USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=22 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 66 HIS : no HE2:sc= -16.2! C(o=-27!,f=-30!) USER MOD Set 1.2: A 81 LYS NZ :NH3+ 180:sc= -10.4! (180deg=-8.01!) USER MOD Set 2.1: A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 36 ASN : amide:sc= -0.135 K(o=-0.14,f=-1) USER MOD Set 3.1: A 12 LYS NZ :NH3+ -173:sc= -0.027 (180deg=-0.106) USER MOD Set 3.2: A 25 ASN : amide:sc= -0.0668 K(o=-0.094,f=-0.85) USER MOD Single : A 1 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLN N :NH3+ 135:sc= -0.201 (180deg=-1.16!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 120:sc= -0.121 USER MOD Single : A 15 THR OG1 : rot -48:sc= 0.766 USER MOD Single : A 17 SER OG : rot 180:sc= -0.321 USER MOD Single : A 18 ASN : amide:sc= -0.0112 X(o=-0.011,f=-0.47) USER MOD Single : A 19 GLN : amide:sc= -9.91! C(o=-9.9!,f=-6.1!) 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 95:sc= -0.972 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -8:sc= -0.0289 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 46 ASN : amide:sc= -7.07! C(o=-7.1!,f=-14!) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 THR OG1 : rot -156:sc= -2.05! USER MOD Single : A 54 THR OG1 : rot 90:sc= -0.158 USER MOD Single : A 57 HIS : no HD1:sc= -3.53! C(o=-3.5!,f=-4.8!) USER MOD Single : A 60 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.57) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot -129:sc= 1.26 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 153:sc= -4.52! 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= -0.0757 X(o=-0.076,f=-0.5) USER MOD Single : A 78 MET CE :methyl -104:sc= -5.59! (180deg=-7.59!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl -160:sc= -3.71! (180deg=-4.89!) USER MOD Single : A 90 MET CE :methyl -172:sc= -9.75! (180deg=-10.2!) USER MOD Single : A 92 SER OG : rot 46:sc= -7.08! USER MOD Single : A 94 THR OG1 : rot -78:sc= 0.0817 USER MOD Single : A 99 ASN : amide:sc= -20.1! C(o=-20!,f=-25!) USER MOD Single : A 105 SER OG : rot -9:sc= 0.564! USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 1.034 -4.924 -1.281 1.00 0.00 N ATOM 2 CA GLN A 1 1.455 -5.220 -2.635 1.00 0.00 C ATOM 3 C GLN A 1 2.970 -5.112 -2.740 1.00 0.00 C ATOM 4 O GLN A 1 3.686 -5.453 -1.801 1.00 0.00 O ATOM 5 CB GLN A 1 0.776 -4.253 -3.600 1.00 0.00 C ATOM 6 CG GLN A 1 1.240 -2.829 -3.307 1.00 0.00 C ATOM 7 CD GLN A 1 0.297 -1.811 -3.930 1.00 0.00 C ATOM 8 OE1 GLN A 1 0.264 -1.656 -5.149 1.00 0.00 O ATOM 9 NE2 GLN A 1 -0.474 -1.117 -3.089 1.00 0.00 N ATOM 0 H1 GLN A 1 0.213 -4.286 -1.304 1.00 0.00 H new ATOM 0 H2 GLN A 1 0.772 -5.807 -0.798 1.00 0.00 H new ATOM 0 H3 GLN A 1 1.814 -4.466 -0.767 1.00 0.00 H new ATOM 0 HA GLN A 1 1.165 -6.238 -2.896 1.00 0.00 H new ATOM 0 HB2 GLN A 1 1.017 -4.521 -4.629 1.00 0.00 H new ATOM 0 HB3 GLN A 1 -0.307 -4.322 -3.498 1.00 0.00 H new ATOM 0 HG2 GLN A 1 1.289 -2.673 -2.229 1.00 0.00 H new ATOM 0 HG3 GLN A 1 2.248 -2.683 -3.697 1.00 0.00 H new ATOM 0 HE21 GLN A 1 -0.410 -1.282 -2.084 1.00 0.00 H new ATOM 0 HE22 GLN A 1 -1.127 -0.422 -3.451 1.00 0.00 H new ATOM 20 N LEU A 2 3.457 -4.634 -3.888 1.00 0.00 N ATOM 21 CA LEU A 2 4.881 -4.481 -4.110 1.00 0.00 C ATOM 22 C LEU A 2 5.538 -3.893 -2.869 1.00 0.00 C ATOM 23 O LEU A 2 5.429 -2.696 -2.614 1.00 0.00 O ATOM 24 CB LEU A 2 5.112 -3.582 -5.322 1.00 0.00 C ATOM 25 CG LEU A 2 4.066 -3.888 -6.389 1.00 0.00 C ATOM 26 CD1 LEU A 2 4.105 -2.806 -7.464 1.00 0.00 C ATOM 27 CD2 LEU A 2 4.366 -5.244 -7.021 1.00 0.00 C ATOM 0 H LEU A 2 2.876 -4.348 -4.676 1.00 0.00 H new ATOM 0 HA LEU A 2 5.329 -5.455 -4.305 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.051 -2.534 -5.028 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.113 -3.743 -5.722 1.00 0.00 H new ATOM 0 HG LEU A 2 3.077 -3.911 -5.932 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.358 -3.024 -8.227 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.891 -1.837 -7.013 1.00 0.00 H new ATOM 0 HD13 LEU A 2 5.094 -2.783 -7.921 1.00 0.00 H new ATOM 0 HD21 LEU A 2 3.619 -5.463 -7.784 1.00 0.00 H new ATOM 0 HD22 LEU A 2 5.355 -5.221 -7.478 1.00 0.00 H new ATOM 0 HD23 LEU A 2 4.339 -6.017 -6.253 1.00 0.00 H new ATOM 39 N PRO A 3 6.222 -4.741 -2.097 1.00 0.00 N ATOM 40 CA PRO A 3 6.912 -4.361 -0.882 1.00 0.00 C ATOM 41 C PRO A 3 8.158 -3.563 -1.232 1.00 0.00 C ATOM 42 O PRO A 3 8.075 -2.547 -1.920 1.00 0.00 O ATOM 43 CB PRO A 3 7.278 -5.684 -0.212 1.00 0.00 C ATOM 44 CG PRO A 3 7.452 -6.629 -1.400 1.00 0.00 C ATOM 45 CD PRO A 3 6.370 -6.154 -2.366 1.00 0.00 C ATOM 0 HA PRO A 3 6.307 -3.734 -0.227 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.192 -5.600 0.375 1.00 0.00 H new ATOM 0 HB3 PRO A 3 6.494 -6.025 0.465 1.00 0.00 H new ATOM 0 HG2 PRO A 3 8.448 -6.552 -1.837 1.00 0.00 H new ATOM 0 HG3 PRO A 3 7.310 -7.671 -1.113 1.00 0.00 H new ATOM 0 HD2 PRO A 3 6.661 -6.330 -3.402 1.00 0.00 H new ATOM 0 HD3 PRO A 3 5.433 -6.687 -2.203 1.00 0.00 H new ATOM 53 N ARG A 4 9.317 -4.021 -0.753 1.00 0.00 N ATOM 54 CA ARG A 4 10.573 -3.348 -1.015 1.00 0.00 C ATOM 55 C ARG A 4 11.330 -4.076 -2.116 1.00 0.00 C ATOM 56 O ARG A 4 11.630 -5.261 -1.987 1.00 0.00 O ATOM 57 CB ARG A 4 11.399 -3.300 0.268 1.00 0.00 C ATOM 58 CG ARG A 4 12.796 -2.769 -0.046 1.00 0.00 C ATOM 59 CD ARG A 4 13.298 -1.931 1.127 1.00 0.00 C ATOM 60 NE ARG A 4 13.641 -2.779 2.269 1.00 0.00 N ATOM 61 CZ ARG A 4 13.984 -2.282 3.464 1.00 0.00 C ATOM 62 NH1 ARG A 4 14.021 -0.956 3.654 1.00 0.00 N ATOM 63 NH2 ARG A 4 14.290 -3.110 4.473 1.00 0.00 N ATOM 0 H ARG A 4 9.402 -4.860 -0.180 1.00 0.00 H new ATOM 0 HA ARG A 4 10.381 -2.328 -1.348 1.00 0.00 H new ATOM 0 HB2 ARG A 4 10.912 -2.660 1.003 1.00 0.00 H new ATOM 0 HB3 ARG A 4 11.467 -4.295 0.707 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.478 -3.598 -0.233 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.772 -2.166 -0.954 1.00 0.00 H new ATOM 0 HD2 ARG A 4 14.172 -1.357 0.820 1.00 0.00 H new ATOM 0 HD3 ARG A 4 12.532 -1.213 1.420 1.00 0.00 H new ATOM 0 HE ARG A 4 13.618 -3.792 2.150 1.00 0.00 H new ATOM 0 HH11 ARG A 4 13.788 -0.324 2.888 1.00 0.00 H new ATOM 0 HH12 ARG A 4 14.282 -0.578 4.565 1.00 0.00 H new ATOM 0 HH21 ARG A 4 14.262 -4.120 4.331 1.00 0.00 H new ATOM 0 HH22 ARG A 4 14.551 -2.730 5.383 1.00 0.00 H new ATOM 77 N LEU A 5 11.639 -3.363 -3.202 1.00 0.00 N ATOM 78 CA LEU A 5 12.359 -3.943 -4.319 1.00 0.00 C ATOM 79 C LEU A 5 13.675 -3.207 -4.521 1.00 0.00 C ATOM 80 O LEU A 5 13.752 -1.997 -4.320 1.00 0.00 O ATOM 81 CB LEU A 5 11.496 -3.863 -5.575 1.00 0.00 C ATOM 82 CG LEU A 5 10.912 -5.241 -5.878 1.00 0.00 C ATOM 83 CD1 LEU A 5 10.316 -5.832 -4.605 1.00 0.00 C ATOM 84 CD2 LEU A 5 9.823 -5.110 -6.938 1.00 0.00 C ATOM 0 H LEU A 5 11.397 -2.380 -3.324 1.00 0.00 H new ATOM 0 HA LEU A 5 12.579 -4.990 -4.112 1.00 0.00 H new ATOM 0 HB2 LEU A 5 10.694 -3.139 -5.433 1.00 0.00 H new ATOM 0 HB3 LEU A 5 12.093 -3.515 -6.418 1.00 0.00 H new ATOM 0 HG LEU A 5 11.700 -5.897 -6.247 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.899 -6.816 -4.821 1.00 0.00 H new ATOM 0 HD12 LEU A 5 11.095 -5.926 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.527 -5.177 -4.234 1.00 0.00 H new ATOM 0 HD21 LEU A 5 9.406 -6.093 -7.155 1.00 0.00 H new ATOM 0 HD22 LEU A 5 9.034 -4.454 -6.570 1.00 0.00 H new ATOM 0 HD23 LEU A 5 10.250 -4.689 -7.848 1.00 0.00 H new ATOM 96 N CYS A 6 14.715 -3.943 -4.925 1.00 0.00 N ATOM 97 CA CYS A 6 16.021 -3.360 -5.154 1.00 0.00 C ATOM 98 C CYS A 6 16.733 -4.114 -6.268 1.00 0.00 C ATOM 99 O CYS A 6 16.436 -5.280 -6.519 1.00 0.00 O ATOM 100 CB CYS A 6 16.834 -3.409 -3.863 1.00 0.00 C ATOM 101 SG CYS A 6 15.848 -3.160 -2.365 1.00 0.00 S ATOM 0 H CYS A 6 14.667 -4.947 -5.098 1.00 0.00 H new ATOM 0 HA CYS A 6 15.910 -2.319 -5.458 1.00 0.00 H new ATOM 0 HB2 CYS A 6 17.337 -4.374 -3.799 1.00 0.00 H new ATOM 0 HB3 CYS A 6 17.611 -2.646 -3.906 1.00 0.00 H new ATOM 106 N LYS A 7 17.675 -3.445 -6.937 1.00 0.00 N ATOM 107 CA LYS A 7 18.421 -4.055 -8.019 1.00 0.00 C ATOM 108 C LYS A 7 19.561 -4.893 -7.454 1.00 0.00 C ATOM 109 O LYS A 7 20.445 -4.371 -6.780 1.00 0.00 O ATOM 110 CB LYS A 7 18.958 -2.965 -8.942 1.00 0.00 C ATOM 111 CG LYS A 7 18.052 -2.844 -10.165 1.00 0.00 C ATOM 112 CD LYS A 7 17.782 -1.369 -10.452 1.00 0.00 C ATOM 113 CE LYS A 7 16.447 -1.230 -11.180 1.00 0.00 C ATOM 114 NZ LYS A 7 16.636 -0.655 -12.521 1.00 0.00 N ATOM 0 H LYS A 7 17.933 -2.478 -6.741 1.00 0.00 H new ATOM 0 HA LYS A 7 17.766 -4.710 -8.593 1.00 0.00 H new ATOM 0 HB2 LYS A 7 19.001 -2.013 -8.412 1.00 0.00 H new ATOM 0 HB3 LYS A 7 19.975 -3.204 -9.252 1.00 0.00 H new ATOM 0 HG2 LYS A 7 18.523 -3.313 -11.028 1.00 0.00 H new ATOM 0 HG3 LYS A 7 17.113 -3.369 -9.989 1.00 0.00 H new ATOM 0 HD2 LYS A 7 17.761 -0.804 -9.520 1.00 0.00 H new ATOM 0 HD3 LYS A 7 18.585 -0.952 -11.060 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.970 -2.207 -11.263 1.00 0.00 H new ATOM 0 HE3 LYS A 7 15.776 -0.596 -10.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 15.714 -0.571 -12.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.070 0.286 -12.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.258 -1.274 -13.080 1.00 0.00 H new ATOM 128 N PHE A 8 19.535 -6.199 -7.733 1.00 0.00 N ATOM 129 CA PHE A 8 20.563 -7.100 -7.254 1.00 0.00 C ATOM 130 C PHE A 8 21.440 -7.548 -8.413 1.00 0.00 C ATOM 131 O PHE A 8 21.277 -8.653 -8.927 1.00 0.00 O ATOM 132 CB PHE A 8 19.909 -8.300 -6.573 1.00 0.00 C ATOM 133 CG PHE A 8 20.787 -8.958 -5.537 1.00 0.00 C ATOM 134 CD1 PHE A 8 21.796 -9.843 -5.934 1.00 0.00 C ATOM 135 CD2 PHE A 8 20.594 -8.682 -4.178 1.00 0.00 C ATOM 136 CE1 PHE A 8 22.612 -10.452 -4.972 1.00 0.00 C ATOM 137 CE2 PHE A 8 21.409 -9.290 -3.217 1.00 0.00 C ATOM 138 CZ PHE A 8 22.418 -10.176 -3.614 1.00 0.00 C ATOM 0 H PHE A 8 18.808 -6.648 -8.290 1.00 0.00 H new ATOM 0 HA PHE A 8 21.193 -6.586 -6.528 1.00 0.00 H new ATOM 0 HB2 PHE A 8 18.981 -7.978 -6.100 1.00 0.00 H new ATOM 0 HB3 PHE A 8 19.641 -9.036 -7.331 1.00 0.00 H new ATOM 0 HD1 PHE A 8 21.945 -10.056 -6.982 1.00 0.00 H new ATOM 0 HD2 PHE A 8 19.815 -7.999 -3.871 1.00 0.00 H new ATOM 0 HE1 PHE A 8 23.391 -11.135 -5.278 1.00 0.00 H new ATOM 0 HE2 PHE A 8 21.260 -9.076 -2.169 1.00 0.00 H new ATOM 0 HZ PHE A 8 23.046 -10.646 -2.872 1.00 0.00 H new ATOM 148 N CYS A 9 22.372 -6.687 -8.826 1.00 0.00 N ATOM 149 CA CYS A 9 23.270 -6.996 -9.922 1.00 0.00 C ATOM 150 C CYS A 9 24.713 -6.909 -9.446 1.00 0.00 C ATOM 151 O CYS A 9 25.045 -6.063 -8.618 1.00 0.00 O ATOM 152 CB CYS A 9 23.019 -6.026 -11.072 1.00 0.00 C ATOM 153 SG CYS A 9 21.486 -6.341 -11.981 1.00 0.00 S ATOM 0 H CYS A 9 22.519 -5.767 -8.410 1.00 0.00 H new ATOM 0 HA CYS A 9 23.086 -8.011 -10.274 1.00 0.00 H new ATOM 0 HB2 CYS A 9 22.993 -5.010 -10.678 1.00 0.00 H new ATOM 0 HB3 CYS A 9 23.858 -6.077 -11.766 1.00 0.00 H new ATOM 158 N ASP A 10 25.570 -7.787 -9.971 1.00 0.00 N ATOM 159 CA ASP A 10 26.970 -7.805 -9.598 1.00 0.00 C ATOM 160 C ASP A 10 27.671 -6.581 -10.168 1.00 0.00 C ATOM 161 O ASP A 10 27.126 -5.897 -11.031 1.00 0.00 O ATOM 162 CB ASP A 10 27.617 -9.088 -10.113 1.00 0.00 C ATOM 163 CG ASP A 10 26.605 -10.225 -10.161 1.00 0.00 C ATOM 164 OD1 ASP A 10 25.934 -10.341 -11.209 1.00 0.00 O ATOM 165 OD2 ASP A 10 26.523 -10.954 -9.150 1.00 0.00 O ATOM 0 H ASP A 10 25.309 -8.494 -10.658 1.00 0.00 H new ATOM 0 HA ASP A 10 27.061 -7.779 -8.512 1.00 0.00 H new ATOM 0 HB2 ASP A 10 28.028 -8.919 -11.108 1.00 0.00 H new ATOM 0 HB3 ASP A 10 28.450 -9.364 -9.467 1.00 0.00 H new ATOM 170 N VAL A 11 28.884 -6.305 -9.684 1.00 0.00 N ATOM 171 CA VAL A 11 29.653 -5.167 -10.147 1.00 0.00 C ATOM 172 C VAL A 11 30.299 -5.492 -11.486 1.00 0.00 C ATOM 173 O VAL A 11 31.167 -6.360 -11.564 1.00 0.00 O ATOM 174 CB VAL A 11 30.712 -4.812 -9.107 1.00 0.00 C ATOM 175 CG1 VAL A 11 30.887 -5.979 -8.140 1.00 0.00 C ATOM 176 CG2 VAL A 11 32.036 -4.528 -9.807 1.00 0.00 C ATOM 0 H VAL A 11 29.350 -6.862 -8.968 1.00 0.00 H new ATOM 0 HA VAL A 11 28.995 -4.309 -10.283 1.00 0.00 H new ATOM 0 HB VAL A 11 30.396 -3.927 -8.554 1.00 0.00 H new ATOM 0 HG11 VAL A 11 31.643 -5.726 -7.397 1.00 0.00 H new ATOM 0 HG12 VAL A 11 29.940 -6.182 -7.639 1.00 0.00 H new ATOM 0 HG13 VAL A 11 31.203 -6.864 -8.692 1.00 0.00 H new ATOM 0 HG21 VAL A 11 32.793 -4.274 -9.065 1.00 0.00 H new ATOM 0 HG22 VAL A 11 32.352 -5.412 -10.360 1.00 0.00 H new ATOM 0 HG23 VAL A 11 31.911 -3.694 -10.497 1.00 0.00 H new ATOM 186 N LYS A 12 29.874 -4.793 -12.541 1.00 0.00 N ATOM 187 CA LYS A 12 30.413 -5.011 -13.868 1.00 0.00 C ATOM 188 C LYS A 12 30.679 -3.675 -14.546 1.00 0.00 C ATOM 189 O LYS A 12 30.142 -2.649 -14.134 1.00 0.00 O ATOM 190 CB LYS A 12 29.431 -5.846 -14.685 1.00 0.00 C ATOM 191 CG LYS A 12 28.039 -5.743 -14.065 1.00 0.00 C ATOM 192 CD LYS A 12 27.580 -4.288 -14.085 1.00 0.00 C ATOM 193 CE LYS A 12 26.170 -4.193 -13.509 1.00 0.00 C ATOM 194 NZ LYS A 12 25.226 -3.665 -14.507 1.00 0.00 N ATOM 0 H LYS A 12 29.155 -4.071 -12.492 1.00 0.00 H new ATOM 0 HA LYS A 12 31.357 -5.551 -13.795 1.00 0.00 H new ATOM 0 HB2 LYS A 12 29.409 -5.495 -15.717 1.00 0.00 H new ATOM 0 HB3 LYS A 12 29.754 -6.887 -14.710 1.00 0.00 H new ATOM 0 HG2 LYS A 12 27.336 -6.365 -14.619 1.00 0.00 H new ATOM 0 HG3 LYS A 12 28.057 -6.116 -13.041 1.00 0.00 H new ATOM 0 HD2 LYS A 12 28.265 -3.671 -13.503 1.00 0.00 H new ATOM 0 HD3 LYS A 12 27.594 -3.905 -15.105 1.00 0.00 H new ATOM 0 HE2 LYS A 12 25.841 -5.178 -13.178 1.00 0.00 H new ATOM 0 HE3 LYS A 12 26.175 -3.547 -12.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 24.303 -3.499 -14.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 25.591 -2.770 -14.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 25.116 -4.353 -15.279 1.00 0.00 H new ATOM 208 N ALA A 13 31.511 -3.689 -15.589 1.00 0.00 N ATOM 209 CA ALA A 13 31.845 -2.482 -16.318 1.00 0.00 C ATOM 210 C ALA A 13 30.587 -1.657 -16.551 1.00 0.00 C ATOM 211 O ALA A 13 29.662 -2.107 -17.222 1.00 0.00 O ATOM 212 CB ALA A 13 32.502 -2.854 -17.643 1.00 0.00 C ATOM 0 H ALA A 13 31.964 -4.532 -15.943 1.00 0.00 H new ATOM 0 HA ALA A 13 32.546 -1.883 -15.737 1.00 0.00 H new ATOM 0 HB1 ALA A 13 32.753 -1.946 -18.192 1.00 0.00 H new ATOM 0 HB2 ALA A 13 33.410 -3.425 -17.451 1.00 0.00 H new ATOM 0 HB3 ALA A 13 31.813 -3.456 -18.234 1.00 0.00 H new ATOM 218 N THR A 14 30.556 -0.443 -15.994 1.00 0.00 N ATOM 219 CA THR A 14 29.414 0.434 -16.146 1.00 0.00 C ATOM 220 C THR A 14 29.854 1.756 -16.757 1.00 0.00 C ATOM 221 O THR A 14 30.823 2.364 -16.306 1.00 0.00 O ATOM 222 CB THR A 14 28.761 0.659 -14.785 1.00 0.00 C ATOM 223 OG1 THR A 14 27.537 1.336 -14.958 1.00 0.00 O ATOM 224 CG2 THR A 14 29.687 1.497 -13.909 1.00 0.00 C ATOM 0 H THR A 14 31.315 -0.054 -15.435 1.00 0.00 H new ATOM 0 HA THR A 14 28.685 -0.026 -16.813 1.00 0.00 H new ATOM 0 HB THR A 14 28.580 -0.303 -14.305 1.00 0.00 H new ATOM 0 HG1 THR A 14 26.806 0.785 -14.609 1.00 0.00 H new ATOM 0 HG21 THR A 14 29.221 1.658 -12.937 1.00 0.00 H new ATOM 0 HG22 THR A 14 30.634 0.974 -13.775 1.00 0.00 H new ATOM 0 HG23 THR A 14 29.869 2.459 -14.388 1.00 0.00 H new ATOM 232 N THR A 15 29.136 2.204 -17.790 1.00 0.00 N ATOM 233 CA THR A 15 29.456 3.451 -18.456 1.00 0.00 C ATOM 234 C THR A 15 28.786 4.611 -17.734 1.00 0.00 C ATOM 235 O THR A 15 28.666 5.704 -18.283 1.00 0.00 O ATOM 236 CB THR A 15 28.997 3.383 -19.910 1.00 0.00 C ATOM 237 OG1 THR A 15 29.442 4.531 -20.598 1.00 0.00 O ATOM 238 CG2 THR A 15 27.474 3.318 -19.961 1.00 0.00 C ATOM 0 H THR A 15 28.329 1.715 -18.178 1.00 0.00 H new ATOM 0 HA THR A 15 30.534 3.611 -18.435 1.00 0.00 H new ATOM 0 HB THR A 15 29.414 2.493 -20.381 1.00 0.00 H new ATOM 0 HG1 THR A 15 29.234 5.330 -20.070 1.00 0.00 H new ATOM 0 HG21 THR A 15 27.146 3.269 -20.999 1.00 0.00 H new ATOM 0 HG22 THR A 15 27.130 2.430 -19.430 1.00 0.00 H new ATOM 0 HG23 THR A 15 27.056 4.208 -19.490 1.00 0.00 H new ATOM 246 N CYS A 16 28.347 4.369 -16.496 1.00 0.00 N ATOM 247 CA CYS A 16 27.692 5.390 -15.703 1.00 0.00 C ATOM 248 C CYS A 16 28.650 6.546 -15.460 1.00 0.00 C ATOM 249 O CYS A 16 29.837 6.333 -15.222 1.00 0.00 O ATOM 250 CB CYS A 16 27.225 4.786 -14.382 1.00 0.00 C ATOM 251 SG CYS A 16 25.770 5.598 -13.674 1.00 0.00 S ATOM 0 H CYS A 16 28.438 3.468 -16.027 1.00 0.00 H new ATOM 0 HA CYS A 16 26.823 5.771 -16.239 1.00 0.00 H new ATOM 0 HB2 CYS A 16 27.000 3.731 -14.536 1.00 0.00 H new ATOM 0 HB3 CYS A 16 28.042 4.836 -13.662 1.00 0.00 H new ATOM 256 N SER A 17 28.133 7.775 -15.519 1.00 0.00 N ATOM 257 CA SER A 17 28.944 8.957 -15.304 1.00 0.00 C ATOM 258 C SER A 17 28.601 9.581 -13.959 1.00 0.00 C ATOM 259 O SER A 17 27.435 9.630 -13.572 1.00 0.00 O ATOM 260 CB SER A 17 28.706 9.950 -16.438 1.00 0.00 C ATOM 261 OG SER A 17 27.758 10.910 -16.030 1.00 0.00 O ATOM 0 H SER A 17 27.151 7.969 -15.715 1.00 0.00 H new ATOM 0 HA SER A 17 29.999 8.682 -15.295 1.00 0.00 H new ATOM 0 HB2 SER A 17 29.641 10.439 -16.710 1.00 0.00 H new ATOM 0 HB3 SER A 17 28.351 9.427 -17.326 1.00 0.00 H new ATOM 0 HG SER A 17 27.606 11.549 -16.757 1.00 0.00 H new ATOM 267 N ASN A 18 29.622 10.061 -13.245 1.00 0.00 N ATOM 268 CA ASN A 18 29.424 10.681 -11.950 1.00 0.00 C ATOM 269 C ASN A 18 28.658 11.987 -12.112 1.00 0.00 C ATOM 270 O ASN A 18 29.052 13.014 -11.564 1.00 0.00 O ATOM 271 CB ASN A 18 30.778 10.927 -11.293 1.00 0.00 C ATOM 272 CG ASN A 18 31.781 11.468 -12.302 1.00 0.00 C ATOM 273 OD1 ASN A 18 32.601 10.718 -12.827 1.00 0.00 O ATOM 274 ND2 ASN A 18 31.714 12.774 -12.573 1.00 0.00 N ATOM 0 H ASN A 18 30.595 10.028 -13.551 1.00 0.00 H new ATOM 0 HA ASN A 18 28.839 10.018 -11.312 1.00 0.00 H new ATOM 0 HB2 ASN A 18 30.665 11.634 -10.472 1.00 0.00 H new ATOM 0 HB3 ASN A 18 31.153 9.998 -10.864 1.00 0.00 H new ATOM 0 HD21 ASN A 18 32.362 13.190 -13.242 1.00 0.00 H new ATOM 0 HD22 ASN A 18 31.015 13.356 -12.111 1.00 0.00 H new ATOM 281 N GLN A 19 27.558 11.943 -12.868 1.00 0.00 N ATOM 282 CA GLN A 19 26.743 13.120 -13.098 1.00 0.00 C ATOM 283 C GLN A 19 25.689 13.239 -12.007 1.00 0.00 C ATOM 284 O GLN A 19 25.461 12.296 -11.253 1.00 0.00 O ATOM 285 CB GLN A 19 26.088 13.021 -14.473 1.00 0.00 C ATOM 286 CG GLN A 19 25.192 14.234 -14.700 1.00 0.00 C ATOM 287 CD GLN A 19 25.858 15.504 -14.188 1.00 0.00 C ATOM 288 OE1 GLN A 19 27.050 15.711 -14.403 1.00 0.00 O ATOM 289 NE2 GLN A 19 25.083 16.354 -13.510 1.00 0.00 N ATOM 0 H GLN A 19 27.218 11.099 -13.329 1.00 0.00 H new ATOM 0 HA GLN A 19 27.369 14.012 -13.070 1.00 0.00 H new ATOM 0 HB2 GLN A 19 26.852 12.970 -15.248 1.00 0.00 H new ATOM 0 HB3 GLN A 19 25.502 12.105 -14.543 1.00 0.00 H new ATOM 0 HG2 GLN A 19 24.974 14.336 -15.763 1.00 0.00 H new ATOM 0 HG3 GLN A 19 24.239 14.088 -14.191 1.00 0.00 H new ATOM 0 HE21 GLN A 19 24.098 16.136 -13.358 1.00 0.00 H new ATOM 0 HE22 GLN A 19 25.476 17.221 -13.144 1.00 0.00 H new ATOM 298 N ASP A 20 25.045 14.406 -11.924 1.00 0.00 N ATOM 299 CA ASP A 20 24.020 14.644 -10.927 1.00 0.00 C ATOM 300 C ASP A 20 23.124 13.420 -10.807 1.00 0.00 C ATOM 301 O ASP A 20 22.740 13.035 -9.705 1.00 0.00 O ATOM 302 CB ASP A 20 23.206 15.874 -11.319 1.00 0.00 C ATOM 303 CG ASP A 20 22.172 15.526 -12.380 1.00 0.00 C ATOM 304 OD1 ASP A 20 22.581 15.416 -13.556 1.00 0.00 O ATOM 305 OD2 ASP A 20 20.992 15.378 -11.995 1.00 0.00 O ATOM 0 H ASP A 20 25.222 15.198 -12.542 1.00 0.00 H new ATOM 0 HA ASP A 20 24.485 14.826 -9.958 1.00 0.00 H new ATOM 0 HB2 ASP A 20 22.707 16.280 -10.439 1.00 0.00 H new ATOM 0 HB3 ASP A 20 23.872 16.651 -11.695 1.00 0.00 H new ATOM 310 N GLN A 21 22.790 12.808 -11.946 1.00 0.00 N ATOM 311 CA GLN A 21 21.941 11.634 -11.962 1.00 0.00 C ATOM 312 C GLN A 21 22.566 10.556 -12.837 1.00 0.00 C ATOM 313 O GLN A 21 23.024 10.839 -13.942 1.00 0.00 O ATOM 314 CB GLN A 21 20.558 12.016 -12.480 1.00 0.00 C ATOM 315 CG GLN A 21 19.684 10.768 -12.569 1.00 0.00 C ATOM 316 CD GLN A 21 18.696 10.878 -13.721 1.00 0.00 C ATOM 317 OE1 GLN A 21 18.672 10.024 -14.605 1.00 0.00 O ATOM 318 NE2 GLN A 21 17.879 11.934 -13.710 1.00 0.00 N ATOM 0 H GLN A 21 23.101 13.114 -12.868 1.00 0.00 H new ATOM 0 HA GLN A 21 21.840 11.239 -10.951 1.00 0.00 H new ATOM 0 HB2 GLN A 21 20.099 12.748 -11.815 1.00 0.00 H new ATOM 0 HB3 GLN A 21 20.642 12.485 -13.461 1.00 0.00 H new ATOM 0 HG2 GLN A 21 20.312 9.888 -12.706 1.00 0.00 H new ATOM 0 HG3 GLN A 21 19.143 10.630 -11.633 1.00 0.00 H new ATOM 0 HE21 GLN A 21 17.937 12.616 -12.954 1.00 0.00 H new ATOM 0 HE22 GLN A 21 17.197 12.059 -14.458 1.00 0.00 H new ATOM 327 N CYS A 22 22.582 9.317 -12.341 1.00 0.00 N ATOM 328 CA CYS A 22 23.148 8.205 -13.076 1.00 0.00 C ATOM 329 C CYS A 22 22.257 6.981 -12.925 1.00 0.00 C ATOM 330 O CYS A 22 21.328 6.982 -12.120 1.00 0.00 O ATOM 331 CB CYS A 22 24.555 7.917 -12.560 1.00 0.00 C ATOM 332 SG CYS A 22 25.733 7.456 -13.853 1.00 0.00 S ATOM 0 H CYS A 22 22.205 9.067 -11.427 1.00 0.00 H new ATOM 0 HA CYS A 22 23.209 8.457 -14.135 1.00 0.00 H new ATOM 0 HB2 CYS A 22 24.928 8.800 -12.041 1.00 0.00 H new ATOM 0 HB3 CYS A 22 24.504 7.113 -11.826 1.00 0.00 H new ATOM 337 N THR A 23 22.540 5.933 -13.703 1.00 0.00 N ATOM 338 CA THR A 23 21.763 4.712 -13.649 1.00 0.00 C ATOM 339 C THR A 23 22.623 3.573 -13.120 1.00 0.00 C ATOM 340 O THR A 23 23.847 3.619 -13.214 1.00 0.00 O ATOM 341 CB THR A 23 21.232 4.386 -15.041 1.00 0.00 C ATOM 342 OG1 THR A 23 20.500 5.486 -15.534 1.00 0.00 O ATOM 343 CG2 THR A 23 20.322 3.163 -14.966 1.00 0.00 C ATOM 0 H THR A 23 23.306 5.915 -14.377 1.00 0.00 H new ATOM 0 HA THR A 23 20.918 4.845 -12.973 1.00 0.00 H new ATOM 0 HB THR A 23 22.068 4.176 -15.708 1.00 0.00 H new ATOM 0 HG1 THR A 23 20.160 5.278 -16.429 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.943 2.930 -15.961 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.887 2.312 -14.585 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.486 3.372 -14.299 1.00 0.00 H new ATOM 351 N SER A 24 21.976 2.548 -12.561 1.00 0.00 N ATOM 352 CA SER A 24 22.682 1.403 -12.021 1.00 0.00 C ATOM 353 C SER A 24 23.045 0.443 -13.146 1.00 0.00 C ATOM 354 O SER A 24 23.977 -0.348 -13.015 1.00 0.00 O ATOM 355 CB SER A 24 21.806 0.710 -10.981 1.00 0.00 C ATOM 356 OG SER A 24 20.522 0.488 -11.521 1.00 0.00 O ATOM 0 H SER A 24 20.961 2.495 -12.474 1.00 0.00 H new ATOM 0 HA SER A 24 23.603 1.733 -11.540 1.00 0.00 H new ATOM 0 HB2 SER A 24 22.256 -0.237 -10.684 1.00 0.00 H new ATOM 0 HB3 SER A 24 21.734 1.324 -10.083 1.00 0.00 H new ATOM 0 HG SER A 24 20.476 -0.417 -11.894 1.00 0.00 H new ATOM 362 N ASN A 25 22.304 0.514 -14.255 1.00 0.00 N ATOM 363 CA ASN A 25 22.552 -0.344 -15.394 1.00 0.00 C ATOM 364 C ASN A 25 22.126 -1.770 -15.072 1.00 0.00 C ATOM 365 O ASN A 25 22.167 -2.644 -15.935 1.00 0.00 O ATOM 366 CB ASN A 25 24.034 -0.293 -15.755 1.00 0.00 C ATOM 367 CG ASN A 25 24.268 -0.802 -17.170 1.00 0.00 C ATOM 368 OD1 ASN A 25 23.499 -0.492 -18.077 1.00 0.00 O ATOM 369 ND2 ASN A 25 25.333 -1.584 -17.358 1.00 0.00 N ATOM 0 H ASN A 25 21.527 1.163 -14.379 1.00 0.00 H new ATOM 0 HA ASN A 25 21.970 0.004 -16.247 1.00 0.00 H new ATOM 0 HB2 ASN A 25 24.398 0.731 -15.668 1.00 0.00 H new ATOM 0 HB3 ASN A 25 24.605 -0.896 -15.049 1.00 0.00 H new ATOM 0 HD21 ASN A 25 25.538 -1.952 -18.287 1.00 0.00 H new ATOM 0 HD22 ASN A 25 25.942 -1.813 -16.573 1.00 0.00 H new ATOM 376 N CYS A 26 21.713 -2.001 -13.824 1.00 0.00 N ATOM 377 CA CYS A 26 21.281 -3.315 -13.392 1.00 0.00 C ATOM 378 C CYS A 26 19.993 -3.694 -14.112 1.00 0.00 C ATOM 379 O CYS A 26 19.318 -2.836 -14.674 1.00 0.00 O ATOM 380 CB CYS A 26 21.074 -3.310 -11.880 1.00 0.00 C ATOM 381 SG CYS A 26 20.463 -4.879 -11.217 1.00 0.00 S ATOM 0 H CYS A 26 21.672 -1.286 -13.098 1.00 0.00 H new ATOM 0 HA CYS A 26 22.044 -4.054 -13.638 1.00 0.00 H new ATOM 0 HB2 CYS A 26 22.019 -3.065 -11.395 1.00 0.00 H new ATOM 0 HB3 CYS A 26 20.369 -2.519 -11.622 1.00 0.00 H new ATOM 386 N ASN A 27 19.655 -4.986 -14.091 1.00 0.00 N ATOM 387 CA ASN A 27 18.452 -5.469 -14.739 1.00 0.00 C ATOM 388 C ASN A 27 17.842 -6.599 -13.923 1.00 0.00 C ATOM 389 O ASN A 27 17.180 -7.479 -14.470 1.00 0.00 O ATOM 390 CB ASN A 27 18.792 -5.944 -16.149 1.00 0.00 C ATOM 391 CG ASN A 27 18.387 -4.905 -17.185 1.00 0.00 C ATOM 392 OD1 ASN A 27 17.287 -4.968 -17.731 1.00 0.00 O ATOM 393 ND2 ASN A 27 19.277 -3.947 -17.453 1.00 0.00 N ATOM 0 H ASN A 27 20.204 -5.711 -13.629 1.00 0.00 H new ATOM 0 HA ASN A 27 17.722 -4.662 -14.806 1.00 0.00 H new ATOM 0 HB2 ASN A 27 19.862 -6.139 -16.223 1.00 0.00 H new ATOM 0 HB3 ASN A 27 18.281 -6.885 -16.353 1.00 0.00 H new ATOM 0 HD21 ASN A 27 19.057 -3.224 -18.138 1.00 0.00 H new ATOM 0 HD22 ASN A 27 20.177 -3.938 -16.973 1.00 0.00 H new ATOM 400 N ILE A 28 18.066 -6.573 -12.607 1.00 0.00 N ATOM 401 CA ILE A 28 17.537 -7.590 -11.719 1.00 0.00 C ATOM 402 C ILE A 28 16.675 -6.939 -10.647 1.00 0.00 C ATOM 403 O ILE A 28 16.951 -5.821 -10.219 1.00 0.00 O ATOM 404 CB ILE A 28 18.692 -8.364 -11.090 1.00 0.00 C ATOM 405 CG1 ILE A 28 19.484 -9.076 -12.182 1.00 0.00 C ATOM 406 CG2 ILE A 28 18.139 -9.394 -10.109 1.00 0.00 C ATOM 407 CD1 ILE A 28 20.436 -10.084 -11.546 1.00 0.00 C ATOM 0 H ILE A 28 18.614 -5.851 -12.139 1.00 0.00 H new ATOM 0 HA ILE A 28 16.916 -8.286 -12.283 1.00 0.00 H new ATOM 0 HB ILE A 28 19.347 -7.672 -10.561 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.804 -9.584 -12.867 1.00 0.00 H new ATOM 0 HG13 ILE A 28 20.046 -8.350 -12.770 1.00 0.00 H new ATOM 0 HG21 ILE A 28 18.963 -9.947 -9.659 1.00 0.00 H new ATOM 0 HG22 ILE A 28 17.574 -8.886 -9.328 1.00 0.00 H new ATOM 0 HG23 ILE A 28 17.484 -10.086 -10.639 1.00 0.00 H new ATOM 0 HD11 ILE A 28 21.002 -10.593 -12.327 1.00 0.00 H new ATOM 0 HD12 ILE A 28 21.124 -9.564 -10.879 1.00 0.00 H new ATOM 0 HD13 ILE A 28 19.863 -10.816 -10.977 1.00 0.00 H new ATOM 419 N THR A 29 15.628 -7.643 -10.211 1.00 0.00 N ATOM 420 CA THR A 29 14.735 -7.129 -9.193 1.00 0.00 C ATOM 421 C THR A 29 14.683 -8.091 -8.015 1.00 0.00 C ATOM 422 O THR A 29 14.025 -9.126 -8.082 1.00 0.00 O ATOM 423 CB THR A 29 13.345 -6.930 -9.790 1.00 0.00 C ATOM 424 OG1 THR A 29 13.420 -6.019 -10.863 1.00 0.00 O ATOM 425 CG2 THR A 29 12.405 -6.378 -8.721 1.00 0.00 C ATOM 0 H THR A 29 15.385 -8.572 -10.554 1.00 0.00 H new ATOM 0 HA THR A 29 15.104 -6.168 -8.834 1.00 0.00 H new ATOM 0 HB THR A 29 12.965 -7.886 -10.150 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.528 -5.892 -11.248 1.00 0.00 H new ATOM 0 HG21 THR A 29 11.412 -6.236 -9.148 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.346 -7.081 -7.890 1.00 0.00 H new ATOM 0 HG23 THR A 29 12.785 -5.422 -8.361 1.00 0.00 H new ATOM 433 N SER A 30 15.381 -7.743 -6.931 1.00 0.00 N ATOM 434 CA SER A 30 15.411 -8.574 -5.743 1.00 0.00 C ATOM 435 C SER A 30 14.356 -8.099 -4.755 1.00 0.00 C ATOM 436 O SER A 30 14.286 -6.912 -4.439 1.00 0.00 O ATOM 437 CB SER A 30 16.802 -8.518 -5.120 1.00 0.00 C ATOM 438 OG SER A 30 17.176 -7.173 -4.926 1.00 0.00 O ATOM 0 H SER A 30 15.932 -6.887 -6.860 1.00 0.00 H new ATOM 0 HA SER A 30 15.189 -9.607 -6.010 1.00 0.00 H new ATOM 0 HB2 SER A 30 16.807 -9.049 -4.168 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.523 -9.017 -5.768 1.00 0.00 H new ATOM 0 HG SER A 30 16.517 -6.586 -5.352 1.00 0.00 H new ATOM 444 N ILE A 31 13.535 -9.030 -4.263 1.00 0.00 N ATOM 445 CA ILE A 31 12.491 -8.706 -3.311 1.00 0.00 C ATOM 446 C ILE A 31 13.084 -8.604 -1.913 1.00 0.00 C ATOM 447 O ILE A 31 13.893 -9.440 -1.517 1.00 0.00 O ATOM 448 CB ILE A 31 11.407 -9.778 -3.363 1.00 0.00 C ATOM 449 CG1 ILE A 31 10.865 -9.887 -4.785 1.00 0.00 C ATOM 450 CG2 ILE A 31 10.272 -9.399 -2.415 1.00 0.00 C ATOM 451 CD1 ILE A 31 9.580 -10.708 -4.780 1.00 0.00 C ATOM 0 H ILE A 31 13.581 -10.017 -4.515 1.00 0.00 H new ATOM 0 HA ILE A 31 12.044 -7.745 -3.566 1.00 0.00 H new ATOM 0 HB ILE A 31 11.830 -10.736 -3.061 1.00 0.00 H new ATOM 0 HG12 ILE A 31 10.672 -8.893 -5.189 1.00 0.00 H new ATOM 0 HG13 ILE A 31 11.606 -10.356 -5.433 1.00 0.00 H new ATOM 0 HG21 ILE A 31 9.497 -10.164 -2.451 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.658 -9.321 -1.398 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.850 -8.441 -2.717 1.00 0.00 H new ATOM 0 HD11 ILE A 31 9.194 -10.785 -5.796 1.00 0.00 H new ATOM 0 HD12 ILE A 31 9.787 -11.706 -4.394 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.839 -10.220 -4.146 1.00 0.00 H new ATOM 463 N CYS A 32 12.678 -7.576 -1.163 1.00 0.00 N ATOM 464 CA CYS A 32 13.169 -7.370 0.185 1.00 0.00 C ATOM 465 C CYS A 32 12.014 -6.996 1.101 1.00 0.00 C ATOM 466 O CYS A 32 12.120 -6.055 1.885 1.00 0.00 O ATOM 467 CB CYS A 32 14.231 -6.273 0.177 1.00 0.00 C ATOM 468 SG CYS A 32 15.765 -6.742 -0.662 1.00 0.00 S ATOM 0 H CYS A 32 12.007 -6.875 -1.477 1.00 0.00 H new ATOM 0 HA CYS A 32 13.620 -8.290 0.558 1.00 0.00 H new ATOM 0 HB2 CYS A 32 13.820 -5.387 -0.307 1.00 0.00 H new ATOM 0 HB3 CYS A 32 14.461 -5.996 1.206 1.00 0.00 H new ATOM 473 N GLU A 33 10.907 -7.736 1.002 1.00 0.00 N ATOM 474 CA GLU A 33 9.741 -7.478 1.823 1.00 0.00 C ATOM 475 C GLU A 33 10.037 -7.835 3.273 1.00 0.00 C ATOM 476 O GLU A 33 9.228 -7.570 4.159 1.00 0.00 O ATOM 477 CB GLU A 33 8.560 -8.288 1.296 1.00 0.00 C ATOM 478 CG GLU A 33 7.259 -7.695 1.828 1.00 0.00 C ATOM 479 CD GLU A 33 6.815 -8.407 3.097 1.00 0.00 C ATOM 480 OE1 GLU A 33 6.605 -9.638 3.013 1.00 0.00 O ATOM 481 OE2 GLU A 33 6.692 -7.710 4.126 1.00 0.00 O ATOM 0 H GLU A 33 10.802 -8.519 0.357 1.00 0.00 H new ATOM 0 HA GLU A 33 9.488 -6.419 1.777 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.557 -8.280 0.206 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.652 -9.329 1.607 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.396 -6.633 2.031 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.481 -7.777 1.069 1.00 0.00 H new ATOM 488 N LYS A 34 11.203 -8.439 3.512 1.00 0.00 N ATOM 489 CA LYS A 34 11.599 -8.828 4.850 1.00 0.00 C ATOM 490 C LYS A 34 12.094 -7.612 5.619 1.00 0.00 C ATOM 491 O LYS A 34 12.371 -7.697 6.813 1.00 0.00 O ATOM 492 CB LYS A 34 12.689 -9.894 4.767 1.00 0.00 C ATOM 493 CG LYS A 34 12.352 -11.041 5.716 1.00 0.00 C ATOM 494 CD LYS A 34 13.256 -10.969 6.943 1.00 0.00 C ATOM 495 CE LYS A 34 14.666 -11.412 6.562 1.00 0.00 C ATOM 496 NZ LYS A 34 15.254 -12.260 7.611 1.00 0.00 N ATOM 0 H LYS A 34 11.885 -8.666 2.788 1.00 0.00 H new ATOM 0 HA LYS A 34 10.741 -9.242 5.380 1.00 0.00 H new ATOM 0 HB2 LYS A 34 12.772 -10.265 3.746 1.00 0.00 H new ATOM 0 HB3 LYS A 34 13.655 -9.463 5.029 1.00 0.00 H new ATOM 0 HG2 LYS A 34 11.306 -10.982 6.018 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.484 -11.997 5.209 1.00 0.00 H new ATOM 0 HD2 LYS A 34 13.276 -9.952 7.334 1.00 0.00 H new ATOM 0 HD3 LYS A 34 12.864 -11.607 7.735 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.637 -11.960 5.620 1.00 0.00 H new ATOM 0 HE3 LYS A 34 15.295 -10.537 6.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 16.212 -12.548 7.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 15.302 -11.726 8.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 14.664 -13.106 7.745 1.00 0.00 H new ATOM 510 N ASN A 35 12.206 -6.475 4.928 1.00 0.00 N ATOM 511 CA ASN A 35 12.665 -5.247 5.548 1.00 0.00 C ATOM 512 C ASN A 35 14.030 -5.467 6.184 1.00 0.00 C ATOM 513 O ASN A 35 14.638 -4.532 6.700 1.00 0.00 O ATOM 514 CB ASN A 35 11.648 -4.795 6.592 1.00 0.00 C ATOM 515 CG ASN A 35 11.141 -3.393 6.285 1.00 0.00 C ATOM 516 OD1 ASN A 35 10.572 -3.157 5.222 1.00 0.00 O ATOM 517 ND2 ASN A 35 11.347 -2.464 7.221 1.00 0.00 N ATOM 0 H ASN A 35 11.982 -6.388 3.937 1.00 0.00 H new ATOM 0 HA ASN A 35 12.761 -4.468 4.792 1.00 0.00 H new ATOM 0 HB2 ASN A 35 10.810 -5.492 6.615 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.105 -4.812 7.582 1.00 0.00 H new ATOM 0 HD21 ASN A 35 11.026 -1.508 7.070 1.00 0.00 H new ATOM 0 HD22 ASN A 35 11.825 -2.710 8.088 1.00 0.00 H new ATOM 524 N ASN A 36 14.512 -6.712 6.147 1.00 0.00 N ATOM 525 CA ASN A 36 15.801 -7.048 6.718 1.00 0.00 C ATOM 526 C ASN A 36 16.912 -6.676 5.746 1.00 0.00 C ATOM 527 O ASN A 36 18.022 -7.195 5.837 1.00 0.00 O ATOM 528 CB ASN A 36 15.840 -8.539 7.037 1.00 0.00 C ATOM 529 CG ASN A 36 16.897 -8.841 8.090 1.00 0.00 C ATOM 530 OD1 ASN A 36 17.041 -8.099 9.060 1.00 0.00 O ATOM 531 ND2 ASN A 36 17.637 -9.936 7.900 1.00 0.00 N ATOM 0 H ASN A 36 14.021 -7.500 5.724 1.00 0.00 H new ATOM 0 HA ASN A 36 15.951 -6.487 7.640 1.00 0.00 H new ATOM 0 HB2 ASN A 36 14.863 -8.865 7.393 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.053 -9.104 6.129 1.00 0.00 H new ATOM 0 HD21 ASN A 36 18.359 -10.187 8.576 1.00 0.00 H new ATOM 0 HD22 ASN A 36 17.481 -10.521 7.079 1.00 0.00 H new ATOM 538 N GLU A 37 16.609 -5.770 4.813 1.00 0.00 N ATOM 539 CA GLU A 37 17.583 -5.334 3.832 1.00 0.00 C ATOM 540 C GLU A 37 17.035 -4.146 3.052 1.00 0.00 C ATOM 541 O GLU A 37 15.836 -4.063 2.800 1.00 0.00 O ATOM 542 CB GLU A 37 17.912 -6.491 2.894 1.00 0.00 C ATOM 543 CG GLU A 37 19.209 -7.158 3.345 1.00 0.00 C ATOM 544 CD GLU A 37 19.009 -8.653 3.547 1.00 0.00 C ATOM 545 OE1 GLU A 37 18.630 -9.314 2.556 1.00 0.00 O ATOM 546 OE2 GLU A 37 19.238 -9.107 4.688 1.00 0.00 O ATOM 0 H GLU A 37 15.694 -5.329 4.723 1.00 0.00 H new ATOM 0 HA GLU A 37 18.497 -5.021 4.336 1.00 0.00 H new ATOM 0 HB2 GLU A 37 17.098 -7.216 2.894 1.00 0.00 H new ATOM 0 HB3 GLU A 37 18.014 -6.127 1.872 1.00 0.00 H new ATOM 0 HG2 GLU A 37 19.988 -6.988 2.601 1.00 0.00 H new ATOM 0 HG3 GLU A 37 19.552 -6.704 4.275 1.00 0.00 H new ATOM 553 N VAL A 38 17.923 -3.225 2.668 1.00 0.00 N ATOM 554 CA VAL A 38 17.528 -2.049 1.919 1.00 0.00 C ATOM 555 C VAL A 38 18.191 -2.065 0.549 1.00 0.00 C ATOM 556 O VAL A 38 19.079 -2.877 0.296 1.00 0.00 O ATOM 557 CB VAL A 38 17.924 -0.796 2.696 1.00 0.00 C ATOM 558 CG1 VAL A 38 17.204 0.415 2.109 1.00 0.00 C ATOM 559 CG2 VAL A 38 17.530 -0.961 4.161 1.00 0.00 C ATOM 0 H VAL A 38 18.922 -3.280 2.869 1.00 0.00 H new ATOM 0 HA VAL A 38 16.447 -2.048 1.779 1.00 0.00 H new ATOM 0 HB VAL A 38 19.002 -0.648 2.624 1.00 0.00 H new ATOM 0 HG11 VAL A 38 17.486 1.310 2.663 1.00 0.00 H new ATOM 0 HG12 VAL A 38 17.484 0.533 1.062 1.00 0.00 H new ATOM 0 HG13 VAL A 38 16.126 0.268 2.182 1.00 0.00 H new ATOM 0 HG21 VAL A 38 17.812 -0.067 4.717 1.00 0.00 H new ATOM 0 HG22 VAL A 38 16.452 -1.108 4.234 1.00 0.00 H new ATOM 0 HG23 VAL A 38 18.043 -1.826 4.581 1.00 0.00 H new ATOM 569 N CYS A 39 17.755 -1.166 -0.337 1.00 0.00 N ATOM 570 CA CYS A 39 18.307 -1.081 -1.675 1.00 0.00 C ATOM 571 C CYS A 39 19.481 -0.114 -1.688 1.00 0.00 C ATOM 572 O CYS A 39 19.338 1.044 -1.300 1.00 0.00 O ATOM 573 CB CYS A 39 17.220 -0.625 -2.644 1.00 0.00 C ATOM 574 SG CYS A 39 15.584 -1.317 -2.293 1.00 0.00 S ATOM 0 H CYS A 39 17.018 -0.488 -0.143 1.00 0.00 H new ATOM 0 HA CYS A 39 18.667 -2.061 -1.988 1.00 0.00 H new ATOM 0 HB2 CYS A 39 17.157 0.463 -2.617 1.00 0.00 H new ATOM 0 HB3 CYS A 39 17.511 -0.902 -3.657 1.00 0.00 H new ATOM 579 N ALA A 40 20.645 -0.591 -2.133 1.00 0.00 N ATOM 580 CA ALA A 40 21.837 0.231 -2.192 1.00 0.00 C ATOM 581 C ALA A 40 22.631 -0.102 -3.447 1.00 0.00 C ATOM 582 O ALA A 40 22.740 -1.267 -3.824 1.00 0.00 O ATOM 583 CB ALA A 40 22.678 -0.004 -0.941 1.00 0.00 C ATOM 0 H ALA A 40 20.779 -1.549 -2.458 1.00 0.00 H new ATOM 0 HA ALA A 40 21.557 1.284 -2.232 1.00 0.00 H new ATOM 0 HB1 ALA A 40 23.575 0.614 -0.984 1.00 0.00 H new ATOM 0 HB2 ALA A 40 22.097 0.261 -0.057 1.00 0.00 H new ATOM 0 HB3 ALA A 40 22.963 -1.055 -0.886 1.00 0.00 H new ATOM 589 N ALA A 41 23.187 0.925 -4.094 1.00 0.00 N ATOM 590 CA ALA A 41 23.966 0.737 -5.301 1.00 0.00 C ATOM 591 C ALA A 41 25.282 1.491 -5.187 1.00 0.00 C ATOM 592 O ALA A 41 25.292 2.692 -4.925 1.00 0.00 O ATOM 593 CB ALA A 41 23.164 1.228 -6.503 1.00 0.00 C ATOM 0 H ALA A 41 23.106 1.896 -3.793 1.00 0.00 H new ATOM 0 HA ALA A 41 24.187 -0.322 -5.436 1.00 0.00 H new ATOM 0 HB1 ALA A 41 23.748 1.087 -7.412 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.236 0.661 -6.577 1.00 0.00 H new ATOM 0 HB3 ALA A 41 22.934 2.286 -6.379 1.00 0.00 H new ATOM 599 N VAL A 42 26.397 0.782 -5.385 1.00 0.00 N ATOM 600 CA VAL A 42 27.711 1.386 -5.304 1.00 0.00 C ATOM 601 C VAL A 42 28.361 1.392 -6.681 1.00 0.00 C ATOM 602 O VAL A 42 28.569 0.339 -7.277 1.00 0.00 O ATOM 603 CB VAL A 42 28.566 0.609 -4.307 1.00 0.00 C ATOM 604 CG1 VAL A 42 28.242 -0.878 -4.409 1.00 0.00 C ATOM 605 CG2 VAL A 42 30.042 0.831 -4.620 1.00 0.00 C ATOM 0 H VAL A 42 26.405 -0.214 -5.603 1.00 0.00 H new ATOM 0 HA VAL A 42 27.622 2.417 -4.961 1.00 0.00 H new ATOM 0 HB VAL A 42 28.353 0.958 -3.297 1.00 0.00 H new ATOM 0 HG11 VAL A 42 28.853 -1.433 -3.697 1.00 0.00 H new ATOM 0 HG12 VAL A 42 27.187 -1.037 -4.184 1.00 0.00 H new ATOM 0 HG13 VAL A 42 28.454 -1.228 -5.419 1.00 0.00 H new ATOM 0 HG21 VAL A 42 30.652 0.276 -3.908 1.00 0.00 H new ATOM 0 HG22 VAL A 42 30.256 0.483 -5.630 1.00 0.00 H new ATOM 0 HG23 VAL A 42 30.274 1.893 -4.546 1.00 0.00 H new ATOM 615 N TRP A 43 28.683 2.587 -7.184 1.00 0.00 N ATOM 616 CA TRP A 43 29.308 2.720 -8.486 1.00 0.00 C ATOM 617 C TRP A 43 30.774 3.093 -8.320 1.00 0.00 C ATOM 618 O TRP A 43 31.092 4.147 -7.774 1.00 0.00 O ATOM 619 CB TRP A 43 28.569 3.778 -9.297 1.00 0.00 C ATOM 620 CG TRP A 43 29.283 4.244 -10.525 1.00 0.00 C ATOM 621 CD1 TRP A 43 29.084 3.768 -11.773 1.00 0.00 C ATOM 622 CD2 TRP A 43 30.315 5.270 -10.651 1.00 0.00 C ATOM 623 NE1 TRP A 43 29.913 4.424 -12.657 1.00 0.00 N ATOM 624 CE2 TRP A 43 30.696 5.363 -12.016 1.00 0.00 C ATOM 625 CE3 TRP A 43 30.967 6.133 -9.751 1.00 0.00 C ATOM 626 CZ2 TRP A 43 31.670 6.260 -12.465 1.00 0.00 C ATOM 627 CZ3 TRP A 43 31.945 7.036 -10.191 1.00 0.00 C ATOM 628 CH2 TRP A 43 32.298 7.102 -11.544 1.00 0.00 C ATOM 0 H TRP A 43 28.518 3.471 -6.703 1.00 0.00 H new ATOM 0 HA TRP A 43 29.255 1.770 -9.018 1.00 0.00 H new ATOM 0 HB2 TRP A 43 27.598 3.378 -9.589 1.00 0.00 H new ATOM 0 HB3 TRP A 43 28.379 4.639 -8.656 1.00 0.00 H new ATOM 0 HD1 TRP A 43 28.382 2.991 -12.038 1.00 0.00 H new ATOM 0 HE1 TRP A 43 29.944 4.239 -13.660 1.00 0.00 H new ATOM 0 HE3 TRP A 43 30.709 6.099 -8.703 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 31.934 6.301 -13.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 32.431 7.687 -9.479 1.00 0.00 H new ATOM 0 HH2 TRP A 43 33.052 7.801 -11.874 1.00 0.00 H new ATOM 639 N ARG A 44 31.669 2.224 -8.795 1.00 0.00 N ATOM 640 CA ARG A 44 33.094 2.463 -8.698 1.00 0.00 C ATOM 641 C ARG A 44 33.649 2.838 -10.065 1.00 0.00 C ATOM 642 O ARG A 44 33.107 2.428 -11.090 1.00 0.00 O ATOM 643 CB ARG A 44 33.783 1.213 -8.159 1.00 0.00 C ATOM 644 CG ARG A 44 32.817 0.446 -7.262 1.00 0.00 C ATOM 645 CD ARG A 44 33.419 -0.910 -6.907 1.00 0.00 C ATOM 646 NE ARG A 44 34.763 -0.758 -6.347 1.00 0.00 N ATOM 647 CZ ARG A 44 35.647 -1.763 -6.298 1.00 0.00 C ATOM 648 NH1 ARG A 44 35.318 -2.970 -6.776 1.00 0.00 N ATOM 649 NH2 ARG A 44 36.863 -1.560 -5.772 1.00 0.00 N ATOM 0 H ARG A 44 31.421 1.346 -9.252 1.00 0.00 H new ATOM 0 HA ARG A 44 33.282 3.290 -8.013 1.00 0.00 H new ATOM 0 HB2 ARG A 44 34.110 0.580 -8.984 1.00 0.00 H new ATOM 0 HB3 ARG A 44 34.675 1.490 -7.597 1.00 0.00 H new ATOM 0 HG2 ARG A 44 32.617 1.016 -6.354 1.00 0.00 H new ATOM 0 HG3 ARG A 44 31.862 0.310 -7.770 1.00 0.00 H new ATOM 0 HD2 ARG A 44 32.777 -1.420 -6.188 1.00 0.00 H new ATOM 0 HD3 ARG A 44 33.461 -1.537 -7.797 1.00 0.00 H new ATOM 0 HE ARG A 44 35.038 0.152 -5.978 1.00 0.00 H new ATOM 0 HH11 ARG A 44 34.393 -3.125 -7.178 1.00 0.00 H new ATOM 0 HH12 ARG A 44 35.992 -3.735 -6.738 1.00 0.00 H new ATOM 0 HH21 ARG A 44 37.115 -0.641 -5.409 1.00 0.00 H new ATOM 0 HH22 ARG A 44 37.537 -2.325 -5.734 1.00 0.00 H new ATOM 663 N ARG A 45 34.731 3.618 -10.079 1.00 0.00 N ATOM 664 CA ARG A 45 35.352 4.044 -11.316 1.00 0.00 C ATOM 665 C ARG A 45 36.864 4.086 -11.148 1.00 0.00 C ATOM 666 O ARG A 45 37.391 4.969 -10.476 1.00 0.00 O ATOM 667 CB ARG A 45 34.813 5.417 -11.709 1.00 0.00 C ATOM 668 CG ARG A 45 35.160 6.429 -10.621 1.00 0.00 C ATOM 669 CD ARG A 45 36.240 7.378 -11.133 1.00 0.00 C ATOM 670 NE ARG A 45 35.934 8.763 -10.777 1.00 0.00 N ATOM 671 CZ ARG A 45 36.323 9.806 -11.523 1.00 0.00 C ATOM 672 NH1 ARG A 45 37.023 9.602 -12.646 1.00 0.00 N ATOM 673 NH2 ARG A 45 36.013 11.053 -11.143 1.00 0.00 N ATOM 0 H ARG A 45 35.191 3.965 -9.237 1.00 0.00 H new ATOM 0 HA ARG A 45 35.115 3.334 -12.109 1.00 0.00 H new ATOM 0 HB2 ARG A 45 35.242 5.729 -12.661 1.00 0.00 H new ATOM 0 HB3 ARG A 45 33.733 5.370 -11.846 1.00 0.00 H new ATOM 0 HG2 ARG A 45 34.271 6.992 -10.337 1.00 0.00 H new ATOM 0 HG3 ARG A 45 35.509 5.912 -9.727 1.00 0.00 H new ATOM 0 HD2 ARG A 45 37.206 7.096 -10.713 1.00 0.00 H new ATOM 0 HD3 ARG A 45 36.325 7.288 -12.216 1.00 0.00 H new ATOM 0 HE ARG A 45 35.402 8.943 -9.925 1.00 0.00 H new ATOM 0 HH11 ARG A 45 37.260 8.653 -12.934 1.00 0.00 H new ATOM 0 HH12 ARG A 45 37.319 10.396 -13.214 1.00 0.00 H new ATOM 0 HH21 ARG A 45 35.481 11.208 -10.286 1.00 0.00 H new ATOM 0 HH22 ARG A 45 36.309 11.847 -11.710 1.00 0.00 H new ATOM 687 N ASN A 46 37.562 3.127 -11.761 1.00 0.00 N ATOM 688 CA ASN A 46 39.007 3.062 -11.675 1.00 0.00 C ATOM 689 C ASN A 46 39.622 3.379 -13.031 1.00 0.00 C ATOM 690 O ASN A 46 39.229 2.807 -14.045 1.00 0.00 O ATOM 691 CB ASN A 46 39.425 1.672 -11.205 1.00 0.00 C ATOM 692 CG ASN A 46 38.829 0.593 -12.100 1.00 0.00 C ATOM 693 OD1 ASN A 46 39.314 0.365 -13.206 1.00 0.00 O ATOM 694 ND2 ASN A 46 37.776 -0.071 -11.618 1.00 0.00 N ATOM 0 H ASN A 46 37.140 2.387 -12.322 1.00 0.00 H new ATOM 0 HA ASN A 46 39.365 3.799 -10.956 1.00 0.00 H new ATOM 0 HB2 ASN A 46 40.512 1.594 -11.209 1.00 0.00 H new ATOM 0 HB3 ASN A 46 39.099 1.518 -10.176 1.00 0.00 H new ATOM 0 HD21 ASN A 46 37.337 -0.805 -12.174 1.00 0.00 H new ATOM 0 HD22 ASN A 46 37.410 0.155 -10.693 1.00 0.00 H new ATOM 701 N ASP A 47 40.592 4.296 -13.046 1.00 0.00 N ATOM 702 CA ASP A 47 41.257 4.686 -14.273 1.00 0.00 C ATOM 703 C ASP A 47 40.232 4.834 -15.389 1.00 0.00 C ATOM 704 O ASP A 47 39.562 5.860 -15.487 1.00 0.00 O ATOM 705 CB ASP A 47 42.306 3.640 -14.636 1.00 0.00 C ATOM 706 CG ASP A 47 43.664 4.004 -14.052 1.00 0.00 C ATOM 707 OD1 ASP A 47 43.831 3.790 -12.833 1.00 0.00 O ATOM 708 OD2 ASP A 47 44.507 4.490 -14.836 1.00 0.00 O ATOM 0 H ASP A 47 40.930 4.779 -12.214 1.00 0.00 H new ATOM 0 HA ASP A 47 41.754 5.646 -14.134 1.00 0.00 H new ATOM 0 HB2 ASP A 47 41.996 2.664 -14.263 1.00 0.00 H new ATOM 0 HB3 ASP A 47 42.383 3.558 -15.720 1.00 0.00 H new ATOM 713 N GLU A 48 40.111 3.805 -16.230 1.00 0.00 N ATOM 714 CA GLU A 48 39.168 3.829 -17.331 1.00 0.00 C ATOM 715 C GLU A 48 38.227 2.636 -17.234 1.00 0.00 C ATOM 716 O GLU A 48 37.548 2.296 -18.201 1.00 0.00 O ATOM 717 CB GLU A 48 39.932 3.809 -18.652 1.00 0.00 C ATOM 718 CG GLU A 48 40.648 2.470 -18.807 1.00 0.00 C ATOM 719 CD GLU A 48 41.137 2.278 -20.236 1.00 0.00 C ATOM 720 OE1 GLU A 48 42.259 2.748 -20.519 1.00 0.00 O ATOM 721 OE2 GLU A 48 40.378 1.663 -21.017 1.00 0.00 O ATOM 0 H GLU A 48 40.659 2.947 -16.163 1.00 0.00 H new ATOM 0 HA GLU A 48 38.571 4.740 -17.283 1.00 0.00 H new ATOM 0 HB2 GLU A 48 39.245 3.964 -19.484 1.00 0.00 H new ATOM 0 HB3 GLU A 48 40.654 4.625 -18.679 1.00 0.00 H new ATOM 0 HG2 GLU A 48 41.493 2.423 -18.120 1.00 0.00 H new ATOM 0 HG3 GLU A 48 39.972 1.658 -18.537 1.00 0.00 H new ATOM 728 N ASN A 49 38.188 2.000 -16.062 1.00 0.00 N ATOM 729 CA ASN A 49 37.331 0.852 -15.844 1.00 0.00 C ATOM 730 C ASN A 49 36.347 1.145 -14.720 1.00 0.00 C ATOM 731 O ASN A 49 36.684 1.016 -13.545 1.00 0.00 O ATOM 732 CB ASN A 49 38.189 -0.365 -15.508 1.00 0.00 C ATOM 733 CG ASN A 49 38.018 -1.455 -16.555 1.00 0.00 C ATOM 734 OD1 ASN A 49 38.720 -1.466 -17.564 1.00 0.00 O ATOM 735 ND2 ASN A 49 37.082 -2.377 -16.313 1.00 0.00 N ATOM 0 H ASN A 49 38.746 2.268 -15.251 1.00 0.00 H new ATOM 0 HA ASN A 49 36.762 0.642 -16.750 1.00 0.00 H new ATOM 0 HB2 ASN A 49 39.237 -0.071 -15.451 1.00 0.00 H new ATOM 0 HB3 ASN A 49 37.912 -0.751 -14.527 1.00 0.00 H new ATOM 0 HD21 ASN A 49 36.925 -3.132 -16.980 1.00 0.00 H new ATOM 0 HD22 ASN A 49 36.524 -2.326 -15.461 1.00 0.00 H new ATOM 742 N VAL A 50 35.124 1.539 -15.085 1.00 0.00 N ATOM 743 CA VAL A 50 34.097 1.848 -14.111 1.00 0.00 C ATOM 744 C VAL A 50 33.146 0.668 -13.975 1.00 0.00 C ATOM 745 O VAL A 50 32.715 0.096 -14.973 1.00 0.00 O ATOM 746 CB VAL A 50 33.345 3.102 -14.546 1.00 0.00 C ATOM 747 CG1 VAL A 50 32.188 3.359 -13.586 1.00 0.00 C ATOM 748 CG2 VAL A 50 34.294 4.296 -14.530 1.00 0.00 C ATOM 0 H VAL A 50 34.829 1.649 -16.055 1.00 0.00 H new ATOM 0 HA VAL A 50 34.555 2.035 -13.140 1.00 0.00 H new ATOM 0 HB VAL A 50 32.956 2.961 -15.555 1.00 0.00 H new ATOM 0 HG11 VAL A 50 31.650 4.255 -13.896 1.00 0.00 H new ATOM 0 HG12 VAL A 50 31.509 2.506 -13.597 1.00 0.00 H new ATOM 0 HG13 VAL A 50 32.577 3.500 -12.577 1.00 0.00 H new ATOM 0 HG21 VAL A 50 33.757 5.192 -14.841 1.00 0.00 H new ATOM 0 HG22 VAL A 50 34.683 4.438 -13.522 1.00 0.00 H new ATOM 0 HG23 VAL A 50 35.121 4.113 -15.216 1.00 0.00 H new ATOM 758 N THR A 51 32.819 0.302 -12.733 1.00 0.00 N ATOM 759 CA THR A 51 31.922 -0.806 -12.477 1.00 0.00 C ATOM 760 C THR A 51 30.820 -0.371 -11.522 1.00 0.00 C ATOM 761 O THR A 51 31.079 0.333 -10.547 1.00 0.00 O ATOM 762 CB THR A 51 32.711 -1.975 -11.893 1.00 0.00 C ATOM 763 OG1 THR A 51 32.762 -1.853 -10.489 1.00 0.00 O ATOM 764 CG2 THR A 51 34.130 -1.961 -12.456 1.00 0.00 C ATOM 0 H THR A 51 33.168 0.764 -11.893 1.00 0.00 H new ATOM 0 HA THR A 51 31.460 -1.126 -13.411 1.00 0.00 H new ATOM 0 HB THR A 51 32.223 -2.913 -12.159 1.00 0.00 H new ATOM 0 HG1 THR A 51 33.542 -2.338 -10.147 1.00 0.00 H new ATOM 0 HG21 THR A 51 34.695 -2.795 -12.040 1.00 0.00 H new ATOM 0 HG22 THR A 51 34.092 -2.054 -13.541 1.00 0.00 H new ATOM 0 HG23 THR A 51 34.618 -1.024 -12.189 1.00 0.00 H new ATOM 772 N LEU A 52 29.585 -0.792 -11.805 1.00 0.00 N ATOM 773 CA LEU A 52 28.449 -0.447 -10.974 1.00 0.00 C ATOM 774 C LEU A 52 27.914 -1.694 -10.285 1.00 0.00 C ATOM 775 O LEU A 52 27.741 -2.732 -10.920 1.00 0.00 O ATOM 776 CB LEU A 52 27.368 0.200 -11.835 1.00 0.00 C ATOM 777 CG LEU A 52 26.518 1.127 -10.970 1.00 0.00 C ATOM 778 CD1 LEU A 52 25.813 2.148 -11.859 1.00 0.00 C ATOM 779 CD2 LEU A 52 25.476 0.306 -10.216 1.00 0.00 C ATOM 0 H LEU A 52 29.355 -1.375 -12.610 1.00 0.00 H new ATOM 0 HA LEU A 52 28.758 0.263 -10.207 1.00 0.00 H new ATOM 0 HB2 LEU A 52 27.825 0.762 -12.650 1.00 0.00 H new ATOM 0 HB3 LEU A 52 26.741 -0.568 -12.289 1.00 0.00 H new ATOM 0 HG LEU A 52 27.158 1.646 -10.257 1.00 0.00 H new ATOM 0 HD11 LEU A 52 25.206 2.810 -11.242 1.00 0.00 H new ATOM 0 HD12 LEU A 52 26.556 2.735 -12.399 1.00 0.00 H new ATOM 0 HD13 LEU A 52 25.173 1.629 -12.572 1.00 0.00 H new ATOM 0 HD21 LEU A 52 24.869 0.968 -9.598 1.00 0.00 H new ATOM 0 HD22 LEU A 52 24.836 -0.213 -10.929 1.00 0.00 H new ATOM 0 HD23 LEU A 52 25.978 -0.424 -9.581 1.00 0.00 H new ATOM 791 N GLU A 53 27.654 -1.591 -8.979 1.00 0.00 N ATOM 792 CA GLU A 53 27.140 -2.708 -8.213 1.00 0.00 C ATOM 793 C GLU A 53 25.821 -2.327 -7.557 1.00 0.00 C ATOM 794 O GLU A 53 25.694 -1.241 -6.994 1.00 0.00 O ATOM 795 CB GLU A 53 28.168 -3.119 -7.163 1.00 0.00 C ATOM 796 CG GLU A 53 28.043 -4.615 -6.887 1.00 0.00 C ATOM 797 CD GLU A 53 29.159 -5.092 -5.969 1.00 0.00 C ATOM 798 OE1 GLU A 53 30.211 -4.416 -5.955 1.00 0.00 O ATOM 799 OE2 GLU A 53 28.942 -6.124 -5.299 1.00 0.00 O ATOM 0 H GLU A 53 27.795 -0.739 -8.437 1.00 0.00 H new ATOM 0 HA GLU A 53 26.958 -3.553 -8.877 1.00 0.00 H new ATOM 0 HB2 GLU A 53 29.174 -2.886 -7.512 1.00 0.00 H new ATOM 0 HB3 GLU A 53 28.011 -2.554 -6.244 1.00 0.00 H new ATOM 0 HG2 GLU A 53 27.076 -4.825 -6.430 1.00 0.00 H new ATOM 0 HG3 GLU A 53 28.078 -5.167 -7.826 1.00 0.00 H new ATOM 806 N THR A 54 24.836 -3.224 -7.631 1.00 0.00 N ATOM 807 CA THR A 54 23.535 -2.977 -7.043 1.00 0.00 C ATOM 808 C THR A 54 23.040 -4.228 -6.332 1.00 0.00 C ATOM 809 O THR A 54 23.081 -5.322 -6.891 1.00 0.00 O ATOM 810 CB THR A 54 22.557 -2.553 -8.134 1.00 0.00 C ATOM 811 OG1 THR A 54 23.249 -1.841 -9.136 1.00 0.00 O ATOM 812 CG2 THR A 54 21.476 -1.660 -7.531 1.00 0.00 C ATOM 0 H THR A 54 24.923 -4.128 -8.095 1.00 0.00 H new ATOM 0 HA THR A 54 23.612 -2.175 -6.309 1.00 0.00 H new ATOM 0 HB THR A 54 22.095 -3.439 -8.570 1.00 0.00 H new ATOM 0 HG1 THR A 54 23.571 -2.466 -9.818 1.00 0.00 H new ATOM 0 HG21 THR A 54 20.777 -1.357 -8.311 1.00 0.00 H new ATOM 0 HG22 THR A 54 20.940 -2.209 -6.757 1.00 0.00 H new ATOM 0 HG23 THR A 54 21.938 -0.775 -7.094 1.00 0.00 H new ATOM 820 N ILE A 55 22.570 -4.064 -5.093 1.00 0.00 N ATOM 821 CA ILE A 55 22.069 -5.174 -4.310 1.00 0.00 C ATOM 822 C ILE A 55 21.341 -4.650 -3.079 1.00 0.00 C ATOM 823 O ILE A 55 21.395 -3.458 -2.786 1.00 0.00 O ATOM 824 CB ILE A 55 23.230 -6.079 -3.908 1.00 0.00 C ATOM 825 CG1 ILE A 55 24.502 -5.246 -3.776 1.00 0.00 C ATOM 826 CG2 ILE A 55 23.432 -7.151 -4.974 1.00 0.00 C ATOM 827 CD1 ILE A 55 24.425 -4.396 -2.511 1.00 0.00 C ATOM 0 H ILE A 55 22.530 -3.163 -4.616 1.00 0.00 H new ATOM 0 HA ILE A 55 21.364 -5.754 -4.905 1.00 0.00 H new ATOM 0 HB ILE A 55 23.006 -6.554 -2.953 1.00 0.00 H new ATOM 0 HG12 ILE A 55 25.374 -5.899 -3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 55 24.623 -4.606 -4.650 1.00 0.00 H new ATOM 0 HG21 ILE A 55 24.261 -7.798 -4.687 1.00 0.00 H new ATOM 0 HG22 ILE A 55 22.524 -7.746 -5.068 1.00 0.00 H new ATOM 0 HG23 ILE A 55 23.656 -6.676 -5.929 1.00 0.00 H new ATOM 0 HD11 ILE A 55 25.333 -3.801 -2.417 1.00 0.00 H new ATOM 0 HD12 ILE A 55 23.562 -3.733 -2.570 1.00 0.00 H new ATOM 0 HD13 ILE A 55 24.325 -5.046 -1.642 1.00 0.00 H new ATOM 839 N CYS A 56 20.659 -5.544 -2.360 1.00 0.00 N ATOM 840 CA CYS A 56 19.926 -5.169 -1.168 1.00 0.00 C ATOM 841 C CYS A 56 20.875 -5.097 0.019 1.00 0.00 C ATOM 842 O CYS A 56 20.922 -6.013 0.837 1.00 0.00 O ATOM 843 CB CYS A 56 18.817 -6.185 -0.913 1.00 0.00 C ATOM 844 SG CYS A 56 17.169 -5.451 -0.755 1.00 0.00 S ATOM 0 H CYS A 56 20.604 -6.536 -2.591 1.00 0.00 H new ATOM 0 HA CYS A 56 19.475 -4.186 -1.307 1.00 0.00 H new ATOM 0 HB2 CYS A 56 18.805 -6.907 -1.729 1.00 0.00 H new ATOM 0 HB3 CYS A 56 19.047 -6.737 -0.002 1.00 0.00 H new ATOM 849 N HIS A 57 21.635 -4.003 0.112 1.00 0.00 N ATOM 850 CA HIS A 57 22.580 -3.821 1.197 1.00 0.00 C ATOM 851 C HIS A 57 22.003 -2.867 2.234 1.00 0.00 C ATOM 852 O HIS A 57 21.236 -1.968 1.896 1.00 0.00 O ATOM 853 CB HIS A 57 23.894 -3.283 0.640 1.00 0.00 C ATOM 854 CG HIS A 57 24.830 -2.810 1.719 1.00 0.00 C ATOM 855 ND1 HIS A 57 25.783 -3.570 2.358 1.00 0.00 N ATOM 856 CD2 HIS A 57 24.888 -1.546 2.239 1.00 0.00 C ATOM 857 CE1 HIS A 57 26.401 -2.773 3.248 1.00 0.00 C ATOM 858 NE2 HIS A 57 25.890 -1.529 3.213 1.00 0.00 N ATOM 0 H HIS A 57 21.608 -3.233 -0.556 1.00 0.00 H new ATOM 0 HA HIS A 57 22.770 -4.779 1.682 1.00 0.00 H new ATOM 0 HB2 HIS A 57 24.383 -4.063 0.056 1.00 0.00 H new ATOM 0 HB3 HIS A 57 23.685 -2.458 -0.041 1.00 0.00 H new ATOM 0 HD2 HIS A 57 24.269 -0.710 1.948 1.00 0.00 H new ATOM 0 HE1 HIS A 57 27.200 -3.089 3.903 1.00 0.00 H new ATOM 0 HE2 HIS A 57 26.176 -0.733 3.783 1.00 0.00 H new ATOM 866 N ASP A 58 22.375 -3.066 3.500 1.00 0.00 N ATOM 867 CA ASP A 58 21.893 -2.226 4.579 1.00 0.00 C ATOM 868 C ASP A 58 22.815 -1.027 4.747 1.00 0.00 C ATOM 869 O ASP A 58 24.034 -1.180 4.788 1.00 0.00 O ATOM 870 CB ASP A 58 21.826 -3.043 5.866 1.00 0.00 C ATOM 871 CG ASP A 58 20.523 -2.782 6.608 1.00 0.00 C ATOM 872 OD1 ASP A 58 19.479 -3.250 6.103 1.00 0.00 O ATOM 873 OD2 ASP A 58 20.595 -2.120 7.665 1.00 0.00 O ATOM 0 H ASP A 58 23.011 -3.806 3.796 1.00 0.00 H new ATOM 0 HA ASP A 58 20.893 -1.861 4.345 1.00 0.00 H new ATOM 0 HB2 ASP A 58 21.910 -4.104 5.632 1.00 0.00 H new ATOM 0 HB3 ASP A 58 22.671 -2.790 6.507 1.00 0.00 H new ATOM 878 N PRO A 59 22.230 0.169 4.846 1.00 0.00 N ATOM 879 CA PRO A 59 22.945 1.416 5.011 1.00 0.00 C ATOM 880 C PRO A 59 23.509 1.497 6.422 1.00 0.00 C ATOM 881 O PRO A 59 23.820 2.583 6.907 1.00 0.00 O ATOM 882 CB PRO A 59 21.897 2.502 4.777 1.00 0.00 C ATOM 883 CG PRO A 59 20.605 1.833 5.245 1.00 0.00 C ATOM 884 CD PRO A 59 20.800 0.384 4.802 1.00 0.00 C ATOM 0 HA PRO A 59 23.786 1.517 4.325 1.00 0.00 H new ATOM 0 HB2 PRO A 59 22.115 3.404 5.348 1.00 0.00 H new ATOM 0 HB3 PRO A 59 21.844 2.794 3.728 1.00 0.00 H new ATOM 0 HG2 PRO A 59 20.475 1.913 6.324 1.00 0.00 H new ATOM 0 HG3 PRO A 59 19.726 2.283 4.784 1.00 0.00 H new ATOM 0 HD2 PRO A 59 20.277 -0.305 5.465 1.00 0.00 H new ATOM 0 HD3 PRO A 59 20.407 0.222 3.798 1.00 0.00 H new ATOM 892 N GLN A 60 23.638 0.344 7.083 1.00 0.00 N ATOM 893 CA GLN A 60 24.161 0.292 8.433 1.00 0.00 C ATOM 894 C GLN A 60 25.623 -0.129 8.406 1.00 0.00 C ATOM 895 O GLN A 60 26.463 0.491 9.053 1.00 0.00 O ATOM 896 CB GLN A 60 23.332 -0.687 9.260 1.00 0.00 C ATOM 897 CG GLN A 60 23.503 -0.374 10.743 1.00 0.00 C ATOM 898 CD GLN A 60 22.206 -0.618 11.502 1.00 0.00 C ATOM 899 OE1 GLN A 60 21.133 -0.238 11.039 1.00 0.00 O ATOM 900 NE2 GLN A 60 22.309 -1.251 12.673 1.00 0.00 N ATOM 0 H GLN A 60 23.384 -0.565 6.696 1.00 0.00 H new ATOM 0 HA GLN A 60 24.098 1.280 8.890 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.281 -0.615 8.981 1.00 0.00 H new ATOM 0 HB3 GLN A 60 23.647 -1.710 9.055 1.00 0.00 H new ATOM 0 HG2 GLN A 60 24.296 -0.994 11.161 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.812 0.664 10.867 1.00 0.00 H new ATOM 0 HE21 GLN A 60 23.224 -1.547 13.014 1.00 0.00 H new ATOM 0 HE22 GLN A 60 21.473 -1.439 13.226 1.00 0.00 H new ATOM 909 N LYS A 61 25.926 -1.189 7.652 1.00 0.00 N ATOM 910 CA LYS A 61 27.283 -1.686 7.544 1.00 0.00 C ATOM 911 C LYS A 61 28.034 -0.913 6.468 1.00 0.00 C ATOM 912 O LYS A 61 27.423 -0.355 5.560 1.00 0.00 O ATOM 913 CB LYS A 61 27.253 -3.176 7.216 1.00 0.00 C ATOM 914 CG LYS A 61 26.698 -3.948 8.410 1.00 0.00 C ATOM 915 CD LYS A 61 27.036 -5.429 8.261 1.00 0.00 C ATOM 916 CE LYS A 61 25.847 -6.270 8.717 1.00 0.00 C ATOM 917 NZ LYS A 61 26.295 -7.553 9.281 1.00 0.00 N ATOM 0 H LYS A 61 25.241 -1.715 7.109 1.00 0.00 H new ATOM 0 HA LYS A 61 27.801 -1.545 8.492 1.00 0.00 H new ATOM 0 HB2 LYS A 61 26.635 -3.353 6.336 1.00 0.00 H new ATOM 0 HB3 LYS A 61 28.257 -3.527 6.977 1.00 0.00 H new ATOM 0 HG2 LYS A 61 27.121 -3.559 9.336 1.00 0.00 H new ATOM 0 HG3 LYS A 61 25.618 -3.815 8.472 1.00 0.00 H new ATOM 0 HD2 LYS A 61 27.278 -5.655 7.223 1.00 0.00 H new ATOM 0 HD3 LYS A 61 27.917 -5.674 8.854 1.00 0.00 H new ATOM 0 HE2 LYS A 61 25.273 -5.721 9.464 1.00 0.00 H new ATOM 0 HE3 LYS A 61 25.181 -6.452 7.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 25.468 -8.107 9.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 26.822 -8.084 8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 26.912 -7.376 10.100 1.00 0.00 H new ATOM 931 N ARG A 62 29.364 -0.881 6.576 1.00 0.00 N ATOM 932 CA ARG A 62 30.191 -0.178 5.617 1.00 0.00 C ATOM 933 C ARG A 62 30.581 -1.117 4.485 1.00 0.00 C ATOM 934 O ARG A 62 31.060 -2.223 4.728 1.00 0.00 O ATOM 935 CB ARG A 62 31.433 0.365 6.319 1.00 0.00 C ATOM 936 CG ARG A 62 31.164 1.787 6.801 1.00 0.00 C ATOM 937 CD ARG A 62 29.874 1.814 7.615 1.00 0.00 C ATOM 938 NE ARG A 62 29.975 2.754 8.731 1.00 0.00 N ATOM 939 CZ ARG A 62 29.264 3.890 8.790 1.00 0.00 C ATOM 940 NH1 ARG A 62 28.416 4.201 7.801 1.00 0.00 N ATOM 941 NH2 ARG A 62 29.402 4.711 9.840 1.00 0.00 N ATOM 0 H ARG A 62 29.885 -1.338 7.324 1.00 0.00 H new ATOM 0 HA ARG A 62 29.633 0.657 5.194 1.00 0.00 H new ATOM 0 HB2 ARG A 62 31.695 -0.273 7.163 1.00 0.00 H new ATOM 0 HB3 ARG A 62 32.283 0.356 5.637 1.00 0.00 H new ATOM 0 HG2 ARG A 62 31.997 2.140 7.409 1.00 0.00 H new ATOM 0 HG3 ARG A 62 31.083 2.462 5.949 1.00 0.00 H new ATOM 0 HD2 ARG A 62 29.040 2.096 6.972 1.00 0.00 H new ATOM 0 HD3 ARG A 62 29.659 0.815 7.995 1.00 0.00 H new ATOM 0 HE ARG A 62 30.613 2.537 9.497 1.00 0.00 H new ATOM 0 HH11 ARG A 62 28.311 3.574 7.003 1.00 0.00 H new ATOM 0 HH12 ARG A 62 27.875 5.065 7.846 1.00 0.00 H new ATOM 0 HH21 ARG A 62 30.047 4.472 10.593 1.00 0.00 H new ATOM 0 HH22 ARG A 62 28.862 5.575 9.886 1.00 0.00 H new ATOM 955 N LEU A 63 30.374 -0.674 3.242 1.00 0.00 N ATOM 956 CA LEU A 63 30.704 -1.475 2.080 1.00 0.00 C ATOM 957 C LEU A 63 32.020 -1.001 1.483 1.00 0.00 C ATOM 958 O LEU A 63 32.202 0.189 1.237 1.00 0.00 O ATOM 959 CB LEU A 63 29.577 -1.371 1.055 1.00 0.00 C ATOM 960 CG LEU A 63 30.005 -2.052 -0.242 1.00 0.00 C ATOM 961 CD1 LEU A 63 29.289 -3.394 -0.372 1.00 0.00 C ATOM 962 CD2 LEU A 63 29.641 -1.164 -1.427 1.00 0.00 C ATOM 0 H LEU A 63 29.977 0.240 3.023 1.00 0.00 H new ATOM 0 HA LEU A 63 30.816 -2.519 2.373 1.00 0.00 H new ATOM 0 HB2 LEU A 63 28.673 -1.840 1.444 1.00 0.00 H new ATOM 0 HB3 LEU A 63 29.337 -0.324 0.867 1.00 0.00 H new ATOM 0 HG LEU A 63 31.083 -2.215 -0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 63 29.594 -3.881 -1.298 1.00 0.00 H new ATOM 0 HD12 LEU A 63 29.550 -4.029 0.475 1.00 0.00 H new ATOM 0 HD13 LEU A 63 28.211 -3.232 -0.386 1.00 0.00 H new ATOM 0 HD21 LEU A 63 29.947 -1.650 -2.353 1.00 0.00 H new ATOM 0 HD22 LEU A 63 28.563 -1.000 -1.441 1.00 0.00 H new ATOM 0 HD23 LEU A 63 30.152 -0.206 -1.334 1.00 0.00 H new ATOM 974 N TYR A 64 32.942 -1.938 1.248 1.00 0.00 N ATOM 975 CA TYR A 64 34.237 -1.611 0.683 1.00 0.00 C ATOM 976 C TYR A 64 34.869 -0.471 1.468 1.00 0.00 C ATOM 977 O TYR A 64 35.688 0.275 0.936 1.00 0.00 O ATOM 978 CB TYR A 64 34.066 -1.229 -0.784 1.00 0.00 C ATOM 979 CG TYR A 64 33.389 -2.295 -1.611 1.00 0.00 C ATOM 980 CD1 TYR A 64 33.930 -3.585 -1.669 1.00 0.00 C ATOM 981 CD2 TYR A 64 32.220 -1.994 -2.320 1.00 0.00 C ATOM 982 CE1 TYR A 64 33.302 -4.574 -2.435 1.00 0.00 C ATOM 983 CE2 TYR A 64 31.592 -2.983 -3.086 1.00 0.00 C ATOM 984 CZ TYR A 64 32.133 -4.273 -3.144 1.00 0.00 C ATOM 985 OH TYR A 64 31.521 -5.236 -3.891 1.00 0.00 O ATOM 0 H TYR A 64 32.807 -2.930 1.444 1.00 0.00 H new ATOM 0 HA TYR A 64 34.896 -2.477 0.746 1.00 0.00 H new ATOM 0 HB2 TYR A 64 33.485 -0.309 -0.846 1.00 0.00 H new ATOM 0 HB3 TYR A 64 35.046 -1.016 -1.212 1.00 0.00 H new ATOM 0 HD1 TYR A 64 34.832 -3.817 -1.123 1.00 0.00 H new ATOM 0 HD2 TYR A 64 31.803 -0.999 -2.276 1.00 0.00 H new ATOM 0 HE1 TYR A 64 33.719 -5.569 -2.479 1.00 0.00 H new ATOM 0 HE2 TYR A 64 30.690 -2.751 -3.632 1.00 0.00 H new ATOM 0 HH TYR A 64 31.363 -4.896 -4.797 1.00 0.00 H new ATOM 995 N GLY A 65 34.488 -0.337 2.740 1.00 0.00 N ATOM 996 CA GLY A 65 35.021 0.710 3.588 1.00 0.00 C ATOM 997 C GLY A 65 34.307 2.026 3.312 1.00 0.00 C ATOM 998 O GLY A 65 34.813 3.095 3.648 1.00 0.00 O ATOM 0 H GLY A 65 33.810 -0.946 3.198 1.00 0.00 H new ATOM 0 HA2 GLY A 65 34.901 0.436 4.636 1.00 0.00 H new ATOM 0 HA3 GLY A 65 36.090 0.824 3.409 1.00 0.00 H new ATOM 1002 N HIS A 66 33.125 1.946 2.697 1.00 0.00 N ATOM 1003 CA HIS A 66 32.351 3.129 2.377 1.00 0.00 C ATOM 1004 C HIS A 66 31.107 3.187 3.253 1.00 0.00 C ATOM 1005 O HIS A 66 30.491 2.161 3.533 1.00 0.00 O ATOM 1006 CB HIS A 66 31.971 3.103 0.900 1.00 0.00 C ATOM 1007 CG HIS A 66 33.144 2.813 0.004 1.00 0.00 C ATOM 1008 ND1 HIS A 66 34.460 3.118 0.266 1.00 0.00 N ATOM 1009 CD2 HIS A 66 33.094 2.198 -1.218 1.00 0.00 C ATOM 1010 CE1 HIS A 66 35.186 2.694 -0.783 1.00 0.00 C ATOM 1011 NE2 HIS A 66 34.399 2.126 -1.713 1.00 0.00 N ATOM 0 H HIS A 66 32.689 1.068 2.413 1.00 0.00 H new ATOM 0 HA HIS A 66 32.948 4.021 2.570 1.00 0.00 H new ATOM 0 HB2 HIS A 66 31.202 2.348 0.740 1.00 0.00 H new ATOM 0 HB3 HIS A 66 31.537 4.064 0.624 1.00 0.00 H new ATOM 0 HD1 HIS A 66 34.818 3.580 1.102 1.00 0.00 H new ATOM 0 HD2 HIS A 66 32.205 1.834 -1.711 1.00 0.00 H new ATOM 0 HE1 HIS A 66 36.258 2.796 -0.867 1.00 0.00 H new ATOM 1019 N MET A 67 30.737 4.395 3.686 1.00 0.00 N ATOM 1020 CA MET A 67 29.572 4.580 4.527 1.00 0.00 C ATOM 1021 C MET A 67 28.586 5.519 3.846 1.00 0.00 C ATOM 1022 O MET A 67 28.953 6.615 3.430 1.00 0.00 O ATOM 1023 CB MET A 67 30.005 5.141 5.878 1.00 0.00 C ATOM 1024 CG MET A 67 31.117 6.165 5.672 1.00 0.00 C ATOM 1025 SD MET A 67 32.714 5.667 6.363 1.00 0.00 S ATOM 1026 CE MET A 67 33.352 7.298 6.823 1.00 0.00 C ATOM 0 H MET A 67 31.235 5.256 3.462 1.00 0.00 H new ATOM 0 HA MET A 67 29.079 3.621 4.686 1.00 0.00 H new ATOM 0 HB2 MET A 67 29.156 5.606 6.379 1.00 0.00 H new ATOM 0 HB3 MET A 67 30.354 4.335 6.523 1.00 0.00 H new ATOM 0 HG2 MET A 67 31.236 6.347 4.604 1.00 0.00 H new ATOM 0 HG3 MET A 67 30.815 7.110 6.125 1.00 0.00 H new ATOM 0 HE1 MET A 67 34.340 7.189 7.271 1.00 0.00 H new ATOM 0 HE2 MET A 67 33.423 7.925 5.934 1.00 0.00 H new ATOM 0 HE3 MET A 67 32.677 7.763 7.542 1.00 0.00 H new ATOM 1036 N LEU A 68 27.328 5.085 3.735 1.00 0.00 N ATOM 1037 CA LEU A 68 26.295 5.885 3.108 1.00 0.00 C ATOM 1038 C LEU A 68 25.132 6.072 4.071 1.00 0.00 C ATOM 1039 O LEU A 68 24.902 5.238 4.943 1.00 0.00 O ATOM 1040 CB LEU A 68 25.830 5.199 1.827 1.00 0.00 C ATOM 1041 CG LEU A 68 25.885 3.685 2.010 1.00 0.00 C ATOM 1042 CD1 LEU A 68 24.692 3.231 2.847 1.00 0.00 C ATOM 1043 CD2 LEU A 68 25.838 3.006 0.645 1.00 0.00 C ATOM 0 H LEU A 68 27.008 4.178 4.076 1.00 0.00 H new ATOM 0 HA LEU A 68 26.693 6.868 2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 68 24.814 5.510 1.584 1.00 0.00 H new ATOM 0 HB3 LEU A 68 26.463 5.498 0.992 1.00 0.00 H new ATOM 0 HG LEU A 68 26.810 3.413 2.519 1.00 0.00 H new ATOM 0 HD11 LEU A 68 24.730 2.150 2.978 1.00 0.00 H new ATOM 0 HD12 LEU A 68 24.726 3.716 3.822 1.00 0.00 H new ATOM 0 HD13 LEU A 68 23.767 3.502 2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 68 25.877 1.925 0.775 1.00 0.00 H new ATOM 0 HD22 LEU A 68 24.913 3.277 0.136 1.00 0.00 H new ATOM 0 HD23 LEU A 68 26.690 3.331 0.048 1.00 0.00 H new ATOM 1055 N ASP A 69 24.395 7.175 3.912 1.00 0.00 N ATOM 1056 CA ASP A 69 23.262 7.468 4.765 1.00 0.00 C ATOM 1057 C ASP A 69 22.153 8.111 3.947 1.00 0.00 C ATOM 1058 O ASP A 69 21.411 8.951 4.452 1.00 0.00 O ATOM 1059 CB ASP A 69 23.704 8.391 5.898 1.00 0.00 C ATOM 1060 CG ASP A 69 24.143 9.744 5.355 1.00 0.00 C ATOM 1061 OD1 ASP A 69 23.256 10.614 5.217 1.00 0.00 O ATOM 1062 OD2 ASP A 69 25.356 9.882 5.089 1.00 0.00 O ATOM 0 H ASP A 69 24.572 7.877 3.194 1.00 0.00 H new ATOM 0 HA ASP A 69 22.878 6.543 5.196 1.00 0.00 H new ATOM 0 HB2 ASP A 69 22.884 8.526 6.603 1.00 0.00 H new ATOM 0 HB3 ASP A 69 24.525 7.931 6.448 1.00 0.00 H new ATOM 1067 N ASP A 70 22.040 7.716 2.677 1.00 0.00 N ATOM 1068 CA ASP A 70 21.024 8.255 1.796 1.00 0.00 C ATOM 1069 C ASP A 70 19.911 7.234 1.604 1.00 0.00 C ATOM 1070 O ASP A 70 19.089 7.371 0.701 1.00 0.00 O ATOM 1071 CB ASP A 70 21.656 8.624 0.456 1.00 0.00 C ATOM 1072 CG ASP A 70 21.949 10.115 0.384 1.00 0.00 C ATOM 1073 OD1 ASP A 70 22.897 10.541 1.080 1.00 0.00 O ATOM 1074 OD2 ASP A 70 21.219 10.801 -0.364 1.00 0.00 O ATOM 0 H ASP A 70 22.647 7.021 2.242 1.00 0.00 H new ATOM 0 HA ASP A 70 20.593 9.153 2.239 1.00 0.00 H new ATOM 0 HB2 ASP A 70 22.579 8.061 0.318 1.00 0.00 H new ATOM 0 HB3 ASP A 70 20.986 8.342 -0.356 1.00 0.00 H new ATOM 1079 N SER A 71 19.888 6.207 2.457 1.00 0.00 N ATOM 1080 CA SER A 71 18.878 5.171 2.377 1.00 0.00 C ATOM 1081 C SER A 71 17.540 5.716 2.854 1.00 0.00 C ATOM 1082 O SER A 71 16.495 5.370 2.309 1.00 0.00 O ATOM 1083 CB SER A 71 19.309 3.976 3.224 1.00 0.00 C ATOM 1084 OG SER A 71 18.692 2.807 2.734 1.00 0.00 O ATOM 0 H SER A 71 20.564 6.078 3.210 1.00 0.00 H new ATOM 0 HA SER A 71 18.766 4.846 1.343 1.00 0.00 H new ATOM 0 HB2 SER A 71 20.393 3.868 3.195 1.00 0.00 H new ATOM 0 HB3 SER A 71 19.033 4.137 4.266 1.00 0.00 H new ATOM 0 HG SER A 71 19.249 2.029 2.947 1.00 0.00 H new ATOM 1090 N SER A 72 17.575 6.574 3.877 1.00 0.00 N ATOM 1091 CA SER A 72 16.368 7.163 4.420 1.00 0.00 C ATOM 1092 C SER A 72 15.898 8.299 3.522 1.00 0.00 C ATOM 1093 O SER A 72 14.774 8.778 3.657 1.00 0.00 O ATOM 1094 CB SER A 72 16.641 7.670 5.834 1.00 0.00 C ATOM 1095 OG SER A 72 17.582 8.720 5.782 1.00 0.00 O ATOM 0 H SER A 72 18.433 6.871 4.341 1.00 0.00 H new ATOM 0 HA SER A 72 15.580 6.411 4.463 1.00 0.00 H new ATOM 0 HB2 SER A 72 15.715 8.019 6.292 1.00 0.00 H new ATOM 0 HB3 SER A 72 17.019 6.859 6.456 1.00 0.00 H new ATOM 0 HG SER A 72 17.757 9.048 6.689 1.00 0.00 H new ATOM 1101 N SER A 73 16.763 8.729 2.601 1.00 0.00 N ATOM 1102 CA SER A 73 16.433 9.802 1.685 1.00 0.00 C ATOM 1103 C SER A 73 15.525 9.279 0.582 1.00 0.00 C ATOM 1104 O SER A 73 15.443 8.073 0.360 1.00 0.00 O ATOM 1105 CB SER A 73 17.717 10.383 1.099 1.00 0.00 C ATOM 1106 OG SER A 73 17.874 11.713 1.540 1.00 0.00 O ATOM 0 H SER A 73 17.699 8.343 2.476 1.00 0.00 H new ATOM 0 HA SER A 73 15.904 10.591 2.219 1.00 0.00 H new ATOM 0 HB2 SER A 73 18.574 9.783 1.406 1.00 0.00 H new ATOM 0 HB3 SER A 73 17.680 10.351 0.010 1.00 0.00 H new ATOM 0 HG SER A 73 18.699 12.087 1.166 1.00 0.00 H new ATOM 1112 N GLU A 74 14.842 10.192 -0.114 1.00 0.00 N ATOM 1113 CA GLU A 74 13.947 9.817 -1.190 1.00 0.00 C ATOM 1114 C GLU A 74 14.736 9.617 -2.476 1.00 0.00 C ATOM 1115 O GLU A 74 14.191 9.164 -3.479 1.00 0.00 O ATOM 1116 CB GLU A 74 12.887 10.901 -1.369 1.00 0.00 C ATOM 1117 CG GLU A 74 11.501 10.292 -1.184 1.00 0.00 C ATOM 1118 CD GLU A 74 10.540 11.304 -0.575 1.00 0.00 C ATOM 1119 OE1 GLU A 74 10.657 11.531 0.648 1.00 0.00 O ATOM 1120 OE2 GLU A 74 9.707 11.828 -1.345 1.00 0.00 O ATOM 0 H GLU A 74 14.898 11.196 0.056 1.00 0.00 H new ATOM 0 HA GLU A 74 13.452 8.878 -0.944 1.00 0.00 H new ATOM 0 HB2 GLU A 74 13.044 11.701 -0.646 1.00 0.00 H new ATOM 0 HB3 GLU A 74 12.971 11.347 -2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.117 9.953 -2.146 1.00 0.00 H new ATOM 0 HG3 GLU A 74 11.568 9.415 -0.540 1.00 0.00 H new ATOM 1127 N GLN A 75 16.027 9.956 -2.443 1.00 0.00 N ATOM 1128 CA GLN A 75 16.885 9.813 -3.602 1.00 0.00 C ATOM 1129 C GLN A 75 18.248 9.290 -3.175 1.00 0.00 C ATOM 1130 O GLN A 75 18.774 9.692 -2.139 1.00 0.00 O ATOM 1131 CB GLN A 75 17.018 11.162 -4.303 1.00 0.00 C ATOM 1132 CG GLN A 75 15.972 11.268 -5.408 1.00 0.00 C ATOM 1133 CD GLN A 75 14.936 12.331 -5.074 1.00 0.00 C ATOM 1134 OE1 GLN A 75 15.282 13.416 -4.610 1.00 0.00 O ATOM 1135 NE2 GLN A 75 13.659 12.017 -5.309 1.00 0.00 N ATOM 0 H GLN A 75 16.495 10.332 -1.618 1.00 0.00 H new ATOM 0 HA GLN A 75 16.447 9.097 -4.298 1.00 0.00 H new ATOM 0 HB2 GLN A 75 16.887 11.971 -3.585 1.00 0.00 H new ATOM 0 HB3 GLN A 75 18.018 11.268 -4.723 1.00 0.00 H new ATOM 0 HG2 GLN A 75 16.458 11.512 -6.352 1.00 0.00 H new ATOM 0 HG3 GLN A 75 15.480 10.305 -5.543 1.00 0.00 H new ATOM 0 HE21 GLN A 75 13.421 11.103 -5.695 1.00 0.00 H new ATOM 0 HE22 GLN A 75 12.922 12.691 -5.102 1.00 0.00 H new ATOM 1144 N CYS A 76 18.822 8.390 -3.977 1.00 0.00 N ATOM 1145 CA CYS A 76 20.118 7.815 -3.681 1.00 0.00 C ATOM 1146 C CYS A 76 21.218 8.758 -4.150 1.00 0.00 C ATOM 1147 O CYS A 76 21.222 9.184 -5.304 1.00 0.00 O ATOM 1148 CB CYS A 76 20.242 6.457 -4.364 1.00 0.00 C ATOM 1149 SG CYS A 76 21.823 6.199 -5.207 1.00 0.00 S ATOM 0 H CYS A 76 18.399 8.048 -4.840 1.00 0.00 H new ATOM 0 HA CYS A 76 20.220 7.674 -2.605 1.00 0.00 H new ATOM 0 HB2 CYS A 76 20.107 5.673 -3.619 1.00 0.00 H new ATOM 0 HB3 CYS A 76 19.434 6.351 -5.088 1.00 0.00 H new ATOM 1154 N VAL A 77 22.151 9.083 -3.253 1.00 0.00 N ATOM 1155 CA VAL A 77 23.248 9.972 -3.579 1.00 0.00 C ATOM 1156 C VAL A 77 24.557 9.196 -3.578 1.00 0.00 C ATOM 1157 O VAL A 77 24.766 8.326 -2.734 1.00 0.00 O ATOM 1158 CB VAL A 77 23.295 11.113 -2.567 1.00 0.00 C ATOM 1159 CG1 VAL A 77 24.142 10.696 -1.368 1.00 0.00 C ATOM 1160 CG2 VAL A 77 23.912 12.347 -3.220 1.00 0.00 C ATOM 0 H VAL A 77 22.161 8.738 -2.293 1.00 0.00 H new ATOM 0 HA VAL A 77 23.098 10.392 -4.573 1.00 0.00 H new ATOM 0 HB VAL A 77 22.283 11.345 -2.234 1.00 0.00 H new ATOM 0 HG11 VAL A 77 24.176 11.511 -0.645 1.00 0.00 H new ATOM 0 HG12 VAL A 77 23.702 9.815 -0.901 1.00 0.00 H new ATOM 0 HG13 VAL A 77 25.154 10.464 -1.700 1.00 0.00 H new ATOM 0 HG21 VAL A 77 23.946 13.162 -2.498 1.00 0.00 H new ATOM 0 HG22 VAL A 77 24.924 12.115 -3.553 1.00 0.00 H new ATOM 0 HG23 VAL A 77 23.308 12.646 -4.076 1.00 0.00 H new ATOM 1170 N MET A 78 25.442 9.512 -4.527 1.00 0.00 N ATOM 1171 CA MET A 78 26.723 8.841 -4.630 1.00 0.00 C ATOM 1172 C MET A 78 27.756 9.566 -3.780 1.00 0.00 C ATOM 1173 O MET A 78 28.034 10.742 -4.002 1.00 0.00 O ATOM 1174 CB MET A 78 27.159 8.801 -6.091 1.00 0.00 C ATOM 1175 CG MET A 78 26.250 7.852 -6.868 1.00 0.00 C ATOM 1176 SD MET A 78 26.937 6.191 -7.086 1.00 0.00 S ATOM 1177 CE MET A 78 25.935 5.301 -5.870 1.00 0.00 C ATOM 0 H MET A 78 25.286 10.232 -5.233 1.00 0.00 H new ATOM 0 HA MET A 78 26.632 7.819 -4.263 1.00 0.00 H new ATOM 0 HB2 MET A 78 27.113 9.801 -6.523 1.00 0.00 H new ATOM 0 HB3 MET A 78 28.195 8.470 -6.163 1.00 0.00 H new ATOM 0 HG2 MET A 78 25.295 7.774 -6.349 1.00 0.00 H new ATOM 0 HG3 MET A 78 26.046 8.282 -7.849 1.00 0.00 H new ATOM 0 HE1 MET A 78 26.534 5.101 -4.981 1.00 0.00 H new ATOM 0 HE2 MET A 78 25.071 5.907 -5.597 1.00 0.00 H new ATOM 0 HE3 MET A 78 25.596 4.358 -6.298 1.00 0.00 H new ATOM 1187 N LYS A 79 28.326 8.858 -2.801 1.00 0.00 N ATOM 1188 CA LYS A 79 29.325 9.436 -1.924 1.00 0.00 C ATOM 1189 C LYS A 79 30.711 8.960 -2.334 1.00 0.00 C ATOM 1190 O LYS A 79 30.969 7.760 -2.391 1.00 0.00 O ATOM 1191 CB LYS A 79 29.022 9.041 -0.482 1.00 0.00 C ATOM 1192 CG LYS A 79 29.763 9.978 0.467 1.00 0.00 C ATOM 1193 CD LYS A 79 28.931 11.237 0.693 1.00 0.00 C ATOM 1194 CE LYS A 79 29.775 12.469 0.376 1.00 0.00 C ATOM 1195 NZ LYS A 79 30.100 13.215 1.601 1.00 0.00 N ATOM 0 H LYS A 79 28.106 7.882 -2.603 1.00 0.00 H new ATOM 0 HA LYS A 79 29.299 10.523 -2.003 1.00 0.00 H new ATOM 0 HB2 LYS A 79 27.949 9.092 -0.297 1.00 0.00 H new ATOM 0 HB3 LYS A 79 29.327 8.010 -0.304 1.00 0.00 H new ATOM 0 HG2 LYS A 79 29.950 9.477 1.417 1.00 0.00 H new ATOM 0 HG3 LYS A 79 30.735 10.242 0.049 1.00 0.00 H new ATOM 0 HD2 LYS A 79 28.044 11.218 0.060 1.00 0.00 H new ATOM 0 HD3 LYS A 79 28.585 11.276 1.726 1.00 0.00 H new ATOM 0 HE2 LYS A 79 30.695 12.165 -0.124 1.00 0.00 H new ATOM 0 HE3 LYS A 79 29.235 13.116 -0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 30.674 14.048 1.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 29.221 13.523 2.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 30.635 12.602 2.249 1.00 0.00 H new ATOM 1209 N GLU A 80 31.607 9.908 -2.620 1.00 0.00 N ATOM 1210 CA GLU A 80 32.960 9.581 -3.021 1.00 0.00 C ATOM 1211 C GLU A 80 33.772 9.150 -1.808 1.00 0.00 C ATOM 1212 O GLU A 80 34.028 9.951 -0.911 1.00 0.00 O ATOM 1213 CB GLU A 80 33.597 10.793 -3.695 1.00 0.00 C ATOM 1214 CG GLU A 80 33.775 11.910 -2.671 1.00 0.00 C ATOM 1215 CD GLU A 80 33.809 13.271 -3.351 1.00 0.00 C ATOM 1216 OE1 GLU A 80 34.688 13.449 -4.220 1.00 0.00 O ATOM 1217 OE2 GLU A 80 32.954 14.107 -2.988 1.00 0.00 O ATOM 0 H GLU A 80 31.410 10.908 -2.578 1.00 0.00 H new ATOM 0 HA GLU A 80 32.941 8.754 -3.731 1.00 0.00 H new ATOM 0 HB2 GLU A 80 34.562 10.520 -4.122 1.00 0.00 H new ATOM 0 HB3 GLU A 80 32.970 11.136 -4.518 1.00 0.00 H new ATOM 0 HG2 GLU A 80 32.959 11.880 -1.949 1.00 0.00 H new ATOM 0 HG3 GLU A 80 34.699 11.754 -2.114 1.00 0.00 H new ATOM 1224 N LYS A 81 34.180 7.880 -1.783 1.00 0.00 N ATOM 1225 CA LYS A 81 34.960 7.350 -0.683 1.00 0.00 C ATOM 1226 C LYS A 81 36.422 7.238 -1.091 1.00 0.00 C ATOM 1227 O LYS A 81 36.735 7.162 -2.277 1.00 0.00 O ATOM 1228 CB LYS A 81 34.407 5.986 -0.278 1.00 0.00 C ATOM 1229 CG LYS A 81 33.408 6.162 0.862 1.00 0.00 C ATOM 1230 CD LYS A 81 32.256 7.049 0.399 1.00 0.00 C ATOM 1231 CE LYS A 81 31.181 6.187 -0.255 1.00 0.00 C ATOM 1232 NZ LYS A 81 31.756 5.327 -1.300 1.00 0.00 N ATOM 0 H LYS A 81 33.978 7.204 -2.519 1.00 0.00 H new ATOM 0 HA LYS A 81 34.893 8.024 0.171 1.00 0.00 H new ATOM 0 HB2 LYS A 81 33.922 5.510 -1.131 1.00 0.00 H new ATOM 0 HB3 LYS A 81 35.220 5.330 0.034 1.00 0.00 H new ATOM 0 HG2 LYS A 81 33.028 5.191 1.179 1.00 0.00 H new ATOM 0 HG3 LYS A 81 33.901 6.609 1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 81 31.837 7.591 1.247 1.00 0.00 H new ATOM 0 HD3 LYS A 81 32.619 7.795 -0.308 1.00 0.00 H new ATOM 0 HE2 LYS A 81 30.695 5.570 0.501 1.00 0.00 H new ATOM 0 HE3 LYS A 81 30.412 6.826 -0.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 31.003 4.751 -1.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 32.199 5.919 -2.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 32.473 4.702 -0.880 1.00 0.00 H new ATOM 1246 N LYS A 82 37.319 7.227 -0.102 1.00 0.00 N ATOM 1247 CA LYS A 82 38.741 7.125 -0.363 1.00 0.00 C ATOM 1248 C LYS A 82 39.072 5.738 -0.896 1.00 0.00 C ATOM 1249 O LYS A 82 39.162 4.781 -0.131 1.00 0.00 O ATOM 1250 CB LYS A 82 39.514 7.409 0.922 1.00 0.00 C ATOM 1251 CG LYS A 82 38.817 6.727 2.096 1.00 0.00 C ATOM 1252 CD LYS A 82 39.689 5.588 2.615 1.00 0.00 C ATOM 1253 CE LYS A 82 38.809 4.538 3.285 1.00 0.00 C ATOM 1254 NZ LYS A 82 39.295 4.227 4.639 1.00 0.00 N ATOM 0 H LYS A 82 37.076 7.288 0.887 1.00 0.00 H new ATOM 0 HA LYS A 82 39.029 7.859 -1.116 1.00 0.00 H new ATOM 0 HB2 LYS A 82 40.537 7.045 0.831 1.00 0.00 H new ATOM 0 HB3 LYS A 82 39.572 8.484 1.094 1.00 0.00 H new ATOM 0 HG2 LYS A 82 38.632 7.449 2.892 1.00 0.00 H new ATOM 0 HG3 LYS A 82 37.847 6.342 1.783 1.00 0.00 H new ATOM 0 HD2 LYS A 82 40.247 5.139 1.793 1.00 0.00 H new ATOM 0 HD3 LYS A 82 40.421 5.971 3.326 1.00 0.00 H new ATOM 0 HE2 LYS A 82 37.782 4.899 3.338 1.00 0.00 H new ATOM 0 HE3 LYS A 82 38.797 3.630 2.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 38.679 3.510 5.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 40.267 3.861 4.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 39.283 5.090 5.219 1.00 0.00 H new ATOM 1268 N ASP A 83 39.252 5.633 -2.214 1.00 0.00 N ATOM 1269 CA ASP A 83 39.571 4.367 -2.843 1.00 0.00 C ATOM 1270 C ASP A 83 40.834 4.510 -3.680 1.00 0.00 C ATOM 1271 O ASP A 83 41.005 5.503 -4.384 1.00 0.00 O ATOM 1272 CB ASP A 83 38.396 3.921 -3.709 1.00 0.00 C ATOM 1273 CG ASP A 83 37.222 3.478 -2.847 1.00 0.00 C ATOM 1274 OD1 ASP A 83 36.581 4.375 -2.257 1.00 0.00 O ATOM 1275 OD2 ASP A 83 36.987 2.252 -2.794 1.00 0.00 O ATOM 0 H ASP A 83 39.180 6.418 -2.862 1.00 0.00 H new ATOM 0 HA ASP A 83 39.750 3.611 -2.078 1.00 0.00 H new ATOM 0 HB2 ASP A 83 38.087 4.740 -4.359 1.00 0.00 H new ATOM 0 HB3 ASP A 83 38.707 3.101 -4.356 1.00 0.00 H new ATOM 1280 N ASP A 84 41.720 3.516 -3.602 1.00 0.00 N ATOM 1281 CA ASP A 84 42.961 3.537 -4.350 1.00 0.00 C ATOM 1282 C ASP A 84 42.774 2.821 -5.679 1.00 0.00 C ATOM 1283 O ASP A 84 42.288 1.692 -5.716 1.00 0.00 O ATOM 1284 CB ASP A 84 44.062 2.873 -3.527 1.00 0.00 C ATOM 1285 CG ASP A 84 45.126 3.884 -3.127 1.00 0.00 C ATOM 1286 OD1 ASP A 84 44.731 5.017 -2.780 1.00 0.00 O ATOM 1287 OD2 ASP A 84 46.317 3.503 -3.175 1.00 0.00 O ATOM 0 H ASP A 84 41.593 2.686 -3.023 1.00 0.00 H new ATOM 0 HA ASP A 84 43.250 4.568 -4.553 1.00 0.00 H new ATOM 0 HB2 ASP A 84 43.631 2.420 -2.634 1.00 0.00 H new ATOM 0 HB3 ASP A 84 44.518 2.068 -4.104 1.00 0.00 H new ATOM 1292 N GLY A 85 43.161 3.478 -6.775 1.00 0.00 N ATOM 1293 CA GLY A 85 43.031 2.899 -8.097 1.00 0.00 C ATOM 1294 C GLY A 85 41.770 3.413 -8.777 1.00 0.00 C ATOM 1295 O GLY A 85 41.577 3.209 -9.973 1.00 0.00 O ATOM 0 H GLY A 85 43.567 4.414 -6.764 1.00 0.00 H new ATOM 0 HA2 GLY A 85 43.905 3.149 -8.699 1.00 0.00 H new ATOM 0 HA3 GLY A 85 42.996 1.812 -8.024 1.00 0.00 H new ATOM 1299 N GLY A 86 40.908 4.082 -8.008 1.00 0.00 N ATOM 1300 CA GLY A 86 39.671 4.621 -8.541 1.00 0.00 C ATOM 1301 C GLY A 86 38.784 5.120 -7.410 1.00 0.00 C ATOM 1302 O GLY A 86 39.133 4.994 -6.238 1.00 0.00 O ATOM 0 H GLY A 86 41.051 4.260 -7.014 1.00 0.00 H new ATOM 0 HA2 GLY A 86 39.889 5.438 -9.229 1.00 0.00 H new ATOM 0 HA3 GLY A 86 39.148 3.854 -9.112 1.00 0.00 H new ATOM 1306 N LEU A 87 37.629 5.689 -7.765 1.00 0.00 N ATOM 1307 CA LEU A 87 36.696 6.204 -6.783 1.00 0.00 C ATOM 1308 C LEU A 87 35.507 5.263 -6.657 1.00 0.00 C ATOM 1309 O LEU A 87 34.944 4.829 -7.660 1.00 0.00 O ATOM 1310 CB LEU A 87 36.239 7.599 -7.200 1.00 0.00 C ATOM 1311 CG LEU A 87 37.441 8.539 -7.235 1.00 0.00 C ATOM 1312 CD1 LEU A 87 38.166 8.488 -5.893 1.00 0.00 C ATOM 1313 CD2 LEU A 87 38.394 8.105 -8.345 1.00 0.00 C ATOM 0 H LEU A 87 37.325 5.801 -8.732 1.00 0.00 H new ATOM 0 HA LEU A 87 37.185 6.271 -5.811 1.00 0.00 H new ATOM 0 HB2 LEU A 87 35.766 7.560 -8.181 1.00 0.00 H new ATOM 0 HB3 LEU A 87 35.492 7.973 -6.500 1.00 0.00 H new ATOM 0 HG LEU A 87 37.101 9.557 -7.426 1.00 0.00 H new ATOM 0 HD11 LEU A 87 39.025 9.159 -5.918 1.00 0.00 H new ATOM 0 HD12 LEU A 87 37.486 8.798 -5.100 1.00 0.00 H new ATOM 0 HD13 LEU A 87 38.506 7.470 -5.702 1.00 0.00 H new ATOM 0 HD21 LEU A 87 39.253 8.776 -8.370 1.00 0.00 H new ATOM 0 HD22 LEU A 87 38.734 7.087 -8.155 1.00 0.00 H new ATOM 0 HD23 LEU A 87 37.877 8.141 -9.304 1.00 0.00 H new ATOM 1325 N MET A 88 35.124 4.947 -5.417 1.00 0.00 N ATOM 1326 CA MET A 88 34.006 4.059 -5.167 1.00 0.00 C ATOM 1327 C MET A 88 32.863 4.834 -4.529 1.00 0.00 C ATOM 1328 O MET A 88 33.004 5.364 -3.429 1.00 0.00 O ATOM 1329 CB MET A 88 34.458 2.918 -4.261 1.00 0.00 C ATOM 1330 CG MET A 88 35.358 1.969 -5.048 1.00 0.00 C ATOM 1331 SD MET A 88 36.753 2.785 -5.863 1.00 0.00 S ATOM 1332 CE MET A 88 37.941 1.421 -5.838 1.00 0.00 C ATOM 0 H MET A 88 35.579 5.298 -4.574 1.00 0.00 H new ATOM 0 HA MET A 88 33.652 3.640 -6.109 1.00 0.00 H new ATOM 0 HB2 MET A 88 34.995 3.315 -3.399 1.00 0.00 H new ATOM 0 HB3 MET A 88 33.592 2.380 -3.877 1.00 0.00 H new ATOM 0 HG2 MET A 88 35.742 1.204 -4.372 1.00 0.00 H new ATOM 0 HG3 MET A 88 34.759 1.457 -5.801 1.00 0.00 H new ATOM 0 HE1 MET A 88 38.950 1.815 -5.963 1.00 0.00 H new ATOM 0 HE2 MET A 88 37.872 0.896 -4.885 1.00 0.00 H new ATOM 0 HE3 MET A 88 37.718 0.729 -6.650 1.00 0.00 H new ATOM 1342 N PHE A 89 31.724 4.896 -5.223 1.00 0.00 N ATOM 1343 CA PHE A 89 30.563 5.603 -4.722 1.00 0.00 C ATOM 1344 C PHE A 89 29.487 4.606 -4.314 1.00 0.00 C ATOM 1345 O PHE A 89 29.158 3.697 -5.073 1.00 0.00 O ATOM 1346 CB PHE A 89 30.042 6.552 -5.797 1.00 0.00 C ATOM 1347 CG PHE A 89 30.935 7.746 -6.032 1.00 0.00 C ATOM 1348 CD1 PHE A 89 32.170 7.581 -6.670 1.00 0.00 C ATOM 1349 CD2 PHE A 89 30.530 9.018 -5.609 1.00 0.00 C ATOM 1350 CE1 PHE A 89 33.000 8.687 -6.885 1.00 0.00 C ATOM 1351 CE2 PHE A 89 31.360 10.125 -5.825 1.00 0.00 C ATOM 1352 CZ PHE A 89 32.595 9.960 -6.463 1.00 0.00 C ATOM 0 H PHE A 89 31.590 4.461 -6.136 1.00 0.00 H new ATOM 0 HA PHE A 89 30.840 6.187 -3.844 1.00 0.00 H new ATOM 0 HB2 PHE A 89 29.930 6.003 -6.732 1.00 0.00 H new ATOM 0 HB3 PHE A 89 29.050 6.901 -5.512 1.00 0.00 H new ATOM 0 HD1 PHE A 89 32.482 6.600 -6.996 1.00 0.00 H new ATOM 0 HD2 PHE A 89 29.577 9.145 -5.116 1.00 0.00 H new ATOM 0 HE1 PHE A 89 33.953 8.559 -7.376 1.00 0.00 H new ATOM 0 HE2 PHE A 89 31.047 11.106 -5.499 1.00 0.00 H new ATOM 0 HZ PHE A 89 33.235 10.814 -6.630 1.00 0.00 H new ATOM 1362 N MET A 90 28.937 4.778 -3.109 1.00 0.00 N ATOM 1363 CA MET A 90 27.905 3.893 -2.608 1.00 0.00 C ATOM 1364 C MET A 90 26.709 4.707 -2.137 1.00 0.00 C ATOM 1365 O MET A 90 26.872 5.753 -1.513 1.00 0.00 O ATOM 1366 CB MET A 90 28.468 3.051 -1.467 1.00 0.00 C ATOM 1367 CG MET A 90 29.299 3.937 -0.544 1.00 0.00 C ATOM 1368 SD MET A 90 28.917 3.729 1.213 1.00 0.00 S ATOM 1369 CE MET A 90 28.813 1.924 1.276 1.00 0.00 C ATOM 0 H MET A 90 29.196 5.527 -2.467 1.00 0.00 H new ATOM 0 HA MET A 90 27.574 3.227 -3.405 1.00 0.00 H new ATOM 0 HB2 MET A 90 27.656 2.586 -0.908 1.00 0.00 H new ATOM 0 HB3 MET A 90 29.083 2.244 -1.865 1.00 0.00 H new ATOM 0 HG2 MET A 90 30.355 3.721 -0.704 1.00 0.00 H new ATOM 0 HG3 MET A 90 29.141 4.980 -0.819 1.00 0.00 H new ATOM 0 HE1 MET A 90 28.444 1.615 2.254 1.00 0.00 H new ATOM 0 HE2 MET A 90 28.130 1.572 0.503 1.00 0.00 H new ATOM 0 HE3 MET A 90 29.802 1.497 1.109 1.00 0.00 H new ATOM 1379 N CYS A 91 25.501 4.223 -2.439 1.00 0.00 N ATOM 1380 CA CYS A 91 24.284 4.903 -2.047 1.00 0.00 C ATOM 1381 C CYS A 91 23.226 3.882 -1.657 1.00 0.00 C ATOM 1382 O CYS A 91 23.143 2.811 -2.257 1.00 0.00 O ATOM 1383 CB CYS A 91 23.796 5.776 -3.200 1.00 0.00 C ATOM 1384 SG CYS A 91 22.929 4.861 -4.498 1.00 0.00 S ATOM 0 H CYS A 91 25.350 3.357 -2.957 1.00 0.00 H new ATOM 0 HA CYS A 91 24.480 5.540 -1.185 1.00 0.00 H new ATOM 0 HB2 CYS A 91 23.131 6.544 -2.805 1.00 0.00 H new ATOM 0 HB3 CYS A 91 24.650 6.290 -3.640 1.00 0.00 H new ATOM 1389 N SER A 92 22.414 4.214 -0.650 1.00 0.00 N ATOM 1390 CA SER A 92 21.367 3.325 -0.189 1.00 0.00 C ATOM 1391 C SER A 92 20.011 3.998 -0.352 1.00 0.00 C ATOM 1392 O SER A 92 19.932 5.212 -0.522 1.00 0.00 O ATOM 1393 CB SER A 92 21.618 2.959 1.270 1.00 0.00 C ATOM 1394 OG SER A 92 22.266 4.031 1.919 1.00 0.00 O ATOM 0 H SER A 92 22.469 5.097 -0.143 1.00 0.00 H new ATOM 0 HA SER A 92 21.371 2.412 -0.784 1.00 0.00 H new ATOM 0 HB2 SER A 92 20.674 2.736 1.768 1.00 0.00 H new ATOM 0 HB3 SER A 92 22.231 2.060 1.330 1.00 0.00 H new ATOM 0 HG SER A 92 21.819 4.872 1.687 1.00 0.00 H new ATOM 1400 N CYS A 93 18.940 3.202 -0.297 1.00 0.00 N ATOM 1401 CA CYS A 93 17.594 3.720 -0.436 1.00 0.00 C ATOM 1402 C CYS A 93 16.595 2.717 0.122 1.00 0.00 C ATOM 1403 O CYS A 93 16.638 1.537 -0.222 1.00 0.00 O ATOM 1404 CB CYS A 93 17.308 4.005 -1.908 1.00 0.00 C ATOM 1405 SG CYS A 93 17.970 5.585 -2.494 1.00 0.00 S ATOM 0 H CYS A 93 18.989 2.193 -0.156 1.00 0.00 H new ATOM 0 HA CYS A 93 17.499 4.649 0.126 1.00 0.00 H new ATOM 0 HB2 CYS A 93 17.728 3.200 -2.512 1.00 0.00 H new ATOM 0 HB3 CYS A 93 16.230 3.993 -2.067 1.00 0.00 H new ATOM 1410 N THR A 94 15.693 3.187 0.986 1.00 0.00 N ATOM 1411 CA THR A 94 14.692 2.327 1.584 1.00 0.00 C ATOM 1412 C THR A 94 13.468 2.252 0.684 1.00 0.00 C ATOM 1413 O THR A 94 12.471 1.624 1.032 1.00 0.00 O ATOM 1414 CB THR A 94 14.316 2.868 2.962 1.00 0.00 C ATOM 1415 OG1 THR A 94 13.676 4.116 2.818 1.00 0.00 O ATOM 1416 CG2 THR A 94 15.578 3.037 3.804 1.00 0.00 C ATOM 0 H THR A 94 15.642 4.162 1.282 1.00 0.00 H new ATOM 0 HA THR A 94 15.095 1.321 1.698 1.00 0.00 H new ATOM 0 HB THR A 94 13.641 2.169 3.456 1.00 0.00 H new ATOM 0 HG1 THR A 94 14.347 4.810 2.648 1.00 0.00 H new ATOM 0 HG21 THR A 94 15.310 3.423 4.788 1.00 0.00 H new ATOM 0 HG22 THR A 94 16.073 2.072 3.915 1.00 0.00 H new ATOM 0 HG23 THR A 94 16.253 3.737 3.311 1.00 0.00 H new ATOM 1424 N GLY A 95 13.546 2.896 -0.484 1.00 0.00 N ATOM 1425 CA GLY A 95 12.447 2.897 -1.427 1.00 0.00 C ATOM 1426 C GLY A 95 12.560 1.708 -2.371 1.00 0.00 C ATOM 1427 O GLY A 95 13.037 0.644 -1.982 1.00 0.00 O ATOM 0 H GLY A 95 14.365 3.422 -0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 95 11.499 2.856 -0.891 1.00 0.00 H new ATOM 0 HA3 GLY A 95 12.450 3.825 -1.998 1.00 0.00 H new ATOM 1431 N GLU A 96 12.117 1.892 -3.617 1.00 0.00 N ATOM 1432 CA GLU A 96 12.172 0.837 -4.609 1.00 0.00 C ATOM 1433 C GLU A 96 13.256 1.141 -5.633 1.00 0.00 C ATOM 1434 O GLU A 96 13.188 2.149 -6.333 1.00 0.00 O ATOM 1435 CB GLU A 96 10.810 0.704 -5.285 1.00 0.00 C ATOM 1436 CG GLU A 96 10.501 -0.770 -5.523 1.00 0.00 C ATOM 1437 CD GLU A 96 9.203 -1.171 -4.837 1.00 0.00 C ATOM 1438 OE1 GLU A 96 9.126 -0.970 -3.606 1.00 0.00 O ATOM 1439 OE2 GLU A 96 8.312 -1.671 -5.556 1.00 0.00 O ATOM 0 H GLU A 96 11.717 2.767 -3.955 1.00 0.00 H new ATOM 0 HA GLU A 96 12.417 -0.108 -4.124 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.037 1.152 -4.661 1.00 0.00 H new ATOM 0 HB3 GLU A 96 10.808 1.244 -6.232 1.00 0.00 H new ATOM 0 HG2 GLU A 96 10.425 -0.962 -6.593 1.00 0.00 H new ATOM 0 HG3 GLU A 96 11.320 -1.383 -5.147 1.00 0.00 H new ATOM 1446 N GLU A 97 14.258 0.264 -5.720 1.00 0.00 N ATOM 1447 CA GLU A 97 15.348 0.443 -6.658 1.00 0.00 C ATOM 1448 C GLU A 97 15.759 1.907 -6.704 1.00 0.00 C ATOM 1449 O GLU A 97 16.318 2.369 -7.697 1.00 0.00 O ATOM 1450 CB GLU A 97 14.914 -0.040 -8.039 1.00 0.00 C ATOM 1451 CG GLU A 97 14.649 -1.542 -7.992 1.00 0.00 C ATOM 1452 CD GLU A 97 13.756 -1.972 -9.147 1.00 0.00 C ATOM 1453 OE1 GLU A 97 12.592 -1.520 -9.164 1.00 0.00 O ATOM 1454 OE2 GLU A 97 14.256 -2.746 -9.993 1.00 0.00 O ATOM 0 H GLU A 97 14.330 -0.577 -5.147 1.00 0.00 H new ATOM 0 HA GLU A 97 16.208 -0.143 -6.335 1.00 0.00 H new ATOM 0 HB2 GLU A 97 14.015 0.489 -8.355 1.00 0.00 H new ATOM 0 HB3 GLU A 97 15.689 0.181 -8.773 1.00 0.00 H new ATOM 0 HG2 GLU A 97 15.594 -2.084 -8.036 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.176 -1.803 -7.045 1.00 0.00 H new ATOM 1461 N CYS A 98 15.479 2.640 -5.623 1.00 0.00 N ATOM 1462 CA CYS A 98 15.820 4.046 -5.542 1.00 0.00 C ATOM 1463 C CYS A 98 17.328 4.217 -5.648 1.00 0.00 C ATOM 1464 O CYS A 98 17.812 5.300 -5.971 1.00 0.00 O ATOM 1465 CB CYS A 98 15.301 4.620 -4.226 1.00 0.00 C ATOM 1466 SG CYS A 98 16.279 6.004 -3.591 1.00 0.00 S ATOM 0 H CYS A 98 15.015 2.272 -4.793 1.00 0.00 H new ATOM 0 HA CYS A 98 15.354 4.586 -6.367 1.00 0.00 H new ATOM 0 HB2 CYS A 98 14.272 4.950 -4.366 1.00 0.00 H new ATOM 0 HB3 CYS A 98 15.283 3.828 -3.478 1.00 0.00 H new ATOM 1471 N ASN A 99 18.073 3.144 -5.373 1.00 0.00 N ATOM 1472 CA ASN A 99 19.520 3.182 -5.440 1.00 0.00 C ATOM 1473 C ASN A 99 19.979 3.010 -6.880 1.00 0.00 C ATOM 1474 O ASN A 99 21.045 3.488 -7.259 1.00 0.00 O ATOM 1475 CB ASN A 99 20.098 2.082 -4.554 1.00 0.00 C ATOM 1476 CG ASN A 99 19.957 0.719 -5.218 1.00 0.00 C ATOM 1477 OD1 ASN A 99 20.508 0.491 -6.292 1.00 0.00 O ATOM 1478 ND2 ASN A 99 19.218 -0.187 -4.574 1.00 0.00 N ATOM 0 H ASN A 99 17.688 2.239 -5.102 1.00 0.00 H new ATOM 0 HA ASN A 99 19.877 4.147 -5.081 1.00 0.00 H new ATOM 0 HB2 ASN A 99 21.150 2.286 -4.353 1.00 0.00 H new ATOM 0 HB3 ASN A 99 19.585 2.077 -3.592 1.00 0.00 H new ATOM 0 HD21 ASN A 99 19.091 -1.117 -4.972 1.00 0.00 H new ATOM 0 HD22 ASN A 99 18.781 0.051 -3.684 1.00 0.00 H new ATOM 1485 N ASP A 100 19.166 2.322 -7.686 1.00 0.00 N ATOM 1486 CA ASP A 100 19.490 2.089 -9.080 1.00 0.00 C ATOM 1487 C ASP A 100 20.037 3.365 -9.702 1.00 0.00 C ATOM 1488 O ASP A 100 20.999 3.322 -10.465 1.00 0.00 O ATOM 1489 CB ASP A 100 18.240 1.619 -9.820 1.00 0.00 C ATOM 1490 CG ASP A 100 17.572 2.777 -10.547 1.00 0.00 C ATOM 1491 OD1 ASP A 100 18.157 3.225 -11.557 1.00 0.00 O ATOM 1492 OD2 ASP A 100 16.490 3.192 -10.081 1.00 0.00 O ATOM 0 H ASP A 100 18.278 1.919 -7.388 1.00 0.00 H new ATOM 0 HA ASP A 100 20.254 1.315 -9.156 1.00 0.00 H new ATOM 0 HB2 ASP A 100 18.507 0.841 -10.535 1.00 0.00 H new ATOM 0 HB3 ASP A 100 17.539 1.175 -9.113 1.00 0.00 H new ATOM 1497 N VAL A 101 19.423 4.504 -9.374 1.00 0.00 N ATOM 1498 CA VAL A 101 19.850 5.784 -9.900 1.00 0.00 C ATOM 1499 C VAL A 101 20.851 6.424 -8.949 1.00 0.00 C ATOM 1500 O VAL A 101 20.474 6.924 -7.891 1.00 0.00 O ATOM 1501 CB VAL A 101 18.634 6.685 -10.093 1.00 0.00 C ATOM 1502 CG1 VAL A 101 18.811 7.514 -11.363 1.00 0.00 C ATOM 1503 CG2 VAL A 101 17.379 5.827 -10.217 1.00 0.00 C ATOM 0 H VAL A 101 18.624 4.556 -8.742 1.00 0.00 H new ATOM 0 HA VAL A 101 20.336 5.641 -10.865 1.00 0.00 H new ATOM 0 HB VAL A 101 18.536 7.350 -9.235 1.00 0.00 H new ATOM 0 HG11 VAL A 101 17.942 8.158 -11.501 1.00 0.00 H new ATOM 0 HG12 VAL A 101 19.707 8.128 -11.275 1.00 0.00 H new ATOM 0 HG13 VAL A 101 18.910 6.849 -12.221 1.00 0.00 H new ATOM 0 HG21 VAL A 101 16.510 6.471 -10.355 1.00 0.00 H new ATOM 0 HG22 VAL A 101 17.477 5.161 -11.074 1.00 0.00 H new ATOM 0 HG23 VAL A 101 17.252 5.235 -9.311 1.00 0.00 H new ATOM 1513 N LEU A 102 22.132 6.407 -9.328 1.00 0.00 N ATOM 1514 CA LEU A 102 23.179 6.985 -8.509 1.00 0.00 C ATOM 1515 C LEU A 102 23.346 8.459 -8.849 1.00 0.00 C ATOM 1516 O LEU A 102 23.633 8.806 -9.992 1.00 0.00 O ATOM 1517 CB LEU A 102 24.482 6.226 -8.741 1.00 0.00 C ATOM 1518 CG LEU A 102 24.375 5.415 -10.030 1.00 0.00 C ATOM 1519 CD1 LEU A 102 25.754 5.299 -10.674 1.00 0.00 C ATOM 1520 CD2 LEU A 102 23.843 4.022 -9.713 1.00 0.00 C ATOM 0 H LEU A 102 22.461 5.996 -10.202 1.00 0.00 H new ATOM 0 HA LEU A 102 22.909 6.904 -7.456 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.316 6.925 -8.806 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.685 5.565 -7.899 1.00 0.00 H new ATOM 0 HG LEU A 102 23.693 5.915 -10.718 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.678 4.720 -11.594 1.00 0.00 H new ATOM 0 HD12 LEU A 102 26.134 6.295 -10.902 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.436 4.799 -9.986 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.767 3.443 -10.634 1.00 0.00 H new ATOM 0 HD22 LEU A 102 24.523 3.521 -9.025 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.858 4.105 -9.254 1.00 0.00 H new ATOM 1532 N ILE A 103 23.166 9.326 -7.850 1.00 0.00 N ATOM 1533 CA ILE A 103 23.298 10.756 -8.043 1.00 0.00 C ATOM 1534 C ILE A 103 24.691 11.205 -7.624 1.00 0.00 C ATOM 1535 O ILE A 103 25.155 10.865 -6.539 1.00 0.00 O ATOM 1536 CB ILE A 103 22.228 11.481 -7.231 1.00 0.00 C ATOM 1537 CG1 ILE A 103 20.920 11.500 -8.015 1.00 0.00 C ATOM 1538 CG2 ILE A 103 22.679 12.912 -6.957 1.00 0.00 C ATOM 1539 CD1 ILE A 103 19.790 10.978 -7.133 1.00 0.00 C ATOM 0 H ILE A 103 22.927 9.052 -6.897 1.00 0.00 H new ATOM 0 HA ILE A 103 23.160 10.999 -9.097 1.00 0.00 H new ATOM 0 HB ILE A 103 22.076 10.961 -6.285 1.00 0.00 H new ATOM 0 HG12 ILE A 103 20.698 12.514 -8.347 1.00 0.00 H new ATOM 0 HG13 ILE A 103 21.011 10.884 -8.910 1.00 0.00 H new ATOM 0 HG21 ILE A 103 21.915 13.430 -6.377 1.00 0.00 H new ATOM 0 HG22 ILE A 103 23.613 12.898 -6.395 1.00 0.00 H new ATOM 0 HG23 ILE A 103 22.832 13.433 -7.902 1.00 0.00 H new ATOM 0 HD11 ILE A 103 18.855 10.992 -7.693 1.00 0.00 H new ATOM 0 HD12 ILE A 103 20.012 9.957 -6.823 1.00 0.00 H new ATOM 0 HD13 ILE A 103 19.694 11.612 -6.252 1.00 0.00 H new ATOM 1551 N PHE A 104 25.358 11.974 -8.490 1.00 0.00 N ATOM 1552 CA PHE A 104 26.692 12.464 -8.203 1.00 0.00 C ATOM 1553 C PHE A 104 26.685 13.985 -8.162 1.00 0.00 C ATOM 1554 O PHE A 104 26.447 14.635 -9.178 1.00 0.00 O ATOM 1555 CB PHE A 104 27.658 11.954 -9.270 1.00 0.00 C ATOM 1556 CG PHE A 104 27.629 10.455 -9.444 1.00 0.00 C ATOM 1557 CD1 PHE A 104 26.485 9.832 -9.955 1.00 0.00 C ATOM 1558 CD2 PHE A 104 28.747 9.688 -9.095 1.00 0.00 C ATOM 1559 CE1 PHE A 104 26.459 8.441 -10.119 1.00 0.00 C ATOM 1560 CE2 PHE A 104 28.721 8.298 -9.257 1.00 0.00 C ATOM 1561 CZ PHE A 104 27.577 7.674 -9.770 1.00 0.00 C ATOM 0 H PHE A 104 24.988 12.266 -9.394 1.00 0.00 H new ATOM 0 HA PHE A 104 27.019 12.097 -7.230 1.00 0.00 H new ATOM 0 HB2 PHE A 104 27.417 12.427 -10.222 1.00 0.00 H new ATOM 0 HB3 PHE A 104 28.670 12.262 -9.009 1.00 0.00 H new ATOM 0 HD1 PHE A 104 25.622 10.424 -10.223 1.00 0.00 H new ATOM 0 HD2 PHE A 104 29.630 10.169 -8.701 1.00 0.00 H new ATOM 0 HE1 PHE A 104 25.577 7.960 -10.515 1.00 0.00 H new ATOM 0 HE2 PHE A 104 29.583 7.707 -8.986 1.00 0.00 H new ATOM 0 HZ PHE A 104 27.557 6.602 -9.896 1.00 0.00 H new ATOM 1571 N SER A 105 26.947 14.552 -6.983 1.00 0.00 N ATOM 1572 CA SER A 105 26.971 15.991 -6.816 1.00 0.00 C ATOM 1573 C SER A 105 28.188 16.396 -5.997 1.00 0.00 C ATOM 1574 O SER A 105 28.421 15.858 -4.917 1.00 0.00 O ATOM 1575 CB SER A 105 25.684 16.445 -6.132 1.00 0.00 C ATOM 1576 OG SER A 105 25.814 16.291 -4.737 1.00 0.00 O ATOM 0 H SER A 105 27.145 14.027 -6.131 1.00 0.00 H new ATOM 0 HA SER A 105 27.038 16.472 -7.792 1.00 0.00 H new ATOM 0 HB2 SER A 105 25.478 17.487 -6.376 1.00 0.00 H new ATOM 0 HB3 SER A 105 24.840 15.859 -6.496 1.00 0.00 H new ATOM 0 HG SER A 105 26.634 15.792 -4.538 1.00 0.00 H new ATOM 1582 N ALA A 106 28.966 17.350 -6.515 1.00 0.00 N ATOM 1583 CA ALA A 106 30.154 17.822 -5.832 1.00 0.00 C ATOM 1584 C ALA A 106 29.756 18.641 -4.612 1.00 0.00 C ATOM 1585 O ALA A 106 30.262 18.411 -3.516 1.00 0.00 O ATOM 1586 CB ALA A 106 30.994 18.658 -6.794 1.00 0.00 C ATOM 0 H ALA A 106 28.786 17.807 -7.409 1.00 0.00 H new ATOM 0 HA ALA A 106 30.748 16.972 -5.496 1.00 0.00 H new ATOM 0 HB1 ALA A 106 31.888 19.014 -6.282 1.00 0.00 H new ATOM 0 HB2 ALA A 106 31.285 18.047 -7.649 1.00 0.00 H new ATOM 0 HB3 ALA A 106 30.410 19.511 -7.140 1.00 0.00 H new ATOM 1592 N ILE A 107 28.846 19.598 -4.805 1.00 0.00 N ATOM 1593 CA ILE A 107 28.383 20.446 -3.724 1.00 0.00 C ATOM 1594 C ILE A 107 27.730 19.593 -2.646 1.00 0.00 C ATOM 1595 O ILE A 107 27.792 19.928 -1.465 1.00 0.00 O ATOM 1596 CB ILE A 107 27.398 21.475 -4.271 1.00 0.00 C ATOM 1597 CG1 ILE A 107 26.939 22.391 -3.141 1.00 0.00 C ATOM 1598 CG2 ILE A 107 26.190 20.756 -4.865 1.00 0.00 C ATOM 1599 CD1 ILE A 107 27.298 23.835 -3.479 1.00 0.00 C ATOM 1600 OXT ILE A 107 27.141 18.555 -3.021 1.00 0.00 O ATOM 0 H ILE A 107 28.418 19.800 -5.709 1.00 0.00 H new ATOM 0 HA ILE A 107 29.228 20.973 -3.281 1.00 0.00 H new ATOM 0 HB ILE A 107 27.885 22.069 -5.045 1.00 0.00 H new ATOM 0 HG12 ILE A 107 25.863 22.297 -2.997 1.00 0.00 H new ATOM 0 HG13 ILE A 107 27.413 22.097 -2.205 1.00 0.00 H new ATOM 0 HG21 ILE A 107 25.486 21.490 -5.256 1.00 0.00 H new ATOM 0 HG22 ILE A 107 26.517 20.101 -5.673 1.00 0.00 H new ATOM 0 HG23 ILE A 107 25.703 20.162 -4.091 1.00 0.00 H new ATOM 0 HD11 ILE A 107 26.970 24.490 -2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 107 28.378 23.922 -3.601 1.00 0.00 H new ATOM 0 HD13 ILE A 107 26.803 24.126 -4.406 1.00 0.00 H new TER 1612 ILE A 107