USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 761 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 138 THR OG1 : rot -83:sc= -0.453 USER MOD Set 1.2: A 140 SER OG : rot -90:sc= -1.16 USER MOD Set 2.1: A 56 TYR OH : rot 47:sc= -3.12! USER MOD Set 2.2: A 118 HIS : no HE2:sc= -6.56! C(o=-9.7!,f=-7.5!) USER MOD Single : A 41 GLN : amide:sc= -0.408 X(o=-0.41,f=-0.083) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 133:sc= -2.99 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -2.55 X(o=-2.6,f=-2.9) USER MOD Single : A 59 SER OG : rot 93:sc= 0.234 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -1.36 K(o=-1.4,f=-3.5!) USER MOD Single : A 85 SER OG : rot -100:sc= -0.748 USER MOD Single : A 86 ASN : amide:sc= -2.69 K(o=-2.7,f=-4.1!) USER MOD Single : A 87 ASN : amide:sc= -0.681 K(o=-0.68,f=-0.033) USER MOD Single : A 89 MET CE :methyl 153:sc= -0.0133 (180deg=-1.46) USER MOD Single : A 90 MET CE :methyl 160:sc= -7.68! (180deg=-10.1!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -4.1! C(o=-4.1!,f=-6.3!) USER MOD Single : A 96 THR OG1 : rot 73:sc= 1.25 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -130:sc= -0.256 USER MOD Single : A 102 THR OG1 : rot -43:sc= 0.19 USER MOD Single : A 106 ASN : amide:sc= -6.41! C(o=-6.4!,f=-10!) USER MOD Single : A 107 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0713) USER MOD Single : A 110 TYR OH : rot 110:sc= -3.02 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 1.15 K(o=1.1,f=-0.7) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.17) USER MOD Single : A 131 ASN : amide:sc= -4.78! C(o=-4.8!,f=-14!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -3.35 K(o=-3.4,f=-2.4) USER MOD Single : A 146 SER OG : rot 155:sc= -2.39! USER MOD Single : A 148 ASN : amide:sc= -2.45! C(o=-2.5!,f=-1.8!) USER MOD Single : A 150 HIS : no HD1:sc= -11.8! C(o=-12!,f=-13!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.399 -10.227 6.687 1.00 0.00 N ATOM 14 CA PHE A 37 7.502 -9.438 6.148 1.00 0.00 C ATOM 15 C PHE A 37 8.841 -9.932 6.689 1.00 0.00 C ATOM 16 O PHE A 37 9.785 -9.157 6.840 1.00 0.00 O ATOM 17 CB PHE A 37 7.319 -7.957 6.494 1.00 0.00 C ATOM 18 CG PHE A 37 5.890 -7.491 6.430 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.353 -6.723 7.450 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.088 -7.820 5.350 1.00 0.00 C ATOM 21 CE1 PHE A 37 4.041 -6.290 7.394 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.775 -7.392 5.288 1.00 0.00 C ATOM 23 CZ PHE A 37 3.252 -6.626 6.312 1.00 0.00 C ATOM 0 HA PHE A 37 7.500 -9.555 5.064 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.705 -7.777 7.497 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.918 -7.357 5.809 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.966 -6.459 8.299 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.493 -8.418 4.547 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.634 -5.690 8.195 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.159 -7.656 4.441 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.227 -6.290 6.266 1.00 0.00 H new ATOM 33 N ALA A 38 8.915 -11.227 6.981 1.00 0.00 N ATOM 34 CA ALA A 38 10.136 -11.825 7.507 1.00 0.00 C ATOM 35 C ALA A 38 11.186 -11.990 6.416 1.00 0.00 C ATOM 36 O ALA A 38 12.321 -11.538 6.556 1.00 0.00 O ATOM 37 CB ALA A 38 9.830 -13.167 8.155 1.00 0.00 C ATOM 0 H ALA A 38 8.143 -11.882 6.862 1.00 0.00 H new ATOM 0 HA ALA A 38 10.541 -11.152 8.262 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.751 -13.602 8.543 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.124 -13.024 8.973 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.396 -13.838 7.414 1.00 0.00 H new ATOM 43 N ASP A 39 10.795 -12.642 5.330 1.00 0.00 N ATOM 44 CA ASP A 39 11.697 -12.872 4.206 1.00 0.00 C ATOM 45 C ASP A 39 11.425 -11.892 3.065 1.00 0.00 C ATOM 46 O ASP A 39 11.998 -12.013 1.983 1.00 0.00 O ATOM 47 CB ASP A 39 11.554 -14.309 3.702 1.00 0.00 C ATOM 48 CG ASP A 39 12.797 -14.797 2.985 1.00 0.00 C ATOM 49 OD1 ASP A 39 13.905 -14.629 3.537 1.00 0.00 O ATOM 50 OD2 ASP A 39 12.664 -15.348 1.873 1.00 0.00 O ATOM 0 H ASP A 39 9.857 -13.022 5.202 1.00 0.00 H new ATOM 0 HA ASP A 39 12.716 -12.711 4.557 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.342 -14.967 4.545 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.701 -14.371 3.027 1.00 0.00 H new ATOM 55 N ALA A 40 10.546 -10.924 3.312 1.00 0.00 N ATOM 56 CA ALA A 40 10.202 -9.928 2.305 1.00 0.00 C ATOM 57 C ALA A 40 11.429 -9.131 1.875 1.00 0.00 C ATOM 58 O ALA A 40 12.226 -8.704 2.710 1.00 0.00 O ATOM 59 CB ALA A 40 9.126 -8.996 2.838 1.00 0.00 C ATOM 0 H ALA A 40 10.060 -10.810 4.201 1.00 0.00 H new ATOM 0 HA ALA A 40 9.818 -10.450 1.429 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.877 -8.256 2.078 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.236 -9.573 3.088 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.493 -8.490 3.731 1.00 0.00 H new ATOM 65 N GLN A 41 11.569 -8.928 0.569 1.00 0.00 N ATOM 66 CA GLN A 41 12.696 -8.174 0.033 1.00 0.00 C ATOM 67 C GLN A 41 12.646 -6.731 0.519 1.00 0.00 C ATOM 68 O GLN A 41 11.684 -6.323 1.170 1.00 0.00 O ATOM 69 CB GLN A 41 12.689 -8.218 -1.496 1.00 0.00 C ATOM 70 CG GLN A 41 14.027 -8.614 -2.100 1.00 0.00 C ATOM 71 CD GLN A 41 14.406 -7.756 -3.291 1.00 0.00 C ATOM 72 OE1 GLN A 41 14.772 -8.270 -4.348 1.00 0.00 O ATOM 73 NE2 GLN A 41 14.320 -6.441 -3.126 1.00 0.00 N ATOM 0 H GLN A 41 10.918 -9.274 -0.136 1.00 0.00 H new ATOM 0 HA GLN A 41 13.619 -8.631 0.389 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.927 -8.924 -1.827 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.403 -7.238 -1.878 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.803 -8.535 -1.338 1.00 0.00 H new ATOM 0 HG3 GLN A 41 13.988 -9.659 -2.408 1.00 0.00 H new ATOM 0 HE21 GLN A 41 14.012 -6.058 -2.232 1.00 0.00 H new ATOM 0 HE22 GLN A 41 14.562 -5.814 -3.893 1.00 0.00 H new ATOM 82 N THR A 42 13.680 -5.958 0.205 1.00 0.00 N ATOM 83 CA THR A 42 13.729 -4.564 0.625 1.00 0.00 C ATOM 84 C THR A 42 14.584 -3.720 -0.315 1.00 0.00 C ATOM 85 O THR A 42 15.587 -4.186 -0.856 1.00 0.00 O ATOM 86 CB THR A 42 14.268 -4.458 2.056 1.00 0.00 C ATOM 87 OG1 THR A 42 14.844 -5.684 2.471 1.00 0.00 O ATOM 88 CG2 THR A 42 13.206 -4.085 3.069 1.00 0.00 C ATOM 0 H THR A 42 14.488 -6.270 -0.334 1.00 0.00 H new ATOM 0 HA THR A 42 12.711 -4.176 0.591 1.00 0.00 H new ATOM 0 HB THR A 42 15.014 -3.664 2.023 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.183 -5.593 3.386 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.654 -4.027 4.061 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.777 -3.118 2.807 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.421 -4.842 3.069 1.00 0.00 H new ATOM 96 N ARG A 43 14.175 -2.469 -0.493 1.00 0.00 N ATOM 97 CA ARG A 43 14.886 -1.529 -1.351 1.00 0.00 C ATOM 98 C ARG A 43 14.562 -0.100 -0.930 1.00 0.00 C ATOM 99 O ARG A 43 13.556 0.137 -0.269 1.00 0.00 O ATOM 100 CB ARG A 43 14.504 -1.747 -2.817 1.00 0.00 C ATOM 101 CG ARG A 43 15.171 -0.772 -3.773 1.00 0.00 C ATOM 102 CD ARG A 43 14.747 -1.026 -5.211 1.00 0.00 C ATOM 103 NE ARG A 43 13.313 -0.829 -5.402 1.00 0.00 N ATOM 104 CZ ARG A 43 12.627 -1.322 -6.430 1.00 0.00 C ATOM 105 NH1 ARG A 43 13.239 -2.041 -7.363 1.00 0.00 N ATOM 106 NH2 ARG A 43 11.324 -1.095 -6.527 1.00 0.00 N ATOM 0 H ARG A 43 13.344 -2.079 -0.048 1.00 0.00 H new ATOM 0 HA ARG A 43 15.958 -1.698 -1.246 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.770 -2.764 -3.105 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.422 -1.659 -2.918 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.914 0.249 -3.491 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.254 -0.862 -3.690 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.296 -0.358 -5.874 1.00 0.00 H new ATOM 0 HD3 ARG A 43 15.014 -2.045 -5.493 1.00 0.00 H new ATOM 0 HE ARG A 43 12.807 -0.281 -4.706 1.00 0.00 H new ATOM 0 HH11 ARG A 43 14.241 -2.219 -7.294 1.00 0.00 H new ATOM 0 HH12 ARG A 43 12.707 -2.416 -8.148 1.00 0.00 H new ATOM 0 HH21 ARG A 43 10.848 -0.543 -5.814 1.00 0.00 H new ATOM 0 HH22 ARG A 43 10.798 -1.473 -7.315 1.00 0.00 H new ATOM 120 N LYS A 44 15.412 0.849 -1.300 1.00 0.00 N ATOM 121 CA LYS A 44 15.186 2.239 -0.931 1.00 0.00 C ATOM 122 C LYS A 44 14.201 2.917 -1.872 1.00 0.00 C ATOM 123 O LYS A 44 14.254 2.743 -3.089 1.00 0.00 O ATOM 124 CB LYS A 44 16.503 3.008 -0.902 1.00 0.00 C ATOM 125 CG LYS A 44 16.810 3.595 0.462 1.00 0.00 C ATOM 126 CD LYS A 44 17.957 4.591 0.399 1.00 0.00 C ATOM 127 CE LYS A 44 17.453 6.025 0.375 1.00 0.00 C ATOM 128 NZ LYS A 44 17.854 6.776 1.597 1.00 0.00 N ATOM 0 H LYS A 44 16.255 0.684 -1.849 1.00 0.00 H new ATOM 0 HA LYS A 44 14.751 2.245 0.068 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.314 2.342 -1.197 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.466 3.811 -1.638 1.00 0.00 H new ATOM 0 HG2 LYS A 44 15.921 4.088 0.855 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.062 2.793 1.155 1.00 0.00 H new ATOM 0 HD2 LYS A 44 18.611 4.449 1.260 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.556 4.401 -0.491 1.00 0.00 H new ATOM 0 HE2 LYS A 44 17.844 6.532 -0.507 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.366 6.026 0.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 17.491 7.749 1.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 17.460 6.307 2.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 18.891 6.797 1.667 1.00 0.00 H new ATOM 142 N LEU A 45 13.301 3.692 -1.281 1.00 0.00 N ATOM 143 CA LEU A 45 12.283 4.414 -2.028 1.00 0.00 C ATOM 144 C LEU A 45 12.900 5.564 -2.819 1.00 0.00 C ATOM 145 O LEU A 45 13.661 6.365 -2.276 1.00 0.00 O ATOM 146 CB LEU A 45 11.226 4.950 -1.057 1.00 0.00 C ATOM 147 CG LEU A 45 9.887 5.370 -1.679 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.561 4.537 -2.911 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.772 5.249 -0.652 1.00 0.00 C ATOM 0 H LEU A 45 13.257 3.837 -0.272 1.00 0.00 H new ATOM 0 HA LEU A 45 11.816 3.730 -2.737 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.030 4.184 -0.306 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.645 5.809 -0.534 1.00 0.00 H new ATOM 0 HG LEU A 45 9.974 6.410 -1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.607 4.860 -3.327 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.345 4.668 -3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.498 3.485 -2.633 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.827 5.549 -1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.700 4.215 -0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.989 5.895 0.199 1.00 0.00 H new ATOM 161 N THR A 46 12.566 5.641 -4.102 1.00 0.00 N ATOM 162 CA THR A 46 13.085 6.695 -4.964 1.00 0.00 C ATOM 163 C THR A 46 12.296 7.987 -4.772 1.00 0.00 C ATOM 164 O THR A 46 11.128 7.957 -4.386 1.00 0.00 O ATOM 165 CB THR A 46 13.027 6.266 -6.431 1.00 0.00 C ATOM 166 OG1 THR A 46 11.704 6.364 -6.929 1.00 0.00 O ATOM 167 CG2 THR A 46 13.502 4.848 -6.663 1.00 0.00 C ATOM 0 H THR A 46 11.938 4.986 -4.568 1.00 0.00 H new ATOM 0 HA THR A 46 14.124 6.874 -4.688 1.00 0.00 H new ATOM 0 HB THR A 46 13.699 6.945 -6.956 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.714 6.819 -7.797 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.434 4.611 -7.725 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.537 4.753 -6.336 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.877 4.158 -6.096 1.00 0.00 H new ATOM 175 N PRO A 47 12.923 9.144 -5.046 1.00 0.00 N ATOM 176 CA PRO A 47 12.266 10.446 -4.904 1.00 0.00 C ATOM 177 C PRO A 47 11.048 10.572 -5.809 1.00 0.00 C ATOM 178 O PRO A 47 10.044 11.180 -5.435 1.00 0.00 O ATOM 179 CB PRO A 47 13.349 11.452 -5.316 1.00 0.00 C ATOM 180 CG PRO A 47 14.339 10.658 -6.099 1.00 0.00 C ATOM 181 CD PRO A 47 14.311 9.274 -5.517 1.00 0.00 C ATOM 0 HA PRO A 47 11.893 10.604 -3.892 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.929 12.260 -5.915 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.813 11.911 -4.443 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.077 10.642 -7.157 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.336 11.093 -6.024 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.557 8.517 -6.262 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.026 9.164 -4.702 1.00 0.00 H new ATOM 189 N GLU A 48 11.138 9.987 -6.998 1.00 0.00 N ATOM 190 CA GLU A 48 10.036 10.028 -7.951 1.00 0.00 C ATOM 191 C GLU A 48 8.853 9.222 -7.430 1.00 0.00 C ATOM 192 O GLU A 48 7.720 9.706 -7.403 1.00 0.00 O ATOM 193 CB GLU A 48 10.485 9.484 -9.309 1.00 0.00 C ATOM 194 CG GLU A 48 9.887 10.229 -10.491 1.00 0.00 C ATOM 195 CD GLU A 48 10.513 9.826 -11.811 1.00 0.00 C ATOM 196 OE1 GLU A 48 10.019 8.863 -12.433 1.00 0.00 O ATOM 197 OE2 GLU A 48 11.499 10.474 -12.223 1.00 0.00 O ATOM 0 H GLU A 48 11.961 9.480 -7.324 1.00 0.00 H new ATOM 0 HA GLU A 48 9.726 11.066 -8.074 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.572 9.535 -9.370 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.211 8.431 -9.378 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.814 10.041 -10.529 1.00 0.00 H new ATOM 0 HG3 GLU A 48 10.017 11.301 -10.344 1.00 0.00 H new ATOM 204 N GLU A 49 9.125 7.992 -7.005 1.00 0.00 N ATOM 205 CA GLU A 49 8.085 7.123 -6.473 1.00 0.00 C ATOM 206 C GLU A 49 7.562 7.666 -5.149 1.00 0.00 C ATOM 207 O GLU A 49 6.388 7.500 -4.818 1.00 0.00 O ATOM 208 CB GLU A 49 8.625 5.705 -6.276 1.00 0.00 C ATOM 209 CG GLU A 49 9.293 5.128 -7.514 1.00 0.00 C ATOM 210 CD GLU A 49 10.294 4.039 -7.181 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.919 4.117 -6.101 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.451 3.106 -7.996 1.00 0.00 O ATOM 0 H GLU A 49 10.056 7.576 -7.019 1.00 0.00 H new ATOM 0 HA GLU A 49 7.264 7.093 -7.190 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.343 5.710 -5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.805 5.051 -5.978 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.530 4.724 -8.179 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.798 5.927 -8.056 1.00 0.00 H new ATOM 219 N ARG A 50 8.444 8.317 -4.397 1.00 0.00 N ATOM 220 CA ARG A 50 8.077 8.887 -3.109 1.00 0.00 C ATOM 221 C ARG A 50 7.209 10.128 -3.290 1.00 0.00 C ATOM 222 O ARG A 50 6.288 10.374 -2.512 1.00 0.00 O ATOM 223 CB ARG A 50 9.332 9.240 -2.311 1.00 0.00 C ATOM 224 CG ARG A 50 9.052 9.606 -0.864 1.00 0.00 C ATOM 225 CD ARG A 50 10.335 9.926 -0.113 1.00 0.00 C ATOM 226 NE ARG A 50 10.626 8.935 0.920 1.00 0.00 N ATOM 227 CZ ARG A 50 10.240 9.048 2.190 1.00 0.00 C ATOM 228 NH1 ARG A 50 9.534 10.099 2.590 1.00 0.00 N ATOM 229 NH2 ARG A 50 10.552 8.100 3.061 1.00 0.00 N ATOM 0 H ARG A 50 9.419 8.462 -4.660 1.00 0.00 H new ATOM 0 HA ARG A 50 7.502 8.142 -2.560 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.018 8.393 -2.336 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.838 10.075 -2.796 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.384 10.466 -0.828 1.00 0.00 H new ATOM 0 HG3 ARG A 50 8.537 8.781 -0.372 1.00 0.00 H new ATOM 0 HD2 ARG A 50 11.166 9.970 -0.817 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.251 10.912 0.344 1.00 0.00 H new ATOM 0 HE ARG A 50 11.157 8.106 0.653 1.00 0.00 H new ATOM 0 HH11 ARG A 50 9.283 10.828 1.923 1.00 0.00 H new ATOM 0 HH12 ARG A 50 9.243 10.177 3.564 1.00 0.00 H new ATOM 0 HH21 ARG A 50 11.087 7.286 2.759 1.00 0.00 H new ATOM 0 HH22 ARG A 50 10.258 8.184 4.034 1.00 0.00 H new ATOM 243 N SER A 51 7.511 10.905 -4.324 1.00 0.00 N ATOM 244 CA SER A 51 6.758 12.120 -4.608 1.00 0.00 C ATOM 245 C SER A 51 5.348 11.784 -5.081 1.00 0.00 C ATOM 246 O SER A 51 4.371 12.396 -4.648 1.00 0.00 O ATOM 247 CB SER A 51 7.476 12.959 -5.667 1.00 0.00 C ATOM 248 OG SER A 51 7.174 14.335 -5.520 1.00 0.00 O ATOM 0 H SER A 51 8.270 10.715 -4.978 1.00 0.00 H new ATOM 0 HA SER A 51 6.688 12.697 -3.686 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.553 12.809 -5.585 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.182 12.623 -6.662 1.00 0.00 H new ATOM 0 HG SER A 51 7.647 14.849 -6.208 1.00 0.00 H new ATOM 254 N ALA A 52 5.250 10.805 -5.967 1.00 0.00 N ATOM 255 CA ALA A 52 3.960 10.385 -6.497 1.00 0.00 C ATOM 256 C ALA A 52 3.098 9.779 -5.401 1.00 0.00 C ATOM 257 O ALA A 52 1.934 10.143 -5.236 1.00 0.00 O ATOM 258 CB ALA A 52 4.156 9.396 -7.630 1.00 0.00 C ATOM 0 H ALA A 52 6.047 10.286 -6.335 1.00 0.00 H new ATOM 0 HA ALA A 52 3.444 11.263 -6.886 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.184 9.090 -8.018 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.733 9.865 -8.427 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.692 8.521 -7.261 1.00 0.00 H new ATOM 264 N VAL A 53 3.685 8.862 -4.645 1.00 0.00 N ATOM 265 CA VAL A 53 2.983 8.214 -3.548 1.00 0.00 C ATOM 266 C VAL A 53 2.474 9.259 -2.570 1.00 0.00 C ATOM 267 O VAL A 53 1.278 9.340 -2.295 1.00 0.00 O ATOM 268 CB VAL A 53 3.897 7.214 -2.808 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.206 6.653 -1.572 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.321 6.090 -3.741 1.00 0.00 C ATOM 0 H VAL A 53 4.648 8.550 -4.772 1.00 0.00 H new ATOM 0 HA VAL A 53 2.142 7.662 -3.968 1.00 0.00 H new ATOM 0 HB VAL A 53 4.789 7.748 -2.481 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.872 5.951 -1.070 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.958 7.468 -0.892 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.293 6.137 -1.868 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.965 5.394 -3.203 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.437 5.563 -4.101 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.865 6.507 -4.589 1.00 0.00 H new ATOM 280 N GLU A 54 3.394 10.071 -2.066 1.00 0.00 N ATOM 281 CA GLU A 54 3.042 11.130 -1.129 1.00 0.00 C ATOM 282 C GLU A 54 1.917 11.988 -1.701 1.00 0.00 C ATOM 283 O GLU A 54 1.035 12.444 -0.973 1.00 0.00 O ATOM 284 CB GLU A 54 4.276 11.984 -0.799 1.00 0.00 C ATOM 285 CG GLU A 54 4.611 13.040 -1.843 1.00 0.00 C ATOM 286 CD GLU A 54 5.532 14.116 -1.304 1.00 0.00 C ATOM 287 OE1 GLU A 54 5.528 15.234 -1.861 1.00 0.00 O ATOM 288 OE2 GLU A 54 6.259 13.841 -0.326 1.00 0.00 O ATOM 0 H GLU A 54 4.388 10.017 -2.290 1.00 0.00 H new ATOM 0 HA GLU A 54 2.687 10.679 -0.202 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.115 12.477 0.160 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.136 11.325 -0.678 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.081 12.561 -2.702 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.689 13.500 -2.199 1.00 0.00 H new ATOM 295 N ASN A 55 1.946 12.183 -3.017 1.00 0.00 N ATOM 296 CA ASN A 55 0.920 12.962 -3.696 1.00 0.00 C ATOM 297 C ASN A 55 -0.404 12.214 -3.671 1.00 0.00 C ATOM 298 O ASN A 55 -1.475 12.818 -3.591 1.00 0.00 O ATOM 299 CB ASN A 55 1.328 13.239 -5.146 1.00 0.00 C ATOM 300 CG ASN A 55 2.470 14.227 -5.250 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.603 15.132 -4.426 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.301 14.057 -6.270 1.00 0.00 N ATOM 0 H ASN A 55 2.670 11.811 -3.632 1.00 0.00 H new ATOM 0 HA ASN A 55 0.807 13.913 -3.175 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.618 12.303 -5.623 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.468 13.624 -5.694 1.00 0.00 H new ATOM 0 HD21 ASN A 55 4.090 14.691 -6.396 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.151 13.292 -6.928 1.00 0.00 H new ATOM 309 N TYR A 56 -0.318 10.891 -3.743 1.00 0.00 N ATOM 310 CA TYR A 56 -1.494 10.041 -3.732 1.00 0.00 C ATOM 311 C TYR A 56 -2.110 9.982 -2.333 1.00 0.00 C ATOM 312 O TYR A 56 -3.314 10.175 -2.167 1.00 0.00 O ATOM 313 CB TYR A 56 -1.115 8.639 -4.217 1.00 0.00 C ATOM 314 CG TYR A 56 -2.123 7.579 -3.856 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.752 6.461 -3.124 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.449 7.707 -4.237 1.00 0.00 C ATOM 317 CE1 TYR A 56 -2.677 5.500 -2.780 1.00 0.00 C ATOM 318 CE2 TYR A 56 -4.380 6.749 -3.899 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.991 5.648 -3.170 1.00 0.00 C ATOM 320 OH TYR A 56 -4.918 4.696 -2.825 1.00 0.00 O ATOM 0 H TYR A 56 0.564 10.384 -3.810 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.241 10.461 -4.405 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.995 8.659 -5.300 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -0.148 8.367 -3.794 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.723 6.342 -2.819 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.758 8.571 -4.807 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -2.375 4.635 -2.208 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -5.410 6.861 -4.205 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.819 4.472 -1.876 1.00 0.00 H new ATOM 330 N LEU A 57 -1.276 9.716 -1.331 1.00 0.00 N ATOM 331 CA LEU A 57 -1.743 9.635 0.051 1.00 0.00 C ATOM 332 C LEU A 57 -2.221 10.999 0.538 1.00 0.00 C ATOM 333 O LEU A 57 -3.223 11.106 1.245 1.00 0.00 O ATOM 334 CB LEU A 57 -0.626 9.131 0.970 1.00 0.00 C ATOM 335 CG LEU A 57 0.295 8.073 0.364 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.233 7.511 1.420 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.519 6.962 -0.276 1.00 0.00 C ATOM 0 H LEU A 57 -0.276 9.553 -1.449 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.576 8.932 0.081 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.020 9.983 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.079 8.720 1.872 1.00 0.00 H new ATOM 0 HG LEU A 57 0.898 8.546 -0.411 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.881 6.759 0.969 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.843 8.316 1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.649 7.054 2.219 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.153 6.218 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.149 6.492 0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.146 7.378 -1.064 1.00 0.00 H new ATOM 349 N GLU A 58 -1.487 12.040 0.158 1.00 0.00 N ATOM 350 CA GLU A 58 -1.822 13.404 0.554 1.00 0.00 C ATOM 351 C GLU A 58 -3.140 13.841 -0.069 1.00 0.00 C ATOM 352 O GLU A 58 -4.027 14.348 0.617 1.00 0.00 O ATOM 353 CB GLU A 58 -0.705 14.365 0.145 1.00 0.00 C ATOM 354 CG GLU A 58 -0.909 15.785 0.649 1.00 0.00 C ATOM 355 CD GLU A 58 0.296 16.671 0.401 1.00 0.00 C ATOM 356 OE1 GLU A 58 1.418 16.264 0.771 1.00 0.00 O ATOM 357 OE2 GLU A 58 0.119 17.770 -0.165 1.00 0.00 O ATOM 0 H GLU A 58 -0.654 11.965 -0.425 1.00 0.00 H new ATOM 0 HA GLU A 58 -1.929 13.426 1.638 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.245 13.987 0.523 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.631 14.381 -0.942 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.781 16.219 0.159 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.123 15.760 1.717 1.00 0.00 H new ATOM 364 N SER A 59 -3.264 13.631 -1.373 1.00 0.00 N ATOM 365 CA SER A 59 -4.479 13.993 -2.091 1.00 0.00 C ATOM 366 C SER A 59 -5.632 13.093 -1.662 1.00 0.00 C ATOM 367 O SER A 59 -6.795 13.494 -1.689 1.00 0.00 O ATOM 368 CB SER A 59 -4.261 13.880 -3.601 1.00 0.00 C ATOM 369 OG SER A 59 -3.432 14.926 -4.077 1.00 0.00 O ATOM 0 H SER A 59 -2.538 13.212 -1.955 1.00 0.00 H new ATOM 0 HA SER A 59 -4.728 15.026 -1.850 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.807 12.917 -3.835 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.222 13.912 -4.114 1.00 0.00 H new ATOM 0 HG SER A 59 -2.500 14.624 -4.091 1.00 0.00 H new ATOM 623 N SER A 78 -5.546 7.793 7.061 1.00 0.00 N ATOM 624 CA SER A 78 -4.384 8.055 6.222 1.00 0.00 C ATOM 625 C SER A 78 -3.100 7.716 6.970 1.00 0.00 C ATOM 626 O SER A 78 -3.033 7.845 8.193 1.00 0.00 O ATOM 627 CB SER A 78 -4.363 9.520 5.781 1.00 0.00 C ATOM 628 OG SER A 78 -3.896 10.360 6.823 1.00 0.00 O ATOM 0 HA SER A 78 -4.451 7.423 5.336 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.722 9.630 4.906 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.365 9.828 5.483 1.00 0.00 H new ATOM 0 HG SER A 78 -3.891 11.290 6.516 1.00 0.00 H new ATOM 634 N LEU A 79 -2.084 7.278 6.236 1.00 0.00 N ATOM 635 CA LEU A 79 -0.808 6.917 6.851 1.00 0.00 C ATOM 636 C LEU A 79 0.234 8.014 6.642 1.00 0.00 C ATOM 637 O LEU A 79 0.359 8.570 5.551 1.00 0.00 O ATOM 638 CB LEU A 79 -0.293 5.582 6.293 1.00 0.00 C ATOM 639 CG LEU A 79 -1.007 5.066 5.044 1.00 0.00 C ATOM 640 CD1 LEU A 79 -0.539 5.822 3.811 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.770 3.571 4.883 1.00 0.00 C ATOM 0 H LEU A 79 -2.115 7.164 5.223 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.976 6.805 7.922 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.767 5.690 6.065 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.376 4.827 7.074 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.078 5.235 5.159 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.058 5.441 2.932 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.758 6.883 3.930 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.535 5.685 3.686 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.284 3.215 3.990 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.299 3.380 4.787 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.155 3.045 5.757 1.00 0.00 H new ATOM 653 N ALA A 80 0.987 8.316 7.701 1.00 0.00 N ATOM 654 CA ALA A 80 2.024 9.341 7.642 1.00 0.00 C ATOM 655 C ALA A 80 3.380 8.717 7.330 1.00 0.00 C ATOM 656 O ALA A 80 3.760 7.710 7.924 1.00 0.00 O ATOM 657 CB ALA A 80 2.084 10.111 8.953 1.00 0.00 C ATOM 0 H ALA A 80 0.896 7.863 8.610 1.00 0.00 H new ATOM 0 HA ALA A 80 1.774 10.037 6.841 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.862 10.872 8.893 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.122 10.590 9.138 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.310 9.424 9.768 1.00 0.00 H new ATOM 663 N LEU A 81 4.103 9.314 6.390 1.00 0.00 N ATOM 664 CA LEU A 81 5.409 8.802 5.988 1.00 0.00 C ATOM 665 C LEU A 81 6.427 8.895 7.122 1.00 0.00 C ATOM 666 O LEU A 81 6.693 9.975 7.650 1.00 0.00 O ATOM 667 CB LEU A 81 5.922 9.563 4.765 1.00 0.00 C ATOM 668 CG LEU A 81 5.486 8.989 3.416 1.00 0.00 C ATOM 669 CD1 LEU A 81 4.157 9.589 2.984 1.00 0.00 C ATOM 670 CD2 LEU A 81 6.554 9.242 2.361 1.00 0.00 C ATOM 0 H LEU A 81 3.808 10.153 5.891 1.00 0.00 H new ATOM 0 HA LEU A 81 5.285 7.749 5.735 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.582 10.596 4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 81 7.011 9.583 4.799 1.00 0.00 H new ATOM 0 HG LEU A 81 5.356 7.912 3.525 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.863 9.168 2.022 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.395 9.359 3.728 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.259 10.670 2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 81 6.228 8.827 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.714 10.315 2.255 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.486 8.765 2.665 1.00 0.00 H new ATOM 682 N ASN A 82 6.997 7.748 7.479 1.00 0.00 N ATOM 683 CA ASN A 82 7.997 7.673 8.538 1.00 0.00 C ATOM 684 C ASN A 82 9.356 7.299 7.961 1.00 0.00 C ATOM 685 O ASN A 82 9.504 7.136 6.749 1.00 0.00 O ATOM 686 CB ASN A 82 7.590 6.648 9.596 1.00 0.00 C ATOM 687 CG ASN A 82 6.796 7.265 10.728 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.256 8.363 10.597 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.724 6.559 11.851 1.00 0.00 N ATOM 0 H ASN A 82 6.780 6.850 7.046 1.00 0.00 H new ATOM 0 HA ASN A 82 8.065 8.655 9.007 1.00 0.00 H new ATOM 0 HB2 ASN A 82 6.997 5.863 9.127 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.484 6.174 10.000 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.205 6.923 12.650 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.188 5.653 11.914 1.00 0.00 H new ATOM 696 N ALA A 83 10.347 7.165 8.833 1.00 0.00 N ATOM 697 CA ALA A 83 11.693 6.808 8.404 1.00 0.00 C ATOM 698 C ALA A 83 11.701 5.479 7.656 1.00 0.00 C ATOM 699 O ALA A 83 12.571 5.235 6.820 1.00 0.00 O ATOM 700 CB ALA A 83 12.638 6.753 9.592 1.00 0.00 C ATOM 0 H ALA A 83 10.245 7.298 9.839 1.00 0.00 H new ATOM 0 HA ALA A 83 12.039 7.582 7.719 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.638 6.485 9.250 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.670 7.729 10.077 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.285 6.006 10.303 1.00 0.00 H new ATOM 706 N GLU A 84 10.723 4.623 7.947 1.00 0.00 N ATOM 707 CA GLU A 84 10.625 3.334 7.283 1.00 0.00 C ATOM 708 C GLU A 84 10.077 3.513 5.872 1.00 0.00 C ATOM 709 O GLU A 84 10.294 2.674 4.999 1.00 0.00 O ATOM 710 CB GLU A 84 9.737 2.384 8.087 1.00 0.00 C ATOM 711 CG GLU A 84 10.297 0.975 8.195 1.00 0.00 C ATOM 712 CD GLU A 84 9.966 0.123 6.985 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.339 0.648 6.041 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.336 -1.070 6.982 1.00 0.00 O ATOM 0 H GLU A 84 9.992 4.802 8.636 1.00 0.00 H new ATOM 0 HA GLU A 84 11.621 2.897 7.218 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.599 2.789 9.089 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.752 2.340 7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.379 1.026 8.314 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.900 0.498 9.091 1.00 0.00 H new ATOM 721 N SER A 85 9.381 4.630 5.654 1.00 0.00 N ATOM 722 CA SER A 85 8.816 4.943 4.347 1.00 0.00 C ATOM 723 C SER A 85 9.912 5.000 3.284 1.00 0.00 C ATOM 724 O SER A 85 9.631 4.949 2.088 1.00 0.00 O ATOM 725 CB SER A 85 8.061 6.272 4.395 1.00 0.00 C ATOM 726 OG SER A 85 6.851 6.198 3.662 1.00 0.00 O ATOM 0 H SER A 85 9.196 5.333 6.370 1.00 0.00 H new ATOM 0 HA SER A 85 8.116 4.151 4.081 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.847 6.535 5.431 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.688 7.065 3.988 1.00 0.00 H new ATOM 0 HG SER A 85 6.976 6.610 2.782 1.00 0.00 H new ATOM 732 N ASN A 86 11.164 5.098 3.728 1.00 0.00 N ATOM 733 CA ASN A 86 12.295 5.146 2.814 1.00 0.00 C ATOM 734 C ASN A 86 12.710 3.738 2.408 1.00 0.00 C ATOM 735 O ASN A 86 13.454 3.553 1.446 1.00 0.00 O ATOM 736 CB ASN A 86 13.481 5.861 3.461 1.00 0.00 C ATOM 737 CG ASN A 86 13.080 7.142 4.160 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.434 7.118 5.208 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.464 8.270 3.579 1.00 0.00 N ATOM 0 H ASN A 86 11.417 5.145 4.715 1.00 0.00 H new ATOM 0 HA ASN A 86 11.989 5.700 1.927 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.955 5.193 4.180 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.225 6.086 2.697 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.225 9.168 4.000 1.00 0.00 H new ATOM 0 HD22 ASN A 86 13.998 8.240 2.711 1.00 0.00 H new ATOM 746 N ASN A 87 12.230 2.747 3.151 1.00 0.00 N ATOM 747 CA ASN A 87 12.556 1.360 2.866 1.00 0.00 C ATOM 748 C ASN A 87 11.322 0.609 2.383 1.00 0.00 C ATOM 749 O ASN A 87 10.435 0.284 3.172 1.00 0.00 O ATOM 750 CB ASN A 87 13.105 0.686 4.124 1.00 0.00 C ATOM 751 CG ASN A 87 14.038 1.584 4.913 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.088 1.997 4.421 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.654 1.889 6.147 1.00 0.00 N ATOM 0 H ASN A 87 11.615 2.881 3.954 1.00 0.00 H new ATOM 0 HA ASN A 87 13.312 1.337 2.081 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.274 0.384 4.761 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.636 -0.223 3.841 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.238 2.489 6.729 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.775 1.523 6.513 1.00 0.00 H new ATOM 760 N VAL A 88 11.278 0.328 1.086 1.00 0.00 N ATOM 761 CA VAL A 88 10.155 -0.392 0.493 1.00 0.00 C ATOM 762 C VAL A 88 10.298 -1.894 0.698 1.00 0.00 C ATOM 763 O VAL A 88 11.314 -2.489 0.341 1.00 0.00 O ATOM 764 CB VAL A 88 10.029 -0.097 -1.015 1.00 0.00 C ATOM 765 CG1 VAL A 88 8.793 -0.772 -1.594 1.00 0.00 C ATOM 766 CG2 VAL A 88 9.988 1.404 -1.264 1.00 0.00 C ATOM 0 H VAL A 88 12.008 0.588 0.423 1.00 0.00 H new ATOM 0 HA VAL A 88 9.254 -0.044 0.997 1.00 0.00 H new ATOM 0 HB VAL A 88 10.906 -0.504 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.723 -0.551 -2.659 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.867 -1.850 -1.451 1.00 0.00 H new ATOM 0 HG13 VAL A 88 7.903 -0.399 -1.087 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.899 1.593 -2.334 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.131 1.835 -0.747 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.905 1.860 -0.890 1.00 0.00 H new ATOM 776 N MET A 89 9.267 -2.496 1.279 1.00 0.00 N ATOM 777 CA MET A 89 9.261 -3.930 1.541 1.00 0.00 C ATOM 778 C MET A 89 8.516 -4.678 0.439 1.00 0.00 C ATOM 779 O MET A 89 7.370 -4.359 0.123 1.00 0.00 O ATOM 780 CB MET A 89 8.617 -4.215 2.902 1.00 0.00 C ATOM 781 CG MET A 89 9.622 -4.568 3.987 1.00 0.00 C ATOM 782 SD MET A 89 10.314 -3.111 4.791 1.00 0.00 S ATOM 783 CE MET A 89 11.460 -3.869 5.940 1.00 0.00 C ATOM 0 H MET A 89 8.421 -2.011 1.579 1.00 0.00 H new ATOM 0 HA MET A 89 10.293 -4.281 1.557 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.048 -3.340 3.216 1.00 0.00 H new ATOM 0 HB3 MET A 89 7.907 -5.035 2.795 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.138 -5.196 4.735 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.430 -5.156 3.552 1.00 0.00 H new ATOM 0 HE1 MET A 89 12.274 -3.176 6.153 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.939 -4.113 6.866 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.866 -4.781 5.501 1.00 0.00 H new ATOM 793 N MET A 90 9.177 -5.674 -0.143 1.00 0.00 N ATOM 794 CA MET A 90 8.583 -6.471 -1.212 1.00 0.00 C ATOM 795 C MET A 90 8.235 -7.866 -0.707 1.00 0.00 C ATOM 796 O MET A 90 9.073 -8.543 -0.111 1.00 0.00 O ATOM 797 CB MET A 90 9.549 -6.569 -2.394 1.00 0.00 C ATOM 798 CG MET A 90 9.923 -5.221 -2.988 1.00 0.00 C ATOM 799 SD MET A 90 11.564 -4.668 -2.483 1.00 0.00 S ATOM 800 CE MET A 90 11.322 -2.894 -2.434 1.00 0.00 C ATOM 0 H MET A 90 10.127 -5.949 0.108 1.00 0.00 H new ATOM 0 HA MET A 90 7.667 -5.981 -1.541 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.457 -7.078 -2.069 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.098 -7.186 -3.171 1.00 0.00 H new ATOM 0 HG2 MET A 90 9.884 -5.285 -4.075 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.185 -4.478 -2.686 1.00 0.00 H new ATOM 0 HE1 MET A 90 12.096 -2.438 -1.817 1.00 0.00 H new ATOM 0 HE2 MET A 90 11.380 -2.491 -3.445 1.00 0.00 H new ATOM 0 HE3 MET A 90 10.343 -2.672 -2.010 1.00 0.00 H new ATOM 810 N LEU A 91 6.996 -8.292 -0.935 1.00 0.00 N ATOM 811 CA LEU A 91 6.559 -9.609 -0.480 1.00 0.00 C ATOM 812 C LEU A 91 5.373 -10.131 -1.276 1.00 0.00 C ATOM 813 O LEU A 91 4.460 -9.381 -1.615 1.00 0.00 O ATOM 814 CB LEU A 91 6.147 -9.544 0.991 1.00 0.00 C ATOM 815 CG LEU A 91 4.984 -8.589 1.279 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.915 -9.276 2.115 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.478 -7.325 1.971 1.00 0.00 C ATOM 0 H LEU A 91 6.284 -7.752 -1.426 1.00 0.00 H new ATOM 0 HA LEU A 91 7.402 -10.285 -0.623 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.871 -10.545 1.323 1.00 0.00 H new ATOM 0 HB3 LEU A 91 7.009 -9.238 1.584 1.00 0.00 H new ATOM 0 HG LEU A 91 4.539 -8.303 0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.099 -8.579 2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.532 -10.142 1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.346 -9.600 3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.634 -6.663 2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.956 -7.590 2.914 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.198 -6.817 1.330 1.00 0.00 H new ATOM 829 N THR A 92 5.361 -11.439 -1.503 1.00 0.00 N ATOM 830 CA THR A 92 4.245 -12.074 -2.180 1.00 0.00 C ATOM 831 C THR A 92 3.267 -12.503 -1.101 1.00 0.00 C ATOM 832 O THR A 92 3.594 -13.346 -0.265 1.00 0.00 O ATOM 833 CB THR A 92 4.712 -13.281 -2.996 1.00 0.00 C ATOM 834 OG1 THR A 92 3.622 -13.881 -3.673 1.00 0.00 O ATOM 835 CG2 THR A 92 5.376 -14.351 -2.156 1.00 0.00 C ATOM 0 H THR A 92 6.109 -12.075 -1.228 1.00 0.00 H new ATOM 0 HA THR A 92 3.777 -11.383 -2.881 1.00 0.00 H new ATOM 0 HB THR A 92 5.445 -12.887 -3.700 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.941 -14.650 -4.190 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.683 -15.178 -2.796 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.251 -13.933 -1.659 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.673 -14.714 -1.407 1.00 0.00 H new ATOM 843 N HIS A 93 2.096 -11.884 -1.067 1.00 0.00 N ATOM 844 CA HIS A 93 1.138 -12.189 -0.016 1.00 0.00 C ATOM 845 C HIS A 93 -0.300 -11.907 -0.433 1.00 0.00 C ATOM 846 O HIS A 93 -0.562 -11.059 -1.287 1.00 0.00 O ATOM 847 CB HIS A 93 1.494 -11.341 1.207 1.00 0.00 C ATOM 848 CG HIS A 93 1.349 -12.045 2.515 1.00 0.00 C ATOM 849 ND1 HIS A 93 0.137 -12.452 3.027 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.282 -12.391 3.431 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.327 -13.019 4.204 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.620 -12.997 4.472 1.00 0.00 N ATOM 0 H HIS A 93 1.791 -11.181 -1.740 1.00 0.00 H new ATOM 0 HA HIS A 93 1.197 -13.255 0.205 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.523 -10.997 1.107 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.861 -10.454 1.215 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.346 -12.223 3.358 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.443 -13.431 4.839 1.00 0.00 H new ATOM 0 HE2 HIS A 93 2.057 -13.369 5.315 1.00 0.00 H new ATOM 861 N ALA A 94 -1.230 -12.611 0.206 1.00 0.00 N ATOM 862 CA ALA A 94 -2.649 -12.430 -0.059 1.00 0.00 C ATOM 863 C ALA A 94 -3.181 -11.266 0.765 1.00 0.00 C ATOM 864 O ALA A 94 -3.143 -11.300 1.996 1.00 0.00 O ATOM 865 CB ALA A 94 -3.416 -13.704 0.261 1.00 0.00 C ATOM 0 H ALA A 94 -1.022 -13.315 0.914 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.787 -12.207 -1.117 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.476 -13.552 0.057 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.041 -14.519 -0.358 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.281 -13.955 1.313 1.00 0.00 H new ATOM 871 N ILE A 95 -3.657 -10.231 0.089 1.00 0.00 N ATOM 872 CA ILE A 95 -4.170 -9.053 0.776 1.00 0.00 C ATOM 873 C ILE A 95 -5.650 -9.188 1.105 1.00 0.00 C ATOM 874 O ILE A 95 -6.395 -9.892 0.423 1.00 0.00 O ATOM 875 CB ILE A 95 -3.954 -7.781 -0.063 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.500 -7.696 -0.525 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.334 -6.544 0.738 1.00 0.00 C ATOM 878 CD1 ILE A 95 -2.278 -6.685 -1.625 1.00 0.00 C ATOM 0 H ILE A 95 -3.699 -10.182 -0.929 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.611 -8.971 1.708 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.596 -7.829 -0.942 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.870 -7.439 0.327 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.179 -8.678 -0.874 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.175 -5.654 0.130 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.384 -6.605 1.025 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.716 -6.486 1.634 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.224 -6.677 -1.905 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -2.882 -6.953 -2.492 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.568 -5.695 -1.273 1.00 0.00 H new ATOM 890 N THR A 96 -6.064 -8.495 2.158 1.00 0.00 N ATOM 891 CA THR A 96 -7.452 -8.513 2.600 1.00 0.00 C ATOM 892 C THR A 96 -8.059 -7.122 2.468 1.00 0.00 C ATOM 893 O THR A 96 -7.348 -6.119 2.519 1.00 0.00 O ATOM 894 CB THR A 96 -7.550 -8.997 4.049 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.331 -9.585 4.466 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.648 -10.015 4.266 1.00 0.00 C ATOM 0 H THR A 96 -5.452 -7.909 2.726 1.00 0.00 H new ATOM 0 HA THR A 96 -8.009 -9.205 1.968 1.00 0.00 H new ATOM 0 HB THR A 96 -7.779 -8.107 4.635 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.658 -8.885 4.598 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.663 -10.316 5.313 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.609 -9.575 4.001 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.464 -10.888 3.640 1.00 0.00 H new ATOM 904 N ARG A 97 -9.371 -7.063 2.284 1.00 0.00 N ATOM 905 CA ARG A 97 -10.054 -5.786 2.129 1.00 0.00 C ATOM 906 C ARG A 97 -11.081 -5.558 3.230 1.00 0.00 C ATOM 907 O ARG A 97 -12.052 -6.306 3.356 1.00 0.00 O ATOM 908 CB ARG A 97 -10.737 -5.722 0.766 1.00 0.00 C ATOM 909 CG ARG A 97 -10.805 -4.321 0.186 1.00 0.00 C ATOM 910 CD ARG A 97 -11.445 -4.319 -1.192 1.00 0.00 C ATOM 911 NE ARG A 97 -12.895 -4.176 -1.109 1.00 0.00 N ATOM 912 CZ ARG A 97 -13.732 -5.186 -0.886 1.00 0.00 C ATOM 913 NH1 ARG A 97 -13.278 -6.433 -0.829 1.00 0.00 N ATOM 914 NH2 ARG A 97 -15.028 -4.948 -0.734 1.00 0.00 N ATOM 0 H ARG A 97 -9.981 -7.879 2.239 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.304 -4.999 2.202 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.202 -6.369 0.070 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -11.748 -6.118 0.857 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.376 -3.677 0.854 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.800 -3.903 0.122 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.031 -3.503 -1.785 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.199 -5.246 -1.710 1.00 0.00 H new ATOM 0 HE ARG A 97 -13.291 -3.244 -1.229 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.283 -6.620 -0.956 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.924 -7.204 -0.658 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -15.381 -3.993 -0.788 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -15.672 -5.720 -0.563 1.00 0.00 H new ATOM 928 N TYR A 98 -10.870 -4.508 4.018 1.00 0.00 N ATOM 929 CA TYR A 98 -11.785 -4.167 5.098 1.00 0.00 C ATOM 930 C TYR A 98 -12.340 -2.759 4.903 1.00 0.00 C ATOM 931 O TYR A 98 -11.693 -1.772 5.254 1.00 0.00 O ATOM 932 CB TYR A 98 -11.065 -4.258 6.446 1.00 0.00 C ATOM 933 CG TYR A 98 -10.837 -5.676 6.918 1.00 0.00 C ATOM 934 CD1 TYR A 98 -11.638 -6.237 7.905 1.00 0.00 C ATOM 935 CD2 TYR A 98 -9.821 -6.453 6.377 1.00 0.00 C ATOM 936 CE1 TYR A 98 -11.432 -7.533 8.340 1.00 0.00 C ATOM 937 CE2 TYR A 98 -9.608 -7.749 6.806 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.417 -8.285 7.787 1.00 0.00 C ATOM 939 OH TYR A 98 -10.209 -9.575 8.216 1.00 0.00 O ATOM 0 H TYR A 98 -10.072 -3.879 3.927 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.613 -4.876 5.086 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.103 -3.751 6.369 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.648 -3.724 7.196 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.434 -5.651 8.339 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.187 -6.037 5.608 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -12.063 -7.954 9.109 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -8.813 -8.339 6.376 1.00 0.00 H new ATOM 0 HH TYR A 98 -9.456 -9.966 7.725 1.00 0.00 H new ATOM 949 N GLY A 99 -13.543 -2.672 4.340 1.00 0.00 N ATOM 950 CA GLY A 99 -14.160 -1.380 4.110 1.00 0.00 C ATOM 951 C GLY A 99 -15.096 -0.972 5.224 1.00 0.00 C ATOM 952 O GLY A 99 -15.774 -1.811 5.817 1.00 0.00 O ATOM 0 H GLY A 99 -14.099 -3.473 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.382 -0.625 4.001 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -14.711 -1.408 3.170 1.00 0.00 H new ATOM 956 N ILE A 100 -15.132 0.324 5.507 1.00 0.00 N ATOM 957 CA ILE A 100 -15.994 0.850 6.557 1.00 0.00 C ATOM 958 C ILE A 100 -16.536 2.228 6.201 1.00 0.00 C ATOM 959 O ILE A 100 -17.711 2.520 6.425 1.00 0.00 O ATOM 960 CB ILE A 100 -15.262 0.935 7.912 1.00 0.00 C ATOM 961 CG1 ILE A 100 -13.904 1.620 7.747 1.00 0.00 C ATOM 962 CG2 ILE A 100 -15.095 -0.453 8.512 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.963 3.125 7.893 1.00 0.00 C ATOM 0 H ILE A 100 -14.575 1.029 5.025 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.825 0.150 6.646 1.00 0.00 H new ATOM 0 HB ILE A 100 -15.865 1.534 8.594 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -13.212 1.218 8.487 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.499 1.374 6.765 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -14.577 -0.376 9.468 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -16.076 -0.903 8.666 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -14.513 -1.075 7.833 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.964 3.542 7.764 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -14.630 3.538 7.136 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -14.337 3.380 8.884 1.00 0.00 H new ATOM 975 N SER A 101 -15.674 3.073 5.647 1.00 0.00 N ATOM 976 CA SER A 101 -16.063 4.427 5.258 1.00 0.00 C ATOM 977 C SER A 101 -17.385 4.419 4.498 1.00 0.00 C ATOM 978 O SER A 101 -18.153 5.380 4.557 1.00 0.00 O ATOM 979 CB SER A 101 -14.974 5.061 4.391 1.00 0.00 C ATOM 980 OG SER A 101 -14.789 6.426 4.722 1.00 0.00 O ATOM 0 H SER A 101 -14.698 2.845 5.456 1.00 0.00 H new ATOM 0 HA SER A 101 -16.189 5.015 6.167 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.037 4.521 4.526 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.245 4.972 3.339 1.00 0.00 H new ATOM 0 HG SER A 101 -14.809 6.966 3.905 1.00 0.00 H new ATOM 986 N THR A 102 -17.639 3.328 3.782 1.00 0.00 N ATOM 987 CA THR A 102 -18.862 3.192 3.002 1.00 0.00 C ATOM 988 C THR A 102 -19.078 1.743 2.577 1.00 0.00 C ATOM 989 O THR A 102 -18.170 0.917 2.673 1.00 0.00 O ATOM 990 CB THR A 102 -18.791 4.089 1.769 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.349 5.390 2.116 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.116 4.234 1.051 1.00 0.00 C ATOM 0 H THR A 102 -17.013 2.525 3.727 1.00 0.00 H new ATOM 0 HA THR A 102 -19.703 3.496 3.625 1.00 0.00 H new ATOM 0 HB THR A 102 -18.086 3.596 1.100 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.802 5.682 2.934 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.991 4.884 0.185 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.461 3.254 0.722 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.851 4.668 1.728 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.282 1.441 2.101 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.613 0.092 1.657 1.00 0.00 C ATOM 1002 C ASP A 103 -20.527 -0.026 0.136 1.00 0.00 C ATOM 1003 O ASP A 103 -21.048 -0.974 -0.451 1.00 0.00 O ATOM 1004 CB ASP A 103 -22.016 -0.289 2.127 1.00 0.00 C ATOM 1005 CG ASP A 103 -22.212 -1.791 2.208 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -23.343 -2.256 1.954 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -21.235 -2.500 2.526 1.00 0.00 O ATOM 0 H ASP A 103 -21.045 2.113 2.013 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.887 -0.592 2.095 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.200 0.152 3.107 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.752 0.134 1.444 1.00 0.00 H new ATOM 1012 N ASP A 104 -19.864 0.938 -0.497 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.705 0.935 -1.946 1.00 0.00 C ATOM 1014 C ASP A 104 -18.227 1.012 -2.312 1.00 0.00 C ATOM 1015 O ASP A 104 -17.473 1.741 -1.678 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.458 2.113 -2.568 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.933 2.106 -2.220 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.513 1.005 -2.112 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.510 3.202 -2.054 1.00 0.00 O ATOM 0 H ASP A 104 -19.428 1.732 -0.027 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.121 0.007 -2.338 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.012 3.047 -2.226 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.343 2.082 -3.652 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.790 0.257 -3.337 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.391 0.237 -3.777 1.00 0.00 C ATOM 1026 C PRO A 105 -15.705 1.598 -3.702 1.00 0.00 C ATOM 1027 O PRO A 105 -15.677 2.347 -4.677 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.519 -0.229 -5.221 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.659 -1.184 -5.184 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.623 -0.649 -4.153 1.00 0.00 C ATOM 0 HA PRO A 105 -15.769 -0.396 -3.144 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.717 0.605 -5.895 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.605 -0.710 -5.569 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.136 -1.259 -6.161 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.320 -2.185 -4.917 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.454 -0.119 -4.618 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.052 -1.450 -3.551 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.136 1.902 -2.536 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.433 3.164 -2.339 1.00 0.00 C ATOM 1040 C ASN A 106 -13.424 3.073 -1.196 1.00 0.00 C ATOM 1041 O ASN A 106 -13.117 1.985 -0.708 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.418 4.317 -2.108 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.453 4.010 -1.048 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.129 3.519 0.033 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -17.712 4.298 -1.362 1.00 0.00 N ATOM 0 H ASN A 106 -15.149 1.293 -1.718 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.878 3.372 -3.254 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -14.863 5.209 -1.817 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.924 4.548 -3.045 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.460 4.113 -0.693 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.931 4.704 -2.272 1.00 0.00 H new ATOM 1052 N LYS A 107 -12.892 4.228 -0.798 1.00 0.00 N ATOM 1053 CA LYS A 107 -11.888 4.315 0.263 1.00 0.00 C ATOM 1054 C LYS A 107 -12.170 3.356 1.417 1.00 0.00 C ATOM 1055 O LYS A 107 -13.113 3.539 2.183 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.806 5.763 0.771 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.150 5.924 2.138 1.00 0.00 C ATOM 1058 CD LYS A 107 -11.941 6.873 3.023 1.00 0.00 C ATOM 1059 CE LYS A 107 -11.846 6.478 4.487 1.00 0.00 C ATOM 1060 NZ LYS A 107 -10.435 6.424 4.956 1.00 0.00 N ATOM 0 H LYS A 107 -13.145 5.130 -1.202 1.00 0.00 H new ATOM 0 HA LYS A 107 -10.929 4.016 -0.161 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.251 6.357 0.045 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.814 6.175 0.816 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.072 4.951 2.623 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.135 6.300 2.014 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.568 7.889 2.894 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.986 6.876 2.713 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.403 7.193 5.093 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -12.314 5.504 4.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -10.417 6.302 5.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -9.949 5.623 4.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -9.951 7.309 4.703 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.315 2.343 1.526 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.413 1.334 2.571 1.00 0.00 C ATOM 1076 C TRP A 108 -10.019 0.920 3.035 1.00 0.00 C ATOM 1077 O TRP A 108 -9.014 1.372 2.484 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.156 0.117 2.042 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.600 0.379 1.746 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.438 1.257 2.370 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.371 -0.257 0.738 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.682 1.200 1.795 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.669 0.271 0.797 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.082 -1.223 -0.207 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.682 -0.143 -0.059 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.083 -1.640 -1.065 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.372 -1.100 -0.984 1.00 0.00 C ATOM 0 H TRP A 108 -10.532 2.200 0.888 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.959 1.754 3.416 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.665 -0.232 1.134 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.084 -0.689 2.773 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.163 1.900 3.193 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.487 1.762 2.070 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.090 -1.645 -0.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.676 0.275 0.004 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -14.867 -2.393 -1.808 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.135 -1.446 -1.665 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.959 0.053 4.040 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.679 -0.422 4.564 1.00 0.00 C ATOM 1100 C ARG A 109 -8.338 -1.794 3.999 1.00 0.00 C ATOM 1101 O ARG A 109 -9.228 -2.585 3.696 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.729 -0.526 6.088 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.499 0.789 6.813 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.787 1.589 6.965 1.00 0.00 C ATOM 1105 NE ARG A 109 -10.954 0.728 7.148 1.00 0.00 N ATOM 1106 CZ ARG A 109 -11.142 -0.052 8.210 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -10.272 -0.043 9.213 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -12.208 -0.838 8.272 1.00 0.00 N ATOM 0 H ARG A 109 -10.778 -0.335 4.508 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.916 0.297 4.265 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.700 -0.924 6.381 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.978 -1.244 6.416 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.077 0.591 7.798 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.766 1.382 6.265 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.696 2.261 7.818 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -9.932 2.212 6.082 1.00 0.00 H new ATOM 0 HE ARG A 109 -11.667 0.725 6.418 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.453 0.564 9.173 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.422 -0.643 10.024 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -12.882 -0.844 7.507 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.354 -1.436 9.085 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.046 -2.085 3.889 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.603 -3.381 3.399 1.00 0.00 C ATOM 1124 C TYR A 110 -5.762 -4.049 4.471 1.00 0.00 C ATOM 1125 O TYR A 110 -5.348 -3.395 5.427 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.819 -3.235 2.099 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.703 -3.034 0.888 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.313 -1.808 0.647 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -6.918 -4.065 -0.022 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -8.113 -1.614 -0.465 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.718 -3.878 -1.135 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.311 -2.651 -1.350 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.105 -2.461 -2.458 1.00 0.00 O ATOM 0 H TYR A 110 -6.292 -1.443 4.132 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.472 -4.003 3.182 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.137 -2.389 2.187 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.207 -4.124 1.950 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -7.160 -0.993 1.339 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.453 -5.026 0.143 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.579 -0.655 -0.638 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -7.877 -4.688 -1.832 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.547 -2.459 -3.264 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.531 -5.349 4.348 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.758 -6.052 5.363 1.00 0.00 C ATOM 1145 C TYR A 111 -3.815 -7.092 4.774 1.00 0.00 C ATOM 1146 O TYR A 111 -4.233 -8.005 4.062 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.700 -6.712 6.368 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.185 -5.764 7.440 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.721 -5.871 8.745 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.101 -4.758 7.146 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.157 -5.002 9.728 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.540 -3.884 8.123 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.065 -4.010 9.412 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.499 -3.143 10.389 1.00 0.00 O ATOM 0 H TYR A 111 -5.859 -5.927 3.575 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.137 -5.309 5.863 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.560 -7.120 5.837 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.188 -7.552 6.839 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.010 -6.644 8.995 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.475 -4.659 6.138 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -5.789 -5.098 10.739 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.250 -3.108 7.879 1.00 0.00 H new ATOM 0 HH TYR A 111 -8.134 -2.505 10.002 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.539 -6.955 5.113 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.513 -7.884 4.668 1.00 0.00 C ATOM 1166 C LEU A 112 -1.201 -8.862 5.792 1.00 0.00 C ATOM 1167 O LEU A 112 -0.576 -8.493 6.786 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.248 -7.126 4.264 1.00 0.00 C ATOM 1169 CG LEU A 112 0.650 -7.849 3.261 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.900 -9.284 3.702 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.026 -7.814 1.877 1.00 0.00 C ATOM 0 H LEU A 112 -2.189 -6.199 5.702 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.877 -8.432 3.799 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.539 -6.165 3.840 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.333 -6.916 5.162 1.00 0.00 H new ATOM 0 HG LEU A 112 1.610 -7.335 3.221 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.541 -9.782 2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.388 -9.285 4.677 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.050 -9.814 3.771 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.676 -8.332 1.172 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.946 -8.306 1.904 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.100 -6.779 1.561 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.660 -10.100 5.651 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.442 -11.103 6.682 1.00 0.00 C ATOM 1185 C ASP A 113 -2.178 -10.685 7.964 1.00 0.00 C ATOM 1186 O ASP A 113 -3.382 -10.434 7.930 1.00 0.00 O ATOM 1187 CB ASP A 113 0.061 -11.293 6.926 1.00 0.00 C ATOM 1188 CG ASP A 113 0.372 -12.585 7.657 1.00 0.00 C ATOM 1189 OD1 ASP A 113 1.339 -13.270 7.264 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.351 -12.910 8.622 1.00 0.00 O ATOM 0 H ASP A 113 -2.181 -10.430 4.839 1.00 0.00 H new ATOM 0 HA ASP A 113 -1.843 -12.062 6.356 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.585 -11.285 5.970 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.441 -10.451 7.505 1.00 0.00 H new ATOM 1195 N SER A 114 -1.465 -10.595 9.087 1.00 0.00 N ATOM 1196 CA SER A 114 -2.078 -10.191 10.347 1.00 0.00 C ATOM 1197 C SER A 114 -1.853 -8.703 10.612 1.00 0.00 C ATOM 1198 O SER A 114 -1.973 -8.244 11.747 1.00 0.00 O ATOM 1199 CB SER A 114 -1.510 -11.017 11.501 1.00 0.00 C ATOM 1200 OG SER A 114 -2.513 -11.322 12.454 1.00 0.00 O ATOM 0 H SER A 114 -0.467 -10.796 9.147 1.00 0.00 H new ATOM 0 HA SER A 114 -3.151 -10.370 10.274 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.080 -11.940 11.114 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.702 -10.466 11.983 1.00 0.00 H new ATOM 0 HG SER A 114 -2.124 -11.852 13.181 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.515 -7.953 9.564 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.264 -6.522 9.700 1.00 0.00 C ATOM 1208 C VAL A 115 -2.120 -5.710 8.733 1.00 0.00 C ATOM 1209 O VAL A 115 -2.540 -6.209 7.691 1.00 0.00 O ATOM 1210 CB VAL A 115 0.221 -6.190 9.456 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.496 -4.719 9.730 1.00 0.00 C ATOM 1212 CG2 VAL A 115 1.115 -7.075 10.311 1.00 0.00 C ATOM 0 H VAL A 115 -1.409 -8.312 8.615 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.530 -6.253 10.722 1.00 0.00 H new ATOM 0 HB VAL A 115 0.448 -6.387 8.408 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.550 -4.507 9.552 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.115 -4.105 9.068 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.250 -4.490 10.767 1.00 0.00 H new ATOM 0 HG21 VAL A 115 2.160 -6.825 10.124 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.886 -6.914 11.364 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.941 -8.121 10.058 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.371 -4.453 9.088 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.173 -3.566 8.252 1.00 0.00 C ATOM 1224 C GLU A 116 -2.290 -2.818 7.257 1.00 0.00 C ATOM 1225 O GLU A 116 -1.181 -2.401 7.589 1.00 0.00 O ATOM 1226 CB GLU A 116 -3.941 -2.569 9.121 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.043 -1.616 9.895 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.086 -1.859 11.391 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -2.096 -2.392 11.935 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -4.109 -1.513 12.019 1.00 0.00 O ATOM 0 H GLU A 116 -2.030 -4.026 9.949 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.886 -4.174 7.695 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.611 -1.989 8.487 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.565 -3.119 9.825 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.017 -1.723 9.543 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.346 -0.589 9.689 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.787 -2.655 6.035 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.038 -1.960 4.997 1.00 0.00 C ATOM 1239 C VAL A 117 -2.944 -1.084 4.135 1.00 0.00 C ATOM 1240 O VAL A 117 -4.176 -1.207 4.165 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.287 -2.950 4.085 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.064 -3.510 4.793 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.213 -4.071 3.637 1.00 0.00 C ATOM 0 H VAL A 117 -3.703 -2.994 5.741 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.317 -1.326 5.513 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.949 -2.413 3.199 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.452 -4.207 4.132 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.609 -2.694 5.057 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.375 -4.031 5.698 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.665 -4.760 2.994 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.584 -4.607 4.510 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.053 -3.650 3.085 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.314 -0.193 3.374 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.030 0.726 2.500 1.00 0.00 C ATOM 1255 C HIS A 118 -2.871 0.339 1.031 1.00 0.00 C ATOM 1256 O HIS A 118 -1.868 0.667 0.397 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.513 2.148 2.715 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.224 3.192 1.907 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -3.986 4.188 2.476 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.269 3.410 0.569 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.468 4.967 1.525 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.049 4.515 0.360 1.00 0.00 N ATOM 0 H HIS A 118 -1.300 -0.089 3.347 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.090 0.674 2.751 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.604 2.399 3.772 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.451 2.177 2.471 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -4.152 4.306 3.476 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.779 2.820 -0.192 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.100 5.830 1.676 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.877 -0.341 0.496 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.869 -0.759 -0.902 1.00 0.00 C ATOM 1273 C LEU A 119 -4.784 0.154 -1.717 1.00 0.00 C ATOM 1274 O LEU A 119 -5.989 0.208 -1.469 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.331 -2.207 -1.021 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.271 -2.791 -2.427 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -4.197 -4.308 -2.375 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.470 -2.334 -3.232 1.00 0.00 C ATOM 0 H LEU A 119 -4.713 -0.616 1.011 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.853 -0.685 -1.290 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.719 -2.823 -0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.357 -2.276 -0.659 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.368 -2.429 -2.918 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.155 -4.705 -3.389 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.303 -4.610 -1.830 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.080 -4.698 -1.869 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.417 -2.757 -4.235 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.385 -2.670 -2.744 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.472 -1.246 -3.297 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.229 0.900 -2.687 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.013 1.822 -3.512 1.00 0.00 C ATOM 1292 C PRO A 120 -6.222 1.149 -4.166 1.00 0.00 C ATOM 1293 O PRO A 120 -6.139 0.018 -4.640 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.018 2.319 -4.569 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.839 1.415 -4.468 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.806 0.923 -3.052 1.00 0.00 C ATOM 0 HA PRO A 120 -5.439 2.628 -2.914 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.455 2.282 -5.567 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.734 3.355 -4.383 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.926 0.583 -5.167 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.920 1.945 -4.717 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.352 -0.065 -2.977 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.232 1.587 -2.405 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.372 1.843 -4.186 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.624 1.323 -4.761 1.00 0.00 C ATOM 1306 C PRO A 121 -8.510 0.827 -6.206 1.00 0.00 C ATOM 1307 O PRO A 121 -9.433 0.188 -6.710 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.579 2.525 -4.695 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.710 3.709 -4.443 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.563 3.193 -3.633 1.00 0.00 C ATOM 0 HA PRO A 121 -8.953 0.443 -4.208 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.135 2.637 -5.626 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.313 2.400 -3.899 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.364 4.149 -5.378 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.252 4.487 -3.906 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.672 3.810 -3.750 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.796 3.167 -2.568 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.401 1.119 -6.879 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.240 0.682 -8.268 1.00 0.00 C ATOM 1320 C PHE A 122 -6.669 -0.729 -8.368 1.00 0.00 C ATOM 1321 O PHE A 122 -6.624 -1.305 -9.455 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.379 1.652 -9.094 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.587 2.655 -8.299 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.223 3.605 -7.512 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.204 2.656 -8.356 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.491 4.533 -6.795 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.468 3.580 -7.642 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.110 4.519 -6.861 1.00 0.00 C ATOM 0 H PHE A 122 -6.614 1.645 -6.498 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.245 0.677 -8.689 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.687 1.069 -9.702 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -7.030 2.192 -9.782 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.302 3.619 -7.459 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.695 1.925 -8.966 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.996 5.267 -6.185 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.389 3.568 -7.695 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.535 5.242 -6.302 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.236 -1.295 -7.246 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.682 -2.640 -7.256 1.00 0.00 C ATOM 1340 C TRP A 123 -6.687 -3.658 -6.721 1.00 0.00 C ATOM 1341 O TRP A 123 -6.406 -4.855 -6.689 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.395 -2.678 -6.439 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.341 -1.759 -6.960 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.274 -1.189 -8.198 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.205 -1.296 -6.241 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.153 -0.393 -8.288 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.484 -0.443 -7.094 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.730 -1.520 -4.953 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.312 0.185 -6.690 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.571 -0.896 -4.557 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.125 -0.053 -5.420 1.00 0.00 C ATOM 0 H TRP A 123 -6.258 -0.848 -6.329 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.457 -2.909 -8.288 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.620 -2.414 -5.406 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -4.008 -3.697 -6.430 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.993 -1.339 -8.990 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.869 0.144 -9.107 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.262 -2.172 -4.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.233 0.837 -7.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.193 -1.062 -3.559 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.031 0.423 -5.076 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.865 -3.184 -6.313 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.908 -4.067 -5.799 1.00 0.00 C ATOM 1364 C GLU A 124 -9.140 -5.227 -6.760 1.00 0.00 C ATOM 1365 O GLU A 124 -9.427 -6.350 -6.343 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.208 -3.285 -5.598 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.852 -3.517 -4.243 1.00 0.00 C ATOM 1368 CD GLU A 124 -12.196 -4.212 -4.343 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -12.308 -5.359 -3.863 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -13.136 -3.608 -4.902 1.00 0.00 O ATOM 0 H GLU A 124 -8.119 -2.196 -6.329 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.584 -4.467 -4.838 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.004 -2.221 -5.717 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.915 -3.564 -6.380 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.183 -4.117 -3.626 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -10.980 -2.560 -3.738 1.00 0.00 H new ATOM 1377 N GLN A 125 -9.005 -4.941 -8.048 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.186 -5.947 -9.086 1.00 0.00 C ATOM 1379 C GLN A 125 -7.866 -6.647 -9.393 1.00 0.00 C ATOM 1380 O GLN A 125 -7.849 -7.783 -9.866 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.735 -5.298 -10.357 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.943 -4.079 -10.807 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.757 -2.800 -10.754 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.936 -2.785 -11.109 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.130 -1.718 -10.309 1.00 0.00 N ATOM 0 H GLN A 125 -8.769 -4.013 -8.401 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.899 -6.688 -8.724 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.739 -6.036 -11.160 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.771 -5.006 -10.188 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.061 -3.970 -10.175 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.588 -4.237 -11.825 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.152 -1.776 -10.025 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.626 -0.829 -10.251 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.761 -5.956 -9.123 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.435 -6.506 -9.372 1.00 0.00 C ATOM 1396 C TYR A 126 -4.994 -7.433 -8.241 1.00 0.00 C ATOM 1397 O TYR A 126 -3.996 -8.143 -8.368 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.416 -5.377 -9.540 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.832 -4.302 -10.525 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -5.897 -4.492 -11.400 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -4.152 -3.093 -10.578 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -6.269 -3.507 -12.296 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -4.518 -2.104 -11.470 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.577 -2.315 -12.325 1.00 0.00 C ATOM 1405 OH TYR A 126 -5.945 -1.333 -13.216 1.00 0.00 O ATOM 0 H TYR A 126 -6.760 -5.014 -8.732 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.486 -7.089 -10.291 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.240 -4.915 -8.569 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.468 -5.805 -9.866 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -6.442 -5.424 -11.379 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.321 -2.923 -9.909 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -7.097 -3.670 -12.970 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -3.977 -1.170 -11.497 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.358 -0.556 -13.107 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.729 -7.418 -7.130 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.387 -8.256 -5.988 1.00 0.00 C ATOM 1417 C ILE A 127 -5.929 -9.675 -6.147 1.00 0.00 C ATOM 1418 O ILE A 127 -7.137 -9.906 -6.105 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.902 -7.652 -4.662 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.418 -7.463 -4.690 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -5.216 -6.325 -4.383 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -8.083 -7.810 -3.377 1.00 0.00 C ATOM 0 H ILE A 127 -6.558 -6.839 -6.999 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.298 -8.299 -5.953 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.662 -8.352 -3.862 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.644 -6.427 -4.943 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.841 -8.084 -5.480 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.589 -5.912 -3.446 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.140 -6.481 -4.308 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.426 -5.629 -5.195 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.159 -7.655 -3.462 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.885 -8.854 -3.134 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.685 -7.172 -2.588 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.017 -10.623 -6.325 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.384 -12.027 -6.487 1.00 0.00 C ATOM 1436 C ASN A 128 -5.078 -12.811 -5.212 1.00 0.00 C ATOM 1437 O ASN A 128 -4.665 -12.231 -4.208 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.627 -12.639 -7.670 1.00 0.00 C ATOM 1439 CG ASN A 128 -4.513 -11.688 -8.847 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -5.272 -11.784 -9.812 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -3.562 -10.761 -8.775 1.00 0.00 N ATOM 0 H ASN A 128 -4.013 -10.445 -6.361 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.455 -12.082 -6.683 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.628 -12.930 -7.345 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.136 -13.548 -7.991 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.440 -10.095 -9.538 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.954 -10.716 -7.957 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.271 -14.131 -5.255 1.00 0.00 N ATOM 1449 CA ASP A 129 -4.997 -14.977 -4.092 1.00 0.00 C ATOM 1450 C ASP A 129 -3.614 -14.663 -3.533 1.00 0.00 C ATOM 1451 O ASP A 129 -3.468 -14.294 -2.369 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.088 -16.457 -4.474 1.00 0.00 C ATOM 1453 CG ASP A 129 -6.418 -17.074 -4.088 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -6.926 -17.917 -4.856 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -6.950 -16.713 -3.017 1.00 0.00 O ATOM 0 H ASP A 129 -5.613 -14.633 -6.074 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.744 -14.770 -3.326 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -4.941 -16.561 -5.549 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.282 -17.005 -3.987 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.610 -14.775 -4.392 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.236 -14.466 -4.021 1.00 0.00 C ATOM 1462 C GLU A 130 -0.734 -13.354 -4.929 1.00 0.00 C ATOM 1463 O GLU A 130 -0.834 -13.461 -6.151 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.348 -15.706 -4.151 1.00 0.00 C ATOM 1465 CG GLU A 130 0.641 -15.868 -3.009 1.00 0.00 C ATOM 1466 CD GLU A 130 0.943 -17.322 -2.703 1.00 0.00 C ATOM 1467 OE1 GLU A 130 1.842 -17.892 -3.356 1.00 0.00 O ATOM 1468 OE2 GLU A 130 0.281 -17.891 -1.809 1.00 0.00 O ATOM 0 H GLU A 130 -2.723 -15.080 -5.359 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.199 -14.143 -2.981 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.981 -16.592 -4.201 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.201 -15.653 -5.091 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.568 -15.353 -3.260 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.241 -15.388 -2.116 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.232 -12.272 -4.346 1.00 0.00 N ATOM 1476 CA ASN A 131 0.226 -11.149 -5.155 1.00 0.00 C ATOM 1477 C ASN A 131 1.537 -10.570 -4.668 1.00 0.00 C ATOM 1478 O ASN A 131 1.817 -10.526 -3.471 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.826 -10.037 -5.166 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.231 -10.553 -4.933 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.642 -11.552 -5.521 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -2.977 -9.871 -4.071 1.00 0.00 N ATOM 0 H ASN A 131 -0.133 -12.148 -3.338 1.00 0.00 H new ATOM 0 HA ASN A 131 0.382 -11.540 -6.160 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.581 -9.304 -4.397 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.789 -9.518 -6.124 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -3.932 -10.171 -3.874 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.595 -9.048 -3.606 1.00 0.00 H new ATOM 1489 N THR A 132 2.309 -10.077 -5.622 1.00 0.00 N ATOM 1490 CA THR A 132 3.573 -9.431 -5.329 1.00 0.00 C ATOM 1491 C THR A 132 3.284 -8.004 -4.898 1.00 0.00 C ATOM 1492 O THR A 132 2.883 -7.167 -5.716 1.00 0.00 O ATOM 1493 CB THR A 132 4.489 -9.445 -6.554 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.765 -10.773 -6.960 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.814 -8.752 -6.319 1.00 0.00 C ATOM 0 H THR A 132 2.077 -10.114 -6.615 1.00 0.00 H new ATOM 0 HA THR A 132 4.087 -9.968 -4.532 1.00 0.00 H new ATOM 0 HB THR A 132 3.945 -8.901 -7.326 1.00 0.00 H new ATOM 0 HG1 THR A 132 5.351 -10.760 -7.746 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.415 -8.798 -7.227 1.00 0.00 H new ATOM 0 HG22 THR A 132 5.637 -7.710 -6.054 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.345 -9.248 -5.507 1.00 0.00 H new ATOM 1503 N VAL A 133 3.433 -7.743 -3.605 1.00 0.00 N ATOM 1504 CA VAL A 133 3.139 -6.425 -3.057 1.00 0.00 C ATOM 1505 C VAL A 133 4.374 -5.730 -2.502 1.00 0.00 C ATOM 1506 O VAL A 133 5.122 -6.297 -1.705 1.00 0.00 O ATOM 1507 CB VAL A 133 2.073 -6.498 -1.936 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.748 -5.937 -2.419 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.896 -7.924 -1.426 1.00 0.00 C ATOM 0 H VAL A 133 3.755 -8.425 -2.918 1.00 0.00 H new ATOM 0 HA VAL A 133 2.757 -5.843 -3.895 1.00 0.00 H new ATOM 0 HB VAL A 133 2.426 -5.889 -1.104 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.013 -5.998 -1.616 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.879 -4.896 -2.713 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.399 -6.514 -3.275 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.141 -7.938 -0.640 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.578 -8.567 -2.247 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.843 -8.287 -1.026 1.00 0.00 H new ATOM 1519 N GLU A 134 4.547 -4.477 -2.903 1.00 0.00 N ATOM 1520 CA GLU A 134 5.649 -3.659 -2.427 1.00 0.00 C ATOM 1521 C GLU A 134 5.082 -2.500 -1.623 1.00 0.00 C ATOM 1522 O GLU A 134 4.350 -1.665 -2.157 1.00 0.00 O ATOM 1523 CB GLU A 134 6.489 -3.133 -3.586 1.00 0.00 C ATOM 1524 CG GLU A 134 6.920 -4.210 -4.569 1.00 0.00 C ATOM 1525 CD GLU A 134 7.168 -3.663 -5.961 1.00 0.00 C ATOM 1526 OE1 GLU A 134 7.884 -2.645 -6.080 1.00 0.00 O ATOM 1527 OE2 GLU A 134 6.647 -4.250 -6.932 1.00 0.00 O ATOM 0 H GLU A 134 3.930 -4.004 -3.563 1.00 0.00 H new ATOM 0 HA GLU A 134 6.300 -4.269 -1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 134 5.919 -2.373 -4.121 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.377 -2.643 -3.186 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.829 -4.688 -4.203 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.151 -4.981 -4.617 1.00 0.00 H new ATOM 1534 N LEU A 135 5.386 -2.473 -0.335 1.00 0.00 N ATOM 1535 CA LEU A 135 4.858 -1.432 0.539 1.00 0.00 C ATOM 1536 C LEU A 135 5.906 -0.881 1.497 1.00 0.00 C ATOM 1537 O LEU A 135 6.798 -1.599 1.945 1.00 0.00 O ATOM 1538 CB LEU A 135 3.684 -1.987 1.349 1.00 0.00 C ATOM 1539 CG LEU A 135 3.908 -3.384 1.936 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.675 -3.299 3.247 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.578 -4.094 2.139 1.00 0.00 C ATOM 0 H LEU A 135 5.990 -3.153 0.127 1.00 0.00 H new ATOM 0 HA LEU A 135 4.533 -0.612 -0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.466 -1.297 2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.801 -2.015 0.710 1.00 0.00 H new ATOM 0 HG LEU A 135 4.504 -3.962 1.230 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.824 -4.302 3.647 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.644 -2.831 3.072 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.108 -2.703 3.962 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.755 -5.085 2.557 1.00 0.00 H new ATOM 0 HD22 LEU A 135 1.958 -3.516 2.825 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.067 -4.190 1.181 1.00 0.00 H new ATOM 1553 N ILE A 136 5.755 0.395 1.836 1.00 0.00 N ATOM 1554 CA ILE A 136 6.649 1.056 2.776 1.00 0.00 C ATOM 1555 C ILE A 136 5.893 1.303 4.076 1.00 0.00 C ATOM 1556 O ILE A 136 4.751 1.752 4.053 1.00 0.00 O ATOM 1557 CB ILE A 136 7.209 2.396 2.233 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.709 2.689 0.814 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.724 2.366 2.247 1.00 0.00 C ATOM 1560 CD1 ILE A 136 5.526 3.632 0.776 1.00 0.00 C ATOM 0 H ILE A 136 5.016 0.995 1.470 1.00 0.00 H new ATOM 0 HA ILE A 136 7.505 0.402 2.939 1.00 0.00 H new ATOM 0 HB ILE A 136 6.850 3.193 2.884 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.524 3.117 0.231 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.432 1.751 0.334 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.110 3.311 1.864 1.00 0.00 H new ATOM 0 HG22 ILE A 136 9.076 2.217 3.268 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.078 1.548 1.619 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.224 3.796 -0.259 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.696 3.197 1.332 1.00 0.00 H new ATOM 0 HD13 ILE A 136 5.805 4.584 1.227 1.00 0.00 H new ATOM 1572 N HIS A 137 6.513 0.978 5.203 1.00 0.00 N ATOM 1573 CA HIS A 137 5.859 1.132 6.496 1.00 0.00 C ATOM 1574 C HIS A 137 5.825 2.584 6.953 1.00 0.00 C ATOM 1575 O HIS A 137 6.863 3.208 7.167 1.00 0.00 O ATOM 1576 CB HIS A 137 6.549 0.245 7.532 1.00 0.00 C ATOM 1577 CG HIS A 137 6.720 -1.168 7.057 1.00 0.00 C ATOM 1578 ND1 HIS A 137 5.984 -2.228 7.549 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.530 -1.689 6.106 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.338 -3.336 6.918 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.274 -3.034 6.040 1.00 0.00 N ATOM 0 H HIS A 137 7.462 0.608 5.248 1.00 0.00 H new ATOM 0 HA HIS A 137 4.821 0.816 6.389 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.526 0.665 7.772 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.966 0.247 8.453 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.279 -2.167 8.283 1.00 0.00 H new ATOM 0 HD2 HIS A 137 8.247 -1.145 5.509 1.00 0.00 H new ATOM 0 HE1 HIS A 137 5.930 -4.320 7.093 1.00 0.00 H new ATOM 1590 N THR A 138 4.614 3.116 7.098 1.00 0.00 N ATOM 1591 CA THR A 138 4.432 4.497 7.530 1.00 0.00 C ATOM 1592 C THR A 138 4.320 4.568 9.052 1.00 0.00 C ATOM 1593 O THR A 138 4.616 3.601 9.750 1.00 0.00 O ATOM 1594 CB THR A 138 3.182 5.110 6.882 1.00 0.00 C ATOM 1595 OG1 THR A 138 2.051 4.954 7.720 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.830 4.518 5.532 1.00 0.00 C ATOM 0 H THR A 138 3.745 2.611 6.923 1.00 0.00 H new ATOM 0 HA THR A 138 5.303 5.070 7.212 1.00 0.00 H new ATOM 0 HB THR A 138 3.435 6.160 6.739 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.669 4.061 7.591 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.936 5.005 5.143 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.658 4.673 4.840 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.643 3.450 5.641 1.00 0.00 H new ATOM 1604 N ASP A 139 3.880 5.716 9.557 1.00 0.00 N ATOM 1605 CA ASP A 139 3.716 5.903 10.995 1.00 0.00 C ATOM 1606 C ASP A 139 2.571 5.042 11.523 1.00 0.00 C ATOM 1607 O ASP A 139 2.432 4.846 12.731 1.00 0.00 O ATOM 1608 CB ASP A 139 3.449 7.375 11.314 1.00 0.00 C ATOM 1609 CG ASP A 139 3.765 7.720 12.757 1.00 0.00 C ATOM 1610 OD1 ASP A 139 4.925 8.082 13.040 1.00 0.00 O ATOM 1611 OD2 ASP A 139 2.849 7.629 13.603 1.00 0.00 O ATOM 0 H ASP A 139 3.631 6.529 8.994 1.00 0.00 H new ATOM 0 HA ASP A 139 4.640 5.596 11.485 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.048 8.002 10.654 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.403 7.605 11.109 1.00 0.00 H new ATOM 1616 N SER A 140 1.754 4.530 10.606 1.00 0.00 N ATOM 1617 CA SER A 140 0.620 3.691 10.968 1.00 0.00 C ATOM 1618 C SER A 140 0.754 2.309 10.339 1.00 0.00 C ATOM 1619 O SER A 140 1.115 1.340 11.008 1.00 0.00 O ATOM 1620 CB SER A 140 -0.686 4.349 10.514 1.00 0.00 C ATOM 1621 OG SER A 140 -0.452 5.285 9.473 1.00 0.00 O ATOM 0 H SER A 140 1.859 4.684 9.603 1.00 0.00 H new ATOM 0 HA SER A 140 0.605 3.579 12.052 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.382 3.584 10.170 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.157 4.851 11.359 1.00 0.00 H new ATOM 0 HG SER A 140 -0.281 6.169 9.860 1.00 0.00 H new ATOM 1627 N LEU A 141 0.465 2.232 9.047 1.00 0.00 N ATOM 1628 CA LEU A 141 0.554 0.978 8.311 1.00 0.00 C ATOM 1629 C LEU A 141 1.380 1.161 7.043 1.00 0.00 C ATOM 1630 O LEU A 141 1.684 2.285 6.645 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.845 0.472 7.954 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.835 1.555 7.521 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.739 1.041 6.412 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.661 2.026 8.708 1.00 0.00 C ATOM 0 H LEU A 141 0.165 3.028 8.484 1.00 0.00 H new ATOM 0 HA LEU A 141 1.046 0.241 8.946 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.756 -0.259 7.151 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.257 -0.051 8.817 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.270 2.404 7.136 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.436 1.826 6.118 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.133 0.753 5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.297 0.175 6.769 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.360 2.796 8.382 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.216 1.184 9.122 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.000 2.436 9.472 1.00 0.00 H new ATOM 1646 N PRO A 142 1.778 0.055 6.400 1.00 0.00 N ATOM 1647 CA PRO A 142 2.582 0.097 5.183 1.00 0.00 C ATOM 1648 C PRO A 142 1.766 0.453 3.948 1.00 0.00 C ATOM 1649 O PRO A 142 0.763 -0.191 3.638 1.00 0.00 O ATOM 1650 CB PRO A 142 3.135 -1.332 5.056 1.00 0.00 C ATOM 1651 CG PRO A 142 2.738 -2.030 6.313 1.00 0.00 C ATOM 1652 CD PRO A 142 1.510 -1.323 6.810 1.00 0.00 C ATOM 0 HA PRO A 142 3.353 0.865 5.246 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.723 -1.835 4.181 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.219 -1.324 4.938 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.532 -3.084 6.126 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.538 -1.988 7.052 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.600 -1.716 6.357 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.394 -1.414 7.890 1.00 0.00 H new ATOM 1660 N LEU A 143 2.222 1.474 3.237 1.00 0.00 N ATOM 1661 CA LEU A 143 1.563 1.918 2.014 1.00 0.00 C ATOM 1662 C LEU A 143 2.063 1.095 0.836 1.00 0.00 C ATOM 1663 O LEU A 143 3.254 1.100 0.527 1.00 0.00 O ATOM 1664 CB LEU A 143 1.834 3.405 1.768 1.00 0.00 C ATOM 1665 CG LEU A 143 0.961 4.075 0.698 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.266 3.540 -0.692 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.506 3.889 1.008 1.00 0.00 C ATOM 0 H LEU A 143 3.050 2.014 3.487 1.00 0.00 H new ATOM 0 HA LEU A 143 0.488 1.777 2.122 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.698 3.940 2.708 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.879 3.522 1.483 1.00 0.00 H new ATOM 0 HG LEU A 143 1.196 5.139 0.712 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.628 4.038 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.312 3.731 -0.934 1.00 0.00 H new ATOM 0 HD13 LEU A 143 1.077 2.467 -0.718 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.105 4.372 0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.740 2.825 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.733 4.336 1.976 1.00 0.00 H new ATOM 1679 N VAL A 144 1.152 0.387 0.187 1.00 0.00 N ATOM 1680 CA VAL A 144 1.513 -0.445 -0.954 1.00 0.00 C ATOM 1681 C VAL A 144 1.767 0.415 -2.188 1.00 0.00 C ATOM 1682 O VAL A 144 0.833 0.852 -2.861 1.00 0.00 O ATOM 1683 CB VAL A 144 0.425 -1.498 -1.251 1.00 0.00 C ATOM 1684 CG1 VAL A 144 0.955 -2.560 -2.201 1.00 0.00 C ATOM 1685 CG2 VAL A 144 -0.075 -2.134 0.042 1.00 0.00 C ATOM 0 H VAL A 144 0.161 0.370 0.428 1.00 0.00 H new ATOM 0 HA VAL A 144 2.432 -0.973 -0.699 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.415 -0.997 -1.732 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.174 -3.294 -2.399 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.258 -2.092 -3.137 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.813 -3.057 -1.749 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.842 -2.874 -0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.756 -2.620 0.553 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.497 -1.363 0.687 1.00 0.00 H new ATOM 1695 N ILE A 145 3.046 0.672 -2.457 1.00 0.00 N ATOM 1696 CA ILE A 145 3.449 1.505 -3.586 1.00 0.00 C ATOM 1697 C ILE A 145 3.354 0.770 -4.919 1.00 0.00 C ATOM 1698 O ILE A 145 3.204 1.401 -5.967 1.00 0.00 O ATOM 1699 CB ILE A 145 4.889 2.026 -3.410 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.867 0.858 -3.248 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.970 2.961 -2.212 1.00 0.00 C ATOM 1702 CD1 ILE A 145 7.016 0.894 -4.232 1.00 0.00 C ATOM 0 H ILE A 145 3.824 0.312 -1.904 1.00 0.00 H new ATOM 0 HA ILE A 145 2.751 2.342 -3.602 1.00 0.00 H new ATOM 0 HB ILE A 145 5.167 2.584 -4.304 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.267 0.867 -2.234 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.324 -0.080 -3.369 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.993 3.321 -2.100 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.302 3.808 -2.366 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.674 2.424 -1.311 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.669 0.038 -4.060 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.626 0.854 -5.249 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.582 1.815 -4.096 1.00 0.00 H new ATOM 1714 N SER A 146 3.445 -0.555 -4.890 1.00 0.00 N ATOM 1715 CA SER A 146 3.371 -1.329 -6.127 1.00 0.00 C ATOM 1716 C SER A 146 2.668 -2.667 -5.923 1.00 0.00 C ATOM 1717 O SER A 146 2.513 -3.142 -4.797 1.00 0.00 O ATOM 1718 CB SER A 146 4.774 -1.560 -6.695 1.00 0.00 C ATOM 1719 OG SER A 146 5.751 -0.852 -5.952 1.00 0.00 O ATOM 0 H SER A 146 3.568 -1.108 -4.042 1.00 0.00 H new ATOM 0 HA SER A 146 2.782 -0.749 -6.837 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.004 -2.625 -6.681 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.804 -1.241 -7.737 1.00 0.00 H new ATOM 0 HG SER A 146 6.619 -1.298 -6.044 1.00 0.00 H new ATOM 1725 N LEU A 147 2.248 -3.268 -7.034 1.00 0.00 N ATOM 1726 CA LEU A 147 1.563 -4.553 -7.012 1.00 0.00 C ATOM 1727 C LEU A 147 1.908 -5.345 -8.268 1.00 0.00 C ATOM 1728 O LEU A 147 2.319 -4.770 -9.273 1.00 0.00 O ATOM 1729 CB LEU A 147 0.051 -4.345 -6.918 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.677 -5.315 -5.986 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.926 -4.670 -4.632 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -1.989 -5.770 -6.605 1.00 0.00 C ATOM 0 H LEU A 147 2.373 -2.879 -7.968 1.00 0.00 H new ATOM 0 HA LEU A 147 1.892 -5.114 -6.137 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.140 -3.327 -6.580 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.376 -4.435 -7.917 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.043 -6.189 -5.841 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.445 -5.375 -3.983 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.027 -4.394 -4.180 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.539 -3.778 -4.761 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.492 -6.459 -5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.628 -4.904 -6.782 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.790 -6.273 -7.551 1.00 0.00 H new ATOM 1744 N ASN A 148 1.761 -6.665 -8.205 1.00 0.00 N ATOM 1745 CA ASN A 148 2.083 -7.517 -9.350 1.00 0.00 C ATOM 1746 C ASN A 148 1.505 -6.973 -10.664 1.00 0.00 C ATOM 1747 O ASN A 148 0.328 -7.160 -10.968 1.00 0.00 O ATOM 1748 CB ASN A 148 1.594 -8.953 -9.101 1.00 0.00 C ATOM 1749 CG ASN A 148 0.114 -9.150 -9.386 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.264 -9.625 -10.456 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.732 -8.785 -8.429 1.00 0.00 N ATOM 0 H ASN A 148 1.425 -7.166 -7.383 1.00 0.00 H new ATOM 0 HA ASN A 148 3.168 -7.520 -9.455 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.170 -9.637 -9.724 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.795 -9.221 -8.064 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.737 -8.895 -8.567 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.377 -8.395 -7.556 1.00 0.00 H new ATOM 1758 N GLY A 149 2.357 -6.322 -11.452 1.00 0.00 N ATOM 1759 CA GLY A 149 1.931 -5.792 -12.738 1.00 0.00 C ATOM 1760 C GLY A 149 1.196 -4.466 -12.650 1.00 0.00 C ATOM 1761 O GLY A 149 0.434 -4.119 -13.551 1.00 0.00 O ATOM 0 H GLY A 149 3.336 -6.151 -11.223 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.806 -5.668 -13.376 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.284 -6.522 -13.223 1.00 0.00 H new ATOM 1765 N HIS A 150 1.424 -3.715 -11.578 1.00 0.00 N ATOM 1766 CA HIS A 150 0.773 -2.417 -11.409 1.00 0.00 C ATOM 1767 C HIS A 150 1.580 -1.521 -10.483 1.00 0.00 C ATOM 1768 O HIS A 150 2.423 -1.995 -9.721 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.644 -2.578 -10.856 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.368 -3.765 -11.401 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.195 -3.710 -12.503 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.376 -5.049 -10.988 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.684 -4.916 -12.742 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.201 -5.746 -11.837 1.00 0.00 N ATOM 0 H HIS A 150 2.050 -3.978 -10.817 1.00 0.00 H new ATOM 0 HA HIS A 150 0.716 -1.952 -12.393 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.594 -2.661 -9.770 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.217 -1.679 -11.081 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.834 -5.454 -10.146 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.362 -5.176 -13.541 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.407 -6.743 -11.777 1.00 0.00 H new ATOM 1783 N THR A 151 1.318 -0.223 -10.558 1.00 0.00 N ATOM 1784 CA THR A 151 2.023 0.739 -9.729 1.00 0.00 C ATOM 1785 C THR A 151 1.108 1.888 -9.323 1.00 0.00 C ATOM 1786 O THR A 151 0.160 2.224 -10.033 1.00 0.00 O ATOM 1787 CB THR A 151 3.246 1.267 -10.469 1.00 0.00 C ATOM 1788 OG1 THR A 151 2.871 2.215 -11.452 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.036 0.174 -11.158 1.00 0.00 C ATOM 0 H THR A 151 0.624 0.185 -11.184 1.00 0.00 H new ATOM 0 HA THR A 151 2.349 0.235 -8.819 1.00 0.00 H new ATOM 0 HB THR A 151 3.874 1.726 -9.705 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.671 2.542 -11.913 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.894 0.612 -11.668 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.382 -0.547 -10.417 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.401 -0.331 -11.886 1.00 0.00 H new ATOM 1797 N LEU A 152 1.393 2.476 -8.166 1.00 0.00 N ATOM 1798 CA LEU A 152 0.594 3.578 -7.645 1.00 0.00 C ATOM 1799 C LEU A 152 0.572 4.753 -8.611 1.00 0.00 C ATOM 1800 O LEU A 152 -0.435 5.453 -8.729 1.00 0.00 O ATOM 1801 CB LEU A 152 1.146 4.020 -6.291 1.00 0.00 C ATOM 1802 CG LEU A 152 0.315 3.590 -5.083 1.00 0.00 C ATOM 1803 CD1 LEU A 152 1.005 3.995 -3.792 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.075 4.194 -5.159 1.00 0.00 C ATOM 0 H LEU A 152 2.175 2.206 -7.569 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.431 3.228 -7.524 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.155 3.622 -6.179 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.230 5.107 -6.287 1.00 0.00 H new ATOM 0 HG LEU A 152 0.221 2.504 -5.094 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.399 3.681 -2.942 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.983 3.517 -3.737 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.128 5.078 -3.770 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.656 3.879 -4.292 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.999 5.281 -5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.569 3.856 -6.070 1.00 0.00 H new