG2 VAL A 42 30.044 0.921 -4.573 1.00 0.00 C ATOM 0 H VAL A 42 26.368 -0.112 -5.571 1.00 0.00 H new ATOM 0 HA VAL A 42 27.665 2.483 -4.948 1.00 0.00 H new ATOM 0 HB VAL A 42 28.308 0.930 -3.303 1.00 0.00 H new ATOM 0 HG11 VAL A 42 28.887 -1.423 -3.820 1.00 0.00 H new ATOM 0 HG12 VAL A 42 27.228 -1.043 -4.341 1.00 0.00 H new ATOM 0 HG13 VAL A 42 28.540 -1.130 -5.540 1.00 0.00 H new ATOM 0 HG21 VAL A 42 30.646 0.342 -3.873 1.00 0.00 H new ATOM 0 HG22 VAL A 42 30.300 0.636 -5.593 1.00 0.00 H new ATOM 0 HG23 VAL A 42 30.244 1.983 -4.432 1.00 0.00 H new ATOM 615 N TRP A 43 28.693 2.647 -7.189 1.00 0.00 N ATOM 616 CA TRP A 43 29.306 2.775 -8.496 1.00 0.00 C ATOM 617 C TRP A 43 30.766 3.177 -8.346 1.00 0.00 C ATOM 618 O TRP A 43 31.071 4.223 -7.778 1.00 0.00 O ATOM 619 CB TRP A 43 28.541 3.811 -9.316 1.00 0.00 C ATOM 620 CG TRP A 43 29.260 4.309 -10.528 1.00 0.00 C ATOM 621 CD1 TRP A 43 29.082 3.847 -11.785 1.00 0.00 C ATOM 622 CD2 TRP A 43 30.271 5.359 -10.628 1.00 0.00 C ATOM 623 NE1 TRP A 43 29.908 4.534 -12.650 1.00 0.00 N ATOM 624 CE2 TRP A 43 30.665 5.479 -11.988 1.00 0.00 C ATOM 625 CE3 TRP A 43 30.895 6.219 -9.709 1.00 0.00 C ATOM 626 CZ2 TRP A 43 31.624 6.402 -12.413 1.00 0.00 C ATOM 627 CZ3 TRP A 43 31.859 7.149 -10.124 1.00 0.00 C ATOM 628 CH2 TRP A 43 32.225 7.243 -11.472 1.00 0.00 C ATOM 0 H TRP A 43 28.548 3.532 -6.703 1.00 0.00 H new ATOM 0 HA TRP A 43 29.266 1.817 -9.015 1.00 0.00 H new ATOM 0 HB2 TRP A 43 27.591 3.377 -9.628 1.00 0.00 H new ATOM 0 HB3 TRP A 43 28.308 4.661 -8.675 1.00 0.00 H new ATOM 0 HD1 TRP A 43 28.398 3.061 -12.069 1.00 0.00 H new ATOM 0 HE1 TRP A 43 29.954 4.364 -13.655 1.00 0.00 H new ATOM 0 HE3 TRP A 43 30.627 6.163 -8.664 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 31.898 6.465 -13.456 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 32.323 7.799 -9.397 1.00 0.00 H new ATOM 0 HH2 TRP A 43 32.968 7.962 -11.783 1.00 0.00 H new ATOM 639 N ARG A 44 31.671 2.340 -8.860 1.00 0.00 N ATOM 640 CA ARG A 44 33.092 2.609 -8.780 1.00 0.00 C ATOM 641 C ARG A 44 33.638 2.914 -10.168 1.00 0.00 C ATOM 642 O ARG A 44 33.076 2.474 -11.169 1.00 0.00 O ATOM 643 CB ARG A 44 33.805 1.403 -8.174 1.00 0.00 C ATOM 644 CG ARG A 44 32.799 0.554 -7.401 1.00 0.00 C ATOM 645 CD ARG A 44 33.437 -0.781 -7.031 1.00 0.00 C ATOM 646 NE ARG A 44 34.485 -1.145 -7.986 1.00 0.00 N ATOM 647 CZ ARG A 44 34.610 -2.379 -8.492 1.00 0.00 C ATOM 648 NH1 ARG A 44 33.753 -3.342 -8.127 1.00 0.00 N ATOM 649 NH2 ARG A 44 35.592 -2.651 -9.363 1.00 0.00 N ATOM 0 H ARG A 44 31.434 1.469 -9.336 1.00 0.00 H new ATOM 0 HA ARG A 44 33.266 3.476 -8.143 1.00 0.00 H new ATOM 0 HB2 ARG A 44 34.270 0.809 -8.961 1.00 0.00 H new ATOM 0 HB3 ARG A 44 34.604 1.735 -7.510 1.00 0.00 H new ATOM 0 HG2 ARG A 44 32.480 1.079 -6.500 1.00 0.00 H new ATOM 0 HG3 ARG A 44 31.907 0.388 -8.005 1.00 0.00 H new ATOM 0 HD2 ARG A 44 33.859 -0.721 -6.028 1.00 0.00 H new ATOM 0 HD3 ARG A 44 32.674 -1.559 -7.009 1.00 0.00 H new ATOM 0 HE ARG A 44 35.149 -0.428 -8.279 1.00 0.00 H new ATOM 0 HH11 ARG A 44 33.006 -3.135 -7.464 1.00 0.00 H new ATOM 0 HH12 ARG A 44 33.848 -4.282 -8.512 1.00 0.00 H new ATOM 0 HH21 ARG A 44 36.245 -1.918 -9.641 1.00 0.00 H new ATOM 0 HH22 ARG A 44 35.687 -3.591 -9.748 1.00 0.00 H new ATOM 663 N ARG A 45 34.735 3.672 -10.226 1.00 0.00 N ATOM 664 CA ARG A 45 35.349 4.034 -11.488 1.00 0.00 C ATOM 665 C ARG A 45 36.864 4.015 -11.348 1.00 0.00 C ATOM 666 O ARG A 45 37.442 4.887 -10.703 1.00 0.00 O ATOM 667 CB ARG A 45 34.863 5.417 -11.911 1.00 0.00 C ATOM 668 CG ARG A 45 34.940 6.369 -10.721 1.00 0.00 C ATOM 669 CD ARG A 45 35.217 7.785 -11.220 1.00 0.00 C ATOM 670 NE ARG A 45 36.653 8.013 -11.379 1.00 0.00 N ATOM 671 CZ ARG A 45 37.152 9.055 -12.057 1.00 0.00 C ATOM 672 NH1 ARG A 45 36.324 9.945 -12.623 1.00 0.00 N ATOM 673 NH2 ARG A 45 38.478 9.210 -12.169 1.00 0.00 N ATOM 0 H ARG A 45 35.212 4.044 -9.405 1.00 0.00 H new ATOM 0 HA ARG A 45 35.065 3.313 -12.255 1.00 0.00 H new ATOM 0 HB2 ARG A 45 35.474 5.794 -12.732 1.00 0.00 H new ATOM 0 HB3 ARG A 45 33.838 5.358 -12.277 1.00 0.00 H new ATOM 0 HG2 ARG A 45 34.005 6.345 -10.162 1.00 0.00 H new ATOM 0 HG3 ARG A 45 35.728 6.052 -10.038 1.00 0.00 H new ATOM 0 HD2 ARG A 45 34.712 7.944 -12.173 1.00 0.00 H new ATOM 0 HD3 ARG A 45 34.806 8.509 -10.517 1.00 0.00 H new ATOM 0 HE ARG A 45 37.302 7.350 -10.955 1.00 0.00 H new ATOM 0 HH11 ARG A 45 35.314 9.829 -12.537 1.00 0.00 H new ATOM 0 HH12 ARG A 45 36.704 10.738 -13.139 1.00 0.00 H new ATOM 0 HH21 ARG A 45 39.109 8.534 -11.738 1.00 0.00 H new ATOM 0 HH22 ARG A 45 38.857 10.004 -12.686 1.00 0.00 H new ATOM 687 N ASN A 46 37.508 3.015 -11.955 1.00 0.00 N ATOM 688 CA ASN A 46 38.950 2.890 -11.896 1.00 0.00 C ATOM 689 C ASN A 46 39.554 3.176 -13.265 1.00 0.00 C ATOM 690 O ASN A 46 39.128 2.606 -14.266 1.00 0.00 O ATOM 691 CB ASN A 46 39.318 1.485 -11.427 1.00 0.00 C ATOM 692 CG ASN A 46 38.630 0.430 -12.281 1.00 0.00 C ATOM 693 OD1 ASN A 46 39.055 0.161 -13.402 1.00 0.00 O ATOM 694 ND2 ASN A 46 37.564 -0.171 -11.746 1.00 0.00 N ATOM 0 H ASN A 46 37.044 2.283 -12.492 1.00 0.00 H new ATOM 0 HA ASN A 46 39.351 3.615 -11.187 1.00 0.00 H new ATOM 0 HB2 ASN A 46 40.399 1.352 -11.478 1.00 0.00 H new ATOM 0 HB3 ASN A 46 39.030 1.358 -10.383 1.00 0.00 H new ATOM 0 HD21 ASN A 46 37.065 -0.888 -12.273 1.00 0.00 H new ATOM 0 HD22 ASN A 46 37.249 0.087 -10.811 1.00 0.00 H new ATOM 701 N ASP A 47 40.549 4.065 -13.303 1.00 0.00 N ATOM 702 CA ASP A 47 41.206 4.423 -14.544 1.00 0.00 C ATOM 703 C ASP A 47 40.167 4.603 -15.642 1.00 0.00 C ATOM 704 O ASP A 47 39.542 5.655 -15.742 1.00 0.00 O ATOM 705 CB ASP A 47 42.209 3.337 -14.920 1.00 0.00 C ATOM 706 CG ASP A 47 43.436 3.395 -14.022 1.00 0.00 C ATOM 707 OD1 ASP A 47 44.343 4.190 -14.350 1.00 0.00 O ATOM 708 OD2 ASP A 47 43.444 2.643 -13.022 1.00 0.00 O ATOM 0 H ASP A 47 40.912 4.547 -12.481 1.00 0.00 H new ATOM 0 HA ASP A 47 41.741 5.364 -14.419 1.00 0.00 H new ATOM 0 HB2 ASP A 47 41.738 2.357 -14.836 1.00 0.00 H new ATOM 0 HB3 ASP A 47 42.509 3.459 -15.961 1.00 0.00 H new ATOM 713 N GLU A 48 39.985 3.570 -16.469 1.00 0.00 N ATOM 714 CA GLU A 48 39.024 3.621 -17.551 1.00 0.00 C ATOM 715 C GLU A 48 38.057 2.451 -17.445 1.00 0.00 C ATOM 716 O GLU A 48 37.419 2.075 -18.426 1.00 0.00 O ATOM 717 CB GLU A 48 39.762 3.592 -18.886 1.00 0.00 C ATOM 718 CG GLU A 48 40.714 4.782 -18.967 1.00 0.00 C ATOM 719 CD GLU A 48 41.124 5.053 -20.407 1.00 0.00 C ATOM 720 OE1 GLU A 48 41.826 4.185 -20.970 1.00 0.00 O ATOM 721 OE2 GLU A 48 40.728 6.123 -20.919 1.00 0.00 O ATOM 0 H GLU A 48 40.497 2.690 -16.402 1.00 0.00 H new ATOM 0 HA GLU A 48 38.449 4.545 -17.486 1.00 0.00 H new ATOM 0 HB2 GLU A 48 40.318 2.660 -18.986 1.00 0.00 H new ATOM 0 HB3 GLU A 48 39.048 3.627 -19.709 1.00 0.00 H new ATOM 0 HG2 GLU A 48 40.233 5.666 -18.549 1.00 0.00 H new ATOM 0 HG3 GLU A 48 41.600 4.586 -18.363 1.00 0.00 H new ATOM 728 N ASN A 49 37.950 1.872 -16.245 1.00 0.00 N ATOM 729 CA ASN A 49 37.062 0.750 -16.016 1.00 0.00 C ATOM 730 C ASN A 49 36.118 1.062 -14.863 1.00 0.00 C ATOM 731 O ASN A 49 36.483 0.911 -13.699 1.00 0.00 O ATOM 732 CB ASN A 49 37.889 -0.497 -15.715 1.00 0.00 C ATOM 733 CG ASN A 49 37.767 -1.514 -16.840 1.00 0.00 C ATOM 734 OD1 ASN A 49 36.661 -1.856 -17.253 1.00 0.00 O ATOM 735 ND2 ASN A 49 38.908 -1.997 -17.337 1.00 0.00 N ATOM 0 H ASN A 49 38.473 2.170 -15.421 1.00 0.00 H new ATOM 0 HA ASN A 49 36.463 0.568 -16.908 1.00 0.00 H new ATOM 0 HB2 ASN A 49 38.935 -0.221 -15.581 1.00 0.00 H new ATOM 0 HB3 ASN A 49 37.554 -0.943 -14.778 1.00 0.00 H new ATOM 0 HD21 ASN A 49 38.886 -2.681 -18.093 1.00 0.00 H new ATOM 0 HD22 ASN A 49 39.802 -1.682 -16.961 1.00 0.00 H new ATOM 742 N VAL A 50 34.900 1.499 -15.191 1.00 0.00 N ATOM 743 CA VAL A 50 33.911 1.830 -14.187 1.00 0.00 C ATOM 744 C VAL A 50 32.959 0.658 -13.997 1.00 0.00 C ATOM 745 O VAL A 50 32.446 0.107 -14.968 1.00 0.00 O ATOM 746 CB VAL A 50 33.149 3.081 -14.617 1.00 0.00 C ATOM 747 CG1 VAL A 50 32.014 3.349 -13.633 1.00 0.00 C ATOM 748 CG2 VAL A 50 34.100 4.274 -14.634 1.00 0.00 C ATOM 0 H VAL A 50 34.583 1.629 -16.152 1.00 0.00 H new ATOM 0 HA VAL A 50 34.405 2.030 -13.236 1.00 0.00 H new ATOM 0 HB VAL A 50 32.736 2.931 -15.615 1.00 0.00 H new ATOM 0 HG11 VAL A 50 31.470 4.242 -13.940 1.00 0.00 H new ATOM 0 HG12 VAL A 50 31.335 2.497 -13.620 1.00 0.00 H new ATOM 0 HG13 VAL A 50 32.426 3.500 -12.635 1.00 0.00 H new ATOM 0 HG21 VAL A 50 33.557 5.168 -14.941 1.00 0.00 H new ATOM 0 HG22 VAL A 50 34.513 4.425 -13.636 1.00 0.00 H new ATOM 0 HG23 VAL A 50 34.911 4.083 -15.337 1.00 0.00 H new ATOM 758 N THR A 51 32.724 0.276 -12.739 1.00 0.00 N ATOM 759 CA THR A 51 31.836 -0.827 -12.431 1.00 0.00 C ATOM 760 C THR A 51 30.781 -0.380 -11.430 1.00 0.00 C ATOM 761 O THR A 51 31.079 0.362 -10.496 1.00 0.00 O ATOM 762 CB THR A 51 32.648 -1.993 -11.876 1.00 0.00 C ATOM 763 OG1 THR A 51 32.733 -1.880 -10.473 1.00 0.00 O ATOM 764 CG2 THR A 51 34.052 -1.966 -12.475 1.00 0.00 C ATOM 0 H THR A 51 33.142 0.721 -11.922 1.00 0.00 H new ATOM 0 HA THR A 51 31.329 -1.153 -13.339 1.00 0.00 H new ATOM 0 HB THR A 51 32.160 -2.932 -12.136 1.00 0.00 H new ATOM 0 HG1 THR A 51 33.144 -1.022 -10.238 1.00 0.00 H new ATOM 0 HG21 THR A 51 34.633 -2.799 -12.079 1.00 0.00 H new ATOM 0 HG22 THR A 51 33.987 -2.053 -13.560 1.00 0.00 H new ATOM 0 HG23 THR A 51 34.541 -1.027 -12.215 1.00 0.00 H new ATOM 772 N LEU A 52 29.541 -0.834 -11.627 1.00 0.00 N ATOM 773 CA LEU A 52 28.448 -0.481 -10.743 1.00 0.00 C ATOM 774 C LEU A 52 27.807 -1.744 -10.185 1.00 0.00 C ATOM 775 O LEU A 52 27.529 -2.684 -10.926 1.00 0.00 O ATOM 776 CB LEU A 52 27.422 0.350 -11.510 1.00 0.00 C ATOM 777 CG LEU A 52 26.586 1.160 -10.525 1.00 0.00 C ATOM 778 CD1 LEU A 52 25.987 2.369 -11.239 1.00 0.00 C ATOM 779 CD2 LEU A 52 25.461 0.287 -9.974 1.00 0.00 C ATOM 0 H LEU A 52 29.277 -1.449 -12.397 1.00 0.00 H new ATOM 0 HA LEU A 52 28.827 0.110 -9.909 1.00 0.00 H new ATOM 0 HB2 LEU A 52 27.927 1.017 -12.209 1.00 0.00 H new ATOM 0 HB3 LEU A 52 26.778 -0.302 -12.100 1.00 0.00 H new ATOM 0 HG LEU A 52 27.219 1.499 -9.705 1.00 0.00 H new ATOM 0 HD11 LEU A 52 25.389 2.948 -10.535 1.00 0.00 H new ATOM 0 HD12 LEU A 52 26.789 2.993 -11.633 1.00 0.00 H new ATOM 0 HD13 LEU A 52 25.354 2.030 -12.059 1.00 0.00 H new ATOM 0 HD21 LEU A 52 24.863 0.866 -9.270 1.00 0.00 H new ATOM 0 HD22 LEU A 52 24.828 -0.052 -10.794 1.00 0.00 H new ATOM 0 HD23 LEU A 52 25.887 -0.577 -9.464 1.00 0.00 H new ATOM 791 N GLU A 53 27.574 -1.764 -8.870 1.00 0.00 N ATOM 792 CA GLU A 53 26.968 -2.910 -8.221 1.00 0.00 C ATOM 793 C GLU A 53 25.667 -2.496 -7.546 1.00 0.00 C ATOM 794 O GLU A 53 25.582 -1.420 -6.960 1.00 0.00 O ATOM 795 CB GLU A 53 27.944 -3.492 -7.203 1.00 0.00 C ATOM 796 CG GLU A 53 27.671 -4.982 -7.031 1.00 0.00 C ATOM 797 CD GLU A 53 28.473 -5.551 -5.868 1.00 0.00 C ATOM 798 OE1 GLU A 53 28.851 -4.744 -4.992 1.00 0.00 O ATOM 799 OE2 GLU A 53 28.691 -6.782 -5.877 1.00 0.00 O ATOM 0 H GLU A 53 27.799 -0.994 -8.240 1.00 0.00 H new ATOM 0 HA GLU A 53 26.740 -3.674 -8.964 1.00 0.00 H new ATOM 0 HB2 GLU A 53 28.970 -3.336 -7.536 1.00 0.00 H new ATOM 0 HB3 GLU A 53 27.838 -2.979 -6.247 1.00 0.00 H new ATOM 0 HG2 GLU A 53 26.607 -5.143 -6.858 1.00 0.00 H new ATOM 0 HG3 GLU A 53 27.928 -5.511 -7.949 1.00 0.00 H new ATOM 806 N THR A 54 24.652 -3.358 -7.630 1.00 0.00 N ATOM 807 CA THR A 54 23.364 -3.079 -7.027 1.00 0.00 C ATOM 808 C THR A 54 22.852 -4.315 -6.301 1.00 0.00 C ATOM 809 O THR A 54 22.853 -5.411 -6.857 1.00 0.00 O ATOM 810 CB THR A 54 22.381 -2.641 -8.108 1.00 0.00 C ATOM 811 OG1 THR A 54 22.525 -3.472 -9.238 1.00 0.00 O ATOM 812 CG2 THR A 54 22.666 -1.194 -8.501 1.00 0.00 C ATOM 0 H THR A 54 24.706 -4.255 -8.113 1.00 0.00 H new ATOM 0 HA THR A 54 23.467 -2.274 -6.300 1.00 0.00 H new ATOM 0 HB THR A 54 21.363 -2.719 -7.726 1.00 0.00 H new ATOM 0 HG1 THR A 54 23.001 -2.986 -9.943 1.00 0.00 H new ATOM 0 HG21 THR A 54 21.963 -0.882 -9.273 1.00 0.00 H new ATOM 0 HG22 THR A 54 22.555 -0.551 -7.628 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.684 -1.114 -8.883 1.00 0.00 H new ATOM 820 N ILE A 55 22.414 -4.133 -5.053 1.00 0.00 N ATOM 821 CA ILE A 55 21.899 -5.229 -4.255 1.00 0.00 C ATOM 822 C ILE A 55 21.203 -4.681 -3.017 1.00 0.00 C ATOM 823 O ILE A 55 21.442 -3.542 -2.621 1.00 0.00 O ATOM 824 CB ILE A 55 23.047 -6.157 -3.865 1.00 0.00 C ATOM 825 CG1 ILE A 55 24.340 -5.352 -3.764 1.00 0.00 C ATOM 826 CG2 ILE A 55 23.204 -7.243 -4.926 1.00 0.00 C ATOM 827 CD1 ILE A 55 24.143 -4.192 -2.792 1.00 0.00 C ATOM 0 H ILE A 55 22.409 -3.230 -4.579 1.00 0.00 H new ATOM 0 HA ILE A 55 21.172 -5.797 -4.835 1.00 0.00 H new ATOM 0 HB ILE A 55 22.831 -6.619 -2.901 1.00 0.00 H new ATOM 0 HG12 ILE A 55 25.154 -5.992 -3.423 1.00 0.00 H new ATOM 0 HG13 ILE A 55 24.623 -4.973 -4.746 1.00 0.00 H new ATOM 0 HG21 ILE A 55 24.023 -7.906 -4.649 1.00 0.00 H new ATOM 0 HG22 ILE A 55 22.280 -7.817 -4.998 1.00 0.00 H new ATOM 0 HG23 ILE A 55 23.421 -6.782 -5.890 1.00 0.00 H new ATOM 0 HD11 ILE A 55 25.066 -3.617 -2.720 1.00 0.00 H new ATOM 0 HD12 ILE A 55 23.341 -3.547 -3.152 1.00 0.00 H new ATOM 0 HD13 ILE A 55 23.881 -4.582 -1.809 1.00 0.00 H new ATOM 839 N CYS A 56 20.340 -5.496 -2.405 1.00 0.00 N ATOM 840 CA CYS A 56 19.615 -5.090 -1.218 1.00 0.00 C ATOM 841 C CYS A 56 20.546 -5.110 -0.015 1.00 0.00 C ATOM 842 O CYS A 56 20.538 -6.059 0.766 1.00 0.00 O ATOM 843 CB CYS A 56 18.431 -6.027 -1.001 1.00 0.00 C ATOM 844 SG CYS A 56 16.903 -5.184 -0.522 1.00 0.00 S ATOM 0 H CYS A 56 20.132 -6.443 -2.721 1.00 0.00 H new ATOM 0 HA CYS A 56 19.239 -4.075 -1.345 1.00 0.00 H new ATOM 0 HB2 CYS A 56 18.252 -6.588 -1.918 1.00 0.00 H new ATOM 0 HB3 CYS A 56 18.691 -6.752 -0.230 1.00 0.00 H new ATOM 849 N HIS A 57 21.352 -4.056 0.135 1.00 0.00 N ATOM 850 CA HIS A 57 22.284 -3.962 1.241 1.00 0.00 C ATOM 851 C HIS A 57 21.764 -2.976 2.278 1.00 0.00 C ATOM 852 O HIS A 57 21.130 -1.983 1.931 1.00 0.00 O ATOM 853 CB HIS A 57 23.650 -3.523 0.718 1.00 0.00 C ATOM 854 CG HIS A 57 24.572 -3.068 1.815 1.00 0.00 C ATOM 855 ND1 HIS A 57 25.434 -3.866 2.533 1.00 0.00 N ATOM 856 CD2 HIS A 57 24.707 -1.787 2.277 1.00 0.00 C ATOM 857 CE1 HIS A 57 26.073 -3.074 3.412 1.00 0.00 C ATOM 858 NE2 HIS A 57 25.665 -1.799 3.295 1.00 0.00 N ATOM 0 H HIS A 57 21.371 -3.259 -0.501 1.00 0.00 H new ATOM 0 HA HIS A 57 22.385 -4.937 1.717 1.00 0.00 H new ATOM 0 HB2 HIS A 57 24.112 -4.351 0.181 1.00 0.00 H new ATOM 0 HB3 HIS A 57 23.517 -2.713 0.001 1.00 0.00 H new ATOM 0 HD2 HIS A 57 24.169 -0.921 1.919 1.00 0.00 H new ATOM 0 HE1 HIS A 57 26.815 -3.417 4.118 1.00 0.00 H new ATOM 0 HE2 HIS A 57 25.989 -1.000 3.840 1.00 0.00 H new ATOM 866 N ASP A 58 22.032 -3.256 3.555 1.00 0.00 N ATOM 867 CA ASP A 58 21.590 -2.397 4.636 1.00 0.00 C ATOM 868 C ASP A 58 22.538 -1.214 4.773 1.00 0.00 C ATOM 869 O ASP A 58 23.754 -1.390 4.785 1.00 0.00 O ATOM 870 CB ASP A 58 21.533 -3.200 5.932 1.00 0.00 C ATOM 871 CG ASP A 58 20.102 -3.322 6.433 1.00 0.00 C ATOM 872 OD1 ASP A 58 19.299 -2.431 6.081 1.00 0.00 O ATOM 873 OD2 ASP A 58 19.837 -4.305 7.159 1.00 0.00 O ATOM 0 H ASP A 58 22.556 -4.077 3.859 1.00 0.00 H new ATOM 0 HA ASP A 58 20.593 -2.014 4.419 1.00 0.00 H new ATOM 0 HB2 ASP A 58 21.951 -4.193 5.768 1.00 0.00 H new ATOM 0 HB3 ASP A 58 22.148 -2.717 6.691 1.00 0.00 H new ATOM 878 N PRO A 59 21.978 -0.006 4.879 1.00 0.00 N ATOM 879 CA PRO A 59 22.721 1.227 5.020 1.00 0.00 C ATOM 880 C PRO A 59 23.321 1.306 6.416 1.00 0.00 C ATOM 881 O PRO A 59 23.714 2.380 6.864 1.00 0.00 O ATOM 882 CB PRO A 59 21.688 2.332 4.805 1.00 0.00 C ATOM 883 CG PRO A 59 20.396 1.690 5.308 1.00 0.00 C ATOM 884 CD PRO A 59 20.552 0.235 4.870 1.00 0.00 C ATOM 0 HA PRO A 59 23.548 1.307 4.314 1.00 0.00 H new ATOM 0 HB2 PRO A 59 21.937 3.233 5.366 1.00 0.00 H new ATOM 0 HB3 PRO A 59 21.615 2.619 3.756 1.00 0.00 H new ATOM 0 HG2 PRO A 59 20.294 1.779 6.390 1.00 0.00 H new ATOM 0 HG3 PRO A 59 19.514 2.154 4.866 1.00 0.00 H new ATOM 0 HD2 PRO A 59 20.033 -0.440 5.550 1.00 0.00 H new ATOM 0 HD3 PRO A 59 20.130 0.074 3.878 1.00 0.00 H new ATOM 892 N GLN A 60 23.389 0.163 7.103 1.00 0.00 N ATOM 893 CA GLN A 60 23.938 0.109 8.444 1.00 0.00 C ATOM 894 C GLN A 60 25.370 -0.406 8.395 1.00 0.00 C ATOM 895 O GLN A 60 26.224 0.055 9.148 1.00 0.00 O ATOM 896 CB GLN A 60 23.066 -0.793 9.312 1.00 0.00 C ATOM 897 CG GLN A 60 23.153 -0.339 10.766 1.00 0.00 C ATOM 898 CD GLN A 60 21.825 -0.548 11.480 1.00 0.00 C ATOM 899 OE1 GLN A 60 21.647 -1.537 12.186 1.00 0.00 O ATOM 900 NE2 GLN A 60 20.891 0.388 11.293 1.00 0.00 N ATOM 0 H GLN A 60 23.067 -0.736 6.744 1.00 0.00 H new ATOM 0 HA GLN A 60 23.949 1.109 8.879 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.032 -0.756 8.970 1.00 0.00 H new ATOM 0 HB3 GLN A 60 23.394 -1.829 9.223 1.00 0.00 H new ATOM 0 HG2 GLN A 60 23.938 -0.895 11.279 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.431 0.714 10.806 1.00 0.00 H new ATOM 0 HE21 GLN A 60 21.087 1.192 10.697 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.982 0.299 11.746 1.00 0.00 H new ATOM 909 N LYS A 61 25.629 -1.368 7.506 1.00 0.00 N ATOM 910 CA LYS A 61 26.952 -1.940 7.365 1.00 0.00 C ATOM 911 C LYS A 61 27.793 -1.077 6.433 1.00 0.00 C ATOM 912 O LYS A 61 27.255 -0.306 5.642 1.00 0.00 O ATOM 913 CB LYS A 61 26.837 -3.362 6.825 1.00 0.00 C ATOM 914 CG LYS A 61 26.461 -4.308 7.964 1.00 0.00 C ATOM 915 CD LYS A 61 26.094 -5.674 7.391 1.00 0.00 C ATOM 916 CE LYS A 61 26.776 -6.767 8.207 1.00 0.00 C ATOM 917 NZ LYS A 61 28.062 -7.150 7.607 1.00 0.00 N ATOM 0 H LYS A 61 24.931 -1.762 6.875 1.00 0.00 H new ATOM 0 HA LYS A 61 27.442 -1.973 8.338 1.00 0.00 H new ATOM 0 HB2 LYS A 61 26.083 -3.404 6.039 1.00 0.00 H new ATOM 0 HB3 LYS A 61 27.782 -3.671 6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 61 27.294 -4.406 8.660 1.00 0.00 H new ATOM 0 HG3 LYS A 61 25.621 -3.901 8.527 1.00 0.00 H new ATOM 0 HD2 LYS A 61 25.013 -5.811 7.412 1.00 0.00 H new ATOM 0 HD3 LYS A 61 26.403 -5.738 6.348 1.00 0.00 H new ATOM 0 HE2 LYS A 61 26.937 -6.417 9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 61 26.125 -7.639 8.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 28.505 -7.895 8.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 27.903 -7.505 6.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 28.689 -6.321 7.572 1.00 0.00 H new ATOM 931 N ARG A 62 29.118 -1.209 6.531 1.00 0.00 N ATOM 932 CA ARG A 62 30.025 -0.444 5.701 1.00 0.00 C ATOM 933 C ARG A 62 30.319 -1.208 4.417 1.00 0.00 C ATOM 934 O ARG A 62 30.737 -2.362 4.461 1.00 0.00 O ATOM 935 CB ARG A 62 31.313 -0.171 6.473 1.00 0.00 C ATOM 936 CG ARG A 62 31.189 1.155 7.217 1.00 0.00 C ATOM 937 CD ARG A 62 29.901 1.162 8.035 1.00 0.00 C ATOM 938 NE ARG A 62 30.064 1.938 9.264 1.00 0.00 N ATOM 939 CZ ARG A 62 29.259 1.795 10.326 1.00 0.00 C ATOM 940 NH1 ARG A 62 28.253 0.909 10.289 1.00 0.00 N ATOM 941 NH2 ARG A 62 29.458 2.536 11.424 1.00 0.00 N ATOM 0 H ARG A 62 29.579 -1.844 7.183 1.00 0.00 H new ATOM 0 HA ARG A 62 29.566 0.509 5.437 1.00 0.00 H new ATOM 0 HB2 ARG A 62 31.505 -0.979 7.178 1.00 0.00 H new ATOM 0 HB3 ARG A 62 32.160 -0.138 5.788 1.00 0.00 H new ATOM 0 HG2 ARG A 62 32.049 1.298 7.872 1.00 0.00 H new ATOM 0 HG3 ARG A 62 31.186 1.983 6.508 1.00 0.00 H new ATOM 0 HD2 ARG A 62 29.091 1.583 7.440 1.00 0.00 H new ATOM 0 HD3 ARG A 62 29.617 0.139 8.282 1.00 0.00 H new ATOM 0 HE ARG A 62 30.823 2.617 9.315 1.00 0.00 H new ATOM 0 HH11 ARG A 62 28.101 0.345 9.453 1.00 0.00 H new ATOM 0 HH12 ARG A 62 27.640 0.799 11.097 1.00 0.00 H new ATOM 0 HH21 ARG A 62 30.223 3.210 11.453 1.00 0.00 H new ATOM 0 HH22 ARG A 62 28.845 2.426 12.231 1.00 0.00 H new ATOM 955 N LEU A 63 30.098 -0.558 3.271 1.00 0.00 N ATOM 956 CA LEU A 63 30.340 -1.176 1.983 1.00 0.00 C ATOM 957 C LEU A 63 31.665 -0.689 1.416 1.00 0.00 C ATOM 958 O LEU A 63 31.932 0.511 1.398 1.00 0.00 O ATOM 959 CB LEU A 63 29.191 -0.843 1.036 1.00 0.00 C ATOM 960 CG LEU A 63 29.521 -1.353 -0.363 1.00 0.00 C ATOM 961 CD1 LEU A 63 29.204 -2.844 -0.450 1.00 0.00 C ATOM 962 CD2 LEU A 63 28.687 -0.595 -1.392 1.00 0.00 C ATOM 0 H LEU A 63 29.750 0.400 3.219 1.00 0.00 H new ATOM 0 HA LEU A 63 30.395 -2.258 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 63 28.268 -1.300 1.393 1.00 0.00 H new ATOM 0 HB3 LEU A 63 29.026 0.234 1.012 1.00 0.00 H new ATOM 0 HG LEU A 63 30.580 -1.194 -0.566 1.00 0.00 H new ATOM 0 HD11 LEU A 63 29.440 -3.208 -1.450 1.00 0.00 H new ATOM 0 HD12 LEU A 63 29.800 -3.386 0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 63 28.145 -3.003 -0.246 1.00 0.00 H new ATOM 0 HD21 LEU A 63 28.923 -0.960 -2.392 1.00 0.00 H new ATOM 0 HD22 LEU A 63 27.628 -0.753 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 63 28.914 0.469 -1.331 1.00 0.00 H new ATOM 974 N TYR A 64 32.497 -1.624 0.951 1.00 0.00 N ATOM 975 CA TYR A 64 33.788 -1.285 0.387 1.00 0.00 C ATOM 976 C TYR A 64 34.543 -0.369 1.341 1.00 0.00 C ATOM 977 O TYR A 64 35.440 0.362 0.927 1.00 0.00 O ATOM 978 CB TYR A 64 33.589 -0.609 -0.966 1.00 0.00 C ATOM 979 CG TYR A 64 33.026 -1.530 -2.022 1.00 0.00 C ATOM 980 CD1 TYR A 64 33.770 -2.632 -2.459 1.00 0.00 C ATOM 981 CD2 TYR A 64 31.759 -1.282 -2.563 1.00 0.00 C ATOM 982 CE1 TYR A 64 33.247 -3.486 -3.439 1.00 0.00 C ATOM 983 CE2 TYR A 64 31.236 -2.135 -3.543 1.00 0.00 C ATOM 984 CZ TYR A 64 31.981 -3.237 -3.980 1.00 0.00 C ATOM 985 OH TYR A 64 31.471 -4.068 -4.934 1.00 0.00 O ATOM 0 H TYR A 64 32.291 -2.623 0.958 1.00 0.00 H new ATOM 0 HA TYR A 64 34.376 -2.192 0.243 1.00 0.00 H new ATOM 0 HB2 TYR A 64 32.919 0.242 -0.843 1.00 0.00 H new ATOM 0 HB3 TYR A 64 34.545 -0.215 -1.311 1.00 0.00 H new ATOM 0 HD1 TYR A 64 34.747 -2.824 -2.041 1.00 0.00 H new ATOM 0 HD2 TYR A 64 31.184 -0.432 -2.225 1.00 0.00 H new ATOM 0 HE1 TYR A 64 33.821 -4.336 -3.777 1.00 0.00 H new ATOM 0 HE2 TYR A 64 30.259 -1.943 -3.961 1.00 0.00 H new ATOM 0 HH TYR A 64 30.503 -4.158 -4.806 1.00 0.00 H new ATOM 995 N GLY A 65 34.177 -0.411 2.624 1.00 0.00 N ATOM 996 CA GLY A 65 34.822 0.415 3.626 1.00 0.00 C ATOM 997 C GLY A 65 34.247 1.824 3.599 1.00 0.00 C ATOM 998 O GLY A 65 34.888 2.770 4.050 1.00 0.00 O ATOM 0 H GLY A 65 33.436 -1.011 2.986 1.00 0.00 H new ATOM 0 HA2 GLY A 65 34.682 -0.024 4.614 1.00 0.00 H new ATOM 0 HA3 GLY A 65 35.896 0.450 3.442 1.00 0.00 H new ATOM 1002 N HIS A 66 33.030 1.961 3.067 1.00 0.00 N ATOM 1003 CA HIS A 66 32.377 3.252 2.981 1.00 0.00 C ATOM 1004 C HIS A 66 31.051 3.215 3.728 1.00 0.00 C ATOM 1005 O HIS A 66 30.447 2.154 3.876 1.00 0.00 O ATOM 1006 CB HIS A 66 32.161 3.615 1.515 1.00 0.00 C ATOM 1007 CG HIS A 66 33.389 3.397 0.676 1.00 0.00 C ATOM 1008 ND1 HIS A 66 34.656 3.857 0.956 1.00 0.00 N ATOM 1009 CD2 HIS A 66 33.448 2.704 -0.504 1.00 0.00 C ATOM 1010 CE1 HIS A 66 35.460 3.446 -0.041 1.00 0.00 C ATOM 1011 NE2 HIS A 66 34.772 2.740 -0.954 1.00 0.00 N ATOM 0 H HIS A 66 32.483 1.187 2.691 1.00 0.00 H new ATOM 0 HA HIS A 66 33.008 4.012 3.442 1.00 0.00 H new ATOM 0 HB2 HIS A 66 31.342 3.018 1.114 1.00 0.00 H new ATOM 0 HB3 HIS A 66 31.859 4.660 1.444 1.00 0.00 H new ATOM 0 HD2 HIS A 66 32.620 2.217 -0.998 1.00 0.00 H new ATOM 0 HE1 HIS A 66 36.518 3.656 -0.100 1.00 0.00 H new ATOM 0 HE2 HIS A 66 35.141 2.315 -1.805 1.00 0.00 H new ATOM 1019 N MET A 67 30.599 4.378 4.201 1.00 0.00 N ATOM 1020 CA MET A 67 29.350 4.471 4.930 1.00 0.00 C ATOM 1021 C MET A 67 28.396 5.412 4.207 1.00 0.00 C ATOM 1022 O MET A 67 28.753 6.545 3.896 1.00 0.00 O ATOM 1023 CB MET A 67 29.626 4.967 6.347 1.00 0.00 C ATOM 1024 CG MET A 67 28.475 4.559 7.261 1.00 0.00 C ATOM 1025 SD MET A 67 28.462 5.419 8.855 1.00 0.00 S ATOM 1026 CE MET A 67 27.284 4.368 9.741 1.00 0.00 C ATOM 0 H MET A 67 31.087 5.266 4.087 1.00 0.00 H new ATOM 0 HA MET A 67 28.884 3.487 4.986 1.00 0.00 H new ATOM 0 HB2 MET A 67 30.563 4.548 6.715 1.00 0.00 H new ATOM 0 HB3 MET A 67 29.739 6.051 6.349 1.00 0.00 H new ATOM 0 HG2 MET A 67 27.532 4.750 6.749 1.00 0.00 H new ATOM 0 HG3 MET A 67 28.529 3.485 7.439 1.00 0.00 H new ATOM 0 HE1 MET A 67 27.593 4.272 10.782 1.00 0.00 H new ATOM 0 HE2 MET A 67 26.292 4.817 9.697 1.00 0.00 H new ATOM 0 HE3 MET A 67 27.257 3.382 9.278 1.00 0.00 H new ATOM 1036 N LEU A 68 27.177 4.936 3.941 1.00 0.00 N ATOM 1037 CA LEU A 68 26.177 5.732 3.258 1.00 0.00 C ATOM 1038 C LEU A 68 25.736 6.884 4.150 1.00 0.00 C ATOM 1039 O LEU A 68 25.317 6.668 5.285 1.00 0.00 O ATOM 1040 CB LEU A 68 24.990 4.849 2.889 1.00 0.00 C ATOM 1041 CG LEU A 68 25.495 3.489 2.418 1.00 0.00 C ATOM 1042 CD1 LEU A 68 24.327 2.510 2.343 1.00 0.00 C ATOM 1043 CD2 LEU A 68 26.127 3.632 1.035 1.00 0.00 C ATOM 0 H LEU A 68 26.866 3.998 4.193 1.00 0.00 H new ATOM 0 HA LEU A 68 26.601 6.149 2.344 1.00 0.00 H new ATOM 0 HB2 LEU A 68 24.333 4.727 3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 68 24.401 5.322 2.103 1.00 0.00 H new ATOM 0 HG LEU A 68 26.239 3.115 3.122 1.00 0.00 H new ATOM 0 HD11 LEU A 68 24.688 1.538 2.006 1.00 0.00 H new ATOM 0 HD12 LEU A 68 23.874 2.407 3.329 1.00 0.00 H new ATOM 0 HD13 LEU A 68 23.583 2.884 1.640 1.00 0.00 H new ATOM 0 HD21 LEU A 68 26.488 2.660 0.698 1.00 0.00 H new ATOM 0 HD22 LEU A 68 25.383 4.007 0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 68 26.962 4.331 1.087 1.00 0.00 H new ATOM 1055 N ASP A 69 25.833 8.111 3.634 1.00 0.00 N ATOM 1056 CA ASP A 69 25.444 9.289 4.384 1.00 0.00 C ATOM 1057 C ASP A 69 24.132 9.028 5.109 1.00 0.00 C ATOM 1058 O ASP A 69 24.097 8.976 6.336 1.00 0.00 O ATOM 1059 CB ASP A 69 25.312 10.476 3.434 1.00 0.00 C ATOM 1060 CG ASP A 69 24.311 10.178 2.328 1.00 0.00 C ATOM 1061 OD1 ASP A 69 24.629 9.303 1.495 1.00 0.00 O ATOM 1062 OD2 ASP A 69 23.245 10.831 2.336 1.00 0.00 O ATOM 0 H ASP A 69 26.180 8.307 2.695 1.00 0.00 H new ATOM 0 HA ASP A 69 26.207 9.520 5.128 1.00 0.00 H new ATOM 0 HB2 ASP A 69 24.994 11.358 3.990 1.00 0.00 H new ATOM 0 HB3 ASP A 69 26.284 10.707 2.998 1.00 0.00 H new ATOM 1067 N ASP A 70 23.049 8.866 4.345 1.00 0.00 N ATOM 1068 CA ASP A 70 21.741 8.614 4.917 1.00 0.00 C ATOM 1069 C ASP A 70 20.792 8.120 3.834 1.00 0.00 C ATOM 1070 O ASP A 70 20.127 8.919 3.179 1.00 0.00 O ATOM 1071 CB ASP A 70 21.212 9.893 5.558 1.00 0.00 C ATOM 1072 CG ASP A 70 21.541 11.107 4.701 1.00 0.00 C ATOM 1073 OD1 ASP A 70 20.752 11.375 3.770 1.00 0.00 O ATOM 1074 OD2 ASP A 70 22.577 11.744 4.994 1.00 0.00 O ATOM 0 H ASP A 70 23.061 8.907 3.326 1.00 0.00 H new ATOM 0 HA ASP A 70 21.817 7.844 5.685 1.00 0.00 H new ATOM 0 HB2 ASP A 70 20.133 9.818 5.691 1.00 0.00 H new ATOM 0 HB3 ASP A 70 21.647 10.014 6.550 1.00 0.00 H new ATOM 1079 N SER A 71 20.731 6.801 3.647 1.00 0.00 N ATOM 1080 CA SER A 71 19.864 6.210 2.647 1.00 0.00 C ATOM 1081 C SER A 71 18.408 6.451 3.018 1.00 0.00 C ATOM 1082 O SER A 71 17.503 5.984 2.330 1.00 0.00 O ATOM 1083 CB SER A 71 20.156 4.716 2.540 1.00 0.00 C ATOM 1084 OG SER A 71 19.893 4.097 3.779 1.00 0.00 O ATOM 0 H SER A 71 21.277 6.126 4.181 1.00 0.00 H new ATOM 0 HA SER A 71 20.052 6.673 1.678 1.00 0.00 H new ATOM 0 HB2 SER A 71 19.540 4.269 1.760 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.196 4.557 2.255 1.00 0.00 H new ATOM 0 HG SER A 71 18.935 3.904 3.851 1.00 0.00 H new ATOM 1090 N SER A 72 18.183 7.185 4.111 1.00 0.00 N ATOM 1091 CA SER A 72 16.841 7.485 4.566 1.00 0.00 C ATOM 1092 C SER A 72 16.217 8.546 3.670 1.00 0.00 C ATOM 1093 O SER A 72 15.050 8.894 3.835 1.00 0.00 O ATOM 1094 CB SER A 72 16.891 7.962 6.015 1.00 0.00 C ATOM 1095 OG SER A 72 17.631 9.160 6.089 1.00 0.00 O ATOM 0 H SER A 72 18.922 7.580 4.693 1.00 0.00 H new ATOM 0 HA SER A 72 16.226 6.587 4.514 1.00 0.00 H new ATOM 0 HB2 SER A 72 15.881 8.122 6.392 1.00 0.00 H new ATOM 0 HB3 SER A 72 17.349 7.199 6.645 1.00 0.00 H new ATOM 0 HG SER A 72 17.662 9.468 7.019 1.00 0.00 H new ATOM 1101 N SER A 73 17.000 9.059 2.717 1.00 0.00 N ATOM 1102 CA SER A 73 16.520 10.073 1.801 1.00 0.00 C ATOM 1103 C SER A 73 15.828 9.414 0.616 1.00 0.00 C ATOM 1104 O SER A 73 16.192 8.311 0.215 1.00 0.00 O ATOM 1105 CB SER A 73 17.693 10.930 1.333 1.00 0.00 C ATOM 1106 OG SER A 73 17.361 12.293 1.464 1.00 0.00 O ATOM 0 H SER A 73 17.970 8.782 2.567 1.00 0.00 H new ATOM 0 HA SER A 73 15.797 10.713 2.308 1.00 0.00 H new ATOM 0 HB2 SER A 73 18.581 10.703 1.923 1.00 0.00 H new ATOM 0 HB3 SER A 73 17.933 10.701 0.295 1.00 0.00 H new ATOM 0 HG SER A 73 18.115 12.843 1.165 1.00 0.00 H new ATOM 1112 N GLU A 74 14.824 10.095 0.057 1.00 0.00 N ATOM 1113 CA GLU A 74 14.090 9.573 -1.078 1.00 0.00 C ATOM 1114 C GLU A 74 14.952 9.639 -2.330 1.00 0.00 C ATOM 1115 O GLU A 74 14.569 9.127 -3.380 1.00 0.00 O ATOM 1116 CB GLU A 74 12.805 10.376 -1.263 1.00 0.00 C ATOM 1117 CG GLU A 74 11.602 9.448 -1.127 1.00 0.00 C ATOM 1118 CD GLU A 74 10.868 9.313 -2.453 1.00 0.00 C ATOM 1119 OE1 GLU A 74 10.272 10.326 -2.878 1.00 0.00 O ATOM 1120 OE2 GLU A 74 10.917 8.198 -3.018 1.00 0.00 O ATOM 0 H GLU A 74 14.507 11.010 0.379 1.00 0.00 H new ATOM 0 HA GLU A 74 13.830 8.530 -0.898 1.00 0.00 H new ATOM 0 HB2 GLU A 74 12.750 11.171 -0.520 1.00 0.00 H new ATOM 0 HB3 GLU A 74 12.800 10.854 -2.242 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.932 8.466 -0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.922 9.836 -0.368 1.00 0.00 H new ATOM 1127 N GLN A 75 16.121 10.273 -2.217 1.00 0.00 N ATOM 1128 CA GLN A 75 17.032 10.404 -3.337 1.00 0.00 C ATOM 1129 C GLN A 75 18.398 9.848 -2.961 1.00 0.00 C ATOM 1130 O GLN A 75 19.017 10.311 -2.006 1.00 0.00 O ATOM 1131 CB GLN A 75 17.138 11.874 -3.735 1.00 0.00 C ATOM 1132 CG GLN A 75 16.041 12.208 -4.744 1.00 0.00 C ATOM 1133 CD GLN A 75 16.431 11.750 -6.141 1.00 0.00 C ATOM 1134 OE1 GLN A 75 16.403 10.558 -6.437 1.00 0.00 O ATOM 1135 NE2 GLN A 75 16.796 12.703 -7.003 1.00 0.00 N ATOM 0 H GLN A 75 16.453 10.703 -1.354 1.00 0.00 H new ATOM 0 HA GLN A 75 16.653 9.836 -4.187 1.00 0.00 H new ATOM 0 HB2 GLN A 75 17.042 12.508 -2.854 1.00 0.00 H new ATOM 0 HB3 GLN A 75 18.118 12.075 -4.167 1.00 0.00 H new ATOM 0 HG2 GLN A 75 15.109 11.728 -4.446 1.00 0.00 H new ATOM 0 HG3 GLN A 75 15.859 13.283 -4.747 1.00 0.00 H new ATOM 0 HE21 GLN A 75 16.803 13.680 -6.710 1.00 0.00 H new ATOM 0 HE22 GLN A 75 17.067 12.454 -7.954 1.00 0.00 H new ATOM 1144 N CYS A 76 18.866 8.851 -3.717 1.00 0.00 N ATOM 1145 CA CYS A 76 20.154 8.239 -3.461 1.00 0.00 C ATOM 1146 C CYS A 76 21.264 9.134 -3.991 1.00 0.00 C ATOM 1147 O CYS A 76 21.237 9.539 -5.151 1.00 0.00 O ATOM 1148 CB CYS A 76 20.203 6.865 -4.126 1.00 0.00 C ATOM 1149 SG CYS A 76 21.824 6.434 -4.805 1.00 0.00 S ATOM 0 H CYS A 76 18.363 8.456 -4.512 1.00 0.00 H new ATOM 0 HA CYS A 76 20.296 8.115 -2.387 1.00 0.00 H new ATOM 0 HB2 CYS A 76 19.913 6.109 -3.396 1.00 0.00 H new ATOM 0 HB3 CYS A 76 19.465 6.834 -4.927 1.00 0.00 H new ATOM 1154 N VAL A 77 22.244 9.441 -3.137 1.00 0.00 N ATOM 1155 CA VAL A 77 23.356 10.286 -3.521 1.00 0.00 C ATOM 1156 C VAL A 77 24.644 9.473 -3.518 1.00 0.00 C ATOM 1157 O VAL A 77 24.847 8.629 -2.648 1.00 0.00 O ATOM 1158 CB VAL A 77 23.458 11.463 -2.555 1.00 0.00 C ATOM 1159 CG1 VAL A 77 24.231 11.035 -1.311 1.00 0.00 C ATOM 1160 CG2 VAL A 77 24.188 12.617 -3.236 1.00 0.00 C ATOM 0 H VAL A 77 22.281 9.111 -2.173 1.00 0.00 H new ATOM 0 HA VAL A 77 23.194 10.673 -4.527 1.00 0.00 H new ATOM 0 HB VAL A 77 22.457 11.785 -2.267 1.00 0.00 H new ATOM 0 HG11 VAL A 77 24.304 11.876 -0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 77 23.710 10.210 -0.825 1.00 0.00 H new ATOM 0 HG13 VAL A 77 25.232 10.713 -1.598 1.00 0.00 H new ATOM 0 HG21 VAL A 77 24.261 13.458 -2.547 1.00 0.00 H new ATOM 0 HG22 VAL A 77 25.189 12.295 -3.524 1.00 0.00 H new ATOM 0 HG23 VAL A 77 23.636 12.923 -4.125 1.00 0.00 H new ATOM 1170 N MET A 78 25.515 9.729 -4.497 1.00 0.00 N ATOM 1171 CA MET A 78 26.774 9.021 -4.602 1.00 0.00 C ATOM 1172 C MET A 78 27.862 9.782 -3.857 1.00 0.00 C ATOM 1173 O MET A 78 28.140 10.938 -4.170 1.00 0.00 O ATOM 1174 CB MET A 78 27.143 8.855 -6.073 1.00 0.00 C ATOM 1175 CG MET A 78 26.895 7.411 -6.500 1.00 0.00 C ATOM 1176 SD MET A 78 25.399 6.680 -5.792 1.00 0.00 S ATOM 1177 CE MET A 78 26.160 5.385 -4.781 1.00 0.00 C ATOM 0 H MET A 78 25.362 10.426 -5.226 1.00 0.00 H new ATOM 0 HA MET A 78 26.676 8.034 -4.151 1.00 0.00 H new ATOM 0 HB2 MET A 78 26.550 9.534 -6.686 1.00 0.00 H new ATOM 0 HB3 MET A 78 28.190 9.117 -6.228 1.00 0.00 H new ATOM 0 HG2 MET A 78 26.827 7.371 -7.587 1.00 0.00 H new ATOM 0 HG3 MET A 78 27.754 6.805 -6.212 1.00 0.00 H new ATOM 0 HE1 MET A 78 25.382 4.746 -4.362 1.00 0.00 H new ATOM 0 HE2 MET A 78 26.828 4.786 -5.400 1.00 0.00 H new ATOM 0 HE3 MET A 78 26.728 5.842 -3.971 1.00 0.00 H new ATOM 1187 N LYS A 79 28.477 9.129 -2.869 1.00 0.00 N ATOM 1188 CA LYS A 79 29.529 9.746 -2.086 1.00 0.00 C ATOM 1189 C LYS A 79 30.878 9.160 -2.479 1.00 0.00 C ATOM 1190 O LYS A 79 31.019 7.946 -2.602 1.00 0.00 O ATOM 1191 CB LYS A 79 29.255 9.523 -0.601 1.00 0.00 C ATOM 1192 CG LYS A 79 29.857 10.670 0.204 1.00 0.00 C ATOM 1193 CD LYS A 79 28.745 11.433 0.917 1.00 0.00 C ATOM 1194 CE LYS A 79 29.012 12.932 0.821 1.00 0.00 C ATOM 1195 NZ LYS A 79 28.167 13.681 1.764 1.00 0.00 N ATOM 0 H LYS A 79 28.258 8.170 -2.598 1.00 0.00 H new ATOM 0 HA LYS A 79 29.551 10.818 -2.281 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.181 9.464 -0.423 1.00 0.00 H new ATOM 0 HB3 LYS A 79 29.684 8.574 -0.279 1.00 0.00 H new ATOM 0 HG2 LYS A 79 30.570 10.282 0.931 1.00 0.00 H new ATOM 0 HG3 LYS A 79 30.407 11.341 -0.455 1.00 0.00 H new ATOM 0 HD2 LYS A 79 27.781 11.195 0.468 1.00 0.00 H new ATOM 0 HD3 LYS A 79 28.693 11.129 1.962 1.00 0.00 H new ATOM 0 HE2 LYS A 79 30.063 13.132 1.031 1.00 0.00 H new ATOM 0 HE3 LYS A 79 28.820 13.275 -0.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 28.368 14.698 1.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 27.165 13.507 1.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 28.369 13.369 2.735 1.00 0.00 H new ATOM 1209 N GLU A 80 31.872 10.030 -2.676 1.00 0.00 N ATOM 1210 CA GLU A 80 33.202 9.595 -3.052 1.00 0.00 C ATOM 1211 C GLU A 80 34.016 9.276 -1.805 1.00 0.00 C ATOM 1212 O GLU A 80 34.353 10.172 -1.034 1.00 0.00 O ATOM 1213 CB GLU A 80 33.879 10.686 -3.876 1.00 0.00 C ATOM 1214 CG GLU A 80 34.093 11.921 -3.005 1.00 0.00 C ATOM 1215 CD GLU A 80 35.538 12.009 -2.533 1.00 0.00 C ATOM 1216 OE1 GLU A 80 36.422 11.655 -3.343 1.00 0.00 O ATOM 1217 OE2 GLU A 80 35.730 12.428 -1.372 1.00 0.00 O ATOM 0 H GLU A 80 31.771 11.040 -2.579 1.00 0.00 H new ATOM 0 HA GLU A 80 33.134 8.690 -3.656 1.00 0.00 H new ATOM 0 HB2 GLU A 80 34.835 10.328 -4.259 1.00 0.00 H new ATOM 0 HB3 GLU A 80 33.264 10.939 -4.740 1.00 0.00 H new ATOM 0 HG2 GLU A 80 33.835 12.818 -3.569 1.00 0.00 H new ATOM 0 HG3 GLU A 80 33.426 11.883 -2.143 1.00 0.00 H new ATOM 1224 N LYS A 81 34.332 7.994 -1.611 1.00 0.00 N ATOM 1225 CA LYS A 81 35.105 7.565 -0.462 1.00 0.00 C ATOM 1226 C LYS A 81 36.529 7.236 -0.889 1.00 0.00 C ATOM 1227 O LYS A 81 36.778 6.933 -2.053 1.00 0.00 O ATOM 1228 CB LYS A 81 34.437 6.347 0.172 1.00 0.00 C ATOM 1229 CG LYS A 81 33.076 6.750 0.735 1.00 0.00 C ATOM 1230 CD LYS A 81 33.084 6.588 2.251 1.00 0.00 C ATOM 1231 CE LYS A 81 31.650 6.590 2.772 1.00 0.00 C ATOM 1232 NZ LYS A 81 31.557 7.289 4.062 1.00 0.00 N ATOM 0 H LYS A 81 34.060 7.239 -2.241 1.00 0.00 H new ATOM 0 HA LYS A 81 35.145 8.368 0.274 1.00 0.00 H new ATOM 0 HB2 LYS A 81 34.317 5.557 -0.570 1.00 0.00 H new ATOM 0 HB3 LYS A 81 35.067 5.945 0.966 1.00 0.00 H new ATOM 0 HG2 LYS A 81 32.853 7.784 0.470 1.00 0.00 H new ATOM 0 HG3 LYS A 81 32.292 6.132 0.297 1.00 0.00 H new ATOM 0 HD2 LYS A 81 33.580 5.657 2.525 1.00 0.00 H new ATOM 0 HD3 LYS A 81 33.650 7.398 2.711 1.00 0.00 H new ATOM 0 HE2 LYS A 81 30.996 7.073 2.045 1.00 0.00 H new ATOM 0 HE3 LYS A 81 31.299 5.564 2.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 30.575 7.261 4.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 32.177 6.823 4.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 31.854 8.279 3.943 1.00 0.00 H new ATOM 1246 N LYS A 82 37.466 7.301 0.061 1.00 0.00 N ATOM 1247 CA LYS A 82 38.858 7.011 -0.220 1.00 0.00 C ATOM 1248 C LYS A 82 38.978 5.655 -0.901 1.00 0.00 C ATOM 1249 O LYS A 82 38.894 4.618 -0.247 1.00 0.00 O ATOM 1250 CB LYS A 82 39.653 7.033 1.082 1.00 0.00 C ATOM 1251 CG LYS A 82 38.846 6.353 2.183 1.00 0.00 C ATOM 1252 CD LYS A 82 39.545 5.063 2.603 1.00 0.00 C ATOM 1253 CE LYS A 82 38.552 4.161 3.333 1.00 0.00 C ATOM 1254 NZ LYS A 82 38.683 4.306 4.792 1.00 0.00 N ATOM 0 H LYS A 82 37.276 7.553 1.031 1.00 0.00 H new ATOM 0 HA LYS A 82 39.262 7.768 -0.892 1.00 0.00 H new ATOM 0 HB2 LYS A 82 40.606 6.522 0.947 1.00 0.00 H new ATOM 0 HB3 LYS A 82 39.880 8.061 1.365 1.00 0.00 H new ATOM 0 HG2 LYS A 82 38.745 7.020 3.039 1.00 0.00 H new ATOM 0 HG3 LYS A 82 37.839 6.135 1.828 1.00 0.00 H new ATOM 0 HD2 LYS A 82 39.943 4.550 1.727 1.00 0.00 H new ATOM 0 HD3 LYS A 82 40.391 5.290 3.251 1.00 0.00 H new ATOM 0 HE2 LYS A 82 37.536 4.411 3.029 1.00 0.00 H new ATOM 0 HE3 LYS A 82 38.723 3.122 3.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 37.998 3.683 5.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 39.647 4.044 5.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 38.497 5.293 5.061 1.00 0.00 H new ATOM 1268 N ASP A 83 39.174 5.666 -2.222 1.00 0.00 N ATOM 1269 CA ASP A 83 39.303 4.441 -2.985 1.00 0.00 C ATOM 1270 C ASP A 83 40.610 4.456 -3.765 1.00 0.00 C ATOM 1271 O ASP A 83 40.883 5.397 -4.506 1.00 0.00 O ATOM 1272 CB ASP A 83 38.112 4.303 -3.930 1.00 0.00 C ATOM 1273 CG ASP A 83 36.816 4.141 -3.149 1.00 0.00 C ATOM 1274 OD1 ASP A 83 36.759 3.195 -2.332 1.00 0.00 O ATOM 1275 OD2 ASP A 83 35.905 4.965 -3.382 1.00 0.00 O ATOM 0 H ASP A 83 39.246 6.518 -2.779 1.00 0.00 H new ATOM 0 HA ASP A 83 39.315 3.586 -2.309 1.00 0.00 H new ATOM 0 HB2 ASP A 83 38.048 5.182 -4.571 1.00 0.00 H new ATOM 0 HB3 ASP A 83 38.258 3.442 -4.583 1.00 0.00 H new ATOM 1280 N ASP A 84 41.421 3.409 -3.596 1.00 0.00 N ATOM 1281 CA ASP A 84 42.694 3.308 -4.282 1.00 0.00 C ATOM 1282 C ASP A 84 42.519 2.534 -5.580 1.00 0.00 C ATOM 1283 O ASP A 84 41.947 1.446 -5.585 1.00 0.00 O ATOM 1284 CB ASP A 84 43.706 2.618 -3.373 1.00 0.00 C ATOM 1285 CG ASP A 84 44.546 3.641 -2.619 1.00 0.00 C ATOM 1286 OD1 ASP A 84 45.436 4.232 -3.266 1.00 0.00 O ATOM 1287 OD2 ASP A 84 44.281 3.811 -1.409 1.00 0.00 O ATOM 0 H ASP A 84 41.210 2.620 -2.985 1.00 0.00 H new ATOM 0 HA ASP A 84 43.063 4.305 -4.524 1.00 0.00 H new ATOM 0 HB2 ASP A 84 43.185 1.976 -2.663 1.00 0.00 H new ATOM 0 HB3 ASP A 84 44.356 1.975 -3.967 1.00 0.00 H new ATOM 1292 N GLY A 85 43.013 3.097 -6.684 1.00 0.00 N ATOM 1293 CA GLY A 85 42.907 2.455 -7.979 1.00 0.00 C ATOM 1294 C GLY A 85 41.719 3.013 -8.749 1.00 0.00 C ATOM 1295 O GLY A 85 41.567 2.756 -9.941 1.00 0.00 O ATOM 0 H GLY A 85 43.490 3.998 -6.699 1.00 0.00 H new ATOM 0 HA2 GLY A 85 43.824 2.613 -8.547 1.00 0.00 H new ATOM 0 HA3 GLY A 85 42.793 1.379 -7.851 1.00 0.00 H new ATOM 1299 N GLY A 86 40.871 3.783 -8.061 1.00 0.00 N ATOM 1300 CA GLY A 86 39.703 4.372 -8.683 1.00 0.00 C ATOM 1301 C GLY A 86 38.715 4.832 -7.620 1.00 0.00 C ATOM 1302 O GLY A 86 38.810 4.430 -6.463 1.00 0.00 O ATOM 0 H GLY A 86 40.980 4.008 -7.072 1.00 0.00 H new ATOM 0 HA2 GLY A 86 40.000 5.217 -9.303 1.00 0.00 H new ATOM 0 HA3 GLY A 86 39.227 3.645 -9.341 1.00 0.00 H new ATOM 1306 N LEU A 87 37.763 5.681 -8.017 1.00 0.00 N ATOM 1307 CA LEU A 87 36.763 6.193 -7.102 1.00 0.00 C ATOM 1308 C LEU A 87 35.613 5.203 -6.988 1.00 0.00 C ATOM 1309 O LEU A 87 35.242 4.561 -7.968 1.00 0.00 O ATOM 1310 CB LEU A 87 36.265 7.547 -7.599 1.00 0.00 C ATOM 1311 CG LEU A 87 37.458 8.434 -7.940 1.00 0.00 C ATOM 1312 CD1 LEU A 87 38.477 8.376 -6.804 1.00 0.00 C ATOM 1313 CD2 LEU A 87 38.106 7.942 -9.231 1.00 0.00 C ATOM 0 H LEU A 87 37.672 6.024 -8.973 1.00 0.00 H new ATOM 0 HA LEU A 87 37.202 6.324 -6.113 1.00 0.00 H new ATOM 0 HB2 LEU A 87 35.634 7.414 -8.478 1.00 0.00 H new ATOM 0 HB3 LEU A 87 35.651 8.023 -6.835 1.00 0.00 H new ATOM 0 HG LEU A 87 37.120 9.462 -8.072 1.00 0.00 H new ATOM 0 HD11 LEU A 87 39.330 9.010 -7.047 1.00 0.00 H new ATOM 0 HD12 LEU A 87 38.014 8.728 -5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 87 38.815 7.348 -6.671 1.00 0.00 H new ATOM 0 HD21 LEU A 87 38.959 8.576 -9.475 1.00 0.00 H new ATOM 0 HD22 LEU A 87 38.444 6.914 -9.100 1.00 0.00 H new ATOM 0 HD23 LEU A 87 37.379 7.984 -10.042 1.00 0.00 H new ATOM 1325 N MET A 88 35.047 5.082 -5.784 1.00 0.00 N ATOM 1326 CA MET A 88 33.943 4.172 -5.550 1.00 0.00 C ATOM 1327 C MET A 88 32.865 4.865 -4.728 1.00 0.00 C ATOM 1328 O MET A 88 33.104 5.256 -3.588 1.00 0.00 O ATOM 1329 CB MET A 88 34.456 2.928 -4.830 1.00 0.00 C ATOM 1330 CG MET A 88 35.728 2.433 -5.512 1.00 0.00 C ATOM 1331 SD MET A 88 35.856 0.630 -5.606 1.00 0.00 S ATOM 1332 CE MET A 88 37.526 0.494 -6.293 1.00 0.00 C ATOM 0 H MET A 88 35.342 5.607 -4.961 1.00 0.00 H new ATOM 0 HA MET A 88 33.506 3.872 -6.503 1.00 0.00 H new ATOM 0 HB2 MET A 88 34.658 3.158 -3.784 1.00 0.00 H new ATOM 0 HB3 MET A 88 33.696 2.147 -4.844 1.00 0.00 H new ATOM 0 HG2 MET A 88 35.771 2.844 -6.521 1.00 0.00 H new ATOM 0 HG3 MET A 88 36.592 2.821 -4.973 1.00 0.00 H new ATOM 0 HE1 MET A 88 37.782 -0.558 -6.422 1.00 0.00 H new ATOM 0 HE2 MET A 88 37.564 0.998 -7.259 1.00 0.00 H new ATOM 0 HE3 MET A 88 38.239 0.960 -5.612 1.00 0.00 H new ATOM 1342 N PHE A 89 31.675 5.015 -5.311 1.00 0.00 N ATOM 1343 CA PHE A 89 30.568 5.657 -4.631 1.00 0.00 C ATOM 1344 C PHE A 89 29.528 4.618 -4.238 1.00 0.00 C ATOM 1345 O PHE A 89 29.170 3.760 -5.042 1.00 0.00 O ATOM 1346 CB PHE A 89 29.957 6.715 -5.546 1.00 0.00 C ATOM 1347 CG PHE A 89 30.927 7.801 -5.945 1.00 0.00 C ATOM 1348 CD1 PHE A 89 32.120 7.468 -6.598 1.00 0.00 C ATOM 1349 CD2 PHE A 89 30.636 9.141 -5.660 1.00 0.00 C ATOM 1350 CE1 PHE A 89 33.020 8.475 -6.966 1.00 0.00 C ATOM 1351 CE2 PHE A 89 31.537 10.147 -6.028 1.00 0.00 C ATOM 1352 CZ PHE A 89 32.729 9.814 -6.682 1.00 0.00 C ATOM 0 H PHE A 89 31.461 4.697 -6.256 1.00 0.00 H new ATOM 0 HA PHE A 89 30.926 6.142 -3.723 1.00 0.00 H new ATOM 0 HB2 PHE A 89 29.577 6.230 -6.445 1.00 0.00 H new ATOM 0 HB3 PHE A 89 29.103 7.169 -5.043 1.00 0.00 H new ATOM 0 HD1 PHE A 89 32.346 6.435 -6.818 1.00 0.00 H new ATOM 0 HD2 PHE A 89 29.716 9.398 -5.156 1.00 0.00 H new ATOM 0 HE1 PHE A 89 33.940 8.218 -7.470 1.00 0.00 H new ATOM 0 HE2 PHE A 89 31.313 11.180 -5.807 1.00 0.00 H new ATOM 0 HZ PHE A 89 33.424 10.590 -6.967 1.00 0.00 H new ATOM 1362 N MET A 90 29.045 4.695 -2.996 1.00 0.00 N ATOM 1363 CA MET A 90 28.053 3.761 -2.505 1.00 0.00 C ATOM 1364 C MET A 90 26.899 4.520 -1.864 1.00 0.00 C ATOM 1365 O MET A 90 27.114 5.371 -1.004 1.00 0.00 O ATOM 1366 CB MET A 90 28.701 2.814 -1.498 1.00 0.00 C ATOM 1367 CG MET A 90 29.377 3.627 -0.398 1.00 0.00 C ATOM 1368 SD MET A 90 30.829 4.554 -0.955 1.00 0.00 S ATOM 1369 CE MET A 90 30.201 6.236 -0.732 1.00 0.00 C ATOM 0 H MET A 90 29.332 5.400 -2.317 1.00 0.00 H new ATOM 0 HA MET A 90 27.659 3.175 -3.336 1.00 0.00 H new ATOM 0 HB2 MET A 90 27.948 2.154 -1.067 1.00 0.00 H new ATOM 0 HB3 MET A 90 29.433 2.179 -1.998 1.00 0.00 H new ATOM 0 HG2 MET A 90 28.652 4.325 0.022 1.00 0.00 H new ATOM 0 HG3 MET A 90 29.675 2.954 0.406 1.00 0.00 H new ATOM 0 HE1 MET A 90 31.031 6.942 -0.768 1.00 0.00 H new ATOM 0 HE2 MET A 90 29.493 6.468 -1.527 1.00 0.00 H new ATOM 0 HE3 MET A 90 29.701 6.313 0.233 1.00 0.00 H new ATOM 1379 N CYS A 91 25.672 4.207 -2.285 1.00 0.00 N ATOM 1380 CA CYS A 91 24.491 4.857 -1.754 1.00 0.00 C ATOM 1381 C CYS A 91 23.348 3.856 -1.667 1.00 0.00 C ATOM 1382 O CYS A 91 23.276 2.923 -2.462 1.00 0.00 O ATOM 1383 CB CYS A 91 24.112 6.035 -2.648 1.00 0.00 C ATOM 1384 SG CYS A 91 23.080 5.580 -4.064 1.00 0.00 S ATOM 0 H CYS A 91 25.479 3.502 -2.996 1.00 0.00 H new ATOM 0 HA CYS A 91 24.697 5.232 -0.752 1.00 0.00 H new ATOM 0 HB2 CYS A 91 23.584 6.777 -2.050 1.00 0.00 H new ATOM 0 HB3 CYS A 91 25.023 6.509 -3.013 1.00 0.00 H new ATOM 1389 N SER A 92 22.452 4.053 -0.696 1.00 0.00 N ATOM 1390 CA SER A 92 21.319 3.169 -0.513 1.00 0.00 C ATOM 1391 C SER A 92 20.038 3.986 -0.407 1.00 0.00 C ATOM 1392 O SER A 92 20.082 5.214 -0.381 1.00 0.00 O ATOM 1393 CB SER A 92 21.529 2.328 0.742 1.00 0.00 C ATOM 1394 OG SER A 92 20.281 2.059 1.342 1.00 0.00 O ATOM 0 H SER A 92 22.498 4.822 -0.027 1.00 0.00 H new ATOM 0 HA SER A 92 21.231 2.502 -1.371 1.00 0.00 H new ATOM 0 HB2 SER A 92 22.031 1.395 0.487 1.00 0.00 H new ATOM 0 HB3 SER A 92 22.175 2.856 1.443 1.00 0.00 H new ATOM 0 HG SER A 92 20.415 1.517 2.148 1.00 0.00 H new ATOM 1400 N CYS A 93 18.895 3.299 -0.346 1.00 0.00 N ATOM 1401 CA CYS A 93 17.609 3.960 -0.242 1.00 0.00 C ATOM 1402 C CYS A 93 16.515 2.925 -0.027 1.00 0.00 C ATOM 1403 O CYS A 93 16.514 1.876 -0.667 1.00 0.00 O ATOM 1404 CB CYS A 93 17.350 4.767 -1.511 1.00 0.00 C ATOM 1405 SG CYS A 93 17.661 3.852 -3.041 1.00 0.00 S ATOM 0 H CYS A 93 18.843 2.281 -0.368 1.00 0.00 H new ATOM 0 HA CYS A 93 17.611 4.639 0.610 1.00 0.00 H new ATOM 0 HB2 CYS A 93 16.315 5.108 -1.508 1.00 0.00 H new ATOM 0 HB3 CYS A 93 17.979 5.657 -1.498 1.00 0.00 H new ATOM 1410 N THR A 94 15.579 3.222 0.878 1.00 0.00 N ATOM 1411 CA THR A 94 14.487 2.316 1.170 1.00 0.00 C ATOM 1412 C THR A 94 13.409 2.444 0.103 1.00 0.00 C ATOM 1413 O THR A 94 12.365 1.802 0.189 1.00 0.00 O ATOM 1414 CB THR A 94 13.920 2.632 2.551 1.00 0.00 C ATOM 1415 OG1 THR A 94 13.002 3.698 2.449 1.00 0.00 O ATOM 1416 CG2 THR A 94 15.056 3.028 3.489 1.00 0.00 C ATOM 0 H THR A 94 15.564 4.087 1.418 1.00 0.00 H new ATOM 0 HA THR A 94 14.852 1.289 1.167 1.00 0.00 H new ATOM 0 HB THR A 94 13.413 1.752 2.946 1.00 0.00 H new ATOM 0 HG1 THR A 94 12.636 3.900 3.335 1.00 0.00 H new ATOM 0 HG21 THR A 94 14.651 3.254 4.476 1.00 0.00 H new ATOM 0 HG22 THR A 94 15.766 2.205 3.568 1.00 0.00 H new ATOM 0 HG23 THR A 94 15.563 3.909 3.095 1.00 0.00 H new ATOM 1424 N GLY A 95 13.666 3.277 -0.908 1.00 0.00 N ATOM 1425 CA GLY A 95 12.719 3.483 -1.985 1.00 0.00 C ATOM 1426 C GLY A 95 12.657 2.250 -2.876 1.00 0.00 C ATOM 1427 O GLY A 95 13.048 1.160 -2.464 1.00 0.00 O ATOM 0 H GLY A 95 14.527 3.817 -0.995 1.00 0.00 H new ATOM 0 HA2 GLY A 95 11.731 3.694 -1.575 1.00 0.00 H new ATOM 0 HA3 GLY A 95 13.011 4.352 -2.575 1.00 0.00 H new ATOM 1431 N GLU A 96 12.163 2.427 -4.104 1.00 0.00 N ATOM 1432 CA GLU A 96 12.054 1.331 -5.045 1.00 0.00 C ATOM 1433 C GLU A 96 13.108 1.474 -6.134 1.00 0.00 C ATOM 1434 O GLU A 96 13.126 2.466 -6.860 1.00 0.00 O ATOM 1435 CB GLU A 96 10.652 1.319 -5.649 1.00 0.00 C ATOM 1436 CG GLU A 96 10.539 0.173 -6.650 1.00 0.00 C ATOM 1437 CD GLU A 96 9.198 0.210 -7.370 1.00 0.00 C ATOM 1438 OE1 GLU A 96 9.135 0.895 -8.414 1.00 0.00 O ATOM 1439 OE2 GLU A 96 8.263 -0.446 -6.863 1.00 0.00 O ATOM 0 H GLU A 96 11.834 3.324 -4.462 1.00 0.00 H new ATOM 0 HA GLU A 96 12.223 0.387 -4.528 1.00 0.00 H new ATOM 0 HB2 GLU A 96 9.907 1.204 -4.862 1.00 0.00 H new ATOM 0 HB3 GLU A 96 10.449 2.269 -6.143 1.00 0.00 H new ATOM 0 HG2 GLU A 96 11.348 0.239 -7.377 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.652 -0.780 -6.132 1.00 0.00 H new ATOM 1446 N GLU A 97 13.988 0.477 -6.248 1.00 0.00 N ATOM 1447 CA GLU A 97 15.038 0.497 -7.247 1.00 0.00 C ATOM 1448 C GLU A 97 15.676 1.877 -7.302 1.00 0.00 C ATOM 1449 O GLU A 97 16.315 2.231 -8.291 1.00 0.00 O ATOM 1450 CB GLU A 97 14.454 0.116 -8.603 1.00 0.00 C ATOM 1451 CG GLU A 97 14.375 -1.403 -8.715 1.00 0.00 C ATOM 1452 CD GLU A 97 13.727 -1.819 -10.028 1.00 0.00 C ATOM 1453 OE1 GLU A 97 12.549 -1.450 -10.222 1.00 0.00 O ATOM 1454 OE2 GLU A 97 14.423 -2.498 -10.815 1.00 0.00 O ATOM 0 H GLU A 97 13.987 -0.353 -5.655 1.00 0.00 H new ATOM 0 HA GLU A 97 15.810 -0.225 -6.982 1.00 0.00 H new ATOM 0 HB2 GLU A 97 13.462 0.552 -8.719 1.00 0.00 H new ATOM 0 HB3 GLU A 97 15.074 0.518 -9.404 1.00 0.00 H new ATOM 0 HG2 GLU A 97 15.376 -1.829 -8.648 1.00 0.00 H new ATOM 0 HG3 GLU A 97 13.802 -1.804 -7.879 1.00 0.00 H new ATOM 1461 N CYS A 98 15.502 2.659 -6.234 1.00 0.00 N ATOM 1462 CA CYS A 98 16.060 3.994 -6.163 1.00 0.00 C ATOM 1463 C CYS A 98 17.579 3.922 -6.234 1.00 0.00 C ATOM 1464 O CYS A 98 18.236 4.913 -6.546 1.00 0.00 O ATOM 1465 CB CYS A 98 15.609 4.665 -4.869 1.00 0.00 C ATOM 1466 SG CYS A 98 15.595 3.561 -3.435 1.00 0.00 S ATOM 0 H CYS A 98 14.975 2.380 -5.407 1.00 0.00 H new ATOM 0 HA CYS A 98 15.705 4.587 -7.006 1.00 0.00 H new ATOM 0 HB2 CYS A 98 16.268 5.508 -4.660 1.00 0.00 H new ATOM 0 HB3 CYS A 98 14.608 5.071 -5.012 1.00 0.00 H new ATOM 1471 N ASN A 99 18.136 2.745 -5.940 1.00 0.00 N ATOM 1472 CA ASN A 99 19.572 2.552 -5.972 1.00 0.00 C ATOM 1473 C ASN A 99 20.069 2.594 -7.409 1.00 0.00 C ATOM 1474 O ASN A 99 21.208 2.979 -7.666 1.00 0.00 O ATOM 1475 CB ASN A 99 19.919 1.216 -5.318 1.00 0.00 C ATOM 1476 CG ASN A 99 18.955 0.127 -5.767 1.00 0.00 C ATOM 1477 OD1 ASN A 99 17.742 0.320 -5.744 1.00 0.00 O ATOM 1478 ND2 ASN A 99 19.498 -1.022 -6.178 1.00 0.00 N ATOM 0 H ASN A 99 17.606 1.914 -5.677 1.00 0.00 H new ATOM 0 HA ASN A 99 20.062 3.352 -5.418 1.00 0.00 H new ATOM 0 HB2 ASN A 99 20.940 0.934 -5.577 1.00 0.00 H new ATOM 0 HB3 ASN A 99 19.881 1.316 -4.233 1.00 0.00 H new ATOM 0 HD21 ASN A 99 18.899 -1.786 -6.491 1.00 0.00 H new ATOM 0 HD22 ASN A 99 20.512 -1.135 -6.179 1.00 0.00 H new ATOM 1485 N ASP A 100 19.209 2.195 -8.350 1.00 0.00 N ATOM 1486 CA ASP A 100 19.564 2.188 -9.755 1.00 0.00 C ATOM 1487 C ASP A 100 19.953 3.591 -10.195 1.00 0.00 C ATOM 1488 O ASP A 100 20.701 3.758 -11.155 1.00 0.00 O ATOM 1489 CB ASP A 100 18.382 1.672 -10.573 1.00 0.00 C ATOM 1490 CG ASP A 100 17.676 2.815 -11.287 1.00 0.00 C ATOM 1491 OD1 ASP A 100 18.258 3.315 -12.274 1.00 0.00 O ATOM 1492 OD2 ASP A 100 16.566 3.168 -10.832 1.00 0.00 O ATOM 0 H ASP A 100 18.261 1.873 -8.154 1.00 0.00 H new ATOM 0 HA ASP A 100 20.417 1.529 -9.917 1.00 0.00 H new ATOM 0 HB2 ASP A 100 18.731 0.942 -11.303 1.00 0.00 H new ATOM 0 HB3 ASP A 100 17.679 1.157 -9.919 1.00 0.00 H new ATOM 1497 N VAL A 101 19.442 4.603 -9.490 1.00 0.00 N ATOM 1498 CA VAL A 101 19.738 5.986 -9.811 1.00 0.00 C ATOM 1499 C VAL A 101 20.799 6.519 -8.860 1.00 0.00 C ATOM 1500 O VAL A 101 20.503 6.838 -7.710 1.00 0.00 O ATOM 1501 CB VAL A 101 18.459 6.814 -9.715 1.00 0.00 C ATOM 1502 CG1 VAL A 101 18.504 7.940 -10.743 1.00 0.00 C ATOM 1503 CG2 VAL A 101 17.253 5.922 -9.989 1.00 0.00 C ATOM 0 H VAL A 101 18.819 4.481 -8.691 1.00 0.00 H new ATOM 0 HA VAL A 101 20.123 6.054 -10.828 1.00 0.00 H new ATOM 0 HB VAL A 101 18.376 7.239 -8.715 1.00 0.00 H new ATOM 0 HG11 VAL A 101 17.591 8.532 -10.675 1.00 0.00 H new ATOM 0 HG12 VAL A 101 19.365 8.578 -10.546 1.00 0.00 H new ATOM 0 HG13 VAL A 101 18.588 7.516 -11.744 1.00 0.00 H new ATOM 0 HG21 VAL A 101 16.340 6.513 -9.920 1.00 0.00 H new ATOM 0 HG22 VAL A 101 17.335 5.496 -10.989 1.00 0.00 H new ATOM 0 HG23 VAL A 101 17.221 5.118 -9.254 1.00 0.00 H new ATOM 1513 N LEU A 102 22.041 6.616 -9.342 1.00 0.00 N ATOM 1514 CA LEU A 102 23.139 7.109 -8.535 1.00 0.00 C ATOM 1515 C LEU A 102 23.408 8.570 -8.867 1.00 0.00 C ATOM 1516 O LEU A 102 23.991 8.875 -9.905 1.00 0.00 O ATOM 1517 CB LEU A 102 24.380 6.258 -8.791 1.00 0.00 C ATOM 1518 CG LEU A 102 24.151 5.382 -10.019 1.00 0.00 C ATOM 1519 CD1 LEU A 102 25.492 5.064 -10.674 1.00 0.00 C ATOM 1520 CD2 LEU A 102 23.469 4.084 -9.598 1.00 0.00 C ATOM 0 H LEU A 102 22.303 6.356 -10.293 1.00 0.00 H new ATOM 0 HA LEU A 102 22.879 7.039 -7.479 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.248 6.899 -8.945 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.593 5.636 -7.922 1.00 0.00 H new ATOM 0 HG LEU A 102 23.516 5.911 -10.730 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.329 4.438 -11.551 1.00 0.00 H new ATOM 0 HD12 LEU A 102 25.979 5.992 -10.975 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.127 4.535 -9.964 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.305 3.458 -10.475 1.00 0.00 H new ATOM 0 HD22 LEU A 102 24.103 3.554 -8.887 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.511 4.311 -9.131 1.00 0.00 H new ATOM 1532 N ILE A 103 22.983 9.472 -7.980 1.00 0.00 N ATOM 1533 CA ILE A 103 23.180 10.894 -8.180 1.00 0.00 C ATOM 1534 C ILE A 103 24.570 11.293 -7.707 1.00 0.00 C ATOM 1535 O ILE A 103 24.935 11.037 -6.561 1.00 0.00 O ATOM 1536 CB ILE A 103 22.106 11.668 -7.420 1.00 0.00 C ATOM 1537 CG1 ILE A 103 20.856 11.789 -8.287 1.00 0.00 C ATOM 1538 CG2 ILE A 103 22.628 13.061 -7.081 1.00 0.00 C ATOM 1539 CD1 ILE A 103 19.709 11.022 -7.635 1.00 0.00 C ATOM 0 H ILE A 103 22.499 9.233 -7.115 1.00 0.00 H new ATOM 0 HA ILE A 103 23.097 11.131 -9.241 1.00 0.00 H new ATOM 0 HB ILE A 103 21.859 11.139 -6.500 1.00 0.00 H new ATOM 0 HG12 ILE A 103 20.584 12.838 -8.408 1.00 0.00 H new ATOM 0 HG13 ILE A 103 21.052 11.394 -9.284 1.00 0.00 H new ATOM 0 HG21 ILE A 103 21.862 13.615 -6.538 1.00 0.00 H new ATOM 0 HG22 ILE A 103 23.520 12.974 -6.461 1.00 0.00 H new ATOM 0 HG23 ILE A 103 22.875 13.591 -8.001 1.00 0.00 H new ATOM 0 HD11 ILE A 103 18.816 11.108 -8.254 1.00 0.00 H new ATOM 0 HD12 ILE A 103 19.983 9.972 -7.537 1.00 0.00 H new ATOM 0 HD13 ILE A 103 19.508 11.438 -6.648 1.00 0.00 H new ATOM 1551 N PHE A 104 25.347 11.922 -8.591 1.00 0.00 N ATOM 1552 CA PHE A 104 26.691 12.351 -8.258 1.00 0.00 C ATOM 1553 C PHE A 104 26.747 13.871 -8.197 1.00 0.00 C ATOM 1554 O PHE A 104 26.551 14.543 -9.208 1.00 0.00 O ATOM 1555 CB PHE A 104 27.668 11.813 -9.299 1.00 0.00 C ATOM 1556 CG PHE A 104 27.634 10.311 -9.439 1.00 0.00 C ATOM 1557 CD1 PHE A 104 26.569 9.694 -10.108 1.00 0.00 C ATOM 1558 CD2 PHE A 104 28.667 9.533 -8.902 1.00 0.00 C ATOM 1559 CE1 PHE A 104 26.539 8.301 -10.240 1.00 0.00 C ATOM 1560 CE2 PHE A 104 28.636 8.140 -9.033 1.00 0.00 C ATOM 1561 CZ PHE A 104 27.572 7.523 -9.702 1.00 0.00 C ATOM 0 H PHE A 104 25.060 12.143 -9.545 1.00 0.00 H new ATOM 0 HA PHE A 104 26.971 11.959 -7.280 1.00 0.00 H new ATOM 0 HB2 PHE A 104 27.442 12.265 -10.265 1.00 0.00 H new ATOM 0 HB3 PHE A 104 28.678 12.122 -9.031 1.00 0.00 H new ATOM 0 HD1 PHE A 104 25.771 10.293 -10.522 1.00 0.00 H new ATOM 0 HD2 PHE A 104 29.488 10.008 -8.386 1.00 0.00 H new ATOM 0 HE1 PHE A 104 25.719 7.826 -10.757 1.00 0.00 H new ATOM 0 HE2 PHE A 104 29.433 7.541 -8.618 1.00 0.00 H new ATOM 0 HZ PHE A 104 27.548 6.448 -9.803 1.00 0.00 H new ATOM 1571 N SER A 105 27.017 14.412 -7.008 1.00 0.00 N ATOM 1572 CA SER A 105 27.099 15.847 -6.823 1.00 0.00 C ATOM 1573 C SER A 105 28.334 16.192 -6.002 1.00 0.00 C ATOM 1574 O SER A 105 28.467 15.755 -4.861 1.00 0.00 O ATOM 1575 CB SER A 105 25.834 16.343 -6.129 1.00 0.00 C ATOM 1576 OG SER A 105 25.896 16.027 -4.756 1.00 0.00 O ATOM 0 H SER A 105 27.182 13.869 -6.161 1.00 0.00 H new ATOM 0 HA SER A 105 27.182 16.338 -7.793 1.00 0.00 H new ATOM 0 HB2 SER A 105 25.733 17.420 -6.261 1.00 0.00 H new ATOM 0 HB3 SER A 105 24.955 15.883 -6.580 1.00 0.00 H new ATOM 0 HG SER A 105 26.714 15.518 -4.574 1.00 0.00 H new ATOM 1582 N ALA A 106 29.239 16.980 -6.588 1.00 0.00 N ATOM 1583 CA ALA A 106 30.456 17.380 -5.912 1.00 0.00 C ATOM 1584 C ALA A 106 30.151 18.484 -4.910 1.00 0.00 C ATOM 1585 O ALA A 106 30.987 18.813 -4.070 1.00 0.00 O ATOM 1586 CB ALA A 106 31.478 17.853 -6.942 1.00 0.00 C ATOM 0 H ALA A 106 29.143 17.350 -7.534 1.00 0.00 H new ATOM 0 HA ALA A 106 30.871 16.530 -5.371 1.00 0.00 H new ATOM 0 HB1 ALA A 106 32.394 18.154 -6.434 1.00 0.00 H new ATOM 0 HB2 ALA A 106 31.698 17.041 -7.636 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.073 18.702 -7.493 1.00 0.00 H new ATOM 1592 N ILE A 107 28.947 19.056 -4.997 1.00 0.00 N ATOM 1593 CA ILE A 107 28.535 20.117 -4.101 1.00 0.00 C ATOM 1594 C ILE A 107 28.095 19.523 -2.770 1.00 0.00 C ATOM 1595 O ILE A 107 28.887 19.435 -1.835 1.00 0.00 O ATOM 1596 CB ILE A 107 27.402 20.912 -4.742 1.00 0.00 C ATOM 1597 CG1 ILE A 107 27.321 22.293 -4.097 1.00 0.00 C ATOM 1598 CG2 ILE A 107 26.082 20.175 -4.532 1.00 0.00 C ATOM 1599 CD1 ILE A 107 27.223 22.142 -2.582 1.00 0.00 C ATOM 1600 OXT ILE A 107 26.909 19.139 -2.685 1.00 0.00 O ATOM 0 H ILE A 107 28.243 18.793 -5.687 1.00 0.00 H new ATOM 0 HA ILE A 107 29.372 20.791 -3.917 1.00 0.00 H new ATOM 0 HB ILE A 107 27.593 21.020 -5.810 1.00 0.00 H new ATOM 0 HG12 ILE A 107 28.201 22.880 -4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 107 26.453 22.833 -4.476 1.00 0.00 H new ATOM 0 HG21 ILE A 107 25.272 20.742 -4.990 1.00 0.00 H new ATOM 0 HG22 ILE A 107 26.139 19.188 -4.992 1.00 0.00 H new ATOM 0 HG23 ILE A 107 25.891 20.067 -3.464 1.00 0.00 H new ATOM 0 HD11 ILE A 107 27.165 23.128 -2.121 1.00 0.00 H new ATOM 0 HD12 ILE A 107 26.329 21.571 -2.330 1.00 0.00 H new ATOM 0 HD13 ILE A 107 28.104 21.619 -2.211 1.00 0.00 H new TER 1612 ILE A 107