USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 775 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 89 HIS : no HE2:sc= 0.00175 X(o=0.0017,f=0.037) USER MOD Set 1.2: A 119 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 80 SER OG : rot 143:sc= 1.13 USER MOD Set 2.2: A 91 TYR OH : rot 180:sc= 0.829 USER MOD Set 3.1: A 57 TYR OH : rot 180:sc= 0.0346 USER MOD Set 3.2: A 73 CYS SG : rot 171:sc= 1.58 USER MOD Set 4.1: A 28 HIS : no HD1:sc= 1.06 K(o=2.4,f=-4.6!) USER MOD Set 4.2: A 40 SER OG : rot -131:sc= 1.29 USER MOD Set 5.1: A 22 TYR OH : rot -70:sc= 0.947 USER MOD Set 5.2: A 102 HIS : no HE2:sc= -0.485 X(o=1.7,f=2.1) USER MOD Set 5.3: A 105 SER OG : rot 158:sc= 1.26 USER MOD Set 6.1: A 21 LYS NZ :NH3+ -171:sc= 1.8 (180deg=0.636) USER MOD Set 6.2: A 94 SER OG : rot -170:sc= 0.971 USER MOD Single : A 29 SER OG : rot -80:sc= 1.2 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -178:sc= 1.83 (180deg=1.78) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= -0.325 K(o=-0.33,f=-4.4!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 81:sc= 1.32 USER MOD Single : A 64 MET CE :methyl -166:sc= 0 (180deg=-0.363) USER MOD Single : A 65 GLN : amide:sc= 0.979 K(o=0.98,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 1.11 K(o=1.1,f=-0.37) USER MOD Single : A 69 CYS SG : rot 17:sc= -0.512 USER MOD Single : A 71 CYS SG : rot -110:sc= -0.521 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot -52:sc= 0.183 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 14:sc= 0.116 USER MOD Single : A 108 LYS NZ :NH3+ 156:sc= 1.43 (180deg=0.21) USER MOD Single : A 110 LYS NZ :NH3+ 159:sc= 0.899 (180deg=0.605) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 46 N ALA A 4 5.218 -2.687 3.750 1.00 10.00 N ATOM 47 CA ALA A 4 5.056 -1.577 4.679 1.00 10.00 C ATOM 48 C ALA A 4 6.431 -1.348 5.325 1.00 10.00 C ATOM 49 O ALA A 4 7.386 -2.066 5.013 1.00 10.00 O ATOM 50 CB ALA A 4 4.000 -1.923 5.737 1.00 10.00 C ATOM 0 HA ALA A 4 4.714 -0.675 4.171 1.00 10.00 H new ATOM 0 HB1 ALA A 4 3.887 -1.086 6.426 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.046 -2.121 5.248 1.00 10.00 H new ATOM 0 HB3 ALA A 4 4.315 -2.808 6.290 1.00 10.00 H new ATOM 56 N ASP A 5 6.538 -0.382 6.235 1.00 10.00 N ATOM 57 CA ASP A 5 7.775 -0.116 6.967 1.00 10.00 C ATOM 58 C ASP A 5 7.418 0.463 8.332 1.00 10.00 C ATOM 59 O ASP A 5 6.376 1.112 8.482 1.00 10.00 O ATOM 60 CB ASP A 5 8.662 0.862 6.181 1.00 10.00 C ATOM 61 CG ASP A 5 10.036 1.033 6.855 1.00 10.00 C ATOM 62 OD1 ASP A 5 10.940 0.232 6.557 1.00 10.00 O ATOM 63 OD2 ASP A 5 10.152 1.943 7.703 1.00 10.00 O ATOM 0 H ASP A 5 5.769 0.239 6.486 1.00 10.00 H new ATOM 0 HA ASP A 5 8.334 -1.043 7.097 1.00 10.00 H new ATOM 0 HB2 ASP A 5 8.796 0.497 5.163 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.166 1.830 6.110 1.00 10.00 H new ATOM 68 N LEU A 6 8.268 0.236 9.337 1.00 10.00 N ATOM 69 CA LEU A 6 8.055 0.715 10.695 1.00 10.00 C ATOM 70 C LEU A 6 7.965 2.244 10.771 1.00 10.00 C ATOM 71 O LEU A 6 7.358 2.753 11.715 1.00 10.00 O ATOM 72 CB LEU A 6 9.171 0.190 11.612 1.00 10.00 C ATOM 73 CG LEU A 6 9.242 -1.342 11.763 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.420 -1.701 12.666 1.00 10.00 C ATOM 75 CD2 LEU A 6 7.958 -1.944 12.355 1.00 10.00 C ATOM 0 H LEU A 6 9.133 -0.293 9.223 1.00 10.00 H new ATOM 0 HA LEU A 6 7.093 0.329 11.034 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.128 0.544 11.229 1.00 10.00 H new ATOM 0 HB3 LEU A 6 9.041 0.629 12.601 1.00 10.00 H new ATOM 0 HG LEU A 6 9.367 -1.760 10.764 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.476 -2.784 12.777 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.345 -1.333 12.221 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.281 -1.242 13.645 1.00 10.00 H new ATOM 0 HD21 LEU A 6 8.068 -3.025 12.437 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.780 -1.521 13.344 1.00 10.00 H new ATOM 0 HD23 LEU A 6 7.114 -1.713 11.704 1.00 10.00 H new ATOM 87 N ALA A 7 8.535 2.979 9.813 1.00 10.00 N ATOM 88 CA ALA A 7 8.384 4.424 9.726 1.00 10.00 C ATOM 89 C ALA A 7 6.972 4.831 9.281 1.00 10.00 C ATOM 90 O ALA A 7 6.493 5.892 9.677 1.00 10.00 O ATOM 91 CB ALA A 7 9.407 4.987 8.737 1.00 10.00 C ATOM 0 H ALA A 7 9.116 2.582 9.075 1.00 10.00 H new ATOM 0 HA ALA A 7 8.552 4.833 10.722 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.293 6.069 8.672 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.414 4.748 9.079 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.244 4.546 7.754 1.00 10.00 H new ATOM 97 N LEU A 8 6.318 4.013 8.444 1.00 10.00 N ATOM 98 CA LEU A 8 4.967 4.293 7.953 1.00 10.00 C ATOM 99 C LEU A 8 3.945 3.991 9.047 1.00 10.00 C ATOM 100 O LEU A 8 2.931 4.675 9.159 1.00 10.00 O ATOM 101 CB LEU A 8 4.638 3.446 6.706 1.00 10.00 C ATOM 102 CG LEU A 8 5.531 3.721 5.481 1.00 10.00 C ATOM 103 CD1 LEU A 8 5.154 2.765 4.342 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.415 5.168 4.981 1.00 10.00 C ATOM 0 H LEU A 8 6.712 3.141 8.091 1.00 10.00 H new ATOM 0 HA LEU A 8 4.922 5.347 7.679 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.721 2.391 6.969 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.599 3.624 6.428 1.00 10.00 H new ATOM 0 HG LEU A 8 6.563 3.560 5.794 1.00 10.00 H new ATOM 0 HD11 LEU A 8 5.787 2.962 3.477 1.00 10.00 H new ATOM 0 HD12 LEU A 8 5.297 1.735 4.669 1.00 10.00 H new ATOM 0 HD13 LEU A 8 4.110 2.918 4.069 1.00 10.00 H new ATOM 0 HD21 LEU A 8 6.065 5.308 4.117 1.00 10.00 H new ATOM 0 HD22 LEU A 8 4.383 5.373 4.696 1.00 10.00 H new ATOM 0 HD23 LEU A 8 5.715 5.852 5.775 1.00 10.00 H new ATOM 116 N ILE A 9 4.212 2.952 9.844 1.00 10.00 N ATOM 117 CA ILE A 9 3.379 2.557 10.970 1.00 10.00 C ATOM 118 C ILE A 9 3.402 3.710 11.993 1.00 10.00 C ATOM 119 O ILE A 9 4.488 4.078 12.456 1.00 10.00 O ATOM 120 CB ILE A 9 3.892 1.201 11.509 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.499 0.095 10.498 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.342 0.879 12.913 1.00 10.00 C ATOM 123 CD1 ILE A 9 4.325 -1.186 10.622 1.00 10.00 C ATOM 0 H ILE A 9 5.029 2.355 9.717 1.00 10.00 H new ATOM 0 HA ILE A 9 2.336 2.395 10.699 1.00 10.00 H new ATOM 0 HB ILE A 9 4.976 1.254 11.613 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.446 -0.150 10.635 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.606 0.487 9.487 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.732 -0.083 13.245 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.651 1.657 13.612 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.253 0.836 12.876 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.988 -1.910 9.880 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.378 -0.958 10.454 1.00 10.00 H new ATOM 0 HD13 ILE A 9 4.199 -1.605 11.620 1.00 10.00 H new ATOM 135 N PRO A 10 2.236 4.278 12.369 1.00 10.00 N ATOM 136 CA PRO A 10 2.183 5.456 13.223 1.00 10.00 C ATOM 137 C PRO A 10 2.796 5.130 14.579 1.00 10.00 C ATOM 138 O PRO A 10 2.609 4.033 15.113 1.00 10.00 O ATOM 139 CB PRO A 10 0.707 5.866 13.310 1.00 10.00 C ATOM 140 CG PRO A 10 -0.057 4.594 12.947 1.00 10.00 C ATOM 141 CD PRO A 10 0.890 3.865 11.994 1.00 10.00 C ATOM 0 HA PRO A 10 2.761 6.290 12.825 1.00 10.00 H new ATOM 0 HB2 PRO A 10 0.449 6.214 14.310 1.00 10.00 H new ATOM 0 HB3 PRO A 10 0.478 6.679 12.621 1.00 10.00 H new ATOM 0 HG2 PRO A 10 -0.278 3.994 13.829 1.00 10.00 H new ATOM 0 HG3 PRO A 10 -1.010 4.821 12.469 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.775 2.785 12.081 1.00 10.00 H new ATOM 0 HD3 PRO A 10 0.677 4.126 10.957 1.00 10.00 H new ATOM 149 N ASP A 11 3.525 6.083 15.154 1.00 10.00 N ATOM 150 CA ASP A 11 4.358 5.835 16.331 1.00 10.00 C ATOM 151 C ASP A 11 3.569 5.947 17.638 1.00 10.00 C ATOM 152 O ASP A 11 3.773 5.173 18.575 1.00 10.00 O ATOM 153 CB ASP A 11 5.538 6.811 16.313 1.00 10.00 C ATOM 154 CG ASP A 11 6.711 6.216 17.079 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.202 5.147 16.640 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.123 6.764 18.119 1.00 10.00 O ATOM 0 H ASP A 11 3.556 7.046 14.820 1.00 10.00 H new ATOM 0 HA ASP A 11 4.724 4.809 16.287 1.00 10.00 H new ATOM 0 HB2 ASP A 11 5.832 7.021 15.285 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.244 7.760 16.761 1.00 10.00 H new ATOM 161 N VAL A 12 2.567 6.826 17.650 1.00 10.00 N ATOM 162 CA VAL A 12 1.645 7.074 18.748 1.00 10.00 C ATOM 163 C VAL A 12 0.272 7.256 18.099 1.00 10.00 C ATOM 164 O VAL A 12 0.168 7.973 17.100 1.00 10.00 O ATOM 165 CB VAL A 12 2.080 8.343 19.514 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.162 8.647 20.708 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.521 8.234 20.023 1.00 10.00 C ATOM 0 H VAL A 12 2.369 7.417 16.843 1.00 10.00 H new ATOM 0 HA VAL A 12 1.626 6.259 19.471 1.00 10.00 H new ATOM 0 HB VAL A 12 2.008 9.158 18.794 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.509 9.548 21.214 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.143 8.800 20.354 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.182 7.809 21.405 1.00 10.00 H new ATOM 0 HG21 VAL A 12 3.789 9.146 20.556 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.605 7.382 20.697 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.196 8.096 19.178 1.00 10.00 H new ATOM 177 N ASP A 13 -0.758 6.615 18.645 1.00 10.00 N ATOM 178 CA ASP A 13 -2.138 6.827 18.211 1.00 10.00 C ATOM 179 C ASP A 13 -3.041 6.599 19.418 1.00 10.00 C ATOM 180 O ASP A 13 -3.256 5.458 19.848 1.00 10.00 O ATOM 181 CB ASP A 13 -2.519 5.928 17.024 1.00 10.00 C ATOM 182 CG ASP A 13 -3.784 6.456 16.313 1.00 10.00 C ATOM 183 OD1 ASP A 13 -4.725 6.907 17.000 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.805 6.413 15.067 1.00 10.00 O ATOM 0 H ASP A 13 -0.661 5.935 19.399 1.00 10.00 H new ATOM 0 HA ASP A 13 -2.258 7.846 17.844 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.691 5.884 16.316 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -2.693 4.911 17.375 1.00 10.00 H new ATOM 189 N ILE A 14 -3.444 7.703 20.051 1.00 10.00 N ATOM 190 CA ILE A 14 -4.204 7.752 21.293 1.00 10.00 C ATOM 191 C ILE A 14 -5.237 8.883 21.172 1.00 10.00 C ATOM 192 O ILE A 14 -5.105 9.748 20.307 1.00 10.00 O ATOM 193 CB ILE A 14 -3.253 7.944 22.507 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.541 9.322 22.509 1.00 10.00 C ATOM 195 CG2 ILE A 14 -2.225 6.798 22.596 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.652 9.575 23.734 1.00 10.00 C ATOM 0 H ILE A 14 -3.236 8.633 19.688 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.729 6.812 21.464 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.885 7.917 23.395 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.931 9.403 21.610 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -3.295 10.107 22.454 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.573 6.960 23.455 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.748 5.848 22.711 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.626 6.775 21.686 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -1.193 10.561 23.653 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.258 9.530 24.639 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.872 8.815 23.781 1.00 10.00 H new ATOM 250 N VAL A 19 -9.230 10.874 30.659 1.00 10.00 N ATOM 251 CA VAL A 19 -8.797 9.564 31.151 1.00 10.00 C ATOM 252 C VAL A 19 -9.134 8.488 30.112 1.00 10.00 C ATOM 253 O VAL A 19 -10.296 8.354 29.720 1.00 10.00 O ATOM 254 CB VAL A 19 -9.447 9.226 32.514 1.00 10.00 C ATOM 255 CG1 VAL A 19 -8.823 7.943 33.103 1.00 10.00 C ATOM 256 CG2 VAL A 19 -9.325 10.367 33.536 1.00 10.00 C ATOM 0 HA VAL A 19 -7.718 9.594 31.304 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.509 9.074 32.319 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -9.290 7.718 34.062 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.984 7.112 32.417 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.753 8.092 33.247 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -9.799 10.070 34.471 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -8.272 10.583 33.716 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -9.817 11.258 33.147 1.00 10.00 H new ATOM 266 N PHE A 20 -8.145 7.690 29.692 1.00 10.00 N ATOM 267 CA PHE A 20 -8.368 6.496 28.886 1.00 10.00 C ATOM 268 C PHE A 20 -7.185 5.535 29.047 1.00 10.00 C ATOM 269 O PHE A 20 -6.057 5.968 29.291 1.00 10.00 O ATOM 270 CB PHE A 20 -8.581 6.871 27.407 1.00 10.00 C ATOM 271 CG PHE A 20 -9.182 5.737 26.599 1.00 10.00 C ATOM 272 CD1 PHE A 20 -10.486 5.285 26.883 1.00 10.00 C ATOM 273 CD2 PHE A 20 -8.426 5.097 25.602 1.00 10.00 C ATOM 274 CE1 PHE A 20 -11.019 4.184 26.189 1.00 10.00 C ATOM 275 CE2 PHE A 20 -8.948 3.979 24.932 1.00 10.00 C ATOM 276 CZ PHE A 20 -10.246 3.524 25.219 1.00 10.00 C ATOM 0 H PHE A 20 -7.163 7.861 29.906 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.272 5.996 29.233 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -9.235 7.741 27.347 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -7.626 7.159 26.968 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -11.078 5.785 27.635 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -7.442 5.466 25.351 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -12.022 3.846 26.402 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -8.350 3.467 24.193 1.00 10.00 H new ATOM 0 HZ PHE A 20 -10.648 2.669 24.695 1.00 10.00 H new ATOM 286 N LYS A 21 -7.440 4.222 28.972 1.00 10.00 N ATOM 287 CA LYS A 21 -6.376 3.210 28.992 1.00 10.00 C ATOM 288 C LYS A 21 -5.518 3.280 27.724 1.00 10.00 C ATOM 289 O LYS A 21 -5.916 3.849 26.714 1.00 10.00 O ATOM 290 CB LYS A 21 -6.939 1.794 29.192 1.00 10.00 C ATOM 291 CG LYS A 21 -7.436 1.606 30.637 1.00 10.00 C ATOM 292 CD LYS A 21 -7.682 0.141 31.032 1.00 10.00 C ATOM 293 CE LYS A 21 -6.475 -0.797 30.847 1.00 10.00 C ATOM 294 NZ LYS A 21 -5.231 -0.328 31.503 1.00 10.00 N ATOM 0 H LYS A 21 -8.380 3.834 28.896 1.00 10.00 H new ATOM 0 HA LYS A 21 -5.738 3.434 29.847 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.759 1.621 28.495 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.169 1.056 28.968 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -6.704 2.037 31.320 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -8.362 2.166 30.767 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -7.990 0.110 32.077 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.515 -0.243 30.443 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -6.731 -1.781 31.241 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -6.285 -0.920 29.781 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -4.435 -0.929 31.207 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -5.043 0.657 31.227 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -5.341 -0.383 32.536 1.00 10.00 H new ATOM 308 N TYR A 22 -4.349 2.644 27.767 1.00 10.00 N ATOM 309 CA TYR A 22 -3.474 2.483 26.610 1.00 10.00 C ATOM 310 C TYR A 22 -2.653 1.200 26.774 1.00 10.00 C ATOM 311 O TYR A 22 -2.604 0.623 27.867 1.00 10.00 O ATOM 312 CB TYR A 22 -2.587 3.733 26.432 1.00 10.00 C ATOM 313 CG TYR A 22 -1.193 3.634 27.021 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.986 3.816 28.399 1.00 10.00 C ATOM 315 CD2 TYR A 22 -0.103 3.330 26.184 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.306 3.710 28.941 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.193 3.226 26.715 1.00 10.00 C ATOM 318 CZ TYR A 22 1.404 3.434 28.095 1.00 10.00 C ATOM 319 OH TYR A 22 2.664 3.390 28.599 1.00 10.00 O ATOM 0 H TYR A 22 -3.979 2.221 28.618 1.00 10.00 H new ATOM 0 HA TYR A 22 -4.067 2.387 25.700 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.498 3.945 25.367 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -3.094 4.585 26.885 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.823 4.038 29.044 1.00 10.00 H new ATOM 0 HD2 TYR A 22 -0.264 3.176 25.127 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.460 3.839 30.002 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.025 2.988 26.070 1.00 10.00 H new ATOM 0 HH TYR A 22 2.948 4.294 28.850 1.00 10.00 H new ATOM 329 N VAL A 23 -2.007 0.750 25.701 1.00 10.00 N ATOM 330 CA VAL A 23 -1.094 -0.386 25.703 1.00 10.00 C ATOM 331 C VAL A 23 0.175 0.005 24.926 1.00 10.00 C ATOM 332 O VAL A 23 0.130 0.810 23.989 1.00 10.00 O ATOM 333 CB VAL A 23 -1.844 -1.646 25.199 1.00 10.00 C ATOM 334 CG1 VAL A 23 -2.393 -1.491 23.777 1.00 10.00 C ATOM 335 CG2 VAL A 23 -1.013 -2.933 25.287 1.00 10.00 C ATOM 0 H VAL A 23 -2.108 1.179 24.781 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.751 -0.652 26.703 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.684 -1.741 25.887 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.907 -2.407 23.483 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -3.093 -0.656 23.746 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.570 -1.300 23.088 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.602 -3.772 24.918 1.00 10.00 H new ATOM 0 HG22 VAL A 23 -0.113 -2.827 24.682 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.733 -3.115 26.325 1.00 10.00 H new ATOM 345 N LEU A 24 1.311 -0.567 25.337 1.00 10.00 N ATOM 346 CA LEU A 24 2.624 -0.387 24.732 1.00 10.00 C ATOM 347 C LEU A 24 2.966 -1.720 24.075 1.00 10.00 C ATOM 348 O LEU A 24 2.971 -2.754 24.750 1.00 10.00 O ATOM 349 CB LEU A 24 3.644 -0.019 25.830 1.00 10.00 C ATOM 350 CG LEU A 24 5.109 0.055 25.348 1.00 10.00 C ATOM 351 CD1 LEU A 24 5.310 1.099 24.245 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.021 0.375 26.539 1.00 10.00 C ATOM 0 H LEU A 24 1.336 -1.197 26.139 1.00 10.00 H new ATOM 0 HA LEU A 24 2.641 0.416 23.996 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.367 0.945 26.257 1.00 10.00 H new ATOM 0 HB3 LEU A 24 3.576 -0.754 26.632 1.00 10.00 H new ATOM 0 HG LEU A 24 5.366 -0.915 24.923 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.357 1.111 23.942 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.687 0.847 23.387 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.030 2.083 24.620 1.00 10.00 H new ATOM 0 HD21 LEU A 24 7.056 0.428 26.201 1.00 10.00 H new ATOM 0 HD22 LEU A 24 5.731 1.332 26.972 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.925 -0.408 27.292 1.00 10.00 H new ATOM 364 N ILE A 25 3.223 -1.711 22.772 1.00 10.00 N ATOM 365 CA ILE A 25 3.395 -2.928 21.989 1.00 10.00 C ATOM 366 C ILE A 25 4.703 -2.766 21.219 1.00 10.00 C ATOM 367 O ILE A 25 4.971 -1.689 20.681 1.00 10.00 O ATOM 368 CB ILE A 25 2.170 -3.143 21.061 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.829 -3.188 21.837 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.330 -4.440 20.246 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.411 -3.067 20.940 1.00 10.00 C ATOM 0 H ILE A 25 3.318 -0.854 22.227 1.00 10.00 H new ATOM 0 HA ILE A 25 3.451 -3.818 22.616 1.00 10.00 H new ATOM 0 HB ILE A 25 2.137 -2.283 20.392 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.773 -4.124 22.393 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.816 -2.381 22.569 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.461 -4.574 19.601 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.230 -4.377 19.634 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.412 -5.289 20.925 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.310 -3.107 21.555 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.380 -2.119 20.403 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.424 -3.889 20.225 1.00 10.00 H new ATOM 383 N ARG A 26 5.516 -3.816 21.168 1.00 10.00 N ATOM 384 CA ARG A 26 6.675 -3.885 20.297 1.00 10.00 C ATOM 385 C ARG A 26 6.211 -4.575 19.028 1.00 10.00 C ATOM 386 O ARG A 26 5.546 -5.606 19.105 1.00 10.00 O ATOM 387 CB ARG A 26 7.804 -4.638 21.016 1.00 10.00 C ATOM 388 CG ARG A 26 9.102 -4.763 20.199 1.00 10.00 C ATOM 389 CD ARG A 26 10.232 -5.236 21.128 1.00 10.00 C ATOM 390 NE ARG A 26 11.518 -5.458 20.432 1.00 10.00 N ATOM 391 CZ ARG A 26 12.427 -4.524 20.122 1.00 10.00 C ATOM 392 NH1 ARG A 26 12.201 -3.234 20.313 1.00 10.00 N ATOM 393 NH2 ARG A 26 13.595 -4.905 19.597 1.00 10.00 N ATOM 0 H ARG A 26 5.384 -4.651 21.739 1.00 10.00 H new ATOM 0 HA ARG A 26 7.078 -2.905 20.044 1.00 10.00 H new ATOM 0 HB2 ARG A 26 8.026 -4.128 21.953 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.452 -5.637 21.273 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.966 -5.470 19.381 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.359 -3.803 19.751 1.00 10.00 H new ATOM 0 HD2 ARG A 26 10.378 -4.496 21.915 1.00 10.00 H new ATOM 0 HD3 ARG A 26 9.927 -6.163 21.614 1.00 10.00 H new ATOM 0 HE ARG A 26 11.734 -6.417 20.161 1.00 10.00 H new ATOM 0 HH11 ARG A 26 11.313 -2.925 20.707 1.00 10.00 H new ATOM 0 HH12 ARG A 26 12.915 -2.549 20.066 1.00 10.00 H new ATOM 0 HH21 ARG A 26 13.784 -5.895 19.438 1.00 10.00 H new ATOM 0 HH22 ARG A 26 14.298 -4.206 19.355 1.00 10.00 H new ATOM 407 N VAL A 27 6.536 -4.008 17.874 1.00 10.00 N ATOM 408 CA VAL A 27 6.251 -4.568 16.570 1.00 10.00 C ATOM 409 C VAL A 27 7.570 -5.035 15.971 1.00 10.00 C ATOM 410 O VAL A 27 8.601 -4.376 16.147 1.00 10.00 O ATOM 411 CB VAL A 27 5.546 -3.539 15.664 1.00 10.00 C ATOM 412 CG1 VAL A 27 4.029 -3.624 15.844 1.00 10.00 C ATOM 413 CG2 VAL A 27 6.005 -2.079 15.843 1.00 10.00 C ATOM 0 H VAL A 27 7.023 -3.113 17.824 1.00 10.00 H new ATOM 0 HA VAL A 27 5.567 -5.412 16.661 1.00 10.00 H new ATOM 0 HB VAL A 27 5.837 -3.816 14.651 1.00 10.00 H new ATOM 0 HG11 VAL A 27 3.544 -2.892 15.198 1.00 10.00 H new ATOM 0 HG12 VAL A 27 3.687 -4.624 15.579 1.00 10.00 H new ATOM 0 HG13 VAL A 27 3.774 -3.416 16.883 1.00 10.00 H new ATOM 0 HG21 VAL A 27 5.449 -1.436 15.161 1.00 10.00 H new ATOM 0 HG22 VAL A 27 5.821 -1.763 16.870 1.00 10.00 H new ATOM 0 HG23 VAL A 27 7.070 -2.003 15.625 1.00 10.00 H new ATOM 423 N HIS A 28 7.524 -6.142 15.239 1.00 10.00 N ATOM 424 CA HIS A 28 8.649 -6.773 14.572 1.00 10.00 C ATOM 425 C HIS A 28 8.272 -6.838 13.099 1.00 10.00 C ATOM 426 O HIS A 28 7.212 -7.367 12.770 1.00 10.00 O ATOM 427 CB HIS A 28 8.859 -8.188 15.130 1.00 10.00 C ATOM 428 CG HIS A 28 8.982 -8.255 16.631 1.00 10.00 C ATOM 429 ND1 HIS A 28 10.062 -7.843 17.376 1.00 10.00 N ATOM 430 CD2 HIS A 28 8.053 -8.758 17.504 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.800 -8.114 18.663 1.00 10.00 C ATOM 432 NE2 HIS A 28 8.587 -8.659 18.798 1.00 10.00 N ATOM 0 H HIS A 28 6.651 -6.648 15.089 1.00 10.00 H new ATOM 0 HA HIS A 28 9.575 -6.219 14.724 1.00 10.00 H new ATOM 0 HB2 HIS A 28 8.024 -8.816 14.818 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.760 -8.611 14.685 1.00 10.00 H new ATOM 0 HD2 HIS A 28 7.084 -9.158 17.243 1.00 10.00 H new ATOM 0 HE1 HIS A 28 10.478 -7.918 19.481 1.00 10.00 H new ATOM 0 HE2 HIS A 28 8.139 -8.946 19.668 1.00 10.00 H new ATOM 440 N SER A 29 9.084 -6.251 12.223 1.00 10.00 N ATOM 441 CA SER A 29 8.764 -6.158 10.807 1.00 10.00 C ATOM 442 C SER A 29 8.974 -7.499 10.095 1.00 10.00 C ATOM 443 O SER A 29 9.854 -8.280 10.458 1.00 10.00 O ATOM 444 CB SER A 29 9.548 -5.008 10.158 1.00 10.00 C ATOM 445 OG SER A 29 10.947 -5.125 10.329 1.00 10.00 O ATOM 0 H SER A 29 9.977 -5.829 12.476 1.00 10.00 H new ATOM 0 HA SER A 29 7.704 -5.926 10.702 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.320 -4.976 9.093 1.00 10.00 H new ATOM 0 HB3 SER A 29 9.214 -4.062 10.584 1.00 10.00 H new ATOM 0 HG SER A 29 11.194 -4.817 11.226 1.00 10.00 H new ATOM 451 N ALA A 30 8.152 -7.742 9.076 1.00 10.00 N ATOM 452 CA ALA A 30 8.262 -8.805 8.088 1.00 10.00 C ATOM 453 C ALA A 30 7.404 -8.377 6.884 1.00 10.00 C ATOM 454 O ALA A 30 6.333 -8.945 6.651 1.00 10.00 O ATOM 455 CB ALA A 30 7.803 -10.139 8.677 1.00 10.00 C ATOM 0 H ALA A 30 7.333 -7.157 8.910 1.00 10.00 H new ATOM 0 HA ALA A 30 9.295 -8.955 7.776 1.00 10.00 H new ATOM 0 HB1 ALA A 30 7.893 -10.920 7.922 1.00 10.00 H new ATOM 0 HB2 ALA A 30 8.425 -10.391 9.536 1.00 10.00 H new ATOM 0 HB3 ALA A 30 6.763 -10.058 8.993 1.00 10.00 H new ATOM 461 N PRO A 31 7.788 -7.289 6.187 1.00 10.00 N ATOM 462 CA PRO A 31 6.960 -6.656 5.166 1.00 10.00 C ATOM 463 C PRO A 31 6.530 -7.664 4.099 1.00 10.00 C ATOM 464 O PRO A 31 7.325 -8.519 3.694 1.00 10.00 O ATOM 465 CB PRO A 31 7.795 -5.514 4.579 1.00 10.00 C ATOM 466 CG PRO A 31 8.887 -5.264 5.621 1.00 10.00 C ATOM 467 CD PRO A 31 9.071 -6.621 6.298 1.00 10.00 C ATOM 0 HA PRO A 31 6.034 -6.269 5.591 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.222 -5.789 3.615 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.190 -4.622 4.417 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.811 -4.922 5.156 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.588 -4.498 6.337 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.857 -7.198 5.811 1.00 10.00 H new ATOM 0 HD3 PRO A 31 9.362 -6.502 7.342 1.00 10.00 H new ATOM 475 N ARG A 32 5.279 -7.565 3.630 1.00 10.00 N ATOM 476 CA ARG A 32 4.661 -8.512 2.688 1.00 10.00 C ATOM 477 C ARG A 32 4.839 -9.992 3.103 1.00 10.00 C ATOM 478 O ARG A 32 4.789 -10.871 2.239 1.00 10.00 O ATOM 479 CB ARG A 32 5.172 -8.210 1.263 1.00 10.00 C ATOM 480 CG ARG A 32 4.223 -8.687 0.143 1.00 10.00 C ATOM 481 CD ARG A 32 4.961 -9.441 -0.972 1.00 10.00 C ATOM 482 NE ARG A 32 5.451 -10.743 -0.490 1.00 10.00 N ATOM 483 CZ ARG A 32 6.210 -11.615 -1.160 1.00 10.00 C ATOM 484 NH1 ARG A 32 6.629 -11.342 -2.396 1.00 10.00 N ATOM 485 NH2 ARG A 32 6.552 -12.763 -0.583 1.00 10.00 N ATOM 0 H ARG A 32 4.653 -6.807 3.901 1.00 10.00 H new ATOM 0 HA ARG A 32 3.581 -8.366 2.707 1.00 10.00 H new ATOM 0 HB2 ARG A 32 5.325 -7.135 1.163 1.00 10.00 H new ATOM 0 HB3 ARG A 32 6.144 -8.684 1.128 1.00 10.00 H new ATOM 0 HG2 ARG A 32 3.458 -9.335 0.571 1.00 10.00 H new ATOM 0 HG3 ARG A 32 3.709 -7.826 -0.284 1.00 10.00 H new ATOM 0 HD2 ARG A 32 4.292 -9.591 -1.820 1.00 10.00 H new ATOM 0 HD3 ARG A 32 5.799 -8.842 -1.329 1.00 10.00 H new ATOM 0 HE ARG A 32 5.182 -11.008 0.458 1.00 10.00 H new ATOM 0 HH11 ARG A 32 6.371 -10.460 -2.839 1.00 10.00 H new ATOM 0 HH12 ARG A 32 7.208 -12.015 -2.898 1.00 10.00 H new ATOM 0 HH21 ARG A 32 6.235 -12.972 0.364 1.00 10.00 H new ATOM 0 HH22 ARG A 32 7.131 -13.435 -1.087 1.00 10.00 H new ATOM 499 N SER A 33 5.090 -10.272 4.383 1.00 10.00 N ATOM 500 CA SER A 33 5.460 -11.588 4.898 1.00 10.00 C ATOM 501 C SER A 33 6.596 -12.251 4.092 1.00 10.00 C ATOM 502 O SER A 33 6.581 -13.466 3.894 1.00 10.00 O ATOM 503 CB SER A 33 4.202 -12.460 5.035 1.00 10.00 C ATOM 504 OG SER A 33 3.219 -11.808 5.824 1.00 10.00 O ATOM 0 H SER A 33 5.039 -9.562 5.114 1.00 10.00 H new ATOM 0 HA SER A 33 5.885 -11.466 5.894 1.00 10.00 H new ATOM 0 HB2 SER A 33 3.796 -12.678 4.047 1.00 10.00 H new ATOM 0 HB3 SER A 33 4.464 -13.415 5.489 1.00 10.00 H new ATOM 0 HG SER A 33 2.426 -12.379 5.897 1.00 10.00 H new ATOM 510 N GLY A 34 7.570 -11.475 3.591 1.00 10.00 N ATOM 511 CA GLY A 34 8.681 -12.044 2.829 1.00 10.00 C ATOM 512 C GLY A 34 9.832 -11.096 2.483 1.00 10.00 C ATOM 513 O GLY A 34 10.866 -11.577 2.023 1.00 10.00 O ATOM 0 H GLY A 34 7.607 -10.462 3.701 1.00 10.00 H new ATOM 0 HA2 GLY A 34 9.088 -12.882 3.395 1.00 10.00 H new ATOM 0 HA3 GLY A 34 8.283 -12.451 1.899 1.00 10.00 H new ATOM 517 N ALA A 35 9.688 -9.775 2.658 1.00 10.00 N ATOM 518 CA ALA A 35 10.774 -8.834 2.391 1.00 10.00 C ATOM 519 C ALA A 35 11.959 -9.080 3.348 1.00 10.00 C ATOM 520 O ALA A 35 11.736 -9.477 4.494 1.00 10.00 O ATOM 521 CB ALA A 35 10.260 -7.399 2.538 1.00 10.00 C ATOM 0 H ALA A 35 8.826 -9.338 2.984 1.00 10.00 H new ATOM 0 HA ALA A 35 11.127 -8.986 1.371 1.00 10.00 H new ATOM 0 HB1 ALA A 35 11.072 -6.700 2.338 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.451 -7.228 1.828 1.00 10.00 H new ATOM 0 HB3 ALA A 35 9.891 -7.247 3.552 1.00 10.00 H new ATOM 527 N PRO A 36 13.206 -8.796 2.927 1.00 10.00 N ATOM 528 CA PRO A 36 14.413 -8.996 3.729 1.00 10.00 C ATOM 529 C PRO A 36 14.599 -7.872 4.770 1.00 10.00 C ATOM 530 O PRO A 36 15.584 -7.133 4.732 1.00 10.00 O ATOM 531 CB PRO A 36 15.547 -9.096 2.698 1.00 10.00 C ATOM 532 CG PRO A 36 15.086 -8.149 1.593 1.00 10.00 C ATOM 533 CD PRO A 36 13.573 -8.367 1.582 1.00 10.00 C ATOM 0 HA PRO A 36 14.375 -9.896 4.342 1.00 10.00 H new ATOM 0 HB2 PRO A 36 16.505 -8.790 3.119 1.00 10.00 H new ATOM 0 HB3 PRO A 36 15.671 -10.115 2.331 1.00 10.00 H new ATOM 0 HG2 PRO A 36 15.345 -7.113 1.812 1.00 10.00 H new ATOM 0 HG3 PRO A 36 15.539 -8.395 0.632 1.00 10.00 H new ATOM 0 HD2 PRO A 36 13.051 -7.449 1.312 1.00 10.00 H new ATOM 0 HD3 PRO A 36 13.295 -9.121 0.845 1.00 10.00 H new ATOM 541 N ALA A 37 13.646 -7.724 5.693 1.00 10.00 N ATOM 542 CA ALA A 37 13.704 -6.787 6.809 1.00 10.00 C ATOM 543 C ALA A 37 13.115 -7.465 8.046 1.00 10.00 C ATOM 544 O ALA A 37 12.121 -8.185 7.935 1.00 10.00 O ATOM 545 CB ALA A 37 12.921 -5.516 6.460 1.00 10.00 C ATOM 0 H ALA A 37 12.786 -8.273 5.681 1.00 10.00 H new ATOM 0 HA ALA A 37 14.737 -6.503 7.012 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.967 -4.819 7.297 1.00 10.00 H new ATOM 0 HB2 ALA A 37 13.357 -5.051 5.576 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.881 -5.773 6.259 1.00 10.00 H new ATOM 551 N ALA A 38 13.742 -7.234 9.203 1.00 10.00 N ATOM 552 CA ALA A 38 13.384 -7.842 10.485 1.00 10.00 C ATOM 553 C ALA A 38 13.725 -6.902 11.653 1.00 10.00 C ATOM 554 O ALA A 38 14.046 -7.348 12.758 1.00 10.00 O ATOM 555 CB ALA A 38 14.090 -9.201 10.611 1.00 10.00 C ATOM 0 H ALA A 38 14.537 -6.599 9.274 1.00 10.00 H new ATOM 0 HA ALA A 38 12.307 -8.008 10.525 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.828 -9.660 11.564 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.774 -9.852 9.796 1.00 10.00 H new ATOM 0 HB3 ALA A 38 15.169 -9.056 10.563 1.00 10.00 H new ATOM 561 N GLU A 39 13.716 -5.590 11.399 1.00 10.00 N ATOM 562 CA GLU A 39 13.868 -4.568 12.434 1.00 10.00 C ATOM 563 C GLU A 39 12.622 -4.562 13.330 1.00 10.00 C ATOM 564 O GLU A 39 11.580 -5.104 12.952 1.00 10.00 O ATOM 565 CB GLU A 39 14.079 -3.189 11.782 1.00 10.00 C ATOM 566 CG GLU A 39 15.406 -3.106 11.009 1.00 10.00 C ATOM 567 CD GLU A 39 15.659 -1.690 10.449 1.00 10.00 C ATOM 568 OE1 GLU A 39 16.243 -0.865 11.182 1.00 10.00 O ATOM 569 OE2 GLU A 39 15.286 -1.434 9.288 1.00 10.00 O ATOM 0 H GLU A 39 13.602 -5.206 10.461 1.00 10.00 H new ATOM 0 HA GLU A 39 14.741 -4.793 13.047 1.00 10.00 H new ATOM 0 HB2 GLU A 39 13.252 -2.980 11.103 1.00 10.00 H new ATOM 0 HB3 GLU A 39 14.061 -2.419 12.553 1.00 10.00 H new ATOM 0 HG2 GLU A 39 16.228 -3.388 11.667 1.00 10.00 H new ATOM 0 HG3 GLU A 39 15.394 -3.824 10.189 1.00 10.00 H new ATOM 576 N SER A 40 12.696 -3.915 14.497 1.00 10.00 N ATOM 577 CA SER A 40 11.584 -3.785 15.437 1.00 10.00 C ATOM 578 C SER A 40 11.555 -2.371 16.028 1.00 10.00 C ATOM 579 O SER A 40 12.574 -1.682 16.034 1.00 10.00 O ATOM 580 CB SER A 40 11.735 -4.809 16.570 1.00 10.00 C ATOM 581 OG SER A 40 11.982 -6.126 16.101 1.00 10.00 O ATOM 0 H SER A 40 13.549 -3.458 14.819 1.00 10.00 H new ATOM 0 HA SER A 40 10.652 -3.970 14.903 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.553 -4.503 17.222 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.828 -4.809 17.175 1.00 10.00 H new ATOM 0 HG SER A 40 11.377 -6.752 16.551 1.00 10.00 H new ATOM 587 N LYS A 41 10.405 -1.957 16.566 1.00 10.00 N ATOM 588 CA LYS A 41 10.246 -0.724 17.345 1.00 10.00 C ATOM 589 C LYS A 41 9.082 -0.882 18.322 1.00 10.00 C ATOM 590 O LYS A 41 8.351 -1.866 18.234 1.00 10.00 O ATOM 591 CB LYS A 41 10.054 0.516 16.441 1.00 10.00 C ATOM 592 CG LYS A 41 8.671 0.645 15.768 1.00 10.00 C ATOM 593 CD LYS A 41 8.459 2.062 15.215 1.00 10.00 C ATOM 594 CE LYS A 41 7.006 2.256 14.761 1.00 10.00 C ATOM 595 NZ LYS A 41 6.759 3.639 14.297 1.00 10.00 N ATOM 0 H LYS A 41 9.536 -2.483 16.470 1.00 10.00 H new ATOM 0 HA LYS A 41 11.165 -0.556 17.907 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.232 1.410 17.039 1.00 10.00 H new ATOM 0 HB3 LYS A 41 10.816 0.497 15.662 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.587 -0.081 14.960 1.00 10.00 H new ATOM 0 HG3 LYS A 41 7.888 0.411 16.489 1.00 10.00 H new ATOM 0 HD2 LYS A 41 8.707 2.797 15.980 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.133 2.235 14.376 1.00 10.00 H new ATOM 0 HE2 LYS A 41 6.779 1.556 13.957 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.333 2.023 15.586 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 5.759 3.742 14.030 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 6.984 4.307 15.062 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.360 3.841 13.473 1.00 10.00 H new ATOM 609 N GLU A 42 8.850 0.109 19.176 1.00 10.00 N ATOM 610 CA GLU A 42 7.649 0.177 19.999 1.00 10.00 C ATOM 611 C GLU A 42 6.622 1.075 19.310 1.00 10.00 C ATOM 612 O GLU A 42 6.978 1.957 18.524 1.00 10.00 O ATOM 613 CB GLU A 42 7.978 0.731 21.397 1.00 10.00 C ATOM 614 CG GLU A 42 8.560 -0.325 22.346 1.00 10.00 C ATOM 615 CD GLU A 42 9.974 -0.786 21.953 1.00 10.00 C ATOM 616 OE1 GLU A 42 10.927 0.006 22.091 1.00 10.00 O ATOM 617 OE2 GLU A 42 10.114 -1.942 21.495 1.00 10.00 O ATOM 0 H GLU A 42 9.491 0.889 19.317 1.00 10.00 H new ATOM 0 HA GLU A 42 7.241 -0.827 20.119 1.00 10.00 H new ATOM 0 HB2 GLU A 42 8.689 1.551 21.297 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.072 1.146 21.838 1.00 10.00 H new ATOM 0 HG2 GLU A 42 8.586 0.081 23.357 1.00 10.00 H new ATOM 0 HG3 GLU A 42 7.897 -1.190 22.367 1.00 10.00 H new ATOM 624 N ILE A 43 5.356 0.919 19.688 1.00 10.00 N ATOM 625 CA ILE A 43 4.244 1.793 19.336 1.00 10.00 C ATOM 626 C ILE A 43 3.369 1.989 20.580 1.00 10.00 C ATOM 627 O ILE A 43 3.228 1.077 21.398 1.00 10.00 O ATOM 628 CB ILE A 43 3.432 1.222 18.145 1.00 10.00 C ATOM 629 CG1 ILE A 43 2.998 -0.249 18.342 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.218 1.401 16.837 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.021 -0.774 17.284 1.00 10.00 C ATOM 0 H ILE A 43 5.065 0.140 20.278 1.00 10.00 H new ATOM 0 HA ILE A 43 4.625 2.760 19.008 1.00 10.00 H new ATOM 0 HB ILE A 43 2.506 1.794 18.091 1.00 10.00 H new ATOM 0 HG12 ILE A 43 3.887 -0.879 18.341 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.537 -0.349 19.325 1.00 10.00 H new ATOM 0 HG21 ILE A 43 3.639 0.997 16.006 1.00 10.00 H new ATOM 0 HG22 ILE A 43 4.405 2.461 16.667 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.168 0.872 16.908 1.00 10.00 H new ATOM 0 HD11 ILE A 43 1.772 -1.813 17.502 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.112 -0.172 17.298 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.483 -0.711 16.299 1.00 10.00 H new ATOM 643 N VAL A 44 2.759 3.167 20.703 1.00 10.00 N ATOM 644 CA VAL A 44 1.854 3.515 21.799 1.00 10.00 C ATOM 645 C VAL A 44 0.450 3.551 21.192 1.00 10.00 C ATOM 646 O VAL A 44 0.242 4.247 20.189 1.00 10.00 O ATOM 647 CB VAL A 44 2.272 4.877 22.403 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.422 5.274 23.617 1.00 10.00 C ATOM 649 CG2 VAL A 44 3.741 4.895 22.859 1.00 10.00 C ATOM 0 H VAL A 44 2.882 3.923 20.029 1.00 10.00 H new ATOM 0 HA VAL A 44 1.885 2.795 22.616 1.00 10.00 H new ATOM 0 HB VAL A 44 2.120 5.587 21.590 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.760 6.237 23.999 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.376 5.348 23.320 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.525 4.519 24.396 1.00 10.00 H new ATOM 0 HG21 VAL A 44 3.981 5.874 23.275 1.00 10.00 H new ATOM 0 HG22 VAL A 44 3.895 4.130 23.620 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.389 4.694 22.006 1.00 10.00 H new ATOM 659 N ARG A 45 -0.498 2.793 21.747 1.00 10.00 N ATOM 660 CA ARG A 45 -1.842 2.622 21.191 1.00 10.00 C ATOM 661 C ARG A 45 -2.861 2.847 22.302 1.00 10.00 C ATOM 662 O ARG A 45 -2.678 2.331 23.403 1.00 10.00 O ATOM 663 CB ARG A 45 -2.001 1.195 20.631 1.00 10.00 C ATOM 664 CG ARG A 45 -1.080 0.785 19.471 1.00 10.00 C ATOM 665 CD ARG A 45 -1.437 1.456 18.140 1.00 10.00 C ATOM 666 NE ARG A 45 -0.726 2.728 18.013 1.00 10.00 N ATOM 667 CZ ARG A 45 0.210 3.028 17.114 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.376 2.341 15.987 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.038 4.015 17.386 1.00 10.00 N ATOM 0 H ARG A 45 -0.351 2.271 22.611 1.00 10.00 H new ATOM 0 HA ARG A 45 -2.000 3.338 20.384 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.845 0.492 21.450 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -3.033 1.076 20.301 1.00 10.00 H new ATOM 0 HG2 ARG A 45 -0.051 1.034 19.730 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -1.125 -0.297 19.347 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -1.175 0.799 17.311 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.513 1.624 18.085 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.972 3.459 18.680 1.00 10.00 H new ATOM 0 HH11 ARG A 45 -0.228 1.546 15.781 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.108 2.610 15.329 1.00 10.00 H new ATOM 0 HH21 ARG A 45 0.952 4.526 18.265 1.00 10.00 H new ATOM 0 HH22 ARG A 45 1.766 4.269 16.718 1.00 10.00 H new ATOM 683 N GLY A 46 -3.937 3.573 22.015 1.00 10.00 N ATOM 684 CA GLY A 46 -4.920 3.998 23.006 1.00 10.00 C ATOM 685 C GLY A 46 -6.205 4.415 22.307 1.00 10.00 C ATOM 686 O GLY A 46 -6.700 5.517 22.542 1.00 10.00 O ATOM 0 H GLY A 46 -4.154 3.888 21.070 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -5.122 3.186 23.704 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.526 4.830 23.590 1.00 10.00 H new ATOM 690 N TYR A 47 -6.689 3.586 21.377 1.00 10.00 N ATOM 691 CA TYR A 47 -7.826 3.920 20.528 1.00 10.00 C ATOM 692 C TYR A 47 -9.117 4.003 21.346 1.00 10.00 C ATOM 693 O TYR A 47 -9.494 3.039 22.006 1.00 10.00 O ATOM 694 CB TYR A 47 -8.007 2.864 19.439 1.00 10.00 C ATOM 695 CG TYR A 47 -6.847 2.666 18.484 1.00 10.00 C ATOM 696 CD1 TYR A 47 -6.487 3.686 17.585 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.198 1.420 18.423 1.00 10.00 C ATOM 698 CE1 TYR A 47 -5.498 3.453 16.612 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.206 1.181 17.455 1.00 10.00 C ATOM 700 CZ TYR A 47 -4.853 2.201 16.538 1.00 10.00 C ATOM 701 OH TYR A 47 -3.907 1.975 15.584 1.00 10.00 O ATOM 0 H TYR A 47 -6.298 2.662 21.195 1.00 10.00 H new ATOM 0 HA TYR A 47 -7.622 4.890 20.075 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.217 1.910 19.922 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -8.889 3.126 18.854 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -6.971 4.650 17.642 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.463 0.642 19.124 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -5.231 4.237 15.918 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.714 0.221 17.411 1.00 10.00 H new ATOM 0 HH TYR A 47 -3.563 1.062 15.675 1.00 10.00 H new ATOM 711 N LYS A 48 -9.826 5.132 21.248 1.00 10.00 N ATOM 712 CA LYS A 48 -10.974 5.443 22.104 1.00 10.00 C ATOM 713 C LYS A 48 -12.107 4.417 22.008 1.00 10.00 C ATOM 714 O LYS A 48 -12.827 4.228 22.981 1.00 10.00 O ATOM 715 CB LYS A 48 -11.488 6.851 21.751 1.00 10.00 C ATOM 716 CG LYS A 48 -12.213 7.581 22.893 1.00 10.00 C ATOM 717 CD LYS A 48 -11.342 7.761 24.150 1.00 10.00 C ATOM 718 CE LYS A 48 -11.797 8.962 24.991 1.00 10.00 C ATOM 719 NZ LYS A 48 -11.302 10.246 24.441 1.00 10.00 N ATOM 0 H LYS A 48 -9.617 5.862 20.566 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.631 5.405 23.138 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -10.643 7.460 21.429 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -12.166 6.772 20.902 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -12.537 8.560 22.541 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -13.111 7.024 23.159 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -11.386 6.856 24.755 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -10.302 7.897 23.855 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -12.886 8.982 25.034 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -11.439 8.844 26.014 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -11.632 11.030 25.039 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -10.262 10.238 24.423 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -11.664 10.372 23.474 1.00 10.00 H new ATOM 733 N TRP A 49 -12.291 3.791 20.841 1.00 10.00 N ATOM 734 CA TRP A 49 -13.362 2.820 20.629 1.00 10.00 C ATOM 735 C TRP A 49 -13.146 1.517 21.419 1.00 10.00 C ATOM 736 O TRP A 49 -14.100 0.757 21.555 1.00 10.00 O ATOM 737 CB TRP A 49 -13.539 2.547 19.121 1.00 10.00 C ATOM 738 CG TRP A 49 -12.297 2.209 18.343 1.00 10.00 C ATOM 739 CD1 TRP A 49 -11.680 3.029 17.459 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.472 1.000 18.396 1.00 10.00 C ATOM 741 NE1 TRP A 49 -10.531 2.431 16.987 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.319 1.210 17.586 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.550 -0.234 19.073 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.252 0.305 17.542 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.470 -1.139 19.070 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.307 -0.851 18.337 1.00 10.00 C ATOM 0 H TRP A 49 -11.703 3.944 20.022 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.283 3.256 21.016 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.246 1.726 19.005 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -13.995 3.427 18.668 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.035 4.006 17.167 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -9.916 2.841 16.284 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.455 -0.491 19.604 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.399 0.493 16.906 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.537 -2.058 19.634 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.458 -1.517 18.385 1.00 10.00 H new ATOM 757 N ALA A 50 -11.924 1.235 21.891 1.00 10.00 N ATOM 758 CA ALA A 50 -11.597 -0.053 22.482 1.00 10.00 C ATOM 759 C ALA A 50 -12.399 -0.305 23.754 1.00 10.00 C ATOM 760 O ALA A 50 -12.483 0.562 24.628 1.00 10.00 O ATOM 761 CB ALA A 50 -10.099 -0.139 22.768 1.00 10.00 C ATOM 0 H ALA A 50 -11.145 1.893 21.871 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.865 -0.828 21.764 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.868 -1.108 23.210 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.544 -0.023 21.837 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.815 0.653 23.461 1.00 10.00 H new ATOM 767 N GLU A 51 -12.909 -1.525 23.882 1.00 10.00 N ATOM 768 CA GLU A 51 -13.575 -1.979 25.099 1.00 10.00 C ATOM 769 C GLU A 51 -12.562 -2.119 26.242 1.00 10.00 C ATOM 770 O GLU A 51 -12.860 -1.774 27.386 1.00 10.00 O ATOM 771 CB GLU A 51 -14.295 -3.316 24.852 1.00 10.00 C ATOM 772 CG GLU A 51 -15.483 -3.177 23.888 1.00 10.00 C ATOM 773 CD GLU A 51 -16.271 -4.498 23.757 1.00 10.00 C ATOM 774 OE1 GLU A 51 -15.902 -5.350 22.921 1.00 10.00 O ATOM 775 OE2 GLU A 51 -17.275 -4.670 24.489 1.00 10.00 O ATOM 0 H GLU A 51 -12.873 -2.228 23.144 1.00 10.00 H new ATOM 0 HA GLU A 51 -14.319 -1.235 25.384 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -13.585 -4.037 24.447 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -14.648 -3.716 25.803 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -16.149 -2.390 24.242 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -15.121 -2.871 22.907 1.00 10.00 H new ATOM 782 N TYR A 52 -11.350 -2.603 25.934 1.00 10.00 N ATOM 783 CA TYR A 52 -10.275 -2.898 26.875 1.00 10.00 C ATOM 784 C TYR A 52 -8.937 -2.814 26.137 1.00 10.00 C ATOM 785 O TYR A 52 -8.889 -2.828 24.910 1.00 10.00 O ATOM 786 CB TYR A 52 -10.437 -4.327 27.435 1.00 10.00 C ATOM 787 CG TYR A 52 -11.703 -4.591 28.231 1.00 10.00 C ATOM 788 CD1 TYR A 52 -11.797 -4.159 29.569 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.781 -5.279 27.641 1.00 10.00 C ATOM 790 CE1 TYR A 52 -12.968 -4.398 30.312 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.956 -5.521 28.376 1.00 10.00 C ATOM 792 CZ TYR A 52 -14.057 -5.077 29.714 1.00 10.00 C ATOM 793 OH TYR A 52 -15.195 -5.317 30.426 1.00 10.00 O ATOM 0 H TYR A 52 -11.086 -2.808 24.970 1.00 10.00 H new ATOM 0 HA TYR A 52 -10.310 -2.181 27.695 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -10.403 -5.028 26.601 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -9.579 -4.546 28.071 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -10.966 -3.642 30.026 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.705 -5.622 26.620 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -13.036 -4.064 31.337 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -14.781 -6.046 27.918 1.00 10.00 H new ATOM 0 HH TYR A 52 -15.840 -5.792 29.861 1.00 10.00 H new ATOM 803 N HIS A 53 -7.828 -2.846 26.883 1.00 10.00 N ATOM 804 CA HIS A 53 -6.476 -3.002 26.339 1.00 10.00 C ATOM 805 C HIS A 53 -6.352 -4.268 25.477 1.00 10.00 C ATOM 806 O HIS A 53 -5.593 -4.270 24.511 1.00 10.00 O ATOM 807 CB HIS A 53 -5.472 -3.031 27.504 1.00 10.00 C ATOM 808 CG HIS A 53 -5.878 -3.986 28.605 1.00 10.00 C ATOM 809 ND1 HIS A 53 -6.786 -3.674 29.622 1.00 10.00 N ATOM 810 CD2 HIS A 53 -5.559 -5.311 28.688 1.00 10.00 C ATOM 811 CE1 HIS A 53 -6.987 -4.818 30.296 1.00 10.00 C ATOM 812 NE2 HIS A 53 -6.261 -5.813 29.759 1.00 10.00 N ATOM 0 H HIS A 53 -7.846 -2.763 27.899 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.259 -2.156 25.687 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -4.491 -3.317 27.125 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -5.374 -2.027 27.918 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -4.888 -5.857 28.041 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -7.640 -4.923 31.150 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -6.235 -6.778 30.090 1.00 10.00 H new ATOM 820 N ALA A 54 -7.091 -5.330 25.810 1.00 10.00 N ATOM 821 CA ALA A 54 -7.155 -6.543 25.000 1.00 10.00 C ATOM 822 C ALA A 54 -7.738 -6.267 23.608 1.00 10.00 C ATOM 823 O ALA A 54 -7.283 -6.860 22.637 1.00 10.00 O ATOM 824 CB ALA A 54 -7.990 -7.598 25.733 1.00 10.00 C ATOM 0 H ALA A 54 -7.663 -5.370 26.653 1.00 10.00 H new ATOM 0 HA ALA A 54 -6.140 -6.914 24.855 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -8.040 -8.505 25.131 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -7.528 -7.825 26.694 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -8.997 -7.215 25.897 1.00 10.00 H new ATOM 830 N ASP A 55 -8.712 -5.359 23.516 1.00 10.00 N ATOM 831 CA ASP A 55 -9.370 -5.026 22.249 1.00 10.00 C ATOM 832 C ASP A 55 -8.391 -4.273 21.350 1.00 10.00 C ATOM 833 O ASP A 55 -8.293 -4.539 20.155 1.00 10.00 O ATOM 834 CB ASP A 55 -10.612 -4.162 22.529 1.00 10.00 C ATOM 835 CG ASP A 55 -11.622 -4.058 21.371 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.586 -4.889 20.442 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.458 -3.134 21.465 1.00 10.00 O ATOM 0 H ASP A 55 -9.067 -4.834 24.316 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.682 -5.940 21.743 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -11.126 -4.567 23.401 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -10.282 -3.157 22.792 1.00 10.00 H new ATOM 842 N ILE A 56 -7.584 -3.377 21.951 1.00 10.00 N ATOM 843 CA ILE A 56 -6.507 -2.683 21.254 1.00 10.00 C ATOM 844 C ILE A 56 -5.511 -3.725 20.742 1.00 10.00 C ATOM 845 O ILE A 56 -5.230 -3.758 19.546 1.00 10.00 O ATOM 846 CB ILE A 56 -5.809 -1.631 22.157 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.796 -0.614 22.764 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.720 -0.911 21.337 1.00 10.00 C ATOM 849 CD1 ILE A 56 -6.178 0.364 23.771 1.00 10.00 C ATOM 0 H ILE A 56 -7.669 -3.121 22.935 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.927 -2.128 20.415 1.00 10.00 H new ATOM 0 HB ILE A 56 -5.360 -2.157 23.000 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.249 -0.041 21.954 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.600 -1.160 23.257 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.224 -0.170 21.963 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -3.988 -1.638 20.986 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.177 -0.415 20.481 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.949 1.039 24.143 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.751 -0.194 24.605 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.394 0.942 23.282 1.00 10.00 H new ATOM 861 N TYR A 57 -4.953 -4.551 21.635 1.00 10.00 N ATOM 862 CA TYR A 57 -3.879 -5.471 21.281 1.00 10.00 C ATOM 863 C TYR A 57 -4.317 -6.435 20.174 1.00 10.00 C ATOM 864 O TYR A 57 -3.550 -6.668 19.238 1.00 10.00 O ATOM 865 CB TYR A 57 -3.415 -6.218 22.537 1.00 10.00 C ATOM 866 CG TYR A 57 -2.245 -7.172 22.346 1.00 10.00 C ATOM 867 CD1 TYR A 57 -1.071 -6.740 21.700 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.312 -8.483 22.857 1.00 10.00 C ATOM 869 CE1 TYR A 57 0.026 -7.605 21.560 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.215 -9.356 22.725 1.00 10.00 C ATOM 871 CZ TYR A 57 -0.036 -8.917 22.079 1.00 10.00 C ATOM 872 OH TYR A 57 1.048 -9.729 21.976 1.00 10.00 O ATOM 0 H TYR A 57 -5.234 -4.597 22.614 1.00 10.00 H new ATOM 0 HA TYR A 57 -3.037 -4.903 20.884 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -3.140 -5.483 23.293 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -4.259 -6.783 22.933 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -1.014 -5.735 21.309 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.210 -8.821 23.353 1.00 10.00 H new ATOM 0 HE1 TYR A 57 0.919 -7.267 21.055 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -1.274 -10.361 23.117 1.00 10.00 H new ATOM 0 HH TYR A 57 0.846 -10.598 22.382 1.00 10.00 H new ATOM 882 N ASP A 58 -5.549 -6.937 20.241 1.00 10.00 N ATOM 883 CA ASP A 58 -6.096 -7.819 19.211 1.00 10.00 C ATOM 884 C ASP A 58 -6.217 -7.106 17.862 1.00 10.00 C ATOM 885 O ASP A 58 -5.748 -7.624 16.844 1.00 10.00 O ATOM 886 CB ASP A 58 -7.467 -8.361 19.632 1.00 10.00 C ATOM 887 CG ASP A 58 -8.066 -9.254 18.525 1.00 10.00 C ATOM 888 OD1 ASP A 58 -7.597 -10.404 18.375 1.00 10.00 O ATOM 889 OD2 ASP A 58 -8.987 -8.790 17.821 1.00 10.00 O ATOM 0 H ASP A 58 -6.194 -6.745 21.007 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.400 -8.650 19.098 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.369 -8.934 20.554 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.142 -7.532 19.842 1.00 10.00 H new ATOM 894 N LYS A 59 -6.764 -5.879 17.844 1.00 10.00 N ATOM 895 CA LYS A 59 -6.938 -5.128 16.602 1.00 10.00 C ATOM 896 C LYS A 59 -5.579 -4.808 15.995 1.00 10.00 C ATOM 897 O LYS A 59 -5.399 -4.970 14.790 1.00 10.00 O ATOM 898 CB LYS A 59 -7.757 -3.857 16.871 1.00 10.00 C ATOM 899 CG LYS A 59 -8.163 -3.117 15.586 1.00 10.00 C ATOM 900 CD LYS A 59 -9.222 -3.865 14.759 1.00 10.00 C ATOM 901 CE LYS A 59 -9.653 -3.005 13.562 1.00 10.00 C ATOM 902 NZ LYS A 59 -10.693 -3.669 12.735 1.00 10.00 N ATOM 0 H LYS A 59 -7.091 -5.391 18.678 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.489 -5.732 15.881 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -8.655 -4.122 17.429 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.176 -3.185 17.502 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -8.548 -2.132 15.849 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -7.277 -2.960 14.971 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -8.818 -4.815 14.409 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -10.086 -4.096 15.382 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -10.034 -2.050 13.923 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -8.783 -2.788 12.942 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -10.951 -3.050 11.940 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -10.322 -4.569 12.368 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -11.534 -3.853 13.318 1.00 10.00 H new ATOM 916 N VAL A 60 -4.627 -4.350 16.811 1.00 10.00 N ATOM 917 CA VAL A 60 -3.286 -4.007 16.366 1.00 10.00 C ATOM 918 C VAL A 60 -2.610 -5.257 15.808 1.00 10.00 C ATOM 919 O VAL A 60 -2.010 -5.178 14.744 1.00 10.00 O ATOM 920 CB VAL A 60 -2.510 -3.356 17.528 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.033 -3.092 17.189 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.141 -2.004 17.901 1.00 10.00 C ATOM 0 H VAL A 60 -4.773 -4.207 17.810 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.314 -3.273 15.560 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.562 -4.065 18.354 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.540 -2.633 18.046 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.541 -4.034 16.949 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -0.971 -2.421 16.332 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.582 -1.556 18.723 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.113 -1.339 17.038 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.176 -2.157 18.207 1.00 10.00 H new ATOM 932 N SER A 61 -2.717 -6.409 16.471 1.00 10.00 N ATOM 933 CA SER A 61 -2.123 -7.647 15.971 1.00 10.00 C ATOM 934 C SER A 61 -2.714 -8.032 14.608 1.00 10.00 C ATOM 935 O SER A 61 -1.974 -8.484 13.734 1.00 10.00 O ATOM 936 CB SER A 61 -2.300 -8.770 17.002 1.00 10.00 C ATOM 937 OG SER A 61 -1.729 -8.396 18.243 1.00 10.00 O ATOM 0 H SER A 61 -3.211 -6.509 17.358 1.00 10.00 H new ATOM 0 HA SER A 61 -1.055 -7.488 15.823 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.360 -8.988 17.133 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.829 -9.683 16.639 1.00 10.00 H new ATOM 0 HG SER A 61 -2.354 -7.820 18.731 1.00 10.00 H new ATOM 943 N GLY A 62 -4.019 -7.835 14.399 1.00 10.00 N ATOM 944 CA GLY A 62 -4.648 -8.084 13.110 1.00 10.00 C ATOM 945 C GLY A 62 -4.113 -7.124 12.049 1.00 10.00 C ATOM 946 O GLY A 62 -3.653 -7.561 10.994 1.00 10.00 O ATOM 0 H GLY A 62 -4.661 -7.500 15.117 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.462 -9.113 12.802 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -5.728 -7.969 13.199 1.00 10.00 H new ATOM 950 N ASP A 63 -4.141 -5.818 12.329 1.00 10.00 N ATOM 951 CA ASP A 63 -3.732 -4.801 11.363 1.00 10.00 C ATOM 952 C ASP A 63 -2.257 -4.939 11.002 1.00 10.00 C ATOM 953 O ASP A 63 -1.909 -4.899 9.826 1.00 10.00 O ATOM 954 CB ASP A 63 -3.995 -3.389 11.894 1.00 10.00 C ATOM 955 CG ASP A 63 -3.692 -2.351 10.796 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.606 -2.075 9.991 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.551 -1.836 10.751 1.00 10.00 O ATOM 0 H ASP A 63 -4.446 -5.440 13.226 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.332 -4.959 10.466 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -5.033 -3.299 12.215 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.373 -3.198 12.769 1.00 10.00 H new ATOM 962 N MET A 64 -1.393 -5.188 11.990 1.00 10.00 N ATOM 963 CA MET A 64 0.033 -5.341 11.765 1.00 10.00 C ATOM 964 C MET A 64 0.312 -6.536 10.867 1.00 10.00 C ATOM 965 O MET A 64 1.160 -6.420 9.988 1.00 10.00 O ATOM 966 CB MET A 64 0.789 -5.453 13.095 1.00 10.00 C ATOM 967 CG MET A 64 0.899 -4.094 13.797 1.00 10.00 C ATOM 968 SD MET A 64 1.759 -2.807 12.847 1.00 10.00 S ATOM 969 CE MET A 64 0.474 -1.529 12.878 1.00 10.00 C ATOM 0 H MET A 64 -1.670 -5.288 12.966 1.00 10.00 H new ATOM 0 HA MET A 64 0.395 -4.449 11.254 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.276 -6.160 13.747 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.787 -5.852 12.915 1.00 10.00 H new ATOM 0 HG2 MET A 64 -0.105 -3.741 14.032 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.418 -4.233 14.745 1.00 10.00 H new ATOM 0 HE1 MET A 64 0.709 -0.759 12.143 1.00 10.00 H new ATOM 0 HE2 MET A 64 -0.490 -1.977 12.639 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.430 -1.082 13.871 1.00 10.00 H new ATOM 979 N GLN A 65 -0.419 -7.647 11.001 1.00 10.00 N ATOM 980 CA GLN A 65 -0.253 -8.766 10.085 1.00 10.00 C ATOM 981 C GLN A 65 -0.621 -8.364 8.653 1.00 10.00 C ATOM 982 O GLN A 65 0.054 -8.795 7.722 1.00 10.00 O ATOM 983 CB GLN A 65 -1.068 -9.965 10.575 1.00 10.00 C ATOM 984 CG GLN A 65 -0.356 -10.632 11.760 1.00 10.00 C ATOM 985 CD GLN A 65 -1.227 -11.709 12.404 1.00 10.00 C ATOM 986 OE1 GLN A 65 -1.129 -12.891 12.095 1.00 10.00 O ATOM 987 NE2 GLN A 65 -2.122 -11.306 13.296 1.00 10.00 N ATOM 0 H GLN A 65 -1.121 -7.790 11.727 1.00 10.00 H new ATOM 0 HA GLN A 65 0.797 -9.059 10.067 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.065 -9.640 10.874 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.197 -10.684 9.766 1.00 10.00 H new ATOM 0 HG2 GLN A 65 0.580 -11.075 11.420 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.100 -9.877 12.504 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -2.189 -10.318 13.541 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -2.743 -11.984 13.737 1.00 10.00 H new ATOM 996 N LYS A 66 -1.633 -7.508 8.459 1.00 10.00 N ATOM 997 CA LYS A 66 -1.943 -6.961 7.137 1.00 10.00 C ATOM 998 C LYS A 66 -0.820 -6.048 6.623 1.00 10.00 C ATOM 999 O LYS A 66 -0.598 -6.027 5.411 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.294 -6.223 7.122 1.00 10.00 C ATOM 1001 CG LYS A 66 -4.475 -7.142 7.478 1.00 10.00 C ATOM 1002 CD LYS A 66 -5.821 -6.403 7.543 1.00 10.00 C ATOM 1003 CE LYS A 66 -6.238 -5.825 6.182 1.00 10.00 C ATOM 1004 NZ LYS A 66 -7.579 -5.187 6.225 1.00 10.00 N ATOM 0 H LYS A 66 -2.250 -7.181 9.203 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.022 -7.811 6.459 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.258 -5.394 7.828 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -3.458 -5.793 6.134 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -4.542 -7.940 6.738 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -4.281 -7.615 8.441 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.592 -7.088 7.895 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -5.754 -5.596 8.272 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -5.499 -5.091 5.860 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -6.241 -6.621 5.438 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -7.816 -4.812 5.284 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.290 -5.892 6.506 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -7.571 -4.409 6.915 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.123 -5.316 7.497 1.00 10.00 N ATOM 1019 CA GLN A 67 1.014 -4.491 7.091 1.00 10.00 C ATOM 1020 C GLN A 67 2.210 -5.370 6.703 1.00 10.00 C ATOM 1021 O GLN A 67 2.933 -5.080 5.750 1.00 10.00 O ATOM 1022 CB GLN A 67 1.464 -3.512 8.200 1.00 10.00 C ATOM 1023 CG GLN A 67 0.411 -2.559 8.787 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.399 -1.760 7.764 1.00 10.00 C ATOM 1025 OE1 GLN A 67 0.043 -1.478 6.656 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -1.605 -1.359 8.128 1.00 10.00 N ATOM 0 H GLN A 67 -0.329 -5.280 8.495 1.00 10.00 H new ATOM 0 HA GLN A 67 0.675 -3.909 6.234 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.876 -4.101 9.019 1.00 10.00 H new ATOM 0 HB3 GLN A 67 2.278 -2.907 7.802 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.280 -3.141 9.397 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.913 -1.858 9.454 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -1.965 -1.598 9.052 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.176 -0.810 7.485 1.00 10.00 H new ATOM 1035 N GLY A 68 2.435 -6.440 7.466 1.00 10.00 N ATOM 1036 CA GLY A 68 3.631 -7.260 7.412 1.00 10.00 C ATOM 1037 C GLY A 68 4.480 -6.971 8.645 1.00 10.00 C ATOM 1038 O GLY A 68 5.640 -6.578 8.526 1.00 10.00 O ATOM 0 H GLY A 68 1.762 -6.765 8.160 1.00 10.00 H new ATOM 0 HA2 GLY A 68 3.363 -8.316 7.377 1.00 10.00 H new ATOM 0 HA3 GLY A 68 4.196 -7.044 6.505 1.00 10.00 H new ATOM 1042 N CYS A 69 3.888 -7.071 9.835 1.00 10.00 N ATOM 1043 CA CYS A 69 4.544 -7.007 11.127 1.00 10.00 C ATOM 1044 C CYS A 69 3.863 -8.024 12.051 1.00 10.00 C ATOM 1045 O CYS A 69 2.748 -8.469 11.779 1.00 10.00 O ATOM 1046 CB CYS A 69 4.428 -5.587 11.714 1.00 10.00 C ATOM 1047 SG CYS A 69 5.511 -4.426 10.837 1.00 10.00 S ATOM 0 H CYS A 69 2.881 -7.206 9.920 1.00 10.00 H new ATOM 0 HA CYS A 69 5.604 -7.241 11.026 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.395 -5.246 11.647 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.690 -5.605 12.772 1.00 10.00 H new ATOM 0 HG CYS A 69 5.865 -4.940 9.696 1.00 10.00 H new ATOM 1053 N ASP A 70 4.506 -8.334 13.167 1.00 10.00 N ATOM 1054 CA ASP A 70 3.966 -9.137 14.267 1.00 10.00 C ATOM 1055 C ASP A 70 4.170 -8.349 15.560 1.00 10.00 C ATOM 1056 O ASP A 70 4.981 -7.415 15.570 1.00 10.00 O ATOM 1057 CB ASP A 70 4.667 -10.503 14.325 1.00 10.00 C ATOM 1058 CG ASP A 70 4.126 -11.415 15.447 1.00 10.00 C ATOM 1059 OD1 ASP A 70 2.903 -11.374 15.705 1.00 10.00 O ATOM 1060 OD2 ASP A 70 4.937 -12.169 16.014 1.00 10.00 O ATOM 0 H ASP A 70 5.461 -8.022 13.344 1.00 10.00 H new ATOM 0 HA ASP A 70 2.904 -9.331 14.119 1.00 10.00 H new ATOM 0 HB2 ASP A 70 4.547 -11.007 13.366 1.00 10.00 H new ATOM 0 HB3 ASP A 70 5.736 -10.350 14.473 1.00 10.00 H new ATOM 1065 N CYS A 71 3.453 -8.684 16.632 1.00 10.00 N ATOM 1066 CA CYS A 71 3.361 -7.881 17.843 1.00 10.00 C ATOM 1067 C CYS A 71 3.680 -8.684 19.106 1.00 10.00 C ATOM 1068 O CYS A 71 3.413 -9.876 19.176 1.00 10.00 O ATOM 1069 CB CYS A 71 1.926 -7.359 17.971 1.00 10.00 C ATOM 1070 SG CYS A 71 1.472 -6.296 16.577 1.00 10.00 S ATOM 0 H CYS A 71 2.907 -9.544 16.680 1.00 10.00 H new ATOM 0 HA CYS A 71 4.090 -7.075 17.758 1.00 10.00 H new ATOM 0 HB2 CYS A 71 1.236 -8.201 18.026 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.823 -6.802 18.902 1.00 10.00 H new ATOM 0 HG CYS A 71 1.366 -5.066 16.985 1.00 10.00 H new ATOM 1076 N GLU A 72 4.136 -7.969 20.137 1.00 10.00 N ATOM 1077 CA GLU A 72 4.303 -8.450 21.501 1.00 10.00 C ATOM 1078 C GLU A 72 3.941 -7.279 22.412 1.00 10.00 C ATOM 1079 O GLU A 72 4.575 -6.220 22.343 1.00 10.00 O ATOM 1080 CB GLU A 72 5.759 -8.887 21.758 1.00 10.00 C ATOM 1081 CG GLU A 72 6.166 -10.209 21.082 1.00 10.00 C ATOM 1082 CD GLU A 72 5.362 -11.447 21.545 1.00 10.00 C ATOM 1083 OE1 GLU A 72 4.815 -11.440 22.673 1.00 10.00 O ATOM 1084 OE2 GLU A 72 5.346 -12.457 20.811 1.00 10.00 O ATOM 0 H GLU A 72 4.411 -6.992 20.033 1.00 10.00 H new ATOM 0 HA GLU A 72 3.671 -9.318 21.686 1.00 10.00 H new ATOM 0 HB2 GLU A 72 6.427 -8.098 21.412 1.00 10.00 H new ATOM 0 HB3 GLU A 72 5.910 -8.984 22.833 1.00 10.00 H new ATOM 0 HG2 GLU A 72 6.050 -10.100 20.004 1.00 10.00 H new ATOM 0 HG3 GLU A 72 7.224 -10.388 21.273 1.00 10.00 H new ATOM 1091 N CYS A 73 2.891 -7.403 23.227 1.00 10.00 N ATOM 1092 CA CYS A 73 2.599 -6.429 24.270 1.00 10.00 C ATOM 1093 C CYS A 73 3.778 -6.392 25.255 1.00 10.00 C ATOM 1094 O CYS A 73 4.229 -7.430 25.731 1.00 10.00 O ATOM 1095 CB CYS A 73 1.263 -6.763 24.956 1.00 10.00 C ATOM 1096 SG CYS A 73 1.135 -8.522 25.396 1.00 10.00 S ATOM 0 H CYS A 73 2.227 -8.176 23.180 1.00 10.00 H new ATOM 0 HA CYS A 73 2.484 -5.433 23.842 1.00 10.00 H new ATOM 0 HB2 CYS A 73 1.158 -6.157 25.856 1.00 10.00 H new ATOM 0 HB3 CYS A 73 0.440 -6.496 24.293 1.00 10.00 H new ATOM 0 HG CYS A 73 0.083 -8.709 26.137 1.00 10.00 H new ATOM 1102 N LEU A 74 4.274 -5.190 25.566 1.00 10.00 N ATOM 1103 CA LEU A 74 5.285 -5.002 26.610 1.00 10.00 C ATOM 1104 C LEU A 74 4.610 -4.741 27.959 1.00 10.00 C ATOM 1105 O LEU A 74 5.213 -4.976 29.002 1.00 10.00 O ATOM 1106 CB LEU A 74 6.233 -3.838 26.265 1.00 10.00 C ATOM 1107 CG LEU A 74 7.048 -4.004 24.965 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.076 -2.869 24.873 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.781 -5.349 24.882 1.00 10.00 C ATOM 0 H LEU A 74 3.988 -4.326 25.105 1.00 10.00 H new ATOM 0 HA LEU A 74 5.875 -5.916 26.673 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.644 -2.924 26.189 1.00 10.00 H new ATOM 0 HB3 LEU A 74 6.928 -3.702 27.093 1.00 10.00 H new ATOM 0 HG LEU A 74 6.342 -3.971 24.135 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.657 -2.978 23.957 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.559 -1.910 24.863 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.744 -2.912 25.734 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.335 -5.404 23.945 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.473 -5.438 25.719 1.00 10.00 H new ATOM 0 HD23 LEU A 74 7.056 -6.162 24.923 1.00 10.00 H new ATOM 1121 N GLY A 75 3.375 -4.234 27.941 1.00 10.00 N ATOM 1122 CA GLY A 75 2.601 -3.878 29.118 1.00 10.00 C ATOM 1123 C GLY A 75 1.518 -2.887 28.715 1.00 10.00 C ATOM 1124 O GLY A 75 1.440 -2.489 27.551 1.00 10.00 O ATOM 0 H GLY A 75 2.874 -4.056 27.071 1.00 10.00 H new ATOM 0 HA2 GLY A 75 2.152 -4.769 29.558 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.249 -3.440 29.877 1.00 10.00 H new ATOM 1128 N GLY A 76 0.687 -2.453 29.659 1.00 10.00 N ATOM 1129 CA GLY A 76 -0.268 -1.380 29.417 1.00 10.00 C ATOM 1130 C GLY A 76 -0.489 -0.538 30.666 1.00 10.00 C ATOM 1131 O GLY A 76 0.130 -0.780 31.700 1.00 10.00 O ATOM 0 H GLY A 76 0.658 -2.833 30.605 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.094 -0.745 28.608 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -1.218 -1.803 29.090 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.356 0.464 30.558 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.545 1.477 31.578 1.00 10.00 C ATOM 1137 C GLY A 77 -2.729 2.355 31.217 1.00 10.00 C ATOM 1138 O GLY A 77 -3.693 1.898 30.583 1.00 10.00 O ATOM 0 H GLY A 77 -1.955 0.593 29.743 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.712 1.005 32.546 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.645 2.085 31.671 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.690 3.615 31.633 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.669 4.631 31.291 1.00 10.00 C ATOM 1144 C ARG A 78 -2.984 5.991 31.209 1.00 10.00 C ATOM 1145 O ARG A 78 -1.852 6.172 31.655 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.853 4.591 32.279 1.00 10.00 C ATOM 1147 CG ARG A 78 -4.507 5.052 33.705 1.00 10.00 C ATOM 1148 CD ARG A 78 -5.606 4.699 34.719 1.00 10.00 C ATOM 1149 NE ARG A 78 -5.708 3.246 34.967 1.00 10.00 N ATOM 1150 CZ ARG A 78 -6.732 2.439 34.679 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -7.803 2.882 34.011 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -6.650 1.166 35.029 1.00 10.00 N ATOM 0 H ARG A 78 -1.948 3.966 32.239 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.095 4.432 30.307 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -5.655 5.220 31.892 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.239 3.573 32.323 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -3.569 4.591 34.015 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -4.348 6.130 33.707 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -5.404 5.211 35.660 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -6.564 5.069 34.354 1.00 10.00 H new ATOM 0 HE ARG A 78 -4.901 2.808 35.411 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -7.850 3.855 33.710 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -8.573 2.246 33.803 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -5.818 0.821 35.508 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -7.419 0.529 34.820 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.688 6.939 30.613 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.214 8.277 30.317 1.00 10.00 C ATOM 1168 C ILE A 79 -4.348 9.193 30.771 1.00 10.00 C ATOM 1169 O ILE A 79 -5.519 8.794 30.758 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.886 8.402 28.804 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.890 7.307 28.344 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.353 9.810 28.477 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.440 7.380 26.879 1.00 10.00 C ATOM 0 H ILE A 79 -4.650 6.788 30.309 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.287 8.539 30.827 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.812 8.251 28.250 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -1.005 7.359 28.978 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -2.348 6.333 28.515 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.129 9.876 27.412 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.107 10.554 28.736 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.445 9.998 29.051 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.746 6.566 26.671 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.309 7.292 26.227 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -0.945 8.334 26.697 1.00 10.00 H new ATOM 1185 N SER A 80 -4.031 10.403 31.217 1.00 10.00 N ATOM 1186 CA SER A 80 -5.018 11.408 31.586 1.00 10.00 C ATOM 1187 C SER A 80 -4.477 12.799 31.264 1.00 10.00 C ATOM 1188 O SER A 80 -3.270 12.986 31.097 1.00 10.00 O ATOM 1189 CB SER A 80 -5.372 11.270 33.073 1.00 10.00 C ATOM 1190 OG SER A 80 -5.821 9.953 33.344 1.00 10.00 O ATOM 0 H SER A 80 -3.068 10.717 31.334 1.00 10.00 H new ATOM 0 HA SER A 80 -5.932 11.259 31.011 1.00 10.00 H new ATOM 0 HB2 SER A 80 -4.500 11.499 33.686 1.00 10.00 H new ATOM 0 HB3 SER A 80 -6.147 11.989 33.339 1.00 10.00 H new ATOM 0 HG SER A 80 -5.495 9.671 34.224 1.00 10.00 H new ATOM 1314 N ILE A 88 -0.484 16.229 30.009 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.598 14.775 29.891 1.00 10.00 C ATOM 1316 C ILE A 88 0.246 14.113 30.986 1.00 10.00 C ATOM 1317 O ILE A 88 1.416 14.460 31.201 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.244 14.273 28.467 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -1.301 14.766 27.452 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.193 12.729 28.418 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -1.019 14.370 25.997 1.00 10.00 C ATOM 0 HA ILE A 88 -1.638 14.486 30.041 1.00 10.00 H new ATOM 0 HB ILE A 88 0.738 14.671 28.210 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.275 14.371 27.740 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.366 15.852 27.513 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.057 12.405 27.408 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.565 12.368 29.113 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.165 12.324 28.698 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.810 14.757 25.355 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -0.062 14.788 25.685 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.985 13.284 25.916 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.326 13.087 31.617 1.00 10.00 N ATOM 1334 CA HIS A 89 0.338 12.225 32.574 1.00 10.00 C ATOM 1335 C HIS A 89 -0.018 10.779 32.236 1.00 10.00 C ATOM 1336 O HIS A 89 -1.120 10.511 31.753 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.090 12.610 33.997 1.00 10.00 C ATOM 1338 CG HIS A 89 0.783 11.978 35.049 1.00 10.00 C ATOM 1339 ND1 HIS A 89 0.608 10.745 35.638 1.00 10.00 N ATOM 1340 CD2 HIS A 89 1.945 12.501 35.550 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.649 10.533 36.459 1.00 10.00 C ATOM 1342 NE2 HIS A 89 2.501 11.569 36.435 1.00 10.00 N ATOM 0 H HIS A 89 -1.301 12.831 31.464 1.00 10.00 H new ATOM 0 HA HIS A 89 1.421 12.338 32.523 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.055 13.694 34.103 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.125 12.307 34.157 1.00 10.00 H new ATOM 0 HD1 HIS A 89 -0.172 10.108 35.479 1.00 10.00 H new ATOM 0 HD2 HIS A 89 2.361 13.467 35.305 1.00 10.00 H new ATOM 0 HE1 HIS A 89 1.783 9.645 37.060 1.00 10.00 H new ATOM 1350 N VAL A 90 0.895 9.847 32.509 1.00 10.00 N ATOM 1351 CA VAL A 90 0.797 8.430 32.167 1.00 10.00 C ATOM 1352 C VAL A 90 1.098 7.632 33.441 1.00 10.00 C ATOM 1353 O VAL A 90 1.947 8.022 34.239 1.00 10.00 O ATOM 1354 CB VAL A 90 1.779 8.114 31.014 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.682 6.648 30.573 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.548 9.009 29.783 1.00 10.00 C ATOM 0 H VAL A 90 1.762 10.071 32.997 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.197 8.159 31.813 1.00 10.00 H new ATOM 0 HB VAL A 90 2.773 8.313 31.415 1.00 10.00 H new ATOM 0 HG11 VAL A 90 2.387 6.465 29.762 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.921 5.998 31.415 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.669 6.438 30.228 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.263 8.747 29.003 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.534 8.861 29.411 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.683 10.054 30.062 1.00 10.00 H new ATOM 1366 N TYR A 91 0.346 6.563 33.693 1.00 10.00 N ATOM 1367 CA TYR A 91 0.361 5.796 34.938 1.00 10.00 C ATOM 1368 C TYR A 91 -0.443 4.509 34.709 1.00 10.00 C ATOM 1369 O TYR A 91 -0.794 4.198 33.570 1.00 10.00 O ATOM 1370 CB TYR A 91 -0.209 6.644 36.101 1.00 10.00 C ATOM 1371 CG TYR A 91 -1.646 7.130 35.969 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -1.985 8.121 35.024 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -2.642 6.638 36.836 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -3.303 8.587 34.918 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -3.960 7.124 36.758 1.00 10.00 C ATOM 1376 CZ TYR A 91 -4.299 8.094 35.789 1.00 10.00 C ATOM 1377 OH TYR A 91 -5.586 8.521 35.672 1.00 10.00 O ATOM 0 H TYR A 91 -0.316 6.193 33.011 1.00 10.00 H new ATOM 0 HA TYR A 91 1.380 5.532 35.220 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.134 6.056 37.016 1.00 10.00 H new ATOM 0 HB3 TYR A 91 0.432 7.516 36.229 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -1.221 8.525 34.376 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.392 5.882 37.566 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -3.557 9.323 34.170 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -4.713 6.755 37.439 1.00 10.00 H new ATOM 0 HH TYR A 91 -6.140 8.080 36.349 1.00 10.00 H new ATOM 1387 N GLY A 92 -0.789 3.776 35.765 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.725 2.668 35.666 1.00 10.00 C ATOM 1389 C GLY A 92 -1.037 1.340 35.367 1.00 10.00 C ATOM 1390 O GLY A 92 0.189 1.243 35.339 1.00 10.00 O ATOM 0 H GLY A 92 -0.429 3.935 36.706 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.280 2.582 36.600 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.451 2.881 34.882 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.850 0.310 35.118 1.00 10.00 N ATOM 1395 CA TYR A 93 -1.400 -0.975 34.595 1.00 10.00 C ATOM 1396 C TYR A 93 -2.489 -1.588 33.710 1.00 10.00 C ATOM 1397 O TYR A 93 -3.611 -1.066 33.635 1.00 10.00 O ATOM 1398 CB TYR A 93 -0.957 -1.924 35.729 1.00 10.00 C ATOM 1399 CG TYR A 93 -2.012 -2.764 36.443 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -3.315 -2.283 36.681 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -1.659 -4.048 36.908 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -4.252 -3.068 37.376 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -2.587 -4.838 37.612 1.00 10.00 C ATOM 1404 CZ TYR A 93 -3.890 -4.344 37.858 1.00 10.00 C ATOM 1405 OH TYR A 93 -4.794 -5.087 38.554 1.00 10.00 O ATOM 0 H TYR A 93 -2.857 0.350 35.278 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.518 -0.814 33.975 1.00 10.00 H new ATOM 0 HB2 TYR A 93 -0.216 -2.608 35.315 1.00 10.00 H new ATOM 0 HB3 TYR A 93 -0.450 -1.322 36.483 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -3.597 -1.302 36.326 1.00 10.00 H new ATOM 0 HD2 TYR A 93 -0.666 -4.429 36.722 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -5.251 -2.693 37.541 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -2.305 -5.819 37.964 1.00 10.00 H new ATOM 0 HH TYR A 93 -4.386 -5.940 38.813 1.00 10.00 H new ATOM 1415 N SER A 94 -2.182 -2.713 33.062 1.00 10.00 N ATOM 1416 CA SER A 94 -3.135 -3.558 32.362 1.00 10.00 C ATOM 1417 C SER A 94 -2.838 -4.974 32.837 1.00 10.00 C ATOM 1418 O SER A 94 -1.815 -5.541 32.467 1.00 10.00 O ATOM 1419 CB SER A 94 -2.977 -3.419 30.844 1.00 10.00 C ATOM 1420 OG SER A 94 -3.333 -2.113 30.423 1.00 10.00 O ATOM 0 H SER A 94 -1.227 -3.068 33.012 1.00 10.00 H new ATOM 0 HA SER A 94 -4.167 -3.279 32.575 1.00 10.00 H new ATOM 0 HB2 SER A 94 -1.946 -3.630 30.559 1.00 10.00 H new ATOM 0 HB3 SER A 94 -3.604 -4.153 30.339 1.00 10.00 H new ATOM 0 HG SER A 94 -3.379 -2.086 29.444 1.00 10.00 H new ATOM 1426 N MET A 95 -3.708 -5.517 33.694 1.00 10.00 N ATOM 1427 CA MET A 95 -3.479 -6.770 34.422 1.00 10.00 C ATOM 1428 C MET A 95 -3.140 -7.953 33.498 1.00 10.00 C ATOM 1429 O MET A 95 -2.421 -8.857 33.911 1.00 10.00 O ATOM 1430 CB MET A 95 -4.719 -7.070 35.283 1.00 10.00 C ATOM 1431 CG MET A 95 -4.493 -8.208 36.285 1.00 10.00 C ATOM 1432 SD MET A 95 -5.912 -8.528 37.367 1.00 10.00 S ATOM 1433 CE MET A 95 -5.238 -9.894 38.352 1.00 10.00 C ATOM 0 H MET A 95 -4.610 -5.090 33.906 1.00 10.00 H new ATOM 0 HA MET A 95 -2.603 -6.640 35.057 1.00 10.00 H new ATOM 0 HB2 MET A 95 -5.005 -6.168 35.825 1.00 10.00 H new ATOM 0 HB3 MET A 95 -5.553 -7.328 34.631 1.00 10.00 H new ATOM 0 HG2 MET A 95 -4.254 -9.119 35.737 1.00 10.00 H new ATOM 0 HG3 MET A 95 -3.626 -7.970 36.901 1.00 10.00 H new ATOM 0 HE1 MET A 95 -5.983 -10.222 39.077 1.00 10.00 H new ATOM 0 HE2 MET A 95 -4.982 -10.725 37.695 1.00 10.00 H new ATOM 0 HE3 MET A 95 -4.344 -9.558 38.877 1.00 10.00 H new ATOM 1443 N ALA A 96 -3.634 -7.936 32.253 1.00 10.00 N ATOM 1444 CA ALA A 96 -3.354 -8.977 31.268 1.00 10.00 C ATOM 1445 C ALA A 96 -1.858 -9.104 30.937 1.00 10.00 C ATOM 1446 O ALA A 96 -1.443 -10.172 30.496 1.00 10.00 O ATOM 1447 CB ALA A 96 -4.156 -8.699 29.989 1.00 10.00 C ATOM 0 H ALA A 96 -4.241 -7.194 31.904 1.00 10.00 H new ATOM 0 HA ALA A 96 -3.657 -9.928 31.706 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.948 -9.475 29.253 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -5.221 -8.695 30.221 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.870 -7.729 29.584 1.00 10.00 H new ATOM 1453 N TYR A 97 -1.068 -8.037 31.115 1.00 10.00 N ATOM 1454 CA TYR A 97 0.320 -7.972 30.659 1.00 10.00 C ATOM 1455 C TYR A 97 1.238 -7.529 31.803 1.00 10.00 C ATOM 1456 O TYR A 97 2.251 -8.168 32.070 1.00 10.00 O ATOM 1457 CB TYR A 97 0.434 -6.979 29.484 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.663 -7.008 28.432 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -1.089 -8.222 27.858 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -1.266 -5.797 28.032 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -2.128 -8.231 26.912 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -2.296 -5.797 27.080 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.736 -7.018 26.525 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.761 -7.028 25.638 1.00 10.00 O ATOM 0 H TYR A 97 -1.381 -7.188 31.585 1.00 10.00 H new ATOM 0 HA TYR A 97 0.628 -8.964 30.328 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.477 -5.972 29.898 1.00 10.00 H new ATOM 0 HB3 TYR A 97 1.385 -7.158 28.983 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -0.615 -9.149 28.146 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -0.932 -4.864 28.462 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -2.460 -9.164 26.482 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -2.751 -4.867 26.773 1.00 10.00 H new ATOM 0 HH TYR A 97 -3.501 -7.539 24.843 1.00 10.00 H new ATOM 1474 N GLY A 98 0.867 -6.439 32.485 1.00 10.00 N ATOM 1475 CA GLY A 98 1.636 -5.773 33.525 1.00 10.00 C ATOM 1476 C GLY A 98 1.681 -4.272 33.225 1.00 10.00 C ATOM 1477 O GLY A 98 1.164 -3.844 32.185 1.00 10.00 O ATOM 0 H GLY A 98 -0.027 -5.979 32.312 1.00 10.00 H new ATOM 0 HA2 GLY A 98 1.182 -5.949 34.500 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.646 -6.180 33.565 1.00 10.00 H new ATOM 1481 N PRO A 99 2.252 -3.451 34.121 1.00 10.00 N ATOM 1482 CA PRO A 99 2.541 -2.052 33.831 1.00 10.00 C ATOM 1483 C PRO A 99 3.378 -1.920 32.553 1.00 10.00 C ATOM 1484 O PRO A 99 4.343 -2.663 32.365 1.00 10.00 O ATOM 1485 CB PRO A 99 3.318 -1.523 35.042 1.00 10.00 C ATOM 1486 CG PRO A 99 2.947 -2.485 36.170 1.00 10.00 C ATOM 1487 CD PRO A 99 2.736 -3.812 35.443 1.00 10.00 C ATOM 0 HA PRO A 99 1.625 -1.485 33.664 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.392 -1.521 34.857 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.034 -0.498 35.282 1.00 10.00 H new ATOM 0 HG2 PRO A 99 3.739 -2.556 36.915 1.00 10.00 H new ATOM 0 HG3 PRO A 99 2.046 -2.164 36.692 1.00 10.00 H new ATOM 0 HD2 PRO A 99 3.665 -4.379 35.381 1.00 10.00 H new ATOM 0 HD3 PRO A 99 2.015 -4.438 35.969 1.00 10.00 H new ATOM 1495 N ALA A 100 3.026 -0.967 31.688 1.00 10.00 N ATOM 1496 CA ALA A 100 3.875 -0.592 30.570 1.00 10.00 C ATOM 1497 C ALA A 100 5.161 0.041 31.106 1.00 10.00 C ATOM 1498 O ALA A 100 5.209 0.566 32.221 1.00 10.00 O ATOM 1499 CB ALA A 100 3.134 0.379 29.646 1.00 10.00 C ATOM 0 H ALA A 100 2.153 -0.442 31.746 1.00 10.00 H new ATOM 0 HA ALA A 100 4.131 -1.479 29.990 1.00 10.00 H new ATOM 0 HB1 ALA A 100 3.780 0.653 28.812 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.232 -0.099 29.264 1.00 10.00 H new ATOM 0 HB3 ALA A 100 2.862 1.275 30.203 1.00 10.00 H new ATOM 1505 N GLN A 101 6.204 0.047 30.273 1.00 10.00 N ATOM 1506 CA GLN A 101 7.423 0.793 30.516 1.00 10.00 C ATOM 1507 C GLN A 101 7.126 2.248 30.147 1.00 10.00 C ATOM 1508 O GLN A 101 7.554 2.730 29.098 1.00 10.00 O ATOM 1509 CB GLN A 101 8.597 0.176 29.736 1.00 10.00 C ATOM 1510 CG GLN A 101 8.947 -1.223 30.273 1.00 10.00 C ATOM 1511 CD GLN A 101 10.135 -1.843 29.530 1.00 10.00 C ATOM 1512 OE1 GLN A 101 11.245 -1.330 29.568 1.00 10.00 O ATOM 1513 NE2 GLN A 101 9.928 -2.958 28.839 1.00 10.00 N ATOM 0 H GLN A 101 6.217 -0.478 29.398 1.00 10.00 H new ATOM 0 HA GLN A 101 7.733 0.753 31.560 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.340 0.109 28.679 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.469 0.826 29.811 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.179 -1.156 31.336 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.079 -1.876 30.177 1.00 10.00 H new ATOM 0 HE21 GLN A 101 8.999 -3.377 28.814 1.00 10.00 H new ATOM 0 HE22 GLN A 101 10.698 -3.395 28.333 1.00 10.00 H new ATOM 1522 N HIS A 102 6.327 2.919 30.984 1.00 10.00 N ATOM 1523 CA HIS A 102 5.736 4.228 30.718 1.00 10.00 C ATOM 1524 C HIS A 102 6.746 5.266 30.226 1.00 10.00 C ATOM 1525 O HIS A 102 6.376 6.084 29.394 1.00 10.00 O ATOM 1526 CB HIS A 102 5.018 4.749 31.972 1.00 10.00 C ATOM 1527 CG HIS A 102 3.945 3.829 32.501 1.00 10.00 C ATOM 1528 ND1 HIS A 102 3.948 3.177 33.715 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.785 3.480 31.865 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.823 2.444 33.791 1.00 10.00 C ATOM 1531 NE2 HIS A 102 2.078 2.596 32.681 1.00 10.00 N ATOM 0 H HIS A 102 6.067 2.549 31.898 1.00 10.00 H new ATOM 0 HA HIS A 102 5.021 4.082 29.908 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.756 4.916 32.756 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.571 5.717 31.745 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.674 3.239 34.429 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.469 3.830 30.893 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.554 1.818 34.629 1.00 10.00 H new ATOM 1539 N ALA A 103 8.007 5.211 30.675 1.00 10.00 N ATOM 1540 CA ALA A 103 9.054 6.128 30.228 1.00 10.00 C ATOM 1541 C ALA A 103 9.247 6.099 28.705 1.00 10.00 C ATOM 1542 O ALA A 103 9.487 7.136 28.090 1.00 10.00 O ATOM 1543 CB ALA A 103 10.374 5.775 30.925 1.00 10.00 C ATOM 0 H ALA A 103 8.326 4.526 31.360 1.00 10.00 H new ATOM 0 HA ALA A 103 8.743 7.138 30.495 1.00 10.00 H new ATOM 0 HB1 ALA A 103 11.155 6.458 30.592 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.250 5.863 32.004 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.656 4.752 30.674 1.00 10.00 H new ATOM 1549 N ILE A 104 9.145 4.913 28.095 1.00 10.00 N ATOM 1550 CA ILE A 104 9.260 4.754 26.650 1.00 10.00 C ATOM 1551 C ILE A 104 8.077 5.495 26.023 1.00 10.00 C ATOM 1552 O ILE A 104 8.253 6.325 25.132 1.00 10.00 O ATOM 1553 CB ILE A 104 9.301 3.249 26.267 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.463 2.523 26.988 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.409 3.094 24.739 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.609 1.037 26.635 1.00 10.00 C ATOM 0 H ILE A 104 8.980 4.039 28.594 1.00 10.00 H new ATOM 0 HA ILE A 104 10.191 5.177 26.273 1.00 10.00 H new ATOM 0 HB ILE A 104 8.372 2.782 26.595 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.396 3.033 26.748 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.318 2.614 28.064 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.437 2.035 24.482 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.546 3.560 24.264 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.321 3.577 24.388 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.448 0.613 27.187 1.00 10.00 H new ATOM 0 HD12 ILE A 104 9.694 0.508 26.902 1.00 10.00 H new ATOM 0 HD13 ILE A 104 10.789 0.933 25.565 1.00 10.00 H new ATOM 1568 N SER A 105 6.862 5.205 26.498 1.00 10.00 N ATOM 1569 CA SER A 105 5.650 5.801 25.976 1.00 10.00 C ATOM 1570 C SER A 105 5.659 7.324 26.118 1.00 10.00 C ATOM 1571 O SER A 105 5.308 8.001 25.154 1.00 10.00 O ATOM 1572 CB SER A 105 4.440 5.173 26.668 1.00 10.00 C ATOM 1573 OG SER A 105 4.599 3.762 26.750 1.00 10.00 O ATOM 0 H SER A 105 6.701 4.546 27.259 1.00 10.00 H new ATOM 0 HA SER A 105 5.589 5.597 24.907 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.325 5.592 27.668 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.531 5.412 26.116 1.00 10.00 H new ATOM 0 HG SER A 105 4.031 3.410 27.467 1.00 10.00 H new ATOM 1579 N THR A 106 6.079 7.882 27.257 1.00 10.00 N ATOM 1580 CA THR A 106 6.052 9.324 27.448 1.00 10.00 C ATOM 1581 C THR A 106 6.977 10.023 26.460 1.00 10.00 C ATOM 1582 O THR A 106 6.573 11.041 25.909 1.00 10.00 O ATOM 1583 CB THR A 106 6.371 9.718 28.898 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.506 9.058 29.416 1.00 10.00 O ATOM 1585 CG2 THR A 106 5.203 9.378 29.818 1.00 10.00 C ATOM 0 H THR A 106 6.439 7.356 28.053 1.00 10.00 H new ATOM 0 HA THR A 106 5.035 9.661 27.248 1.00 10.00 H new ATOM 0 HB THR A 106 6.563 10.791 28.868 1.00 10.00 H new ATOM 0 HG1 THR A 106 8.005 8.641 28.683 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.450 9.665 30.840 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.314 9.919 29.493 1.00 10.00 H new ATOM 0 HG23 THR A 106 5.009 8.306 29.779 1.00 10.00 H new ATOM 1593 N GLU A 107 8.166 9.483 26.185 1.00 10.00 N ATOM 1594 CA GLU A 107 9.084 10.101 25.235 1.00 10.00 C ATOM 1595 C GLU A 107 8.502 10.067 23.822 1.00 10.00 C ATOM 1596 O GLU A 107 8.591 11.044 23.080 1.00 10.00 O ATOM 1597 CB GLU A 107 10.443 9.391 25.261 1.00 10.00 C ATOM 1598 CG GLU A 107 11.255 9.677 26.536 1.00 10.00 C ATOM 1599 CD GLU A 107 11.750 11.137 26.610 1.00 10.00 C ATOM 1600 OE1 GLU A 107 12.822 11.437 26.047 1.00 10.00 O ATOM 1601 OE2 GLU A 107 11.053 11.974 27.234 1.00 10.00 O ATOM 0 H GLU A 107 8.512 8.621 26.607 1.00 10.00 H new ATOM 0 HA GLU A 107 9.226 11.141 25.528 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.285 8.316 25.173 1.00 10.00 H new ATOM 0 HB3 GLU A 107 11.023 9.701 24.392 1.00 10.00 H new ATOM 0 HG2 GLU A 107 10.640 9.461 27.410 1.00 10.00 H new ATOM 0 HG3 GLU A 107 12.112 9.004 26.575 1.00 10.00 H new ATOM 1608 N LYS A 108 7.857 8.956 23.455 1.00 10.00 N ATOM 1609 CA LYS A 108 7.238 8.800 22.141 1.00 10.00 C ATOM 1610 C LYS A 108 6.067 9.771 21.995 1.00 10.00 C ATOM 1611 O LYS A 108 5.980 10.476 20.992 1.00 10.00 O ATOM 1612 CB LYS A 108 6.825 7.333 21.963 1.00 10.00 C ATOM 1613 CG LYS A 108 8.064 6.440 21.771 1.00 10.00 C ATOM 1614 CD LYS A 108 7.735 4.941 21.824 1.00 10.00 C ATOM 1615 CE LYS A 108 7.015 4.400 20.581 1.00 10.00 C ATOM 1616 NZ LYS A 108 7.868 4.436 19.373 1.00 10.00 N ATOM 0 H LYS A 108 7.751 8.142 24.061 1.00 10.00 H new ATOM 0 HA LYS A 108 7.943 9.047 21.348 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.262 7.000 22.835 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.164 7.238 21.101 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.527 6.671 20.812 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.797 6.673 22.543 1.00 10.00 H new ATOM 0 HD2 LYS A 108 8.662 4.384 21.962 1.00 10.00 H new ATOM 0 HD3 LYS A 108 7.114 4.749 22.699 1.00 10.00 H new ATOM 0 HE2 LYS A 108 6.697 3.374 20.767 1.00 10.00 H new ATOM 0 HE3 LYS A 108 6.113 4.986 20.403 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 7.533 3.727 18.690 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 7.820 5.381 18.942 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 8.852 4.225 19.636 1.00 10.00 H new ATOM 1630 N ILE A 109 5.197 9.873 23.004 1.00 10.00 N ATOM 1631 CA ILE A 109 4.119 10.862 23.032 1.00 10.00 C ATOM 1632 C ILE A 109 4.741 12.264 22.949 1.00 10.00 C ATOM 1633 O ILE A 109 4.239 13.106 22.215 1.00 10.00 O ATOM 1634 CB ILE A 109 3.229 10.661 24.284 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.521 9.282 24.287 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.140 11.748 24.397 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.023 8.870 25.682 1.00 10.00 C ATOM 0 H ILE A 109 5.222 9.270 23.826 1.00 10.00 H new ATOM 0 HA ILE A 109 3.457 10.737 22.175 1.00 10.00 H new ATOM 0 HB ILE A 109 3.910 10.725 25.133 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.676 9.311 23.599 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.210 8.524 23.914 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.539 11.569 25.288 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.611 12.729 24.467 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.500 11.715 23.515 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.536 7.897 25.622 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.868 8.811 26.367 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.311 9.610 26.047 1.00 10.00 H new ATOM 1649 N LYS A 110 5.840 12.538 23.654 1.00 10.00 N ATOM 1650 CA LYS A 110 6.481 13.852 23.641 1.00 10.00 C ATOM 1651 C LYS A 110 7.019 14.195 22.252 1.00 10.00 C ATOM 1652 O LYS A 110 6.906 15.341 21.839 1.00 10.00 O ATOM 1653 CB LYS A 110 7.565 13.893 24.729 1.00 10.00 C ATOM 1654 CG LYS A 110 7.967 15.329 25.102 1.00 10.00 C ATOM 1655 CD LYS A 110 8.812 15.414 26.388 1.00 10.00 C ATOM 1656 CE LYS A 110 8.103 14.744 27.578 1.00 10.00 C ATOM 1657 NZ LYS A 110 8.606 15.188 28.896 1.00 10.00 N ATOM 0 H LYS A 110 6.310 11.855 24.249 1.00 10.00 H new ATOM 0 HA LYS A 110 5.744 14.622 23.869 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.203 13.377 25.618 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.445 13.351 24.382 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.529 15.767 24.277 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.066 15.929 25.228 1.00 10.00 H new ATOM 0 HD2 LYS A 110 9.777 14.935 26.222 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.012 16.459 26.624 1.00 10.00 H new ATOM 0 HE2 LYS A 110 7.035 14.953 27.518 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.222 13.663 27.499 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 7.889 14.995 29.624 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 9.480 14.673 29.125 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 8.803 16.209 28.866 1.00 10.00 H new ATOM 1671 N ALA A 111 7.541 13.214 21.510 1.00 10.00 N ATOM 1672 CA ALA A 111 7.942 13.393 20.120 1.00 10.00 C ATOM 1673 C ALA A 111 6.727 13.693 19.230 1.00 10.00 C ATOM 1674 O ALA A 111 6.799 14.575 18.377 1.00 10.00 O ATOM 1675 CB ALA A 111 8.699 12.154 19.625 1.00 10.00 C ATOM 0 H ALA A 111 7.696 12.270 21.863 1.00 10.00 H new ATOM 0 HA ALA A 111 8.611 14.252 20.060 1.00 10.00 H new ATOM 0 HB1 ALA A 111 8.994 12.299 18.586 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.588 12.003 20.237 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.053 11.279 19.701 1.00 10.00 H new ATOM 1681 N LYS A 112 5.603 12.986 19.428 1.00 10.00 N ATOM 1682 CA LYS A 112 4.334 13.273 18.742 1.00 10.00 C ATOM 1683 C LYS A 112 3.819 14.681 19.099 1.00 10.00 C ATOM 1684 O LYS A 112 3.160 15.306 18.272 1.00 10.00 O ATOM 1685 CB LYS A 112 3.323 12.160 19.084 1.00 10.00 C ATOM 1686 CG LYS A 112 1.948 12.276 18.404 1.00 10.00 C ATOM 1687 CD LYS A 112 2.016 12.167 16.873 1.00 10.00 C ATOM 1688 CE LYS A 112 0.598 12.158 16.286 1.00 10.00 C ATOM 1689 NZ LYS A 112 0.601 12.082 14.803 1.00 10.00 N ATOM 0 H LYS A 112 5.549 12.196 20.071 1.00 10.00 H new ATOM 0 HA LYS A 112 4.483 13.277 17.662 1.00 10.00 H new ATOM 0 HB2 LYS A 112 3.762 11.200 18.813 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.174 12.149 20.164 1.00 10.00 H new ATOM 0 HG2 LYS A 112 1.293 11.494 18.788 1.00 10.00 H new ATOM 0 HG3 LYS A 112 1.496 13.231 18.674 1.00 10.00 H new ATOM 0 HD2 LYS A 112 2.582 13.004 16.465 1.00 10.00 H new ATOM 0 HD3 LYS A 112 2.543 11.256 16.588 1.00 10.00 H new ATOM 0 HE2 LYS A 112 0.046 11.309 16.690 1.00 10.00 H new ATOM 0 HE3 LYS A 112 0.072 13.059 16.600 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 -0.379 12.079 14.454 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 1.104 12.905 14.414 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 1.079 11.209 14.501 1.00 10.00 H new ATOM 1786 N VAL A 118 4.601 15.985 28.823 1.00 10.00 N ATOM 1787 CA VAL A 118 4.200 14.606 29.074 1.00 10.00 C ATOM 1788 C VAL A 118 5.047 14.106 30.246 1.00 10.00 C ATOM 1789 O VAL A 118 6.248 14.383 30.301 1.00 10.00 O ATOM 1790 CB VAL A 118 4.417 13.728 27.819 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.629 12.416 27.943 1.00 10.00 C ATOM 1792 CG2 VAL A 118 4.020 14.385 26.488 1.00 10.00 C ATOM 0 HA VAL A 118 3.138 14.550 29.312 1.00 10.00 H new ATOM 0 HB VAL A 118 5.494 13.562 27.789 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.791 11.809 27.053 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.969 11.869 28.822 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.566 12.638 28.042 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.209 13.691 25.669 1.00 10.00 H new ATOM 0 HG22 VAL A 118 2.960 14.640 26.510 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.608 15.291 26.340 1.00 10.00 H new ATOM 1802 N THR A 119 4.449 13.355 31.173 1.00 10.00 N ATOM 1803 CA THR A 119 5.096 12.883 32.398 1.00 10.00 C ATOM 1804 C THR A 119 4.525 11.513 32.787 1.00 10.00 C ATOM 1805 O THR A 119 3.478 11.126 32.265 1.00 10.00 O ATOM 1806 CB THR A 119 4.881 13.916 33.527 1.00 10.00 C ATOM 1807 OG1 THR A 119 3.616 14.554 33.445 1.00 10.00 O ATOM 1808 CG2 THR A 119 5.929 15.031 33.506 1.00 10.00 C ATOM 0 H THR A 119 3.479 13.051 31.090 1.00 10.00 H new ATOM 0 HA THR A 119 6.168 12.773 32.233 1.00 10.00 H new ATOM 0 HB THR A 119 4.958 13.333 34.445 1.00 10.00 H new ATOM 0 HG1 THR A 119 3.525 15.196 34.179 1.00 10.00 H new ATOM 0 HG21 THR A 119 5.733 15.730 34.319 1.00 10.00 H new ATOM 0 HG22 THR A 119 6.922 14.599 33.630 1.00 10.00 H new ATOM 0 HG23 THR A 119 5.879 15.559 32.554 1.00 10.00 H new ATOM 1816 N TRP A 120 5.183 10.788 33.694 1.00 10.00 N ATOM 1817 CA TRP A 120 4.623 9.576 34.278 1.00 10.00 C ATOM 1818 C TRP A 120 5.054 9.415 35.733 1.00 10.00 C ATOM 1819 O TRP A 120 6.048 9.999 36.165 1.00 10.00 O ATOM 1820 CB TRP A 120 5.020 8.330 33.465 1.00 10.00 C ATOM 1821 CG TRP A 120 6.456 7.916 33.555 1.00 10.00 C ATOM 1822 CD1 TRP A 120 7.484 8.441 32.851 1.00 10.00 C ATOM 1823 CD2 TRP A 120 7.048 6.895 34.415 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.666 7.847 33.240 1.00 10.00 N ATOM 1825 CE2 TRP A 120 8.457 6.876 34.197 1.00 10.00 C ATOM 1826 CE3 TRP A 120 6.530 5.976 35.356 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 9.310 5.997 34.883 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 7.375 5.089 36.049 1.00 10.00 C ATOM 1829 CH2 TRP A 120 8.763 5.099 35.816 1.00 10.00 C ATOM 0 H TRP A 120 6.113 11.026 34.040 1.00 10.00 H new ATOM 0 HA TRP A 120 3.538 9.673 34.249 1.00 10.00 H new ATOM 0 HB2 TRP A 120 4.401 7.495 33.792 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.780 8.513 32.417 1.00 10.00 H new ATOM 0 HD1 TRP A 120 7.393 9.210 32.098 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.582 8.095 32.866 1.00 10.00 H new ATOM 0 HE3 TRP A 120 5.467 5.954 35.547 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 10.374 6.011 34.696 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 6.956 4.396 36.764 1.00 10.00 H new ATOM 0 HH2 TRP A 120 9.407 4.418 36.353 1.00 10.00 H new ATOM 1840 N ALA A 121 4.317 8.567 36.459 1.00 10.00 N ATOM 1841 CA ALA A 121 4.624 8.073 37.795 1.00 10.00 C ATOM 1842 C ALA A 121 3.750 6.839 38.038 1.00 10.00 C ATOM 1843 O ALA A 121 2.781 6.614 37.311 1.00 10.00 O ATOM 1844 CB ALA A 121 4.317 9.145 38.854 1.00 10.00 C ATOM 0 H ALA A 121 3.439 8.188 36.103 1.00 10.00 H new ATOM 0 HA ALA A 121 5.683 7.824 37.870 1.00 10.00 H new ATOM 0 HB1 ALA A 121 4.553 8.756 39.845 1.00 10.00 H new ATOM 0 HB2 ALA A 121 4.920 10.032 38.659 1.00 10.00 H new ATOM 0 HB3 ALA A 121 3.260 9.408 38.810 1.00 10.00 H new