USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 976 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 92 THR OG1 : rot -36:sc= 0.16 USER MOD Set 1.2: A 93 GLN : amide:sc= 0.988 K(o=1.1,f=-0.12) USER MOD Set 2.1: A 5 MET CE :methyl 167:sc= -0.0214 (180deg=-0.546) USER MOD Set 2.2: A 35 CYS SG : rot -93:sc= 0.0253 USER MOD Set 2.3: A 69 ASN : amide:sc= 0.428 K(o=0.65,f=-0.37) USER MOD Set 2.4: A 73 TYR OH : rot -116:sc= 0.218 USER MOD Set 3.1: A 11 ASN : amide:sc= 1.02 K(o=2.4,f=-3.5!) USER MOD Set 3.2: A 15 SER OG : rot -61:sc= 0.624 USER MOD Set 3.3: A 34 SER OG : rot 170:sc= 0.742 USER MOD Set 4.1: A 16 GLN : amide:sc= 2 K(o=6.5,f=-4.3) USER MOD Set 4.2: A 23 LYS NZ :NH3+ -173:sc= 2.24 (180deg=1.97) USER MOD Set 4.3: A 60 GLN : amide:sc= 2.3 K(o=6.5,f=-2.2!) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0835 (180deg=-0.393) USER MOD Single : A 1 MET N :NH3+ 151:sc= 1.27 (180deg=0.701) USER MOD Single : A 2 LYS NZ :NH3+ 156:sc= 2.41 (180deg=1.85) USER MOD Single : A 3 LYS NZ :NH3+ -179:sc= 1.25 (180deg=1.24) USER MOD Single : A 8 CYS SG : rot 172:sc= 0.266 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0648 USER MOD Single : A 13 CYS SG : rot 180:sc= 0.296 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -140:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -170:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0.854 K(o=0.85,f=-4.6!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 173:sc= -0.628 (180deg=-0.863) USER MOD Single : A 50 MET CE :methyl -140:sc= -0.186 (180deg=-2.4) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -128:sc= 0.593 USER MOD Single : A 67 ASN : amide:sc= 0.774 K(o=0.77,f=-0.17) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= 0.896 K(o=0.9,f=-1.7) USER MOD Single : A 107 GLN : amide:sc= 0.354 K(o=0.35,f=-0.84) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 78:sc= 1.22 USER MOD Single : A 118 GLN : amide:sc= 0.876 K(o=0.88,f=-0.014) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -1.32 K(o=-1.3,f=-0.28) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 83:sc= 1.04 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.702 0.030 1.260 1.00 0.00 N ATOM 2 CA MET A 1 2.175 0.203 -0.144 1.00 0.00 C ATOM 3 C MET A 1 2.261 1.685 -0.518 1.00 0.00 C ATOM 4 O MET A 1 1.258 2.392 -0.451 1.00 0.00 O ATOM 5 CB MET A 1 1.300 -0.577 -1.153 1.00 0.00 C ATOM 6 CG MET A 1 1.879 -0.558 -2.577 1.00 0.00 C ATOM 7 SD MET A 1 0.968 -1.603 -3.749 1.00 0.00 S ATOM 8 CE MET A 1 2.287 -1.936 -4.947 1.00 0.00 C ATOM 0 H1 MET A 1 1.195 -0.874 1.347 1.00 0.00 H new ATOM 0 H2 MET A 1 2.518 0.033 1.904 1.00 0.00 H new ATOM 0 H3 MET A 1 1.062 0.811 1.509 1.00 0.00 H new ATOM 0 HA MET A 1 3.178 -0.219 -0.198 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.200 -1.610 -0.819 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.298 -0.148 -1.167 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.882 0.468 -2.945 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.918 -0.887 -2.542 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.852 -2.318 -5.870 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.830 -1.014 -5.156 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.974 -2.676 -4.536 1.00 0.00 H new ATOM 18 N LYS A 2 3.444 2.147 -0.951 1.00 0.00 N ATOM 19 CA LYS A 2 3.694 3.500 -1.509 1.00 0.00 C ATOM 20 C LYS A 2 4.462 3.438 -2.836 1.00 0.00 C ATOM 21 O LYS A 2 4.994 2.388 -3.190 1.00 0.00 O ATOM 22 CB LYS A 2 4.402 4.367 -0.448 1.00 0.00 C ATOM 23 CG LYS A 2 3.408 4.797 0.644 1.00 0.00 C ATOM 24 CD LYS A 2 4.012 5.744 1.692 1.00 0.00 C ATOM 25 CE LYS A 2 2.890 6.339 2.556 1.00 0.00 C ATOM 26 NZ LYS A 2 2.314 7.569 1.946 1.00 0.00 N ATOM 0 H LYS A 2 4.288 1.574 -0.925 1.00 0.00 H new ATOM 0 HA LYS A 2 2.740 3.970 -1.749 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.223 3.807 -0.001 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.837 5.248 -0.920 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.555 5.286 0.174 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.028 3.908 1.147 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.721 5.204 2.320 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.567 6.542 1.199 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.103 5.597 2.690 1.00 0.00 H new ATOM 0 HE3 LYS A 2 3.280 6.573 3.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 1.346 7.711 2.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 2.899 8.390 2.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 2.294 7.467 0.911 1.00 0.00 H new ATOM 40 N LYS A 3 4.491 4.551 -3.582 1.00 0.00 N ATOM 41 CA LYS A 3 5.112 4.651 -4.920 1.00 0.00 C ATOM 42 C LYS A 3 6.380 5.504 -4.880 1.00 0.00 C ATOM 43 O LYS A 3 6.409 6.551 -4.237 1.00 0.00 O ATOM 44 CB LYS A 3 4.114 5.163 -5.983 1.00 0.00 C ATOM 45 CG LYS A 3 2.874 4.262 -6.174 1.00 0.00 C ATOM 46 CD LYS A 3 1.699 4.498 -5.210 1.00 0.00 C ATOM 47 CE LYS A 3 1.137 5.911 -5.387 1.00 0.00 C ATOM 48 NZ LYS A 3 0.499 6.438 -4.153 1.00 0.00 N ATOM 0 H LYS A 3 4.076 5.429 -3.270 1.00 0.00 H new ATOM 0 HA LYS A 3 5.402 3.643 -5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.783 6.163 -5.702 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.633 5.255 -6.937 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.511 4.393 -7.193 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.189 3.223 -6.079 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.916 3.763 -5.395 1.00 0.00 H new ATOM 0 HD3 LYS A 3 2.031 4.358 -4.181 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.942 6.581 -5.689 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.405 5.907 -6.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.122 7.390 -4.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.277 5.807 -3.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.205 6.486 -3.391 1.00 0.00 H new ATOM 62 N VAL A 4 7.412 5.071 -5.599 1.00 0.00 N ATOM 63 CA VAL A 4 8.706 5.775 -5.704 1.00 0.00 C ATOM 64 C VAL A 4 9.027 6.063 -7.173 1.00 0.00 C ATOM 65 O VAL A 4 8.815 5.217 -8.040 1.00 0.00 O ATOM 66 CB VAL A 4 9.857 5.021 -4.992 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.124 5.883 -4.901 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.478 4.556 -3.579 1.00 0.00 C ATOM 0 H VAL A 4 7.381 4.206 -6.138 1.00 0.00 H new ATOM 0 HA VAL A 4 8.612 6.725 -5.178 1.00 0.00 H new ATOM 0 HB VAL A 4 10.051 4.141 -5.606 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.910 5.322 -4.396 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.456 6.149 -5.905 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.907 6.791 -4.338 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.322 4.034 -3.129 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.219 5.421 -2.969 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.623 3.882 -3.635 1.00 0.00 H new ATOM 78 N MET A 5 9.550 7.254 -7.463 1.00 0.00 N ATOM 79 CA MET A 5 9.903 7.689 -8.819 1.00 0.00 C ATOM 80 C MET A 5 11.328 8.238 -8.851 1.00 0.00 C ATOM 81 O MET A 5 11.719 9.019 -7.985 1.00 0.00 O ATOM 82 CB MET A 5 8.856 8.688 -9.334 1.00 0.00 C ATOM 83 CG MET A 5 9.272 9.442 -10.605 1.00 0.00 C ATOM 84 SD MET A 5 9.620 8.442 -12.077 1.00 0.00 S ATOM 85 CE MET A 5 8.155 8.810 -13.078 1.00 0.00 C ATOM 0 H MET A 5 9.745 7.958 -6.751 1.00 0.00 H new ATOM 0 HA MET A 5 9.890 6.836 -9.498 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.927 8.153 -9.531 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.646 9.413 -8.548 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.480 10.148 -10.855 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.162 10.028 -10.375 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.316 8.464 -14.099 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.288 8.302 -12.655 1.00 0.00 H new ATOM 0 HE3 MET A 5 7.978 9.886 -13.083 1.00 0.00 H new ATOM 95 N PHE A 6 12.092 7.841 -9.866 1.00 0.00 N ATOM 96 CA PHE A 6 13.522 8.163 -10.009 1.00 0.00 C ATOM 97 C PHE A 6 13.797 9.078 -11.216 1.00 0.00 C ATOM 98 O PHE A 6 13.535 8.680 -12.346 1.00 0.00 O ATOM 99 CB PHE A 6 14.313 6.845 -10.102 1.00 0.00 C ATOM 100 CG PHE A 6 13.982 5.823 -9.030 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.500 5.958 -7.727 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.143 4.735 -9.334 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.134 5.045 -6.720 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.780 3.827 -8.328 1.00 0.00 C ATOM 105 CZ PHE A 6 13.249 3.996 -7.014 1.00 0.00 C ATOM 0 H PHE A 6 11.732 7.273 -10.633 1.00 0.00 H new ATOM 0 HA PHE A 6 13.848 8.725 -9.134 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.131 6.397 -11.079 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.378 7.073 -10.050 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.181 6.765 -7.500 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.779 4.599 -10.342 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.534 5.152 -5.722 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.136 2.993 -8.565 1.00 0.00 H new ATOM 0 HZ PHE A 6 12.930 3.321 -6.233 1.00 0.00 H new ATOM 115 N VAL A 7 14.363 10.269 -10.993 1.00 0.00 N ATOM 116 CA VAL A 7 14.812 11.237 -12.022 1.00 0.00 C ATOM 117 C VAL A 7 16.319 11.112 -12.289 1.00 0.00 C ATOM 118 O VAL A 7 17.102 10.893 -11.375 1.00 0.00 O ATOM 119 CB VAL A 7 14.397 12.690 -11.634 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.433 13.787 -11.949 1.00 0.00 C ATOM 121 CG2 VAL A 7 13.116 13.083 -12.374 1.00 0.00 C ATOM 0 H VAL A 7 14.533 10.609 -10.046 1.00 0.00 H new ATOM 0 HA VAL A 7 14.309 10.997 -12.959 1.00 0.00 H new ATOM 0 HB VAL A 7 14.280 12.647 -10.551 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.042 14.756 -11.639 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.358 13.579 -11.411 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.632 13.802 -13.020 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.833 14.099 -12.098 1.00 0.00 H new ATOM 0 HG22 VAL A 7 13.287 13.034 -13.449 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.314 12.396 -12.103 1.00 0.00 H new ATOM 131 N CYS A 8 16.742 11.314 -13.537 1.00 0.00 N ATOM 132 CA CYS A 8 18.138 11.467 -13.986 1.00 0.00 C ATOM 133 C CYS A 8 18.140 12.503 -15.135 1.00 0.00 C ATOM 134 O CYS A 8 17.102 13.111 -15.388 1.00 0.00 O ATOM 135 CB CYS A 8 18.637 10.048 -14.342 1.00 0.00 C ATOM 136 SG CYS A 8 20.399 9.978 -14.796 1.00 0.00 S ATOM 0 H CYS A 8 16.084 11.380 -14.313 1.00 0.00 H new ATOM 0 HA CYS A 8 18.831 11.859 -13.242 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.465 9.389 -13.491 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.043 9.662 -15.170 1.00 0.00 H new ATOM 0 HG CYS A 8 20.770 8.737 -14.905 1.00 0.00 H new ATOM 142 N LYS A 9 19.234 12.708 -15.884 1.00 0.00 N ATOM 143 CA LYS A 9 19.221 13.623 -17.055 1.00 0.00 C ATOM 144 C LYS A 9 18.283 13.123 -18.158 1.00 0.00 C ATOM 145 O LYS A 9 17.201 13.667 -18.327 1.00 0.00 O ATOM 146 CB LYS A 9 20.652 13.970 -17.527 1.00 0.00 C ATOM 147 CG LYS A 9 21.399 14.819 -16.478 1.00 0.00 C ATOM 148 CD LYS A 9 22.698 15.449 -17.008 1.00 0.00 C ATOM 149 CE LYS A 9 23.751 14.414 -17.443 1.00 0.00 C ATOM 150 NZ LYS A 9 25.013 15.075 -17.898 1.00 0.00 N ATOM 0 H LYS A 9 20.134 12.262 -15.709 1.00 0.00 H new ATOM 0 HA LYS A 9 18.794 14.575 -16.740 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.207 13.051 -17.716 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.604 14.514 -18.470 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.738 15.611 -16.126 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.633 14.194 -15.617 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.461 16.092 -17.856 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.125 16.086 -16.234 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.969 13.744 -16.612 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.349 13.801 -18.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.701 14.350 -18.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.808 15.696 -18.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.409 15.640 -17.120 1.00 0.00 H new ATOM 164 N ARG A 10 18.646 12.022 -18.822 1.00 0.00 N ATOM 165 CA ARG A 10 17.926 11.452 -20.001 1.00 0.00 C ATOM 166 C ARG A 10 17.308 10.068 -19.788 1.00 0.00 C ATOM 167 O ARG A 10 16.986 9.375 -20.749 1.00 0.00 O ATOM 168 CB ARG A 10 18.820 11.574 -21.249 1.00 0.00 C ATOM 169 CG ARG A 10 20.065 10.678 -21.187 1.00 0.00 C ATOM 170 CD ARG A 10 21.262 11.316 -21.885 1.00 0.00 C ATOM 171 NE ARG A 10 21.165 11.234 -23.359 1.00 0.00 N ATOM 172 CZ ARG A 10 21.082 12.216 -24.244 1.00 0.00 C ATOM 173 NH1 ARG A 10 20.852 13.461 -23.939 1.00 0.00 N ATOM 174 NH2 ARG A 10 21.222 11.942 -25.511 1.00 0.00 N ATOM 0 H ARG A 10 19.467 11.477 -18.560 1.00 0.00 H new ATOM 0 HA ARG A 10 17.032 12.054 -20.161 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.237 11.315 -22.133 1.00 0.00 H new ATOM 0 HB3 ARG A 10 19.132 12.612 -21.365 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.317 10.478 -20.145 1.00 0.00 H new ATOM 0 HG3 ARG A 10 19.844 9.717 -21.652 1.00 0.00 H new ATOM 0 HD2 ARG A 10 21.339 12.361 -21.586 1.00 0.00 H new ATOM 0 HD3 ARG A 10 22.177 10.823 -21.556 1.00 0.00 H new ATOM 0 HE ARG A 10 21.162 10.291 -23.747 1.00 0.00 H new ATOM 0 HH11 ARG A 10 20.723 13.732 -22.964 1.00 0.00 H new ATOM 0 HH12 ARG A 10 20.801 14.165 -24.675 1.00 0.00 H new ATOM 0 HH21 ARG A 10 21.393 10.982 -25.809 1.00 0.00 H new ATOM 0 HH22 ARG A 10 21.161 12.688 -26.204 1.00 0.00 H new ATOM 188 N ASN A 11 17.192 9.658 -18.521 1.00 0.00 N ATOM 189 CA ASN A 11 16.713 8.338 -18.063 1.00 0.00 C ATOM 190 C ASN A 11 17.518 7.150 -18.635 1.00 0.00 C ATOM 191 O ASN A 11 16.981 6.064 -18.820 1.00 0.00 O ATOM 192 CB ASN A 11 15.189 8.302 -18.280 1.00 0.00 C ATOM 193 CG ASN A 11 14.413 7.175 -17.610 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.394 6.757 -18.130 1.00 0.00 O ATOM 195 ND2 ASN A 11 14.784 6.685 -16.445 1.00 0.00 N ATOM 0 H ASN A 11 17.442 10.266 -17.741 1.00 0.00 H new ATOM 0 HA ASN A 11 16.900 8.207 -16.997 1.00 0.00 H new ATOM 0 HB2 ASN A 11 14.776 9.249 -17.932 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.002 8.248 -19.353 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.220 5.966 -15.991 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.635 7.025 -15.997 1.00 0.00 H new ATOM 202 N SER A 12 18.808 7.373 -18.914 1.00 0.00 N ATOM 203 CA SER A 12 19.722 6.404 -19.541 1.00 0.00 C ATOM 204 C SER A 12 20.316 5.415 -18.538 1.00 0.00 C ATOM 205 O SER A 12 20.342 4.215 -18.795 1.00 0.00 O ATOM 206 CB SER A 12 20.847 7.164 -20.252 1.00 0.00 C ATOM 207 OG SER A 12 21.339 8.157 -19.365 1.00 0.00 O ATOM 0 H SER A 12 19.262 8.262 -18.703 1.00 0.00 H new ATOM 0 HA SER A 12 19.143 5.818 -20.255 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.646 6.480 -20.538 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.476 7.623 -21.169 1.00 0.00 H new ATOM 0 HG SER A 12 22.062 8.655 -19.800 1.00 0.00 H new ATOM 213 N CYS A 13 20.791 5.919 -17.396 1.00 0.00 N ATOM 214 CA CYS A 13 21.457 5.151 -16.338 1.00 0.00 C ATOM 215 C CYS A 13 21.012 5.653 -14.951 1.00 0.00 C ATOM 216 O CYS A 13 20.221 6.590 -14.856 1.00 0.00 O ATOM 217 CB CYS A 13 22.980 5.253 -16.593 1.00 0.00 C ATOM 218 SG CYS A 13 23.898 3.992 -15.653 1.00 0.00 S ATOM 0 H CYS A 13 20.720 6.912 -17.173 1.00 0.00 H new ATOM 0 HA CYS A 13 21.179 4.097 -16.355 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.181 5.133 -17.658 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.332 6.246 -16.312 1.00 0.00 H new ATOM 0 HG CYS A 13 25.170 4.110 -15.896 1.00 0.00 H new ATOM 224 N ARG A 14 21.492 5.025 -13.867 1.00 0.00 N ATOM 225 CA ARG A 14 21.120 5.254 -12.441 1.00 0.00 C ATOM 226 C ARG A 14 19.633 5.052 -12.137 1.00 0.00 C ATOM 227 O ARG A 14 19.259 4.037 -11.573 1.00 0.00 O ATOM 228 CB ARG A 14 21.695 6.607 -11.950 1.00 0.00 C ATOM 229 CG ARG A 14 23.226 6.666 -12.078 1.00 0.00 C ATOM 230 CD ARG A 14 23.853 7.868 -11.358 1.00 0.00 C ATOM 231 NE ARG A 14 23.451 9.156 -11.972 1.00 0.00 N ATOM 232 CZ ARG A 14 24.215 10.060 -12.564 1.00 0.00 C ATOM 233 NH1 ARG A 14 25.508 9.958 -12.642 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.666 11.116 -13.086 1.00 0.00 N ATOM 0 H ARG A 14 22.197 4.294 -13.957 1.00 0.00 H new ATOM 0 HA ARG A 14 21.590 4.467 -11.851 1.00 0.00 H new ATOM 0 HB2 ARG A 14 21.252 7.419 -12.526 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.412 6.764 -10.909 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.652 5.748 -11.675 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.494 6.705 -13.134 1.00 0.00 H new ATOM 0 HD2 ARG A 14 23.555 7.858 -10.309 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.939 7.779 -11.382 1.00 0.00 H new ATOM 0 HE ARG A 14 22.455 9.374 -11.933 1.00 0.00 H new ATOM 0 HH11 ARG A 14 25.981 9.151 -12.235 1.00 0.00 H new ATOM 0 HH12 ARG A 14 26.050 10.685 -13.110 1.00 0.00 H new ATOM 0 HH21 ARG A 14 22.655 11.242 -13.037 1.00 0.00 H new ATOM 0 HH22 ARG A 14 24.246 11.819 -13.544 1.00 0.00 H new ATOM 248 N SER A 15 18.777 5.963 -12.594 1.00 0.00 N ATOM 249 CA SER A 15 17.300 5.924 -12.458 1.00 0.00 C ATOM 250 C SER A 15 16.684 4.587 -12.901 1.00 0.00 C ATOM 251 O SER A 15 15.819 4.045 -12.224 1.00 0.00 O ATOM 252 CB SER A 15 16.706 7.081 -13.277 1.00 0.00 C ATOM 253 OG SER A 15 17.071 6.961 -14.653 1.00 0.00 O ATOM 0 H SER A 15 19.096 6.792 -13.095 1.00 0.00 H new ATOM 0 HA SER A 15 17.059 6.029 -11.400 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.620 7.081 -13.182 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.061 8.033 -12.882 1.00 0.00 H new ATOM 0 HG SER A 15 18.047 6.992 -14.736 1.00 0.00 H new ATOM 259 N GLN A 16 17.202 4.011 -13.987 1.00 0.00 N ATOM 260 CA GLN A 16 16.769 2.699 -14.506 1.00 0.00 C ATOM 261 C GLN A 16 17.227 1.540 -13.595 1.00 0.00 C ATOM 262 O GLN A 16 16.466 0.610 -13.357 1.00 0.00 O ATOM 263 CB GLN A 16 17.318 2.523 -15.935 1.00 0.00 C ATOM 264 CG GLN A 16 16.794 3.566 -16.945 1.00 0.00 C ATOM 265 CD GLN A 16 15.385 3.299 -17.475 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.670 2.412 -17.033 1.00 0.00 O ATOM 267 NE2 GLN A 16 14.961 4.046 -18.465 1.00 0.00 N ATOM 0 H GLN A 16 17.942 4.441 -14.542 1.00 0.00 H new ATOM 0 HA GLN A 16 15.679 2.671 -14.523 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.406 2.578 -15.904 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.059 1.526 -16.292 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.808 4.548 -16.471 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.482 3.610 -17.790 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.556 4.787 -18.836 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.036 3.886 -18.865 1.00 0.00 H new ATOM 276 N MET A 17 18.437 1.612 -13.010 1.00 0.00 N ATOM 277 CA MET A 17 18.914 0.620 -12.022 1.00 0.00 C ATOM 278 C MET A 17 18.119 0.695 -10.713 1.00 0.00 C ATOM 279 O MET A 17 17.863 -0.333 -10.095 1.00 0.00 O ATOM 280 CB MET A 17 20.408 0.817 -11.699 1.00 0.00 C ATOM 281 CG MET A 17 21.386 0.509 -12.835 1.00 0.00 C ATOM 282 SD MET A 17 23.100 0.727 -12.283 1.00 0.00 S ATOM 283 CE MET A 17 23.974 -0.042 -13.666 1.00 0.00 C ATOM 0 H MET A 17 19.110 2.354 -13.206 1.00 0.00 H new ATOM 0 HA MET A 17 18.766 -0.359 -12.479 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.559 1.850 -11.387 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.661 0.186 -10.847 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.238 -0.514 -13.182 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.185 1.165 -13.682 1.00 0.00 H new ATOM 0 HE1 MET A 17 25.048 0.005 -13.489 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.667 -1.084 -13.756 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.735 0.488 -14.588 1.00 0.00 H new ATOM 293 N ALA A 18 17.694 1.894 -10.302 1.00 0.00 N ATOM 294 CA ALA A 18 16.862 2.083 -9.109 1.00 0.00 C ATOM 295 C ALA A 18 15.484 1.420 -9.271 1.00 0.00 C ATOM 296 O ALA A 18 15.042 0.687 -8.388 1.00 0.00 O ATOM 297 CB ALA A 18 16.771 3.588 -8.829 1.00 0.00 C ATOM 0 H ALA A 18 17.918 2.762 -10.788 1.00 0.00 H new ATOM 0 HA ALA A 18 17.316 1.591 -8.249 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.156 3.757 -7.945 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.771 3.987 -8.658 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.321 4.091 -9.685 1.00 0.00 H new ATOM 303 N GLU A 19 14.853 1.579 -10.441 1.00 0.00 N ATOM 304 CA GLU A 19 13.643 0.826 -10.809 1.00 0.00 C ATOM 305 C GLU A 19 13.937 -0.684 -10.829 1.00 0.00 C ATOM 306 O GLU A 19 13.183 -1.454 -10.237 1.00 0.00 O ATOM 307 CB GLU A 19 13.113 1.369 -12.147 1.00 0.00 C ATOM 308 CG GLU A 19 11.738 0.834 -12.571 1.00 0.00 C ATOM 309 CD GLU A 19 11.740 -0.580 -13.193 1.00 0.00 C ATOM 310 OE1 GLU A 19 12.782 -1.033 -13.728 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.669 -1.227 -13.201 1.00 0.00 O ATOM 0 H GLU A 19 15.165 2.232 -11.160 1.00 0.00 H new ATOM 0 HA GLU A 19 12.858 0.963 -10.066 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.058 2.456 -12.084 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.834 1.131 -12.929 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.085 0.828 -11.699 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.303 1.528 -13.290 1.00 0.00 H new ATOM 318 N GLY A 20 15.089 -1.078 -11.387 1.00 0.00 N ATOM 319 CA GLY A 20 15.654 -2.430 -11.357 1.00 0.00 C ATOM 320 C GLY A 20 15.646 -3.078 -9.971 1.00 0.00 C ATOM 321 O GLY A 20 14.967 -4.079 -9.767 1.00 0.00 O ATOM 0 H GLY A 20 15.683 -0.425 -11.899 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.093 -3.062 -12.045 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.680 -2.392 -11.723 1.00 0.00 H new ATOM 325 N PHE A 21 16.366 -2.525 -8.990 1.00 0.00 N ATOM 326 CA PHE A 21 16.404 -3.115 -7.639 1.00 0.00 C ATOM 327 C PHE A 21 15.051 -3.064 -6.937 1.00 0.00 C ATOM 328 O PHE A 21 14.639 -4.038 -6.314 1.00 0.00 O ATOM 329 CB PHE A 21 17.511 -2.456 -6.800 1.00 0.00 C ATOM 330 CG PHE A 21 18.872 -2.910 -7.258 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.254 -4.246 -7.042 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.727 -2.038 -7.948 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.494 -4.709 -7.503 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.968 -2.502 -8.414 1.00 0.00 C ATOM 335 CZ PHE A 21 21.350 -3.840 -8.194 1.00 0.00 C ATOM 0 H PHE A 21 16.926 -1.679 -9.099 1.00 0.00 H new ATOM 0 HA PHE A 21 16.641 -4.173 -7.749 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.438 -1.371 -6.881 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.374 -2.707 -5.748 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.589 -4.918 -6.519 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.432 -1.013 -8.120 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.789 -5.733 -7.326 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.630 -1.832 -8.942 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.302 -4.196 -8.558 1.00 0.00 H new ATOM 345 N ALA A 22 14.323 -1.958 -7.074 1.00 0.00 N ATOM 346 CA ALA A 22 13.041 -1.789 -6.392 1.00 0.00 C ATOM 347 C ALA A 22 11.950 -2.751 -6.898 1.00 0.00 C ATOM 348 O ALA A 22 11.227 -3.304 -6.073 1.00 0.00 O ATOM 349 CB ALA A 22 12.636 -0.318 -6.503 1.00 0.00 C ATOM 0 H ALA A 22 14.599 -1.164 -7.652 1.00 0.00 H new ATOM 0 HA ALA A 22 13.157 -2.057 -5.342 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.681 -0.165 -6.001 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.397 0.305 -6.033 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.542 -0.045 -7.554 1.00 0.00 H new ATOM 355 N LYS A 23 11.855 -3.035 -8.207 1.00 0.00 N ATOM 356 CA LYS A 23 10.821 -3.942 -8.760 1.00 0.00 C ATOM 357 C LYS A 23 10.916 -5.372 -8.204 1.00 0.00 C ATOM 358 O LYS A 23 9.903 -6.050 -8.065 1.00 0.00 O ATOM 359 CB LYS A 23 10.861 -3.911 -10.306 1.00 0.00 C ATOM 360 CG LYS A 23 11.945 -4.810 -10.940 1.00 0.00 C ATOM 361 CD LYS A 23 12.529 -4.275 -12.255 1.00 0.00 C ATOM 362 CE LYS A 23 11.540 -4.299 -13.422 1.00 0.00 C ATOM 363 NZ LYS A 23 12.140 -3.639 -14.603 1.00 0.00 N ATOM 0 H LYS A 23 12.484 -2.649 -8.911 1.00 0.00 H new ATOM 0 HA LYS A 23 9.849 -3.573 -8.432 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.886 -4.216 -10.688 1.00 0.00 H new ATOM 0 HB3 LYS A 23 11.024 -2.884 -10.631 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.756 -4.939 -10.223 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.520 -5.797 -11.121 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.870 -3.251 -12.101 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.405 -4.867 -12.521 1.00 0.00 H new ATOM 0 HE2 LYS A 23 11.275 -5.328 -13.665 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.618 -3.791 -13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.425 -3.552 -15.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.479 -2.693 -14.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 12.938 -4.208 -14.950 1.00 0.00 H new ATOM 377 N THR A 24 12.134 -5.803 -7.866 1.00 0.00 N ATOM 378 CA THR A 24 12.457 -7.133 -7.313 1.00 0.00 C ATOM 379 C THR A 24 12.439 -7.146 -5.780 1.00 0.00 C ATOM 380 O THR A 24 11.750 -7.971 -5.184 1.00 0.00 O ATOM 381 CB THR A 24 13.825 -7.607 -7.830 1.00 0.00 C ATOM 382 OG1 THR A 24 13.870 -7.522 -9.239 1.00 0.00 O ATOM 383 CG2 THR A 24 14.163 -9.047 -7.449 1.00 0.00 C ATOM 0 H THR A 24 12.961 -5.215 -7.972 1.00 0.00 H new ATOM 0 HA THR A 24 11.682 -7.820 -7.653 1.00 0.00 H new ATOM 0 HB THR A 24 14.555 -6.949 -7.358 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.337 -8.305 -9.599 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.143 -9.309 -7.849 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.177 -9.142 -6.363 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.411 -9.719 -7.862 1.00 0.00 H new ATOM 391 N LEU A 25 13.161 -6.226 -5.126 1.00 0.00 N ATOM 392 CA LEU A 25 13.307 -6.201 -3.658 1.00 0.00 C ATOM 393 C LEU A 25 12.050 -5.671 -2.949 1.00 0.00 C ATOM 394 O LEU A 25 11.724 -6.097 -1.843 1.00 0.00 O ATOM 395 CB LEU A 25 14.546 -5.362 -3.278 1.00 0.00 C ATOM 396 CG LEU A 25 15.891 -5.867 -3.832 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.004 -4.921 -3.388 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.243 -7.270 -3.339 1.00 0.00 C ATOM 0 H LEU A 25 13.663 -5.474 -5.599 1.00 0.00 H new ATOM 0 HA LEU A 25 13.441 -7.228 -3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.391 -4.341 -3.627 1.00 0.00 H new ATOM 0 HB3 LEU A 25 14.614 -5.321 -2.191 1.00 0.00 H new ATOM 0 HG LEU A 25 15.795 -5.900 -4.917 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.959 -5.274 -3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.804 -3.920 -3.770 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.045 -4.893 -2.299 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.201 -7.574 -3.761 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.311 -7.267 -2.251 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.469 -7.971 -3.653 1.00 0.00 H new ATOM 410 N GLY A 26 11.325 -4.762 -3.609 1.00 0.00 N ATOM 411 CA GLY A 26 10.057 -4.180 -3.172 1.00 0.00 C ATOM 412 C GLY A 26 8.809 -4.802 -3.802 1.00 0.00 C ATOM 413 O GLY A 26 7.729 -4.230 -3.664 1.00 0.00 O ATOM 0 H GLY A 26 11.626 -4.394 -4.512 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.985 -4.276 -2.089 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.067 -3.114 -3.398 1.00 0.00 H new ATOM 417 N ALA A 27 8.929 -5.941 -4.492 1.00 0.00 N ATOM 418 CA ALA A 27 7.841 -6.563 -5.259 1.00 0.00 C ATOM 419 C ALA A 27 6.518 -6.690 -4.464 1.00 0.00 C ATOM 420 O ALA A 27 6.413 -7.479 -3.523 1.00 0.00 O ATOM 421 CB ALA A 27 8.319 -7.939 -5.748 1.00 0.00 C ATOM 0 H ALA A 27 9.801 -6.468 -4.535 1.00 0.00 H new ATOM 0 HA ALA A 27 7.609 -5.912 -6.102 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.525 -8.418 -6.320 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.198 -7.815 -6.381 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.574 -8.561 -4.890 1.00 0.00 H new ATOM 427 N GLY A 28 5.502 -5.903 -4.843 1.00 0.00 N ATOM 428 CA GLY A 28 4.146 -5.943 -4.267 1.00 0.00 C ATOM 429 C GLY A 28 3.965 -5.132 -2.977 1.00 0.00 C ATOM 430 O GLY A 28 2.838 -4.756 -2.651 1.00 0.00 O ATOM 0 H GLY A 28 5.600 -5.202 -5.577 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.440 -5.575 -5.012 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.884 -6.982 -4.065 1.00 0.00 H new ATOM 434 N LYS A 29 5.063 -4.790 -2.286 1.00 0.00 N ATOM 435 CA LYS A 29 5.066 -3.834 -1.158 1.00 0.00 C ATOM 436 C LYS A 29 5.234 -2.392 -1.607 1.00 0.00 C ATOM 437 O LYS A 29 4.726 -1.493 -0.944 1.00 0.00 O ATOM 438 CB LYS A 29 6.062 -4.222 -0.055 1.00 0.00 C ATOM 439 CG LYS A 29 7.487 -4.544 -0.532 1.00 0.00 C ATOM 440 CD LYS A 29 8.363 -5.232 0.528 1.00 0.00 C ATOM 441 CE LYS A 29 8.652 -4.346 1.747 1.00 0.00 C ATOM 442 NZ LYS A 29 9.440 -5.080 2.782 1.00 0.00 N ATOM 0 H LYS A 29 5.986 -5.171 -2.494 1.00 0.00 H new ATOM 0 HA LYS A 29 4.074 -3.899 -0.712 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.115 -3.406 0.666 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.670 -5.090 0.475 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.428 -5.185 -1.411 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.972 -3.619 -0.844 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.869 -6.145 0.860 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.307 -5.529 0.072 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.201 -3.459 1.431 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.712 -4.002 2.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.618 -4.453 3.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.904 -5.913 3.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.347 -5.386 2.375 1.00 0.00 H new ATOM 456 N ILE A 30 5.874 -2.162 -2.753 1.00 0.00 N ATOM 457 CA ILE A 30 5.921 -0.852 -3.412 1.00 0.00 C ATOM 458 C ILE A 30 5.636 -0.959 -4.920 1.00 0.00 C ATOM 459 O ILE A 30 5.564 -2.058 -5.474 1.00 0.00 O ATOM 460 CB ILE A 30 7.249 -0.103 -3.110 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.559 -0.801 -3.513 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.384 0.163 -1.604 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.696 -1.224 -4.975 1.00 0.00 C ATOM 0 H ILE A 30 6.382 -2.888 -3.258 1.00 0.00 H new ATOM 0 HA ILE A 30 5.119 -0.247 -2.988 1.00 0.00 H new ATOM 0 HB ILE A 30 7.149 0.791 -3.725 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.387 -0.133 -3.274 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.676 -1.688 -2.891 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.319 0.688 -1.410 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.547 0.775 -1.266 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.381 -0.785 -1.065 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.663 -1.703 -5.126 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.900 -1.925 -5.227 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.622 -0.346 -5.616 1.00 0.00 H new ATOM 475 N ALA A 31 5.481 0.188 -5.588 1.00 0.00 N ATOM 476 CA ALA A 31 5.441 0.290 -7.056 1.00 0.00 C ATOM 477 C ALA A 31 6.405 1.399 -7.518 1.00 0.00 C ATOM 478 O ALA A 31 6.612 2.380 -6.800 1.00 0.00 O ATOM 479 CB ALA A 31 4.001 0.475 -7.556 1.00 0.00 C ATOM 0 H ALA A 31 5.378 1.088 -5.119 1.00 0.00 H new ATOM 0 HA ALA A 31 5.785 -0.642 -7.505 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.000 0.548 -8.644 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.397 -0.378 -7.249 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.583 1.387 -7.131 1.00 0.00 H new ATOM 485 N VAL A 32 7.047 1.239 -8.680 1.00 0.00 N ATOM 486 CA VAL A 32 8.148 2.099 -9.119 1.00 0.00 C ATOM 487 C VAL A 32 8.140 2.453 -10.603 1.00 0.00 C ATOM 488 O VAL A 32 7.724 1.665 -11.452 1.00 0.00 O ATOM 489 CB VAL A 32 9.494 1.446 -8.773 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.903 1.896 -7.373 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.544 -0.085 -8.881 1.00 0.00 C ATOM 0 H VAL A 32 6.814 0.503 -9.347 1.00 0.00 H new ATOM 0 HA VAL A 32 8.004 3.036 -8.581 1.00 0.00 H new ATOM 0 HB VAL A 32 10.198 1.785 -9.533 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.858 1.442 -7.109 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.000 2.982 -7.354 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.144 1.587 -6.655 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.541 -0.436 -8.614 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.812 -0.522 -8.202 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.315 -0.385 -9.904 1.00 0.00 H new ATOM 501 N THR A 33 8.690 3.637 -10.887 1.00 0.00 N ATOM 502 CA THR A 33 8.816 4.229 -12.227 1.00 0.00 C ATOM 503 C THR A 33 10.142 4.994 -12.310 1.00 0.00 C ATOM 504 O THR A 33 10.608 5.517 -11.297 1.00 0.00 O ATOM 505 CB THR A 33 7.626 5.188 -12.489 1.00 0.00 C ATOM 506 OG1 THR A 33 6.399 4.575 -12.141 1.00 0.00 O ATOM 507 CG2 THR A 33 7.482 5.597 -13.955 1.00 0.00 C ATOM 0 H THR A 33 9.077 4.237 -10.159 1.00 0.00 H new ATOM 0 HA THR A 33 8.803 3.444 -12.983 1.00 0.00 H new ATOM 0 HB THR A 33 7.843 6.066 -11.880 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.662 5.198 -12.313 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.630 6.268 -14.064 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.389 6.107 -14.281 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.325 4.709 -14.567 1.00 0.00 H new ATOM 515 N SER A 34 10.774 5.090 -13.483 1.00 0.00 N ATOM 516 CA SER A 34 11.922 5.983 -13.698 1.00 0.00 C ATOM 517 C SER A 34 11.702 6.943 -14.877 1.00 0.00 C ATOM 518 O SER A 34 10.930 6.656 -15.793 1.00 0.00 O ATOM 519 CB SER A 34 13.224 5.191 -13.816 1.00 0.00 C ATOM 520 OG SER A 34 13.353 4.562 -15.079 1.00 0.00 O ATOM 0 H SER A 34 10.508 4.554 -14.309 1.00 0.00 H new ATOM 0 HA SER A 34 12.013 6.616 -12.815 1.00 0.00 H new ATOM 0 HB2 SER A 34 14.070 5.859 -13.656 1.00 0.00 H new ATOM 0 HB3 SER A 34 13.261 4.436 -13.030 1.00 0.00 H new ATOM 0 HG SER A 34 14.260 4.204 -15.175 1.00 0.00 H new ATOM 526 N CYS A 35 12.342 8.112 -14.818 1.00 0.00 N ATOM 527 CA CYS A 35 12.246 9.180 -15.811 1.00 0.00 C ATOM 528 C CYS A 35 13.499 10.073 -15.793 1.00 0.00 C ATOM 529 O CYS A 35 14.463 9.820 -15.067 1.00 0.00 O ATOM 530 CB CYS A 35 10.958 9.974 -15.553 1.00 0.00 C ATOM 531 SG CYS A 35 11.057 11.006 -14.072 1.00 0.00 S ATOM 0 H CYS A 35 12.966 8.349 -14.046 1.00 0.00 H new ATOM 0 HA CYS A 35 12.198 8.752 -16.812 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.746 10.605 -16.416 1.00 0.00 H new ATOM 0 HB3 CYS A 35 10.123 9.281 -15.452 1.00 0.00 H new ATOM 0 HG CYS A 35 10.582 10.351 -13.054 1.00 0.00 H new ATOM 537 N GLY A 36 13.520 11.121 -16.611 1.00 0.00 N ATOM 538 CA GLY A 36 14.537 12.176 -16.555 1.00 0.00 C ATOM 539 C GLY A 36 13.989 13.521 -16.996 1.00 0.00 C ATOM 540 O GLY A 36 12.904 13.577 -17.564 1.00 0.00 O ATOM 0 H GLY A 36 12.824 11.267 -17.342 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.919 12.257 -15.537 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.379 11.902 -17.191 1.00 0.00 H new ATOM 544 N LEU A 37 14.705 14.621 -16.753 1.00 0.00 N ATOM 545 CA LEU A 37 14.243 15.946 -17.225 1.00 0.00 C ATOM 546 C LEU A 37 14.227 16.077 -18.762 1.00 0.00 C ATOM 547 O LEU A 37 13.588 16.973 -19.314 1.00 0.00 O ATOM 548 CB LEU A 37 14.977 17.106 -16.548 1.00 0.00 C ATOM 549 CG LEU A 37 16.513 17.012 -16.622 1.00 0.00 C ATOM 550 CD1 LEU A 37 17.150 18.376 -16.874 1.00 0.00 C ATOM 551 CD2 LEU A 37 17.040 16.480 -15.290 1.00 0.00 C ATOM 0 H LEU A 37 15.589 14.632 -16.244 1.00 0.00 H new ATOM 0 HA LEU A 37 13.201 16.016 -16.911 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.659 18.041 -17.009 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.677 17.149 -15.501 1.00 0.00 H new ATOM 0 HG LEU A 37 16.770 16.348 -17.448 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.234 18.269 -16.920 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.785 18.779 -17.819 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.887 19.056 -16.064 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.127 16.409 -15.331 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.750 17.158 -14.487 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.619 15.493 -15.100 1.00 0.00 H new ATOM 563 N GLU A 38 14.899 15.150 -19.437 1.00 0.00 N ATOM 564 CA GLU A 38 14.867 14.910 -20.882 1.00 0.00 C ATOM 565 C GLU A 38 14.785 13.388 -21.135 1.00 0.00 C ATOM 566 O GLU A 38 14.731 12.598 -20.189 1.00 0.00 O ATOM 567 CB GLU A 38 16.060 15.613 -21.578 1.00 0.00 C ATOM 568 CG GLU A 38 17.440 15.265 -21.002 1.00 0.00 C ATOM 569 CD GLU A 38 18.615 15.802 -21.849 1.00 0.00 C ATOM 570 OE1 GLU A 38 18.565 16.964 -22.324 1.00 0.00 O ATOM 571 OE2 GLU A 38 19.616 15.063 -22.021 1.00 0.00 O ATOM 0 H GLU A 38 15.524 14.500 -18.960 1.00 0.00 H new ATOM 0 HA GLU A 38 13.978 15.353 -21.331 1.00 0.00 H new ATOM 0 HB2 GLU A 38 16.048 15.354 -22.637 1.00 0.00 H new ATOM 0 HB3 GLU A 38 15.916 16.691 -21.512 1.00 0.00 H new ATOM 0 HG2 GLU A 38 17.516 15.669 -19.993 1.00 0.00 H new ATOM 0 HG3 GLU A 38 17.528 14.182 -20.919 1.00 0.00 H new ATOM 578 N SER A 39 14.751 12.952 -22.397 1.00 0.00 N ATOM 579 CA SER A 39 14.672 11.528 -22.760 1.00 0.00 C ATOM 580 C SER A 39 15.599 11.169 -23.929 1.00 0.00 C ATOM 581 O SER A 39 15.791 11.962 -24.853 1.00 0.00 O ATOM 582 CB SER A 39 13.229 11.157 -23.101 1.00 0.00 C ATOM 583 OG SER A 39 13.130 9.749 -23.208 1.00 0.00 O ATOM 0 H SER A 39 14.777 13.577 -23.202 1.00 0.00 H new ATOM 0 HA SER A 39 15.007 10.954 -21.896 1.00 0.00 H new ATOM 0 HB2 SER A 39 12.553 11.525 -22.329 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.930 11.628 -24.037 1.00 0.00 H new ATOM 0 HG SER A 39 12.207 9.502 -23.425 1.00 0.00 H new ATOM 589 N SER A 40 16.170 9.961 -23.878 1.00 0.00 N ATOM 590 CA SER A 40 17.005 9.372 -24.936 1.00 0.00 C ATOM 591 C SER A 40 16.746 7.855 -25.047 1.00 0.00 C ATOM 592 O SER A 40 15.694 7.452 -25.550 1.00 0.00 O ATOM 593 CB SER A 40 18.468 9.777 -24.693 1.00 0.00 C ATOM 594 OG SER A 40 19.363 9.188 -25.624 1.00 0.00 O ATOM 0 H SER A 40 16.061 9.344 -23.073 1.00 0.00 H new ATOM 0 HA SER A 40 16.741 9.762 -25.919 1.00 0.00 H new ATOM 0 HB2 SER A 40 18.554 10.862 -24.750 1.00 0.00 H new ATOM 0 HB3 SER A 40 18.758 9.486 -23.683 1.00 0.00 H new ATOM 0 HG SER A 40 20.286 9.346 -25.335 1.00 0.00 H new ATOM 600 N ARG A 41 17.661 7.006 -24.552 1.00 0.00 N ATOM 601 CA ARG A 41 17.528 5.538 -24.452 1.00 0.00 C ATOM 602 C ARG A 41 18.253 4.992 -23.217 1.00 0.00 C ATOM 603 O ARG A 41 19.153 5.651 -22.699 1.00 0.00 O ATOM 604 CB ARG A 41 17.990 4.871 -25.773 1.00 0.00 C ATOM 605 CG ARG A 41 19.279 5.400 -26.438 1.00 0.00 C ATOM 606 CD ARG A 41 20.539 5.375 -25.560 1.00 0.00 C ATOM 607 NE ARG A 41 21.752 5.647 -26.359 1.00 0.00 N ATOM 608 CZ ARG A 41 22.502 4.777 -27.014 1.00 0.00 C ATOM 609 NH1 ARG A 41 22.239 3.500 -27.029 1.00 0.00 N ATOM 610 NH2 ARG A 41 23.543 5.186 -27.678 1.00 0.00 N ATOM 0 H ARG A 41 18.557 7.337 -24.193 1.00 0.00 H new ATOM 0 HA ARG A 41 16.477 5.285 -24.313 1.00 0.00 H new ATOM 0 HB2 ARG A 41 18.126 3.807 -25.580 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.179 4.963 -26.495 1.00 0.00 H new ATOM 0 HG2 ARG A 41 19.471 4.811 -27.335 1.00 0.00 H new ATOM 0 HG3 ARG A 41 19.104 6.426 -26.762 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.448 6.118 -24.768 1.00 0.00 H new ATOM 0 HD3 ARG A 41 20.629 4.402 -25.076 1.00 0.00 H new ATOM 0 HE ARG A 41 22.046 6.622 -26.412 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.430 3.140 -26.523 1.00 0.00 H new ATOM 0 HH12 ARG A 41 22.842 2.861 -27.547 1.00 0.00 H new ATOM 0 HH21 ARG A 41 23.781 6.178 -27.693 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.122 4.515 -28.183 1.00 0.00 H new ATOM 624 N VAL A 42 17.914 3.777 -22.772 1.00 0.00 N ATOM 625 CA VAL A 42 18.674 3.088 -21.699 1.00 0.00 C ATOM 626 C VAL A 42 20.105 2.819 -22.174 1.00 0.00 C ATOM 627 O VAL A 42 20.313 2.424 -23.321 1.00 0.00 O ATOM 628 CB VAL A 42 18.018 1.774 -21.208 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.651 1.321 -19.886 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.532 1.955 -20.940 1.00 0.00 C ATOM 0 H VAL A 42 17.122 3.244 -23.131 1.00 0.00 H new ATOM 0 HA VAL A 42 18.676 3.760 -20.840 1.00 0.00 H new ATOM 0 HB VAL A 42 18.172 1.038 -21.997 1.00 0.00 H new ATOM 0 HG11 VAL A 42 18.179 0.396 -19.555 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.718 1.151 -20.033 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.507 2.093 -19.130 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.107 1.012 -20.597 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.391 2.717 -20.173 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.032 2.266 -21.857 1.00 0.00 H new ATOM 640 N HIS A 43 21.097 3.012 -21.298 1.00 0.00 N ATOM 641 CA HIS A 43 22.480 2.623 -21.590 1.00 0.00 C ATOM 642 C HIS A 43 22.553 1.095 -21.659 1.00 0.00 C ATOM 643 O HIS A 43 22.155 0.437 -20.696 1.00 0.00 O ATOM 644 CB HIS A 43 23.426 3.203 -20.530 1.00 0.00 C ATOM 645 CG HIS A 43 24.848 3.242 -21.008 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.707 2.146 -21.128 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.483 4.361 -21.450 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.860 2.645 -21.618 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.743 3.965 -21.830 1.00 0.00 N ATOM 0 H HIS A 43 20.967 3.436 -20.380 1.00 0.00 H new ATOM 0 HA HIS A 43 22.798 3.026 -22.551 1.00 0.00 H new ATOM 0 HB2 HIS A 43 23.103 4.211 -20.268 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.365 2.603 -19.622 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.078 5.361 -21.494 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.750 2.065 -21.812 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.468 4.573 -22.210 1.00 0.00 H new ATOM 657 N PRO A 44 23.047 0.489 -22.751 1.00 0.00 N ATOM 658 CA PRO A 44 22.908 -0.952 -22.931 1.00 0.00 C ATOM 659 C PRO A 44 23.760 -1.751 -21.932 1.00 0.00 C ATOM 660 O PRO A 44 23.397 -2.864 -21.559 1.00 0.00 O ATOM 661 CB PRO A 44 23.305 -1.196 -24.390 1.00 0.00 C ATOM 662 CG PRO A 44 24.306 -0.079 -24.678 1.00 0.00 C ATOM 663 CD PRO A 44 23.732 1.094 -23.884 1.00 0.00 C ATOM 0 HA PRO A 44 21.893 -1.297 -22.731 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.752 -2.181 -24.525 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.443 -1.144 -25.055 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.311 -0.340 -24.347 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.369 0.144 -25.743 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.521 1.769 -23.552 1.00 0.00 H new ATOM 0 HD3 PRO A 44 23.044 1.682 -24.492 1.00 0.00 H new ATOM 671 N THR A 45 24.846 -1.164 -21.414 1.00 0.00 N ATOM 672 CA THR A 45 25.672 -1.776 -20.358 1.00 0.00 C ATOM 673 C THR A 45 24.935 -1.837 -19.016 1.00 0.00 C ATOM 674 O THR A 45 25.157 -2.765 -18.243 1.00 0.00 O ATOM 675 CB THR A 45 27.017 -1.040 -20.224 1.00 0.00 C ATOM 676 OG1 THR A 45 27.660 -1.020 -21.486 1.00 0.00 O ATOM 677 CG2 THR A 45 27.967 -1.729 -19.246 1.00 0.00 C ATOM 0 H THR A 45 25.180 -0.248 -21.714 1.00 0.00 H new ATOM 0 HA THR A 45 25.874 -2.805 -20.655 1.00 0.00 H new ATOM 0 HB THR A 45 26.796 -0.039 -19.854 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.517 -0.551 -21.409 1.00 0.00 H new ATOM 0 HG21 THR A 45 28.900 -1.169 -19.189 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.507 -1.768 -18.259 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.173 -2.742 -19.591 1.00 0.00 H new ATOM 685 N ALA A 46 23.978 -0.939 -18.747 1.00 0.00 N ATOM 686 CA ALA A 46 23.162 -1.005 -17.532 1.00 0.00 C ATOM 687 C ALA A 46 22.314 -2.284 -17.473 1.00 0.00 C ATOM 688 O ALA A 46 22.247 -2.916 -16.424 1.00 0.00 O ATOM 689 CB ALA A 46 22.286 0.249 -17.455 1.00 0.00 C ATOM 0 H ALA A 46 23.751 -0.155 -19.359 1.00 0.00 H new ATOM 0 HA ALA A 46 23.824 -1.041 -16.667 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.674 0.210 -16.554 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.920 1.135 -17.425 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.639 0.295 -18.331 1.00 0.00 H new ATOM 695 N ILE A 47 21.751 -2.725 -18.607 1.00 0.00 N ATOM 696 CA ILE A 47 21.051 -4.022 -18.712 1.00 0.00 C ATOM 697 C ILE A 47 22.022 -5.138 -18.310 1.00 0.00 C ATOM 698 O ILE A 47 21.701 -5.945 -17.441 1.00 0.00 O ATOM 699 CB ILE A 47 20.499 -4.275 -20.143 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.308 -3.391 -20.568 1.00 0.00 C ATOM 701 CG2 ILE A 47 20.007 -5.727 -20.297 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.539 -1.880 -20.563 1.00 0.00 C ATOM 0 H ILE A 47 21.766 -2.196 -19.479 1.00 0.00 H new ATOM 0 HA ILE A 47 20.192 -4.007 -18.041 1.00 0.00 H new ATOM 0 HB ILE A 47 21.353 -4.035 -20.776 1.00 0.00 H new ATOM 0 HG12 ILE A 47 19.007 -3.686 -21.573 1.00 0.00 H new ATOM 0 HG13 ILE A 47 18.469 -3.609 -19.907 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.626 -5.877 -21.307 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.835 -6.413 -20.116 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.212 -5.920 -19.577 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.628 -1.372 -20.880 1.00 0.00 H new ATOM 0 HD12 ILE A 47 19.804 -1.556 -19.557 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.350 -1.634 -21.249 1.00 0.00 H new ATOM 714 N ALA A 48 23.238 -5.130 -18.864 1.00 0.00 N ATOM 715 CA ALA A 48 24.231 -6.177 -18.602 1.00 0.00 C ATOM 716 C ALA A 48 24.659 -6.229 -17.124 1.00 0.00 C ATOM 717 O ALA A 48 24.820 -7.304 -16.551 1.00 0.00 O ATOM 718 CB ALA A 48 25.428 -5.958 -19.524 1.00 0.00 C ATOM 0 H ALA A 48 23.561 -4.403 -19.503 1.00 0.00 H new ATOM 0 HA ALA A 48 23.778 -7.146 -18.811 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.175 -6.730 -19.340 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.101 -6.009 -20.563 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.863 -4.978 -19.329 1.00 0.00 H new ATOM 724 N MET A 49 24.788 -5.063 -16.482 1.00 0.00 N ATOM 725 CA MET A 49 25.178 -4.938 -15.072 1.00 0.00 C ATOM 726 C MET A 49 24.035 -5.302 -14.119 1.00 0.00 C ATOM 727 O MET A 49 24.308 -5.797 -13.029 1.00 0.00 O ATOM 728 CB MET A 49 25.721 -3.523 -14.807 1.00 0.00 C ATOM 729 CG MET A 49 26.916 -3.175 -15.702 1.00 0.00 C ATOM 730 SD MET A 49 28.553 -3.532 -15.006 1.00 0.00 S ATOM 731 CE MET A 49 28.801 -5.250 -15.497 1.00 0.00 C ATOM 0 H MET A 49 24.622 -4.164 -16.935 1.00 0.00 H new ATOM 0 HA MET A 49 25.972 -5.657 -14.872 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.926 -2.796 -14.970 1.00 0.00 H new ATOM 0 HB3 MET A 49 26.018 -3.441 -13.762 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.814 -3.720 -16.640 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.868 -2.113 -15.943 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.816 -5.558 -15.244 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.087 -5.885 -14.972 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.650 -5.347 -16.572 1.00 0.00 H new ATOM 741 N MET A 50 22.772 -5.123 -14.517 1.00 0.00 N ATOM 742 CA MET A 50 21.618 -5.643 -13.768 1.00 0.00 C ATOM 743 C MET A 50 21.423 -7.151 -13.994 1.00 0.00 C ATOM 744 O MET A 50 21.024 -7.863 -13.071 1.00 0.00 O ATOM 745 CB MET A 50 20.350 -4.850 -14.130 1.00 0.00 C ATOM 746 CG MET A 50 20.410 -3.378 -13.686 1.00 0.00 C ATOM 747 SD MET A 50 20.750 -3.047 -11.932 1.00 0.00 S ATOM 748 CE MET A 50 19.466 -4.049 -11.138 1.00 0.00 C ATOM 0 H MET A 50 22.518 -4.615 -15.365 1.00 0.00 H new ATOM 0 HA MET A 50 21.816 -5.509 -12.705 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.198 -4.892 -15.209 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.486 -5.328 -13.668 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.177 -2.879 -14.278 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.458 -2.911 -13.939 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.053 -3.505 -10.289 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.672 -4.258 -11.855 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.899 -4.987 -10.792 1.00 0.00 H new ATOM 758 N GLU A 51 21.797 -7.684 -15.164 1.00 0.00 N ATOM 759 CA GLU A 51 21.756 -9.134 -15.408 1.00 0.00 C ATOM 760 C GLU A 51 22.778 -9.911 -14.555 1.00 0.00 C ATOM 761 O GLU A 51 22.521 -11.068 -14.229 1.00 0.00 O ATOM 762 CB GLU A 51 21.959 -9.451 -16.899 1.00 0.00 C ATOM 763 CG GLU A 51 20.702 -9.203 -17.738 1.00 0.00 C ATOM 764 CD GLU A 51 20.908 -9.677 -19.191 1.00 0.00 C ATOM 765 OE1 GLU A 51 21.758 -9.105 -19.918 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.219 -10.636 -19.620 1.00 0.00 O ATOM 0 H GLU A 51 22.131 -7.135 -15.956 1.00 0.00 H new ATOM 0 HA GLU A 51 20.763 -9.466 -15.106 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.775 -8.841 -17.287 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.261 -10.493 -17.006 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.855 -9.729 -17.296 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.458 -8.141 -17.729 1.00 0.00 H new ATOM 773 N GLU A 52 23.887 -9.292 -14.108 1.00 0.00 N ATOM 774 CA GLU A 52 24.835 -9.948 -13.180 1.00 0.00 C ATOM 775 C GLU A 52 24.184 -10.341 -11.839 1.00 0.00 C ATOM 776 O GLU A 52 24.575 -11.336 -11.225 1.00 0.00 O ATOM 777 CB GLU A 52 26.026 -9.043 -12.841 1.00 0.00 C ATOM 778 CG GLU A 52 26.876 -8.617 -14.039 1.00 0.00 C ATOM 779 CD GLU A 52 28.283 -8.201 -13.588 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.406 -7.284 -12.739 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.277 -8.764 -14.098 1.00 0.00 O ATOM 0 H GLU A 52 24.150 -8.342 -14.372 1.00 0.00 H new ATOM 0 HA GLU A 52 25.163 -10.841 -13.712 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.653 -8.148 -12.343 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.666 -9.562 -12.127 1.00 0.00 H new ATOM 0 HG2 GLU A 52 26.946 -9.439 -14.752 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.394 -7.787 -14.556 1.00 0.00 H new ATOM 788 N VAL A 53 23.182 -9.567 -11.396 1.00 0.00 N ATOM 789 CA VAL A 53 22.386 -9.819 -10.178 1.00 0.00 C ATOM 790 C VAL A 53 21.033 -10.487 -10.482 1.00 0.00 C ATOM 791 O VAL A 53 20.201 -10.637 -9.587 1.00 0.00 O ATOM 792 CB VAL A 53 22.254 -8.546 -9.311 1.00 0.00 C ATOM 793 CG1 VAL A 53 23.627 -8.081 -8.803 1.00 0.00 C ATOM 794 CG2 VAL A 53 21.611 -7.376 -10.063 1.00 0.00 C ATOM 0 H VAL A 53 22.892 -8.722 -11.888 1.00 0.00 H new ATOM 0 HA VAL A 53 22.937 -10.545 -9.580 1.00 0.00 H new ATOM 0 HB VAL A 53 21.608 -8.826 -8.479 1.00 0.00 H new ATOM 0 HG11 VAL A 53 23.506 -7.184 -8.196 1.00 0.00 H new ATOM 0 HG12 VAL A 53 24.078 -8.869 -8.200 1.00 0.00 H new ATOM 0 HG13 VAL A 53 24.273 -7.860 -9.652 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.545 -6.511 -9.403 1.00 0.00 H new ATOM 0 HG22 VAL A 53 22.219 -7.124 -10.932 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.611 -7.660 -10.390 1.00 0.00 H new ATOM 804 N GLY A 54 20.807 -10.910 -11.734 1.00 0.00 N ATOM 805 CA GLY A 54 19.600 -11.615 -12.178 1.00 0.00 C ATOM 806 C GLY A 54 18.339 -10.742 -12.274 1.00 0.00 C ATOM 807 O GLY A 54 17.228 -11.267 -12.167 1.00 0.00 O ATOM 0 H GLY A 54 21.480 -10.766 -12.487 1.00 0.00 H new ATOM 0 HA2 GLY A 54 19.794 -12.057 -13.156 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.403 -12.437 -11.490 1.00 0.00 H new ATOM 811 N ILE A 55 18.496 -9.422 -12.448 1.00 0.00 N ATOM 812 CA ILE A 55 17.403 -8.436 -12.484 1.00 0.00 C ATOM 813 C ILE A 55 17.267 -7.843 -13.895 1.00 0.00 C ATOM 814 O ILE A 55 18.262 -7.541 -14.557 1.00 0.00 O ATOM 815 CB ILE A 55 17.636 -7.364 -11.394 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.530 -8.004 -9.986 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.654 -6.187 -11.520 1.00 0.00 C ATOM 818 CD1 ILE A 55 17.812 -7.050 -8.815 1.00 0.00 C ATOM 0 H ILE A 55 19.415 -8.997 -12.571 1.00 0.00 H new ATOM 0 HA ILE A 55 16.452 -8.920 -12.261 1.00 0.00 H new ATOM 0 HB ILE A 55 18.640 -6.965 -11.536 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.528 -8.416 -9.866 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.228 -8.840 -9.930 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.855 -5.459 -10.734 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.777 -5.713 -12.494 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.632 -6.554 -11.422 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.713 -7.590 -7.874 1.00 0.00 H new ATOM 0 HD12 ILE A 55 18.824 -6.656 -8.903 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.099 -6.226 -8.837 1.00 0.00 H new ATOM 830 N ASP A 56 16.028 -7.655 -14.356 1.00 0.00 N ATOM 831 CA ASP A 56 15.714 -7.274 -15.737 1.00 0.00 C ATOM 832 C ASP A 56 15.308 -5.798 -15.915 1.00 0.00 C ATOM 833 O ASP A 56 14.372 -5.302 -15.282 1.00 0.00 O ATOM 834 CB ASP A 56 14.663 -8.238 -16.308 1.00 0.00 C ATOM 835 CG ASP A 56 13.271 -8.100 -15.660 1.00 0.00 C ATOM 836 OD1 ASP A 56 13.096 -8.530 -14.493 1.00 0.00 O ATOM 837 OD2 ASP A 56 12.341 -7.597 -16.337 1.00 0.00 O ATOM 0 H ASP A 56 15.200 -7.765 -13.771 1.00 0.00 H new ATOM 0 HA ASP A 56 16.638 -7.363 -16.309 1.00 0.00 H new ATOM 0 HB2 ASP A 56 14.572 -8.067 -17.381 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.014 -9.262 -16.177 1.00 0.00 H new ATOM 842 N ILE A 57 16.006 -5.100 -16.823 1.00 0.00 N ATOM 843 CA ILE A 57 15.637 -3.754 -17.312 1.00 0.00 C ATOM 844 C ILE A 57 15.749 -3.633 -18.848 1.00 0.00 C ATOM 845 O ILE A 57 15.904 -2.539 -19.380 1.00 0.00 O ATOM 846 CB ILE A 57 16.386 -2.623 -16.561 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.909 -2.631 -16.818 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.115 -2.635 -15.046 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.506 -1.227 -16.710 1.00 0.00 C ATOM 0 H ILE A 57 16.861 -5.458 -17.249 1.00 0.00 H new ATOM 0 HA ILE A 57 14.581 -3.620 -17.077 1.00 0.00 H new ATOM 0 HB ILE A 57 15.980 -1.700 -16.976 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.396 -3.290 -16.100 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.109 -3.037 -17.810 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.665 -1.822 -14.572 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.048 -2.505 -14.866 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.440 -3.587 -14.626 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.579 -1.272 -16.897 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.037 -0.574 -17.446 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.328 -0.832 -15.710 1.00 0.00 H new ATOM 861 N SER A 58 15.712 -4.757 -19.578 1.00 0.00 N ATOM 862 CA SER A 58 15.894 -4.783 -21.046 1.00 0.00 C ATOM 863 C SER A 58 14.632 -4.345 -21.808 1.00 0.00 C ATOM 864 O SER A 58 14.713 -3.728 -22.871 1.00 0.00 O ATOM 865 CB SER A 58 16.326 -6.194 -21.475 1.00 0.00 C ATOM 866 OG SER A 58 16.776 -6.197 -22.819 1.00 0.00 O ATOM 0 H SER A 58 15.555 -5.679 -19.171 1.00 0.00 H new ATOM 0 HA SER A 58 16.670 -4.061 -21.301 1.00 0.00 H new ATOM 0 HB2 SER A 58 17.121 -6.550 -20.820 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.489 -6.884 -21.366 1.00 0.00 H new ATOM 0 HG SER A 58 17.047 -7.104 -23.071 1.00 0.00 H new ATOM 872 N GLY A 59 13.453 -4.612 -21.232 1.00 0.00 N ATOM 873 CA GLY A 59 12.143 -4.307 -21.816 1.00 0.00 C ATOM 874 C GLY A 59 11.636 -2.873 -21.599 1.00 0.00 C ATOM 875 O GLY A 59 10.442 -2.637 -21.795 1.00 0.00 O ATOM 0 H GLY A 59 13.384 -5.060 -20.318 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.190 -4.498 -22.888 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.410 -4.999 -21.401 1.00 0.00 H new ATOM 879 N GLN A 60 12.486 -1.926 -21.167 1.00 0.00 N ATOM 880 CA GLN A 60 12.088 -0.531 -20.917 1.00 0.00 C ATOM 881 C GLN A 60 12.990 0.461 -21.665 1.00 0.00 C ATOM 882 O GLN A 60 14.065 0.109 -22.155 1.00 0.00 O ATOM 883 CB GLN A 60 11.981 -0.284 -19.399 1.00 0.00 C ATOM 884 CG GLN A 60 13.321 -0.365 -18.650 1.00 0.00 C ATOM 885 CD GLN A 60 13.152 -0.827 -17.202 1.00 0.00 C ATOM 886 OE1 GLN A 60 12.677 -1.922 -16.928 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.546 -0.045 -16.226 1.00 0.00 N ATOM 0 H GLN A 60 13.472 -2.108 -20.981 1.00 0.00 H new ATOM 0 HA GLN A 60 11.095 -0.353 -21.330 1.00 0.00 H new ATOM 0 HB2 GLN A 60 11.544 0.701 -19.233 1.00 0.00 H new ATOM 0 HB3 GLN A 60 11.294 -1.014 -18.971 1.00 0.00 H new ATOM 0 HG2 GLN A 60 13.985 -1.053 -19.173 1.00 0.00 H new ATOM 0 HG3 GLN A 60 13.801 0.613 -18.663 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.944 0.871 -16.435 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.454 -0.352 -15.258 1.00 0.00 H new ATOM 896 N THR A 61 12.538 1.709 -21.781 1.00 0.00 N ATOM 897 CA THR A 61 13.134 2.797 -22.547 1.00 0.00 C ATOM 898 C THR A 61 13.206 4.019 -21.630 1.00 0.00 C ATOM 899 O THR A 61 12.765 3.987 -20.475 1.00 0.00 O ATOM 900 CB THR A 61 12.303 3.093 -23.816 1.00 0.00 C ATOM 901 OG1 THR A 61 10.943 3.295 -23.485 1.00 0.00 O ATOM 902 CG2 THR A 61 12.377 1.940 -24.823 1.00 0.00 C ATOM 0 H THR A 61 11.684 2.005 -21.307 1.00 0.00 H new ATOM 0 HA THR A 61 14.134 2.525 -22.885 1.00 0.00 H new ATOM 0 HB THR A 61 12.725 3.993 -24.263 1.00 0.00 H new ATOM 0 HG1 THR A 61 10.432 3.483 -24.300 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.780 2.185 -25.702 1.00 0.00 H new ATOM 0 HG22 THR A 61 13.414 1.783 -25.121 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.990 1.030 -24.364 1.00 0.00 H new ATOM 910 N SER A 62 13.794 5.098 -22.121 1.00 0.00 N ATOM 911 CA SER A 62 13.747 6.383 -21.435 1.00 0.00 C ATOM 912 C SER A 62 12.377 7.067 -21.563 1.00 0.00 C ATOM 913 O SER A 62 11.723 6.959 -22.603 1.00 0.00 O ATOM 914 CB SER A 62 14.790 7.274 -22.058 1.00 0.00 C ATOM 915 OG SER A 62 16.086 6.799 -21.738 1.00 0.00 O ATOM 0 H SER A 62 14.314 5.111 -22.999 1.00 0.00 H new ATOM 0 HA SER A 62 13.930 6.213 -20.374 1.00 0.00 H new ATOM 0 HB2 SER A 62 14.660 7.299 -23.140 1.00 0.00 H new ATOM 0 HB3 SER A 62 14.669 8.296 -21.699 1.00 0.00 H new ATOM 0 HG SER A 62 16.619 7.531 -21.363 1.00 0.00 H new ATOM 921 N ASP A 63 11.977 7.830 -20.540 1.00 0.00 N ATOM 922 CA ASP A 63 10.790 8.707 -20.568 1.00 0.00 C ATOM 923 C ASP A 63 11.012 10.054 -19.832 1.00 0.00 C ATOM 924 O ASP A 63 11.721 10.089 -18.820 1.00 0.00 O ATOM 925 CB ASP A 63 9.574 7.982 -19.975 1.00 0.00 C ATOM 926 CG ASP A 63 8.972 6.939 -20.930 1.00 0.00 C ATOM 927 OD1 ASP A 63 8.374 7.341 -21.958 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.031 5.725 -20.624 1.00 0.00 O ATOM 0 H ASP A 63 12.475 7.859 -19.650 1.00 0.00 H new ATOM 0 HA ASP A 63 10.605 8.943 -21.616 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.868 7.490 -19.047 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.810 8.716 -19.719 1.00 0.00 H new ATOM 933 N PRO A 64 10.400 11.169 -20.293 1.00 0.00 N ATOM 934 CA PRO A 64 10.625 12.511 -19.745 1.00 0.00 C ATOM 935 C PRO A 64 9.698 12.874 -18.569 1.00 0.00 C ATOM 936 O PRO A 64 8.528 12.492 -18.529 1.00 0.00 O ATOM 937 CB PRO A 64 10.419 13.453 -20.934 1.00 0.00 C ATOM 938 CG PRO A 64 9.309 12.758 -21.721 1.00 0.00 C ATOM 939 CD PRO A 64 9.610 11.272 -21.517 1.00 0.00 C ATOM 0 HA PRO A 64 11.622 12.583 -19.311 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.124 14.452 -20.613 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.328 13.563 -21.526 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.321 13.024 -21.344 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.332 13.032 -22.776 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.687 10.698 -21.432 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.159 10.868 -22.367 1.00 0.00 H new ATOM 947 N ILE A 65 10.192 13.702 -17.646 1.00 0.00 N ATOM 948 CA ILE A 65 9.510 14.186 -16.432 1.00 0.00 C ATOM 949 C ILE A 65 8.199 14.918 -16.759 1.00 0.00 C ATOM 950 O ILE A 65 7.200 14.763 -16.061 1.00 0.00 O ATOM 951 CB ILE A 65 10.509 15.079 -15.645 1.00 0.00 C ATOM 952 CG1 ILE A 65 10.095 15.193 -14.176 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.715 16.485 -16.250 1.00 0.00 C ATOM 954 CD1 ILE A 65 11.067 16.015 -13.328 1.00 0.00 C ATOM 0 H ILE A 65 11.137 14.079 -17.726 1.00 0.00 H new ATOM 0 HA ILE A 65 9.215 13.340 -15.812 1.00 0.00 H new ATOM 0 HB ILE A 65 11.471 14.573 -15.721 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.105 15.646 -14.120 1.00 0.00 H new ATOM 0 HG13 ILE A 65 10.012 14.192 -13.752 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.426 17.043 -15.641 1.00 0.00 H new ATOM 0 HG22 ILE A 65 11.102 16.391 -17.265 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.763 17.015 -16.272 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.710 16.053 -12.299 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.053 15.552 -13.353 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.132 17.027 -13.727 1.00 0.00 H new ATOM 966 N GLU A 66 8.179 15.655 -17.876 1.00 0.00 N ATOM 967 CA GLU A 66 7.028 16.469 -18.314 1.00 0.00 C ATOM 968 C GLU A 66 5.760 15.647 -18.631 1.00 0.00 C ATOM 969 O GLU A 66 4.655 16.193 -18.578 1.00 0.00 O ATOM 970 CB GLU A 66 7.422 17.302 -19.547 1.00 0.00 C ATOM 971 CG GLU A 66 8.536 18.314 -19.256 1.00 0.00 C ATOM 972 CD GLU A 66 8.780 19.219 -20.478 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.536 18.819 -21.398 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.225 20.344 -20.523 1.00 0.00 O ATOM 0 H GLU A 66 8.973 15.706 -18.514 1.00 0.00 H new ATOM 0 HA GLU A 66 6.774 17.113 -17.472 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.747 16.632 -20.343 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.544 17.833 -19.916 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.265 18.923 -18.394 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.455 17.787 -18.998 1.00 0.00 H new ATOM 981 N ASN A 67 5.894 14.343 -18.928 1.00 0.00 N ATOM 982 CA ASN A 67 4.748 13.449 -19.168 1.00 0.00 C ATOM 983 C ASN A 67 4.178 12.808 -17.878 1.00 0.00 C ATOM 984 O ASN A 67 3.087 12.237 -17.909 1.00 0.00 O ATOM 985 CB ASN A 67 5.113 12.415 -20.262 1.00 0.00 C ATOM 986 CG ASN A 67 5.298 10.994 -19.737 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.490 10.106 -19.968 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.344 10.742 -18.986 1.00 0.00 N ATOM 0 H ASN A 67 6.799 13.879 -19.008 1.00 0.00 H new ATOM 0 HA ASN A 67 3.922 14.056 -19.538 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.330 12.412 -21.020 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.032 12.732 -20.755 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.480 9.809 -18.598 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.021 11.479 -18.790 1.00 0.00 H new ATOM 995 N PHE A 68 4.910 12.879 -16.759 1.00 0.00 N ATOM 996 CA PHE A 68 4.623 12.160 -15.518 1.00 0.00 C ATOM 997 C PHE A 68 3.908 13.022 -14.456 1.00 0.00 C ATOM 998 O PHE A 68 3.739 14.234 -14.614 1.00 0.00 O ATOM 999 CB PHE A 68 5.934 11.539 -15.007 1.00 0.00 C ATOM 1000 CG PHE A 68 6.393 10.302 -15.759 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.545 9.183 -15.893 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.683 10.257 -16.314 1.00 0.00 C ATOM 1003 CE1 PHE A 68 5.977 8.040 -16.586 1.00 0.00 C ATOM 1004 CE2 PHE A 68 8.112 9.112 -17.011 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.264 8.002 -17.145 1.00 0.00 C ATOM 0 H PHE A 68 5.746 13.459 -16.694 1.00 0.00 H new ATOM 0 HA PHE A 68 3.905 11.367 -15.729 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.721 12.292 -15.061 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.811 11.282 -13.955 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.556 9.205 -15.460 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.346 11.102 -16.206 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.319 7.190 -16.689 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.100 9.088 -17.446 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.600 7.123 -17.675 1.00 0.00 H new ATOM 1015 N ASN A 69 3.463 12.374 -13.374 1.00 0.00 N ATOM 1016 CA ASN A 69 2.576 12.943 -12.352 1.00 0.00 C ATOM 1017 C ASN A 69 3.172 12.838 -10.935 1.00 0.00 C ATOM 1018 O ASN A 69 2.857 11.907 -10.191 1.00 0.00 O ATOM 1019 CB ASN A 69 1.173 12.301 -12.498 1.00 0.00 C ATOM 1020 CG ASN A 69 1.150 10.784 -12.686 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.770 10.275 -13.731 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.549 10.016 -11.699 1.00 0.00 N ATOM 0 H ASN A 69 3.719 11.406 -13.179 1.00 0.00 H new ATOM 0 HA ASN A 69 2.470 14.016 -12.511 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.588 12.547 -11.612 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.671 12.761 -13.349 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.541 9.002 -11.807 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.867 10.434 -10.824 1.00 0.00 H new ATOM 1029 N ALA A 70 3.997 13.813 -10.532 1.00 0.00 N ATOM 1030 CA ALA A 70 4.633 13.821 -9.208 1.00 0.00 C ATOM 1031 C ALA A 70 3.632 13.650 -8.051 1.00 0.00 C ATOM 1032 O ALA A 70 3.959 13.012 -7.055 1.00 0.00 O ATOM 1033 CB ALA A 70 5.400 15.126 -8.997 1.00 0.00 C ATOM 0 H ALA A 70 4.242 14.616 -11.112 1.00 0.00 H new ATOM 0 HA ALA A 70 5.308 12.965 -9.194 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.866 15.119 -8.012 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.170 15.223 -9.762 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.711 15.968 -9.066 1.00 0.00 H new ATOM 1039 N ASP A 71 2.417 14.182 -8.209 1.00 0.00 N ATOM 1040 CA ASP A 71 1.327 14.129 -7.226 1.00 0.00 C ATOM 1041 C ASP A 71 0.949 12.702 -6.773 1.00 0.00 C ATOM 1042 O ASP A 71 0.468 12.513 -5.653 1.00 0.00 O ATOM 1043 CB ASP A 71 0.101 14.804 -7.853 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.063 14.936 -6.856 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -0.946 15.725 -5.886 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.114 14.281 -7.060 1.00 0.00 O ATOM 0 H ASP A 71 2.153 14.682 -9.058 1.00 0.00 H new ATOM 0 HA ASP A 71 1.673 14.641 -6.328 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.379 15.793 -8.217 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.227 14.227 -8.718 1.00 0.00 H new ATOM 1051 N ASP A 72 1.179 11.694 -7.624 1.00 0.00 N ATOM 1052 CA ASP A 72 0.958 10.289 -7.278 1.00 0.00 C ATOM 1053 C ASP A 72 2.134 9.658 -6.523 1.00 0.00 C ATOM 1054 O ASP A 72 1.929 8.770 -5.697 1.00 0.00 O ATOM 1055 CB ASP A 72 0.664 9.485 -8.546 1.00 0.00 C ATOM 1056 CG ASP A 72 0.190 8.058 -8.212 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -0.885 7.913 -7.582 1.00 0.00 O ATOM 1058 OD2 ASP A 72 0.878 7.082 -8.593 1.00 0.00 O ATOM 0 H ASP A 72 1.524 11.833 -8.574 1.00 0.00 H new ATOM 0 HA ASP A 72 0.103 10.262 -6.603 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.100 9.995 -9.133 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.561 9.436 -9.164 1.00 0.00 H new ATOM 1063 N TYR A 73 3.364 10.091 -6.793 1.00 0.00 N ATOM 1064 CA TYR A 73 4.572 9.460 -6.285 1.00 0.00 C ATOM 1065 C TYR A 73 4.816 9.915 -4.840 1.00 0.00 C ATOM 1066 O TYR A 73 5.300 11.019 -4.593 1.00 0.00 O ATOM 1067 CB TYR A 73 5.754 9.769 -7.218 1.00 0.00 C ATOM 1068 CG TYR A 73 5.503 9.607 -8.710 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.703 8.557 -9.205 1.00 0.00 C ATOM 1070 CD2 TYR A 73 6.059 10.540 -9.609 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.405 8.481 -10.579 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.761 10.470 -10.982 1.00 0.00 C ATOM 1073 CZ TYR A 73 4.911 9.455 -11.463 1.00 0.00 C ATOM 1074 OH TYR A 73 4.577 9.421 -12.781 1.00 0.00 O ATOM 0 H TYR A 73 3.548 10.904 -7.381 1.00 0.00 H new ATOM 0 HA TYR A 73 4.459 8.376 -6.268 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.073 10.795 -7.035 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.586 9.122 -6.940 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.318 7.809 -8.528 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.718 11.313 -9.241 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.789 7.677 -10.955 1.00 0.00 H new ATOM 0 HE2 TYR A 73 6.183 11.192 -11.665 1.00 0.00 H new ATOM 0 HH TYR A 73 5.381 9.259 -13.318 1.00 0.00 H new ATOM 1084 N ASP A 74 4.501 9.048 -3.872 1.00 0.00 N ATOM 1085 CA ASP A 74 4.759 9.278 -2.442 1.00 0.00 C ATOM 1086 C ASP A 74 6.209 9.730 -2.189 1.00 0.00 C ATOM 1087 O ASP A 74 6.463 10.587 -1.340 1.00 0.00 O ATOM 1088 CB ASP A 74 4.524 7.974 -1.667 1.00 0.00 C ATOM 1089 CG ASP A 74 3.087 7.466 -1.740 1.00 0.00 C ATOM 1090 OD1 ASP A 74 2.816 6.663 -2.663 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.273 7.802 -0.850 1.00 0.00 O ATOM 0 H ASP A 74 4.052 8.152 -4.061 1.00 0.00 H new ATOM 0 HA ASP A 74 4.082 10.064 -2.108 1.00 0.00 H new ATOM 0 HB2 ASP A 74 5.192 7.205 -2.056 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.792 8.130 -0.622 1.00 0.00 H new ATOM 1096 N VAL A 75 7.159 9.190 -2.960 1.00 0.00 N ATOM 1097 CA VAL A 75 8.575 9.556 -2.890 1.00 0.00 C ATOM 1098 C VAL A 75 9.125 9.865 -4.282 1.00 0.00 C ATOM 1099 O VAL A 75 8.911 9.104 -5.226 1.00 0.00 O ATOM 1100 CB VAL A 75 9.395 8.440 -2.229 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.849 8.879 -2.026 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.801 7.999 -0.886 1.00 0.00 C ATOM 0 H VAL A 75 6.961 8.475 -3.661 1.00 0.00 H new ATOM 0 HA VAL A 75 8.659 10.454 -2.278 1.00 0.00 H new ATOM 0 HB VAL A 75 9.363 7.587 -2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.411 8.072 -1.556 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.295 9.117 -2.991 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.877 9.761 -1.386 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.417 7.208 -0.458 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.775 8.848 -0.203 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.788 7.627 -1.041 1.00 0.00 H new ATOM 1112 N VAL A 76 9.903 10.941 -4.406 1.00 0.00 N ATOM 1113 CA VAL A 76 10.662 11.271 -5.625 1.00 0.00 C ATOM 1114 C VAL A 76 12.151 11.356 -5.309 1.00 0.00 C ATOM 1115 O VAL A 76 12.554 11.937 -4.307 1.00 0.00 O ATOM 1116 CB VAL A 76 10.145 12.570 -6.266 1.00 0.00 C ATOM 1117 CG1 VAL A 76 11.052 13.098 -7.385 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.760 12.346 -6.882 1.00 0.00 C ATOM 0 H VAL A 76 10.029 11.620 -3.656 1.00 0.00 H new ATOM 0 HA VAL A 76 10.514 10.474 -6.353 1.00 0.00 H new ATOM 0 HB VAL A 76 10.118 13.301 -5.458 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.629 14.016 -7.794 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.044 13.303 -6.983 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.128 12.351 -8.175 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.407 13.274 -7.332 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.823 11.573 -7.648 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.063 12.031 -6.105 1.00 0.00 H new ATOM 1128 N ILE A 77 12.981 10.795 -6.179 1.00 0.00 N ATOM 1129 CA ILE A 77 14.435 10.744 -6.026 1.00 0.00 C ATOM 1130 C ILE A 77 15.097 11.397 -7.233 1.00 0.00 C ATOM 1131 O ILE A 77 14.716 11.092 -8.360 1.00 0.00 O ATOM 1132 CB ILE A 77 14.893 9.278 -5.916 1.00 0.00 C ATOM 1133 CG1 ILE A 77 14.116 8.415 -4.896 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.398 9.209 -5.630 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.197 8.882 -3.439 1.00 0.00 C ATOM 0 H ILE A 77 12.655 10.349 -7.036 1.00 0.00 H new ATOM 0 HA ILE A 77 14.722 11.280 -5.121 1.00 0.00 H new ATOM 0 HB ILE A 77 14.666 8.841 -6.888 1.00 0.00 H new ATOM 0 HG12 ILE A 77 13.068 8.389 -5.193 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.489 7.392 -4.953 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.707 8.166 -5.555 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.945 9.692 -6.440 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.614 9.720 -4.692 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.618 8.208 -2.808 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.237 8.880 -3.114 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.793 9.891 -3.357 1.00 0.00 H new ATOM 1147 N SER A 78 16.120 12.222 -7.030 1.00 0.00 N ATOM 1148 CA SER A 78 16.975 12.727 -8.115 1.00 0.00 C ATOM 1149 C SER A 78 18.340 12.037 -8.101 1.00 0.00 C ATOM 1150 O SER A 78 18.975 11.919 -7.060 1.00 0.00 O ATOM 1151 CB SER A 78 17.122 14.242 -8.030 1.00 0.00 C ATOM 1152 OG SER A 78 17.772 14.678 -9.213 1.00 0.00 O ATOM 0 H SER A 78 16.386 12.564 -6.107 1.00 0.00 H new ATOM 0 HA SER A 78 16.493 12.491 -9.064 1.00 0.00 H new ATOM 0 HB2 SER A 78 16.145 14.716 -7.933 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.701 14.522 -7.150 1.00 0.00 H new ATOM 0 HG SER A 78 17.879 15.652 -9.187 1.00 0.00 H new ATOM 1158 N LEU A 79 18.803 11.576 -9.262 1.00 0.00 N ATOM 1159 CA LEU A 79 20.083 10.891 -9.474 1.00 0.00 C ATOM 1160 C LEU A 79 20.834 11.631 -10.589 1.00 0.00 C ATOM 1161 O LEU A 79 21.256 11.048 -11.585 1.00 0.00 O ATOM 1162 CB LEU A 79 19.844 9.391 -9.774 1.00 0.00 C ATOM 1163 CG LEU A 79 18.980 8.613 -8.757 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.487 8.672 -9.090 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.340 7.126 -8.805 1.00 0.00 C ATOM 0 H LEU A 79 18.270 11.674 -10.126 1.00 0.00 H new ATOM 0 HA LEU A 79 20.704 10.914 -8.578 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.373 9.310 -10.754 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.814 8.899 -9.845 1.00 0.00 H new ATOM 0 HG LEU A 79 19.173 9.072 -7.787 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.925 8.109 -8.344 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.154 9.710 -9.088 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.317 8.239 -10.076 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.729 6.580 -8.086 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.155 6.739 -9.807 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.393 6.998 -8.556 1.00 0.00 H new ATOM 1213 N VAL A 84 20.671 19.995 -11.288 1.00 0.00 N ATOM 1214 CA VAL A 84 19.215 19.737 -11.301 1.00 0.00 C ATOM 1215 C VAL A 84 18.650 19.934 -9.891 1.00 0.00 C ATOM 1216 O VAL A 84 19.243 19.450 -8.926 1.00 0.00 O ATOM 1217 CB VAL A 84 18.923 18.295 -11.774 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.420 17.987 -11.842 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.527 17.971 -13.143 1.00 0.00 C ATOM 0 HA VAL A 84 18.742 20.435 -11.992 1.00 0.00 H new ATOM 0 HB VAL A 84 19.397 17.671 -11.016 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.274 16.961 -12.180 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.978 18.110 -10.853 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.940 18.671 -12.541 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.284 16.944 -13.414 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.118 18.650 -13.891 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.610 18.088 -13.100 1.00 0.00 H new ATOM 1229 N ASN A 85 17.494 20.604 -9.759 1.00 0.00 N ATOM 1230 CA ASN A 85 16.850 20.827 -8.449 1.00 0.00 C ATOM 1231 C ASN A 85 15.312 20.626 -8.416 1.00 0.00 C ATOM 1232 O ASN A 85 14.708 20.773 -7.356 1.00 0.00 O ATOM 1233 CB ASN A 85 17.290 22.220 -7.950 1.00 0.00 C ATOM 1234 CG ASN A 85 17.420 22.275 -6.435 1.00 0.00 C ATOM 1235 OD1 ASN A 85 16.640 22.906 -5.734 1.00 0.00 O ATOM 1236 ND2 ASN A 85 18.430 21.628 -5.889 1.00 0.00 N ATOM 0 H ASN A 85 16.982 21.003 -10.546 1.00 0.00 H new ATOM 0 HA ASN A 85 17.189 20.047 -7.768 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.246 22.481 -8.404 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.567 22.966 -8.278 1.00 0.00 H new ATOM 0 HD21 ASN A 85 18.564 21.652 -4.878 1.00 0.00 H new ATOM 0 HD22 ASN A 85 19.077 21.103 -6.477 1.00 0.00 H new ATOM 1243 N LEU A 86 14.685 20.276 -9.557 1.00 0.00 N ATOM 1244 CA LEU A 86 13.235 20.030 -9.721 1.00 0.00 C ATOM 1245 C LEU A 86 12.307 21.068 -9.029 1.00 0.00 C ATOM 1246 O LEU A 86 11.554 20.704 -8.127 1.00 0.00 O ATOM 1247 CB LEU A 86 12.900 18.574 -9.314 1.00 0.00 C ATOM 1248 CG LEU A 86 13.643 17.420 -9.994 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.003 16.103 -9.547 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.518 17.533 -11.510 1.00 0.00 C ATOM 0 H LEU A 86 15.197 20.151 -10.430 1.00 0.00 H new ATOM 0 HA LEU A 86 13.019 20.168 -10.781 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.069 18.486 -8.241 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.834 18.423 -9.483 1.00 0.00 H new ATOM 0 HG LEU A 86 14.697 17.455 -9.718 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.519 15.268 -10.021 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.081 16.010 -8.464 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.952 16.092 -9.837 1.00 0.00 H new ATOM 0 HD21 LEU A 86 14.050 16.707 -11.982 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.466 17.495 -11.792 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.948 18.478 -11.841 1.00 0.00 H new ATOM 1262 N PRO A 87 12.293 22.347 -9.461 1.00 0.00 N ATOM 1263 CA PRO A 87 11.434 23.391 -8.877 1.00 0.00 C ATOM 1264 C PRO A 87 9.910 23.117 -8.715 1.00 0.00 C ATOM 1265 O PRO A 87 9.334 23.721 -7.802 1.00 0.00 O ATOM 1266 CB PRO A 87 11.652 24.624 -9.758 1.00 0.00 C ATOM 1267 CG PRO A 87 13.070 24.439 -10.290 1.00 0.00 C ATOM 1268 CD PRO A 87 13.155 22.928 -10.486 1.00 0.00 C ATOM 0 HA PRO A 87 11.738 23.487 -7.835 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.923 24.672 -10.567 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.555 25.547 -9.187 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.227 24.979 -11.224 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.818 24.799 -9.584 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.823 22.643 -11.484 1.00 0.00 H new ATOM 0 HD3 PRO A 87 14.181 22.577 -10.380 1.00 0.00 H new ATOM 1276 N PRO A 88 9.221 22.287 -9.542 1.00 0.00 N ATOM 1277 CA PRO A 88 7.765 22.090 -9.438 1.00 0.00 C ATOM 1278 C PRO A 88 7.310 21.167 -8.279 1.00 0.00 C ATOM 1279 O PRO A 88 8.045 20.889 -7.333 1.00 0.00 O ATOM 1280 CB PRO A 88 7.326 21.547 -10.812 1.00 0.00 C ATOM 1281 CG PRO A 88 8.509 21.748 -11.747 1.00 0.00 C ATOM 1282 CD PRO A 88 9.694 21.712 -10.797 1.00 0.00 C ATOM 0 HA PRO A 88 7.288 23.038 -9.189 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.057 20.493 -10.746 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.447 22.078 -11.177 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.569 20.962 -12.499 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.447 22.696 -12.281 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.046 20.691 -10.650 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.532 22.283 -11.197 1.00 0.00 H new ATOM 1290 N GLU A 89 6.095 20.607 -8.395 1.00 0.00 N ATOM 1291 CA GLU A 89 5.520 19.578 -7.500 1.00 0.00 C ATOM 1292 C GLU A 89 6.398 18.322 -7.284 1.00 0.00 C ATOM 1293 O GLU A 89 6.192 17.552 -6.346 1.00 0.00 O ATOM 1294 CB GLU A 89 4.119 19.187 -8.007 1.00 0.00 C ATOM 1295 CG GLU A 89 4.060 18.782 -9.490 1.00 0.00 C ATOM 1296 CD GLU A 89 2.660 18.260 -9.879 1.00 0.00 C ATOM 1297 OE1 GLU A 89 1.710 19.079 -9.964 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.502 17.039 -10.128 1.00 0.00 O ATOM 0 H GLU A 89 5.456 20.867 -9.146 1.00 0.00 H new ATOM 0 HA GLU A 89 5.462 20.038 -6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.748 18.359 -7.404 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.443 20.027 -7.847 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.316 19.639 -10.113 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.805 18.011 -9.688 1.00 0.00 H new ATOM 1305 N TRP A 90 7.435 18.137 -8.100 1.00 0.00 N ATOM 1306 CA TRP A 90 8.450 17.084 -7.977 1.00 0.00 C ATOM 1307 C TRP A 90 9.251 17.107 -6.664 1.00 0.00 C ATOM 1308 O TRP A 90 9.851 16.093 -6.311 1.00 0.00 O ATOM 1309 CB TRP A 90 9.350 17.163 -9.208 1.00 0.00 C ATOM 1310 CG TRP A 90 8.643 16.677 -10.435 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.871 17.413 -11.265 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.580 15.315 -10.946 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.228 16.578 -12.159 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.625 15.266 -12.002 1.00 0.00 C ATOM 1315 CE3 TRP A 90 9.269 14.123 -10.642 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.319 14.080 -12.680 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 9.029 12.947 -11.369 1.00 0.00 C ATOM 1318 CH2 TRP A 90 8.053 12.919 -12.380 1.00 0.00 C ATOM 0 H TRP A 90 7.601 18.744 -8.903 1.00 0.00 H new ATOM 0 HA TRP A 90 7.937 16.123 -7.932 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.675 18.193 -9.357 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.247 16.567 -9.043 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.772 18.488 -11.234 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.545 16.892 -12.849 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.991 14.115 -9.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.533 14.057 -13.420 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.599 12.056 -11.150 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.867 12.006 -12.926 1.00 0.00 H new ATOM 1329 N VAL A 91 9.219 18.210 -5.905 1.00 0.00 N ATOM 1330 CA VAL A 91 9.833 18.321 -4.561 1.00 0.00 C ATOM 1331 C VAL A 91 8.827 18.624 -3.440 1.00 0.00 C ATOM 1332 O VAL A 91 9.227 18.759 -2.283 1.00 0.00 O ATOM 1333 CB VAL A 91 11.019 19.310 -4.544 1.00 0.00 C ATOM 1334 CG1 VAL A 91 12.122 18.863 -5.502 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.599 20.752 -4.857 1.00 0.00 C ATOM 0 H VAL A 91 8.759 19.069 -6.206 1.00 0.00 H new ATOM 0 HA VAL A 91 10.225 17.327 -4.344 1.00 0.00 H new ATOM 0 HB VAL A 91 11.406 19.302 -3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.944 19.578 -5.469 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.485 17.879 -5.205 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.725 18.813 -6.516 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.475 21.400 -4.830 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.148 20.792 -5.848 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.875 21.089 -4.115 1.00 0.00 H new ATOM 1345 N THR A 92 7.521 18.690 -3.740 1.00 0.00 N ATOM 1346 CA THR A 92 6.450 18.928 -2.743 1.00 0.00 C ATOM 1347 C THR A 92 5.823 17.632 -2.200 1.00 0.00 C ATOM 1348 O THR A 92 4.900 17.683 -1.382 1.00 0.00 O ATOM 1349 CB THR A 92 5.356 19.865 -3.282 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.650 19.232 -4.325 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.918 21.177 -3.836 1.00 0.00 C ATOM 0 H THR A 92 7.168 18.579 -4.691 1.00 0.00 H new ATOM 0 HA THR A 92 6.945 19.420 -1.906 1.00 0.00 H new ATOM 0 HB THR A 92 4.706 20.092 -2.437 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.267 18.683 -4.852 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.100 21.797 -4.202 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.450 21.707 -3.046 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.604 20.962 -4.655 1.00 0.00 H new ATOM 1359 N GLN A 93 6.323 16.467 -2.634 1.00 0.00 N ATOM 1360 CA GLN A 93 5.860 15.146 -2.201 1.00 0.00 C ATOM 1361 C GLN A 93 6.345 14.789 -0.782 1.00 0.00 C ATOM 1362 O GLN A 93 7.089 15.540 -0.148 1.00 0.00 O ATOM 1363 CB GLN A 93 6.239 14.081 -3.250 1.00 0.00 C ATOM 1364 CG GLN A 93 5.736 14.397 -4.668 1.00 0.00 C ATOM 1365 CD GLN A 93 4.290 14.907 -4.692 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.365 14.303 -4.161 1.00 0.00 O ATOM 1367 NE2 GLN A 93 4.052 16.087 -5.231 1.00 0.00 N ATOM 0 H GLN A 93 7.081 16.419 -3.314 1.00 0.00 H new ATOM 0 HA GLN A 93 4.772 15.172 -2.132 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.324 13.979 -3.274 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.835 13.118 -2.938 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.387 15.146 -5.120 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.809 13.499 -5.282 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.808 16.606 -5.678 1.00 0.00 H new ATOM 0 HE22 GLN A 93 3.112 16.481 -5.201 1.00 0.00 H new ATOM 1376 N GLU A 94 5.903 13.640 -0.267 1.00 0.00 N ATOM 1377 CA GLU A 94 6.093 13.259 1.145 1.00 0.00 C ATOM 1378 C GLU A 94 7.573 13.056 1.516 1.00 0.00 C ATOM 1379 O GLU A 94 7.986 13.454 2.609 1.00 0.00 O ATOM 1380 CB GLU A 94 5.218 12.039 1.474 1.00 0.00 C ATOM 1381 CG GLU A 94 5.370 11.553 2.918 1.00 0.00 C ATOM 1382 CD GLU A 94 4.264 10.542 3.271 1.00 0.00 C ATOM 1383 OE1 GLU A 94 4.156 9.494 2.590 1.00 0.00 O ATOM 1384 OE2 GLU A 94 3.487 10.791 4.225 1.00 0.00 O ATOM 0 H GLU A 94 5.401 12.941 -0.815 1.00 0.00 H new ATOM 0 HA GLU A 94 5.765 14.090 1.770 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.173 12.291 1.291 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.473 11.225 0.796 1.00 0.00 H new ATOM 0 HG2 GLU A 94 6.348 11.090 3.050 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.324 12.402 3.600 1.00 0.00 H new ATOM 1391 N ILE A 95 8.382 12.509 0.601 1.00 0.00 N ATOM 1392 CA ILE A 95 9.847 12.456 0.728 1.00 0.00 C ATOM 1393 C ILE A 95 10.506 12.805 -0.618 1.00 0.00 C ATOM 1394 O ILE A 95 10.104 12.302 -1.669 1.00 0.00 O ATOM 1395 CB ILE A 95 10.338 11.076 1.255 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.620 10.647 2.557 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.869 11.074 1.456 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.055 9.285 3.114 1.00 0.00 C ATOM 0 H ILE A 95 8.036 12.085 -0.260 1.00 0.00 H new ATOM 0 HA ILE A 95 10.147 13.198 1.468 1.00 0.00 H new ATOM 0 HB ILE A 95 10.082 10.342 0.491 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.794 11.407 3.318 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.546 10.622 2.371 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.186 10.099 1.825 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.361 11.280 0.506 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.142 11.842 2.180 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.498 9.070 4.026 1.00 0.00 H new ATOM 0 HD12 ILE A 95 9.855 8.509 2.375 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.122 9.307 3.337 1.00 0.00 H new ATOM 1410 N PHE A 96 11.542 13.645 -0.576 1.00 0.00 N ATOM 1411 CA PHE A 96 12.437 13.910 -1.706 1.00 0.00 C ATOM 1412 C PHE A 96 13.892 13.682 -1.263 1.00 0.00 C ATOM 1413 O PHE A 96 14.296 14.137 -0.190 1.00 0.00 O ATOM 1414 CB PHE A 96 12.205 15.301 -2.320 1.00 0.00 C ATOM 1415 CG PHE A 96 13.217 15.649 -3.404 1.00 0.00 C ATOM 1416 CD1 PHE A 96 13.018 15.264 -4.747 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.409 16.313 -3.049 1.00 0.00 C ATOM 1418 CE1 PHE A 96 14.017 15.505 -5.708 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.398 16.572 -4.014 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.203 16.167 -5.344 1.00 0.00 C ATOM 0 H PHE A 96 11.788 14.172 0.262 1.00 0.00 H new ATOM 0 HA PHE A 96 12.212 13.209 -2.510 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.201 15.343 -2.741 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.252 16.052 -1.532 1.00 0.00 H new ATOM 0 HD1 PHE A 96 12.096 14.783 -5.038 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.564 16.625 -2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.873 15.181 -6.728 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.307 17.082 -3.732 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.963 16.364 -6.086 1.00 0.00 H new ATOM 1430 N GLU A 97 14.679 12.987 -2.088 1.00 0.00 N ATOM 1431 CA GLU A 97 16.118 12.766 -1.867 1.00 0.00 C ATOM 1432 C GLU A 97 16.924 12.999 -3.152 1.00 0.00 C ATOM 1433 O GLU A 97 16.419 12.797 -4.257 1.00 0.00 O ATOM 1434 CB GLU A 97 16.413 11.342 -1.360 1.00 0.00 C ATOM 1435 CG GLU A 97 15.717 10.949 -0.049 1.00 0.00 C ATOM 1436 CD GLU A 97 16.206 9.596 0.512 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.311 9.126 0.137 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.495 9.009 1.364 1.00 0.00 O ATOM 0 H GLU A 97 14.332 12.553 -2.944 1.00 0.00 H new ATOM 0 HA GLU A 97 16.419 13.486 -1.106 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.120 10.632 -2.133 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.490 11.239 -1.224 1.00 0.00 H new ATOM 0 HG2 GLU A 97 15.888 11.728 0.694 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.641 10.899 -0.216 1.00 0.00 H new ATOM 1445 N ASP A 98 18.202 13.362 -3.014 1.00 0.00 N ATOM 1446 CA ASP A 98 19.142 13.489 -4.130 1.00 0.00 C ATOM 1447 C ASP A 98 20.406 12.631 -3.917 1.00 0.00 C ATOM 1448 O ASP A 98 21.180 12.838 -2.980 1.00 0.00 O ATOM 1449 CB ASP A 98 19.420 14.971 -4.428 1.00 0.00 C ATOM 1450 CG ASP A 98 20.314 15.678 -3.388 1.00 0.00 C ATOM 1451 OD1 ASP A 98 19.877 15.872 -2.226 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.435 16.106 -3.761 1.00 0.00 O ATOM 0 H ASP A 98 18.619 13.579 -2.109 1.00 0.00 H new ATOM 0 HA ASP A 98 18.685 13.079 -5.031 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.893 15.049 -5.407 1.00 0.00 H new ATOM 0 HB3 ASP A 98 18.469 15.500 -4.490 1.00 0.00 H new ATOM 1457 N TRP A 99 20.591 11.625 -4.779 1.00 0.00 N ATOM 1458 CA TRP A 99 21.655 10.617 -4.705 1.00 0.00 C ATOM 1459 C TRP A 99 22.736 10.929 -5.748 1.00 0.00 C ATOM 1460 O TRP A 99 22.668 10.498 -6.900 1.00 0.00 O ATOM 1461 CB TRP A 99 21.065 9.209 -4.897 1.00 0.00 C ATOM 1462 CG TRP A 99 19.927 8.787 -4.012 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.537 9.354 -2.846 1.00 0.00 C ATOM 1464 CD2 TRP A 99 19.013 7.668 -4.226 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.420 8.699 -2.363 1.00 0.00 N ATOM 1466 CE2 TRP A 99 18.043 7.665 -3.182 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.917 6.649 -5.198 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.033 6.694 -3.100 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.897 5.678 -5.137 1.00 0.00 C ATOM 1470 CH2 TRP A 99 16.959 5.697 -4.089 1.00 0.00 C ATOM 0 H TRP A 99 19.977 11.485 -5.582 1.00 0.00 H new ATOM 0 HA TRP A 99 22.120 10.646 -3.720 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.730 9.127 -5.931 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.873 8.489 -4.766 1.00 0.00 H new ATOM 0 HD1 TRP A 99 20.024 10.190 -2.367 1.00 0.00 H new ATOM 0 HE1 TRP A 99 17.935 8.953 -1.502 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.637 6.613 -6.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.322 6.712 -2.288 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.835 4.915 -5.899 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.183 4.947 -4.044 1.00 0.00 H new ATOM 1481 N GLN A 100 23.731 11.718 -5.343 1.00 0.00 N ATOM 1482 CA GLN A 100 24.784 12.198 -6.241 1.00 0.00 C ATOM 1483 C GLN A 100 25.883 11.129 -6.393 1.00 0.00 C ATOM 1484 O GLN A 100 26.724 10.964 -5.506 1.00 0.00 O ATOM 1485 CB GLN A 100 25.329 13.546 -5.725 1.00 0.00 C ATOM 1486 CG GLN A 100 24.259 14.617 -5.431 1.00 0.00 C ATOM 1487 CD GLN A 100 23.354 14.970 -6.611 1.00 0.00 C ATOM 1488 OE1 GLN A 100 23.563 14.591 -7.754 1.00 0.00 O ATOM 1489 NE2 GLN A 100 22.300 15.713 -6.390 1.00 0.00 N ATOM 0 H GLN A 100 23.831 12.044 -4.381 1.00 0.00 H new ATOM 0 HA GLN A 100 24.376 12.371 -7.237 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.899 13.365 -4.814 1.00 0.00 H new ATOM 0 HB3 GLN A 100 26.026 13.944 -6.462 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.636 14.269 -4.607 1.00 0.00 H new ATOM 0 HG3 GLN A 100 24.759 15.524 -5.092 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.099 16.045 -5.447 1.00 0.00 H new ATOM 0 HE22 GLN A 100 21.680 15.960 -7.161 1.00 0.00 H new ATOM 1498 N LEU A 101 25.864 10.397 -7.514 1.00 0.00 N ATOM 1499 CA LEU A 101 26.846 9.363 -7.876 1.00 0.00 C ATOM 1500 C LEU A 101 27.602 9.763 -9.157 1.00 0.00 C ATOM 1501 O LEU A 101 27.207 10.696 -9.862 1.00 0.00 O ATOM 1502 CB LEU A 101 26.141 7.998 -8.041 1.00 0.00 C ATOM 1503 CG LEU A 101 25.411 7.419 -6.811 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.900 6.025 -7.155 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.300 7.310 -5.577 1.00 0.00 C ATOM 0 H LEU A 101 25.138 10.512 -8.221 1.00 0.00 H new ATOM 0 HA LEU A 101 27.579 9.271 -7.074 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.416 8.090 -8.850 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.887 7.271 -8.362 1.00 0.00 H new ATOM 0 HG LEU A 101 24.600 8.106 -6.571 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.382 5.605 -6.293 1.00 0.00 H new ATOM 0 HD12 LEU A 101 24.211 6.088 -7.998 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.741 5.384 -7.421 1.00 0.00 H new ATOM 0 HD21 LEU A 101 25.724 6.896 -4.749 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.145 6.657 -5.794 1.00 0.00 H new ATOM 0 HD23 LEU A 101 26.667 8.300 -5.304 1.00 0.00 H new ATOM 1517 N GLU A 102 28.673 9.042 -9.484 1.00 0.00 N ATOM 1518 CA GLU A 102 29.413 9.204 -10.735 1.00 0.00 C ATOM 1519 C GLU A 102 28.622 8.685 -11.946 1.00 0.00 C ATOM 1520 O GLU A 102 27.519 8.146 -11.826 1.00 0.00 O ATOM 1521 CB GLU A 102 30.825 8.591 -10.622 1.00 0.00 C ATOM 1522 CG GLU A 102 30.897 7.092 -10.309 1.00 0.00 C ATOM 1523 CD GLU A 102 30.879 6.806 -8.789 1.00 0.00 C ATOM 1524 OE1 GLU A 102 29.786 6.803 -8.173 1.00 0.00 O ATOM 1525 OE2 GLU A 102 31.971 6.583 -8.207 1.00 0.00 O ATOM 0 H GLU A 102 29.057 8.317 -8.878 1.00 0.00 H new ATOM 0 HA GLU A 102 29.547 10.271 -10.912 1.00 0.00 H new ATOM 0 HB2 GLU A 102 31.350 8.769 -11.560 1.00 0.00 H new ATOM 0 HB3 GLU A 102 31.369 9.128 -9.845 1.00 0.00 H new ATOM 0 HG2 GLU A 102 30.056 6.584 -10.782 1.00 0.00 H new ATOM 0 HG3 GLU A 102 31.806 6.676 -10.744 1.00 0.00 H new ATOM 1532 N ASP A 103 29.159 8.913 -13.139 1.00 0.00 N ATOM 1533 CA ASP A 103 28.520 8.698 -14.439 1.00 0.00 C ATOM 1534 C ASP A 103 29.226 7.580 -15.252 1.00 0.00 C ATOM 1535 O ASP A 103 30.278 7.833 -15.843 1.00 0.00 O ATOM 1536 CB ASP A 103 28.435 10.053 -15.169 1.00 0.00 C ATOM 1537 CG ASP A 103 29.802 10.694 -15.508 1.00 0.00 C ATOM 1538 OD1 ASP A 103 30.603 10.965 -14.579 1.00 0.00 O ATOM 1539 OD2 ASP A 103 30.048 10.991 -16.703 1.00 0.00 O ATOM 0 H ASP A 103 30.108 9.274 -13.234 1.00 0.00 H new ATOM 0 HA ASP A 103 27.504 8.327 -14.306 1.00 0.00 H new ATOM 0 HB2 ASP A 103 27.874 9.917 -16.094 1.00 0.00 H new ATOM 0 HB3 ASP A 103 27.867 10.748 -14.551 1.00 0.00 H new ATOM 1544 N PRO A 104 28.683 6.337 -15.288 1.00 0.00 N ATOM 1545 CA PRO A 104 29.373 5.165 -15.855 1.00 0.00 C ATOM 1546 C PRO A 104 29.556 5.122 -17.381 1.00 0.00 C ATOM 1547 O PRO A 104 30.343 4.310 -17.866 1.00 0.00 O ATOM 1548 CB PRO A 104 28.567 3.952 -15.391 1.00 0.00 C ATOM 1549 CG PRO A 104 27.903 4.427 -14.111 1.00 0.00 C ATOM 1550 CD PRO A 104 27.562 5.866 -14.480 1.00 0.00 C ATOM 0 HA PRO A 104 30.402 5.196 -15.498 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.830 3.652 -16.136 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.209 3.089 -15.212 1.00 0.00 H new ATOM 0 HG2 PRO A 104 27.016 3.843 -13.865 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.572 4.368 -13.253 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.627 5.917 -15.038 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.435 6.480 -13.589 1.00 0.00 H new ATOM 1558 N ASP A 105 28.859 5.962 -18.150 1.00 0.00 N ATOM 1559 CA ASP A 105 28.921 5.957 -19.617 1.00 0.00 C ATOM 1560 C ASP A 105 30.362 6.122 -20.149 1.00 0.00 C ATOM 1561 O ASP A 105 30.990 7.174 -19.983 1.00 0.00 O ATOM 1562 CB ASP A 105 28.001 7.050 -20.178 1.00 0.00 C ATOM 1563 CG ASP A 105 28.147 7.222 -21.705 1.00 0.00 C ATOM 1564 OD1 ASP A 105 28.307 6.207 -22.427 1.00 0.00 O ATOM 1565 OD2 ASP A 105 28.086 8.378 -22.191 1.00 0.00 O ATOM 0 H ASP A 105 28.231 6.671 -17.771 1.00 0.00 H new ATOM 0 HA ASP A 105 28.576 4.982 -19.960 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.966 6.805 -19.941 1.00 0.00 H new ATOM 0 HB3 ASP A 105 28.225 7.997 -19.686 1.00 0.00 H new ATOM 1570 N GLY A 106 30.883 5.072 -20.799 1.00 0.00 N ATOM 1571 CA GLY A 106 32.229 5.053 -21.378 1.00 0.00 C ATOM 1572 C GLY A 106 33.362 4.931 -20.347 1.00 0.00 C ATOM 1573 O GLY A 106 34.517 5.204 -20.683 1.00 0.00 O ATOM 0 H GLY A 106 30.372 4.200 -20.938 1.00 0.00 H new ATOM 0 HA2 GLY A 106 32.299 4.219 -22.077 1.00 0.00 H new ATOM 0 HA3 GLY A 106 32.376 5.966 -21.955 1.00 0.00 H new ATOM 1577 N GLN A 107 33.046 4.539 -19.104 1.00 0.00 N ATOM 1578 CA GLN A 107 34.024 4.392 -18.014 1.00 0.00 C ATOM 1579 C GLN A 107 34.622 2.970 -18.000 1.00 0.00 C ATOM 1580 O GLN A 107 35.550 2.671 -18.755 1.00 0.00 O ATOM 1581 CB GLN A 107 33.421 4.799 -16.654 1.00 0.00 C ATOM 1582 CG GLN A 107 32.773 6.183 -16.576 1.00 0.00 C ATOM 1583 CD GLN A 107 33.692 7.395 -16.673 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.902 7.319 -16.853 1.00 0.00 O ATOM 1585 NE2 GLN A 107 33.120 8.573 -16.532 1.00 0.00 N ATOM 0 H GLN A 107 32.092 4.312 -18.823 1.00 0.00 H new ATOM 0 HA GLN A 107 34.848 5.081 -18.199 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.672 4.057 -16.378 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.210 4.750 -15.904 1.00 0.00 H new ATOM 0 HG2 GLN A 107 32.035 6.255 -17.375 1.00 0.00 H new ATOM 0 HG3 GLN A 107 32.229 6.247 -15.634 1.00 0.00 H new ATOM 0 HE21 GLN A 107 32.113 8.636 -16.382 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.684 9.422 -16.573 1.00 0.00 H new ATOM 1594 N SER A 108 34.080 2.089 -17.149 1.00 0.00 N ATOM 1595 CA SER A 108 34.367 0.649 -17.103 1.00 0.00 C ATOM 1596 C SER A 108 33.245 -0.077 -16.365 1.00 0.00 C ATOM 1597 O SER A 108 32.490 0.539 -15.612 1.00 0.00 O ATOM 1598 CB SER A 108 35.699 0.368 -16.388 1.00 0.00 C ATOM 1599 OG SER A 108 36.094 -0.980 -16.605 1.00 0.00 O ATOM 0 H SER A 108 33.400 2.372 -16.443 1.00 0.00 H new ATOM 0 HA SER A 108 34.439 0.289 -18.129 1.00 0.00 H new ATOM 0 HB2 SER A 108 36.469 1.045 -16.758 1.00 0.00 H new ATOM 0 HB3 SER A 108 35.594 0.557 -15.320 1.00 0.00 H new ATOM 0 HG SER A 108 36.944 -1.150 -16.148 1.00 0.00 H new ATOM 1605 N LEU A 109 33.182 -1.400 -16.493 1.00 0.00 N ATOM 1606 CA LEU A 109 32.229 -2.246 -15.769 1.00 0.00 C ATOM 1607 C LEU A 109 32.372 -2.111 -14.254 1.00 0.00 C ATOM 1608 O LEU A 109 31.379 -2.026 -13.548 1.00 0.00 O ATOM 1609 CB LEU A 109 32.440 -3.705 -16.200 1.00 0.00 C ATOM 1610 CG LEU A 109 32.265 -3.978 -17.705 1.00 0.00 C ATOM 1611 CD1 LEU A 109 32.375 -5.483 -17.937 1.00 0.00 C ATOM 1612 CD2 LEU A 109 30.926 -3.477 -18.250 1.00 0.00 C ATOM 0 H LEU A 109 33.800 -1.925 -17.112 1.00 0.00 H new ATOM 0 HA LEU A 109 31.219 -1.920 -16.018 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.444 -4.012 -15.906 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.740 -4.334 -15.650 1.00 0.00 H new ATOM 0 HG LEU A 109 33.046 -3.433 -18.236 1.00 0.00 H new ATOM 0 HD11 LEU A 109 32.254 -5.697 -18.999 1.00 0.00 H new ATOM 0 HD12 LEU A 109 33.353 -5.832 -17.606 1.00 0.00 H new ATOM 0 HD13 LEU A 109 31.597 -5.996 -17.372 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.861 -3.698 -19.315 1.00 0.00 H new ATOM 0 HD22 LEU A 109 30.110 -3.975 -17.726 1.00 0.00 H new ATOM 0 HD23 LEU A 109 30.851 -2.400 -18.098 1.00 0.00 H new ATOM 1624 N GLU A 110 33.598 -1.983 -13.752 1.00 0.00 N ATOM 1625 CA GLU A 110 33.865 -1.718 -12.327 1.00 0.00 C ATOM 1626 C GLU A 110 33.215 -0.413 -11.838 1.00 0.00 C ATOM 1627 O GLU A 110 32.686 -0.358 -10.729 1.00 0.00 O ATOM 1628 CB GLU A 110 35.387 -1.718 -12.107 1.00 0.00 C ATOM 1629 CG GLU A 110 35.773 -1.568 -10.631 1.00 0.00 C ATOM 1630 CD GLU A 110 37.294 -1.728 -10.440 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.036 -0.721 -10.558 1.00 0.00 O ATOM 1632 OE2 GLU A 110 37.763 -2.861 -10.166 1.00 0.00 O ATOM 0 H GLU A 110 34.443 -2.059 -14.319 1.00 0.00 H new ATOM 0 HA GLU A 110 33.409 -2.508 -11.730 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.806 -2.647 -12.495 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.832 -0.904 -12.679 1.00 0.00 H new ATOM 0 HG2 GLU A 110 35.458 -0.590 -10.266 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.247 -2.315 -10.036 1.00 0.00 H new ATOM 1639 N VAL A 111 33.158 0.615 -12.687 1.00 0.00 N ATOM 1640 CA VAL A 111 32.484 1.889 -12.378 1.00 0.00 C ATOM 1641 C VAL A 111 30.966 1.741 -12.456 1.00 0.00 C ATOM 1642 O VAL A 111 30.269 2.249 -11.580 1.00 0.00 O ATOM 1643 CB VAL A 111 33.017 3.013 -13.282 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.285 4.340 -13.083 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.504 3.258 -13.009 1.00 0.00 C ATOM 0 H VAL A 111 33.579 0.592 -13.616 1.00 0.00 H new ATOM 0 HA VAL A 111 32.714 2.168 -11.350 1.00 0.00 H new ATOM 0 HB VAL A 111 32.851 2.674 -14.305 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.708 5.092 -13.749 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.227 4.209 -13.308 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.398 4.666 -12.049 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.866 4.056 -13.657 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.640 3.547 -11.967 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.066 2.346 -13.209 1.00 0.00 H new ATOM 1655 N PHE A 112 30.439 0.968 -13.417 1.00 0.00 N ATOM 1656 CA PHE A 112 29.011 0.616 -13.425 1.00 0.00 C ATOM 1657 C PHE A 112 28.618 -0.155 -12.161 1.00 0.00 C ATOM 1658 O PHE A 112 27.636 0.199 -11.520 1.00 0.00 O ATOM 1659 CB PHE A 112 28.660 -0.216 -14.664 1.00 0.00 C ATOM 1660 CG PHE A 112 28.264 0.560 -15.898 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.921 0.940 -16.076 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.218 0.883 -16.877 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.530 1.640 -17.231 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.832 1.593 -18.025 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.494 1.983 -18.193 1.00 0.00 C ATOM 0 H PHE A 112 30.974 0.577 -14.192 1.00 0.00 H new ATOM 0 HA PHE A 112 28.449 1.550 -13.451 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.519 -0.840 -14.912 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.842 -0.888 -14.405 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.188 0.693 -15.323 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.248 0.585 -16.747 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.495 1.912 -17.377 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.565 1.839 -18.779 1.00 0.00 H new ATOM 0 HZ PHE A 112 27.205 2.549 -19.066 1.00 0.00 H new ATOM 1675 N ARG A 113 29.405 -1.155 -11.750 1.00 0.00 N ATOM 1676 CA ARG A 113 29.188 -1.945 -10.520 1.00 0.00 C ATOM 1677 C ARG A 113 29.278 -1.077 -9.258 1.00 0.00 C ATOM 1678 O ARG A 113 28.440 -1.201 -8.368 1.00 0.00 O ATOM 1679 CB ARG A 113 30.211 -3.095 -10.472 1.00 0.00 C ATOM 1680 CG ARG A 113 29.982 -4.158 -11.563 1.00 0.00 C ATOM 1681 CD ARG A 113 31.146 -5.152 -11.578 1.00 0.00 C ATOM 1682 NE ARG A 113 31.012 -6.157 -12.652 1.00 0.00 N ATOM 1683 CZ ARG A 113 31.975 -6.626 -13.427 1.00 0.00 C ATOM 1684 NH1 ARG A 113 33.203 -6.187 -13.384 1.00 0.00 N ATOM 1685 NH2 ARG A 113 31.717 -7.569 -14.278 1.00 0.00 N ATOM 0 H ARG A 113 30.231 -1.449 -12.271 1.00 0.00 H new ATOM 0 HA ARG A 113 28.178 -2.355 -10.545 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.215 -2.684 -10.579 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.165 -3.573 -9.493 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.046 -4.685 -11.378 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.891 -3.677 -12.537 1.00 0.00 H new ATOM 0 HD2 ARG A 113 32.083 -4.609 -11.706 1.00 0.00 H new ATOM 0 HD3 ARG A 113 31.201 -5.659 -10.614 1.00 0.00 H new ATOM 0 HE ARG A 113 30.076 -6.529 -12.813 1.00 0.00 H new ATOM 0 HH11 ARG A 113 33.457 -5.447 -12.730 1.00 0.00 H new ATOM 0 HH12 ARG A 113 33.908 -6.584 -14.005 1.00 0.00 H new ATOM 0 HH21 ARG A 113 30.773 -7.948 -14.349 1.00 0.00 H new ATOM 0 HH22 ARG A 113 32.458 -7.932 -14.877 1.00 0.00 H new ATOM 1699 N THR A 114 30.225 -0.134 -9.225 1.00 0.00 N ATOM 1700 CA THR A 114 30.388 0.842 -8.124 1.00 0.00 C ATOM 1701 C THR A 114 29.160 1.746 -7.982 1.00 0.00 C ATOM 1702 O THR A 114 28.710 2.008 -6.867 1.00 0.00 O ATOM 1703 CB THR A 114 31.654 1.690 -8.347 1.00 0.00 C ATOM 1704 OG1 THR A 114 32.801 0.870 -8.277 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.842 2.794 -7.305 1.00 0.00 C ATOM 0 H THR A 114 30.913 -0.019 -9.969 1.00 0.00 H new ATOM 0 HA THR A 114 30.493 0.280 -7.196 1.00 0.00 H new ATOM 0 HB THR A 114 31.527 2.149 -9.328 1.00 0.00 H new ATOM 0 HG1 THR A 114 32.897 0.369 -9.114 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.753 3.350 -7.525 1.00 0.00 H new ATOM 0 HG22 THR A 114 30.988 3.471 -7.334 1.00 0.00 H new ATOM 0 HG23 THR A 114 31.919 2.349 -6.313 1.00 0.00 H new ATOM 1713 N VAL A 115 28.565 2.178 -9.098 1.00 0.00 N ATOM 1714 CA VAL A 115 27.287 2.913 -9.094 1.00 0.00 C ATOM 1715 C VAL A 115 26.120 2.001 -8.707 1.00 0.00 C ATOM 1716 O VAL A 115 25.385 2.324 -7.778 1.00 0.00 O ATOM 1717 CB VAL A 115 27.090 3.620 -10.448 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.672 4.143 -10.691 1.00 0.00 C ATOM 1719 CG2 VAL A 115 28.036 4.822 -10.506 1.00 0.00 C ATOM 0 H VAL A 115 28.951 2.031 -10.030 1.00 0.00 H new ATOM 0 HA VAL A 115 27.316 3.687 -8.327 1.00 0.00 H new ATOM 0 HB VAL A 115 27.292 2.871 -11.214 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.625 4.626 -11.667 1.00 0.00 H new ATOM 0 HG12 VAL A 115 24.968 3.312 -10.663 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.413 4.865 -9.916 1.00 0.00 H new ATOM 0 HG21 VAL A 115 27.912 5.337 -11.459 1.00 0.00 H new ATOM 0 HG22 VAL A 115 27.805 5.507 -9.690 1.00 0.00 H new ATOM 0 HG23 VAL A 115 29.066 4.479 -10.411 1.00 0.00 H new ATOM 1729 N ARG A 116 25.989 0.833 -9.349 1.00 0.00 N ATOM 1730 CA ARG A 116 24.921 -0.167 -9.131 1.00 0.00 C ATOM 1731 C ARG A 116 24.736 -0.500 -7.649 1.00 0.00 C ATOM 1732 O ARG A 116 23.614 -0.466 -7.163 1.00 0.00 O ATOM 1733 CB ARG A 116 25.266 -1.422 -9.968 1.00 0.00 C ATOM 1734 CG ARG A 116 24.176 -2.502 -9.930 1.00 0.00 C ATOM 1735 CD ARG A 116 24.630 -3.830 -10.550 1.00 0.00 C ATOM 1736 NE ARG A 116 25.655 -4.506 -9.714 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.543 -5.400 -10.118 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.530 -5.867 -11.326 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.469 -5.832 -9.319 1.00 0.00 N ATOM 0 H ARG A 116 26.651 0.541 -10.068 1.00 0.00 H new ATOM 0 HA ARG A 116 23.965 0.242 -9.456 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.435 -1.124 -11.003 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.201 -1.847 -9.602 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.877 -2.673 -8.896 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.295 -2.141 -10.461 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.769 -4.487 -10.672 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.035 -3.647 -11.545 1.00 0.00 H new ATOM 0 HE ARG A 116 25.677 -4.255 -8.726 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.825 -5.546 -11.989 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.225 -6.556 -11.614 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.521 -5.482 -8.362 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.145 -6.521 -9.647 1.00 0.00 H new ATOM 1753 N GLY A 117 25.830 -0.761 -6.932 1.00 0.00 N ATOM 1754 CA GLY A 117 25.808 -1.063 -5.492 1.00 0.00 C ATOM 1755 C GLY A 117 25.208 0.068 -4.654 1.00 0.00 C ATOM 1756 O GLY A 117 24.304 -0.164 -3.858 1.00 0.00 O ATOM 0 H GLY A 117 26.767 -0.770 -7.334 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.234 -1.975 -5.326 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.825 -1.260 -5.152 1.00 0.00 H new ATOM 1760 N GLN A 118 25.613 1.317 -4.894 1.00 0.00 N ATOM 1761 CA GLN A 118 25.091 2.473 -4.144 1.00 0.00 C ATOM 1762 C GLN A 118 23.619 2.766 -4.490 1.00 0.00 C ATOM 1763 O GLN A 118 22.817 3.060 -3.608 1.00 0.00 O ATOM 1764 CB GLN A 118 25.993 3.695 -4.381 1.00 0.00 C ATOM 1765 CG GLN A 118 27.408 3.500 -3.805 1.00 0.00 C ATOM 1766 CD GLN A 118 28.356 4.613 -4.248 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.569 5.601 -3.558 1.00 0.00 O ATOM 1768 NE2 GLN A 118 28.947 4.497 -5.419 1.00 0.00 N ATOM 0 H GLN A 118 26.304 1.559 -5.604 1.00 0.00 H new ATOM 0 HA GLN A 118 25.109 2.233 -3.081 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.063 3.890 -5.451 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.536 4.574 -3.926 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.358 3.476 -2.716 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.802 2.536 -4.127 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.774 3.676 -5.999 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.578 5.228 -5.746 1.00 0.00 H new ATOM 1777 N VAL A 119 23.222 2.611 -5.757 1.00 0.00 N ATOM 1778 CA VAL A 119 21.808 2.738 -6.199 1.00 0.00 C ATOM 1779 C VAL A 119 20.926 1.640 -5.587 1.00 0.00 C ATOM 1780 O VAL A 119 19.845 1.947 -5.078 1.00 0.00 O ATOM 1781 CB VAL A 119 21.663 2.766 -7.737 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.206 2.959 -8.162 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.430 3.934 -8.363 1.00 0.00 C ATOM 0 H VAL A 119 23.867 2.393 -6.517 1.00 0.00 H new ATOM 0 HA VAL A 119 21.459 3.702 -5.830 1.00 0.00 H new ATOM 0 HB VAL A 119 22.056 1.808 -8.077 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.143 2.974 -9.250 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.602 2.138 -7.775 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.833 3.903 -7.764 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.301 3.916 -9.445 1.00 0.00 H new ATOM 0 HG22 VAL A 119 22.047 4.875 -7.968 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.489 3.844 -8.122 1.00 0.00 H new ATOM 1793 N LYS A 120 21.404 0.385 -5.551 1.00 0.00 N ATOM 1794 CA LYS A 120 20.767 -0.725 -4.813 1.00 0.00 C ATOM 1795 C LYS A 120 20.550 -0.321 -3.361 1.00 0.00 C ATOM 1796 O LYS A 120 19.412 -0.326 -2.911 1.00 0.00 O ATOM 1797 CB LYS A 120 21.631 -1.999 -4.913 1.00 0.00 C ATOM 1798 CG LYS A 120 20.986 -3.198 -4.199 1.00 0.00 C ATOM 1799 CD LYS A 120 21.885 -4.440 -4.262 1.00 0.00 C ATOM 1800 CE LYS A 120 21.125 -5.641 -3.685 1.00 0.00 C ATOM 1801 NZ LYS A 120 22.010 -6.829 -3.511 1.00 0.00 N ATOM 0 H LYS A 120 22.255 0.106 -6.039 1.00 0.00 H new ATOM 0 HA LYS A 120 19.796 -0.943 -5.258 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.790 -2.246 -5.963 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.612 -1.805 -4.479 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.791 -2.941 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.023 -3.421 -4.658 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.177 -4.640 -5.293 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.802 -4.269 -3.698 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.691 -5.368 -2.723 1.00 0.00 H new ATOM 0 HE3 LYS A 120 20.298 -5.899 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.458 -7.619 -3.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.404 -7.106 -4.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 22.785 -6.592 -2.860 1.00 0.00 H new ATOM 1815 N GLU A 121 21.610 0.093 -2.664 1.00 0.00 N ATOM 1816 CA GLU A 121 21.545 0.504 -1.255 1.00 0.00 C ATOM 1817 C GLU A 121 20.509 1.583 -1.021 1.00 0.00 C ATOM 1818 O GLU A 121 19.638 1.424 -0.170 1.00 0.00 O ATOM 1819 CB GLU A 121 22.895 1.040 -0.757 1.00 0.00 C ATOM 1820 CG GLU A 121 23.840 -0.111 -0.501 1.00 0.00 C ATOM 1821 CD GLU A 121 25.163 0.377 0.124 1.00 0.00 C ATOM 1822 OE1 GLU A 121 26.083 0.795 -0.620 1.00 0.00 O ATOM 1823 OE2 GLU A 121 25.292 0.343 1.372 1.00 0.00 O ATOM 0 H GLU A 121 22.547 0.154 -3.063 1.00 0.00 H new ATOM 0 HA GLU A 121 21.270 -0.395 -0.703 1.00 0.00 H new ATOM 0 HB2 GLU A 121 23.323 1.716 -1.497 1.00 0.00 H new ATOM 0 HB3 GLU A 121 22.753 1.616 0.157 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.366 -0.832 0.164 1.00 0.00 H new ATOM 0 HG3 GLU A 121 24.047 -0.629 -1.437 1.00 0.00 H new ATOM 1830 N ARG A 122 20.550 2.677 -1.783 1.00 0.00 N ATOM 1831 CA ARG A 122 19.626 3.777 -1.519 1.00 0.00 C ATOM 1832 C ARG A 122 18.173 3.354 -1.733 1.00 0.00 C ATOM 1833 O ARG A 122 17.326 3.767 -0.954 1.00 0.00 O ATOM 1834 CB ARG A 122 20.019 5.031 -2.301 1.00 0.00 C ATOM 1835 CG ARG A 122 21.385 5.648 -1.950 1.00 0.00 C ATOM 1836 CD ARG A 122 21.584 6.065 -0.489 1.00 0.00 C ATOM 1837 NE ARG A 122 20.561 7.021 0.000 1.00 0.00 N ATOM 1838 CZ ARG A 122 20.496 7.535 1.219 1.00 0.00 C ATOM 1839 NH1 ARG A 122 21.392 7.271 2.127 1.00 0.00 N ATOM 1840 NH2 ARG A 122 19.524 8.324 1.569 1.00 0.00 N ATOM 0 H ARG A 122 21.191 2.823 -2.563 1.00 0.00 H new ATOM 0 HA ARG A 122 19.703 4.043 -0.465 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.015 4.788 -3.364 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.250 5.788 -2.144 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.162 4.930 -2.210 1.00 0.00 H new ATOM 0 HG3 ARG A 122 21.537 6.524 -2.580 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.567 5.175 0.140 1.00 0.00 H new ATOM 0 HD3 ARG A 122 22.571 6.514 -0.379 1.00 0.00 H new ATOM 0 HE ARG A 122 19.842 7.309 -0.663 1.00 0.00 H new ATOM 0 HH11 ARG A 122 22.173 6.652 1.908 1.00 0.00 H new ATOM 0 HH12 ARG A 122 21.313 7.683 3.057 1.00 0.00 H new ATOM 0 HH21 ARG A 122 18.791 8.559 0.899 1.00 0.00 H new ATOM 0 HH22 ARG A 122 19.494 8.708 2.513 1.00 0.00 H new ATOM 1854 N VAL A 123 17.896 2.423 -2.644 1.00 0.00 N ATOM 1855 CA VAL A 123 16.575 1.797 -2.757 1.00 0.00 C ATOM 1856 C VAL A 123 16.249 0.853 -1.610 1.00 0.00 C ATOM 1857 O VAL A 123 15.219 1.035 -0.967 1.00 0.00 O ATOM 1858 CB VAL A 123 16.436 1.099 -4.123 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.292 0.088 -4.196 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.236 2.139 -5.225 1.00 0.00 C ATOM 0 H VAL A 123 18.576 2.081 -3.323 1.00 0.00 H new ATOM 0 HA VAL A 123 15.838 2.597 -2.688 1.00 0.00 H new ATOM 0 HB VAL A 123 17.364 0.544 -4.262 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.263 -0.358 -5.190 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.449 -0.693 -3.452 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.347 0.593 -3.998 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.139 1.636 -6.187 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.332 2.714 -5.023 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.094 2.810 -5.252 1.00 0.00 H new ATOM 1870 N GLU A 124 17.074 -0.149 -1.322 1.00 0.00 N ATOM 1871 CA GLU A 124 16.707 -1.157 -0.319 1.00 0.00 C ATOM 1872 C GLU A 124 16.658 -0.604 1.104 1.00 0.00 C ATOM 1873 O GLU A 124 15.895 -1.092 1.936 1.00 0.00 O ATOM 1874 CB GLU A 124 17.560 -2.418 -0.440 1.00 0.00 C ATOM 1875 CG GLU A 124 19.072 -2.242 -0.298 1.00 0.00 C ATOM 1876 CD GLU A 124 19.715 -3.466 0.380 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.097 -4.429 -0.327 1.00 0.00 O ATOM 1878 OE2 GLU A 124 19.854 -3.462 1.627 1.00 0.00 O ATOM 0 H GLU A 124 17.986 -0.289 -1.757 1.00 0.00 H new ATOM 0 HA GLU A 124 15.682 -1.451 -0.543 1.00 0.00 H new ATOM 0 HB2 GLU A 124 17.228 -3.127 0.318 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.360 -2.872 -1.411 1.00 0.00 H new ATOM 0 HG2 GLU A 124 19.517 -2.093 -1.282 1.00 0.00 H new ATOM 0 HG3 GLU A 124 19.283 -1.347 0.287 1.00 0.00 H new ATOM 1885 N ASN A 125 17.381 0.487 1.349 1.00 0.00 N ATOM 1886 CA ASN A 125 17.297 1.225 2.599 1.00 0.00 C ATOM 1887 C ASN A 125 16.077 2.176 2.667 1.00 0.00 C ATOM 1888 O ASN A 125 15.562 2.437 3.752 1.00 0.00 O ATOM 1889 CB ASN A 125 18.662 1.864 2.891 1.00 0.00 C ATOM 1890 CG ASN A 125 18.631 3.369 2.866 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.566 4.066 3.866 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.623 3.876 1.665 1.00 0.00 N ATOM 0 H ASN A 125 18.043 0.882 0.681 1.00 0.00 H new ATOM 0 HA ASN A 125 17.088 0.539 3.420 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.010 1.531 3.869 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.386 1.510 2.157 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.561 4.886 1.538 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.679 3.262 0.852 1.00 0.00 H new ATOM 1899 N LEU A 126 15.592 2.660 1.516 1.00 0.00 N ATOM 1900 CA LEU A 126 14.389 3.496 1.404 1.00 0.00 C ATOM 1901 C LEU A 126 13.103 2.682 1.527 1.00 0.00 C ATOM 1902 O LEU A 126 12.220 3.067 2.285 1.00 0.00 O ATOM 1903 CB LEU A 126 14.440 4.287 0.079 1.00 0.00 C ATOM 1904 CG LEU A 126 13.145 5.024 -0.316 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.746 6.102 0.693 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.342 5.674 -1.682 1.00 0.00 C ATOM 0 H LEU A 126 16.035 2.477 0.616 1.00 0.00 H new ATOM 0 HA LEU A 126 14.378 4.197 2.238 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.245 5.019 0.146 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.702 3.597 -0.723 1.00 0.00 H new ATOM 0 HG LEU A 126 12.344 4.286 -0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.827 6.587 0.363 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.584 5.645 1.669 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.542 6.843 0.767 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.431 6.198 -1.970 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.168 6.383 -1.632 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.568 4.906 -2.421 1.00 0.00 H new ATOM 1918 N ILE A 127 12.964 1.563 0.811 1.00 0.00 N ATOM 1919 CA ILE A 127 11.690 0.818 0.787 1.00 0.00 C ATOM 1920 C ILE A 127 11.287 0.299 2.163 1.00 0.00 C ATOM 1921 O ILE A 127 10.098 0.271 2.463 1.00 0.00 O ATOM 1922 CB ILE A 127 11.689 -0.313 -0.265 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.805 -1.353 -0.016 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.760 0.323 -1.668 1.00 0.00 C ATOM 1925 CD1 ILE A 127 12.977 -2.384 -1.136 1.00 0.00 C ATOM 0 H ILE A 127 13.706 1.152 0.244 1.00 0.00 H new ATOM 0 HA ILE A 127 10.930 1.539 0.485 1.00 0.00 H new ATOM 0 HB ILE A 127 10.763 -0.882 -0.183 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.749 -0.827 0.124 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.592 -1.879 0.915 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.760 -0.462 -2.424 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.896 0.971 -1.818 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.674 0.911 -1.755 1.00 0.00 H new ATOM 0 HD11 ILE A 127 13.781 -3.073 -0.876 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.049 -2.941 -1.263 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.224 -1.873 -2.066 1.00 0.00 H new ATOM 1937 N ALA A 128 12.246 0.000 3.039 1.00 0.00 N ATOM 1938 CA ALA A 128 11.946 -0.407 4.413 1.00 0.00 C ATOM 1939 C ALA A 128 11.331 0.730 5.267 1.00 0.00 C ATOM 1940 O ALA A 128 10.649 0.453 6.256 1.00 0.00 O ATOM 1941 CB ALA A 128 13.237 -0.959 5.031 1.00 0.00 C ATOM 0 H ALA A 128 13.242 0.032 2.821 1.00 0.00 H new ATOM 0 HA ALA A 128 11.177 -1.179 4.395 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.044 -1.271 6.057 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.582 -1.814 4.450 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.003 -0.184 5.025 1.00 0.00 H new ATOM 1947 N LYS A 129 11.535 2.002 4.876 1.00 0.00 N ATOM 1948 CA LYS A 129 10.922 3.182 5.517 1.00 0.00 C ATOM 1949 C LYS A 129 9.492 3.450 5.031 1.00 0.00 C ATOM 1950 O LYS A 129 8.649 3.855 5.834 1.00 0.00 O ATOM 1951 CB LYS A 129 11.785 4.437 5.270 1.00 0.00 C ATOM 1952 CG LYS A 129 13.229 4.326 5.785 1.00 0.00 C ATOM 1953 CD LYS A 129 14.025 5.586 5.402 1.00 0.00 C ATOM 1954 CE LYS A 129 15.521 5.493 5.747 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.778 5.480 7.219 1.00 0.00 N ATOM 0 H LYS A 129 12.141 2.243 4.092 1.00 0.00 H new ATOM 0 HA LYS A 129 10.872 2.961 6.583 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.809 4.642 4.200 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.306 5.292 5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.229 4.202 6.868 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.707 3.442 5.363 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.917 5.763 4.332 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.595 6.447 5.913 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.936 4.588 5.303 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.045 6.337 5.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.801 5.416 7.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.409 6.355 7.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.303 4.660 7.647 1.00 0.00 H new ATOM 1969 N ILE A 130 9.222 3.241 3.731 1.00 0.00 N ATOM 1970 CA ILE A 130 7.965 3.663 3.072 1.00 0.00 C ATOM 1971 C ILE A 130 6.990 2.544 2.663 1.00 0.00 C ATOM 1972 O ILE A 130 5.884 2.859 2.218 1.00 0.00 O ATOM 1973 CB ILE A 130 8.230 4.688 1.940 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.168 4.235 0.799 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.810 5.978 2.545 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.617 3.105 -0.070 1.00 0.00 C ATOM 0 H ILE A 130 9.872 2.772 3.100 1.00 0.00 H new ATOM 0 HA ILE A 130 7.410 4.166 3.863 1.00 0.00 H new ATOM 0 HB ILE A 130 7.253 4.827 1.477 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.384 5.093 0.162 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.115 3.913 1.232 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.997 6.700 1.750 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.099 6.398 3.257 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.745 5.751 3.057 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.343 2.854 -0.843 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.429 2.228 0.550 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.686 3.426 -0.537 1.00 0.00 H new ATOM 1988 N SER A 131 7.342 1.259 2.809 1.00 0.00 N ATOM 1989 CA SER A 131 6.433 0.128 2.497 1.00 0.00 C ATOM 1990 C SER A 131 5.149 0.144 3.343 1.00 0.00 C ATOM 1991 O SER A 131 4.049 0.083 2.746 1.00 0.00 O ATOM 1992 CB SER A 131 7.129 -1.214 2.671 1.00 0.00 C ATOM 1993 OG SER A 131 8.098 -1.346 1.653 1.00 0.00 O ATOM 1994 OXT SER A 131 5.238 0.186 4.593 1.00 0.00 O ATOM 0 H SER A 131 8.260 0.967 3.145 1.00 0.00 H new ATOM 0 HA SER A 131 6.152 0.259 1.452 1.00 0.00 H new ATOM 0 HB2 SER A 131 7.599 -1.273 3.653 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.405 -2.027 2.614 1.00 0.00 H new ATOM 0 HG SER A 131 8.916 -0.874 1.916 1.00 0.00 H new