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 -105:sc= 0.0511! USER MOD Set 1.2: A 140 SER OG : rot -80:sc= -1.12 USER MOD Set 2.1: A 56 TYR OH : rot 80:sc= -2.4! USER MOD Set 2.2: A 118 HIS : no HE2:sc= -6.24! C(o=-8.6!,f=-12!) USER MOD Single : A 41 GLN : amide:sc= -0.287 X(o=-0.29,f=-0.095) 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 180:sc= 0.325 USER MOD Single : A 51 SER OG : rot 80:sc= 1.17 USER MOD Single : A 55 ASN : amide:sc= -1.64 K(o=-1.6,f=-0.62) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -22:sc= 0.656 USER MOD Single : A 82 ASN : amide:sc= -1.68 K(o=-1.7,f=-3.4!) USER MOD Single : A 85 SER OG : rot -100:sc= 0.776 USER MOD Single : A 86 ASN : amide:sc= -5.1! C(o=-5.1!,f=-6!) USER MOD Single : A 87 ASN : amide:sc= -0.799 K(o=-0.8,f=-0.061) USER MOD Single : A 89 MET CE :methyl 169:sc= -0.0194 (180deg=-0.187) USER MOD Single : A 90 MET CE :methyl 168:sc= -8.85! (180deg=-9.53!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0608 USER MOD Single : A 93 HIS : no HD1:sc= -4.78! C(o=-4.8!,f=-6.5!) USER MOD Single : A 96 THR OG1 : rot 78:sc= 1.22 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -130:sc=-0.00217 USER MOD Single : A 102 THR OG1 : rot -36:sc= 0.502 USER MOD Single : A 106 ASN : amide:sc= -1.96 X(o=-2,f=-2.2) USER MOD Single : A 107 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000667) USER MOD Single : A 110 TYR OH : rot 180:sc= -1.49! USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 64:sc= 0.124 USER MOD Single : A 125 GLN : amide:sc= 0.513 K(o=0.51,f=-0.87) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.565 X(o=-0.57,f=-0.083) USER MOD Single : A 131 ASN : amide:sc= -5.08! C(o=-5.1!,f=-12!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -3.49 K(o=-3.5,f=-1.6) USER MOD Single : A 146 SER OG : rot 171:sc= -2.27 USER MOD Single : A 148 ASN : amide:sc= -3.07! C(o=-3.1!,f=-12!) USER MOD Single : A 150 HIS : no HD1:sc= -13.7! C(o=-14!,f=-14!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.490 -10.463 6.830 1.00 0.00 N ATOM 14 CA PHE A 37 7.594 -9.737 6.210 1.00 0.00 C ATOM 15 C PHE A 37 8.938 -10.267 6.702 1.00 0.00 C ATOM 16 O PHE A 37 9.911 -9.521 6.803 1.00 0.00 O ATOM 17 CB PHE A 37 7.486 -8.240 6.513 1.00 0.00 C ATOM 18 CG PHE A 37 6.079 -7.709 6.475 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.628 -6.839 7.454 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.210 -8.078 5.459 1.00 0.00 C ATOM 21 CE1 PHE A 37 4.338 -6.345 7.422 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.918 -7.586 5.423 1.00 0.00 C ATOM 23 CZ PHE A 37 3.482 -6.720 6.405 1.00 0.00 C ATOM 0 HA PHE A 37 7.533 -9.889 5.132 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.910 -8.048 7.499 1.00 0.00 H new ATOM 0 HB3 PHE A 37 8.091 -7.689 5.793 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.293 -6.543 8.252 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.546 -8.756 4.688 1.00 0.00 H new ATOM 0 HE1 PHE A 37 4.000 -5.667 8.191 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.250 -7.879 4.626 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.473 -6.336 6.378 1.00 0.00 H new ATOM 33 N ALA A 38 8.984 -11.560 7.011 1.00 0.00 N ATOM 34 CA ALA A 38 10.207 -12.187 7.495 1.00 0.00 C ATOM 35 C ALA A 38 11.206 -12.403 6.363 1.00 0.00 C ATOM 36 O ALA A 38 12.406 -12.185 6.531 1.00 0.00 O ATOM 37 CB ALA A 38 9.887 -13.509 8.177 1.00 0.00 C ATOM 0 H ALA A 38 8.188 -12.193 6.934 1.00 0.00 H new ATOM 0 HA ALA A 38 10.664 -11.515 8.221 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.809 -13.967 8.534 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.220 -13.331 9.021 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.402 -14.177 7.466 1.00 0.00 H new ATOM 43 N ASP A 39 10.702 -12.835 5.213 1.00 0.00 N ATOM 44 CA ASP A 39 11.550 -13.084 4.051 1.00 0.00 C ATOM 45 C ASP A 39 11.287 -12.069 2.939 1.00 0.00 C ATOM 46 O ASP A 39 11.803 -12.206 1.830 1.00 0.00 O ATOM 47 CB ASP A 39 11.315 -14.499 3.524 1.00 0.00 C ATOM 48 CG ASP A 39 12.578 -15.129 2.971 1.00 0.00 C ATOM 49 OD1 ASP A 39 12.817 -15.009 1.751 1.00 0.00 O ATOM 50 OD2 ASP A 39 13.329 -15.742 3.758 1.00 0.00 O ATOM 0 H ASP A 39 9.711 -13.020 5.059 1.00 0.00 H new ATOM 0 HA ASP A 39 12.588 -12.979 4.367 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.924 -15.122 4.328 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.555 -14.471 2.743 1.00 0.00 H new ATOM 55 N ALA A 40 10.483 -11.053 3.239 1.00 0.00 N ATOM 56 CA ALA A 40 10.154 -10.023 2.262 1.00 0.00 C ATOM 57 C ALA A 40 11.392 -9.230 1.854 1.00 0.00 C ATOM 58 O ALA A 40 12.119 -8.716 2.705 1.00 0.00 O ATOM 59 CB ALA A 40 9.091 -9.091 2.823 1.00 0.00 C ATOM 0 H ALA A 40 10.048 -10.922 4.152 1.00 0.00 H new ATOM 0 HA ALA A 40 9.763 -10.514 1.371 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.852 -8.325 2.085 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.193 -9.662 3.056 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.465 -8.617 3.730 1.00 0.00 H new ATOM 65 N GLN A 41 11.623 -9.129 0.547 1.00 0.00 N ATOM 66 CA GLN A 41 12.771 -8.391 0.028 1.00 0.00 C ATOM 67 C GLN A 41 12.736 -6.944 0.503 1.00 0.00 C ATOM 68 O GLN A 41 11.771 -6.516 1.137 1.00 0.00 O ATOM 69 CB GLN A 41 12.790 -8.442 -1.501 1.00 0.00 C ATOM 70 CG GLN A 41 13.697 -9.525 -2.062 1.00 0.00 C ATOM 71 CD GLN A 41 14.420 -9.088 -3.320 1.00 0.00 C ATOM 72 OE1 GLN A 41 14.389 -9.777 -4.340 1.00 0.00 O ATOM 73 NE2 GLN A 41 15.076 -7.935 -3.255 1.00 0.00 N ATOM 0 H GLN A 41 11.031 -9.548 -0.170 1.00 0.00 H new ATOM 0 HA GLN A 41 13.679 -8.860 0.407 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.775 -8.606 -1.863 1.00 0.00 H new ATOM 0 HB3 GLN A 41 13.113 -7.474 -1.885 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.430 -9.807 -1.306 1.00 0.00 H new ATOM 0 HG3 GLN A 41 13.104 -10.414 -2.279 1.00 0.00 H new ATOM 0 HE21 GLN A 41 15.075 -7.396 -2.389 1.00 0.00 H new ATOM 0 HE22 GLN A 41 15.580 -7.589 -4.071 1.00 0.00 H new ATOM 82 N THR A 42 13.789 -6.190 0.201 1.00 0.00 N ATOM 83 CA THR A 42 13.856 -4.794 0.616 1.00 0.00 C ATOM 84 C THR A 42 14.726 -3.963 -0.324 1.00 0.00 C ATOM 85 O THR A 42 15.747 -4.430 -0.828 1.00 0.00 O ATOM 86 CB THR A 42 14.390 -4.692 2.047 1.00 0.00 C ATOM 87 OG1 THR A 42 15.063 -5.883 2.418 1.00 0.00 O ATOM 88 CG2 THR A 42 13.306 -4.438 3.073 1.00 0.00 C ATOM 0 H THR A 42 14.599 -6.518 -0.324 1.00 0.00 H new ATOM 0 HA THR A 42 12.844 -4.392 0.576 1.00 0.00 H new ATOM 0 HB THR A 42 15.070 -3.840 2.042 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.398 -5.797 3.335 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.752 -4.377 4.066 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.800 -3.500 2.844 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.584 -5.254 3.049 1.00 0.00 H new ATOM 96 N ARG A 43 14.311 -2.718 -0.537 1.00 0.00 N ATOM 97 CA ARG A 43 15.034 -1.786 -1.396 1.00 0.00 C ATOM 98 C ARG A 43 14.711 -0.355 -0.983 1.00 0.00 C ATOM 99 O ARG A 43 13.735 -0.121 -0.277 1.00 0.00 O ATOM 100 CB ARG A 43 14.669 -2.011 -2.865 1.00 0.00 C ATOM 101 CG ARG A 43 13.217 -1.697 -3.188 1.00 0.00 C ATOM 102 CD ARG A 43 12.930 -1.849 -4.675 1.00 0.00 C ATOM 103 NE ARG A 43 12.261 -0.673 -5.226 1.00 0.00 N ATOM 104 CZ ARG A 43 12.140 -0.432 -6.529 1.00 0.00 C ATOM 105 NH1 ARG A 43 12.640 -1.281 -7.418 1.00 0.00 N ATOM 106 NH2 ARG A 43 11.517 0.662 -6.946 1.00 0.00 N ATOM 0 H ARG A 43 13.466 -2.327 -0.120 1.00 0.00 H new ATOM 0 HA ARG A 43 16.104 -1.959 -1.283 1.00 0.00 H new ATOM 0 HB2 ARG A 43 15.313 -1.392 -3.489 1.00 0.00 H new ATOM 0 HB3 ARG A 43 14.874 -3.049 -3.126 1.00 0.00 H new ATOM 0 HG2 ARG A 43 12.565 -2.362 -2.621 1.00 0.00 H new ATOM 0 HG3 ARG A 43 12.985 -0.679 -2.874 1.00 0.00 H new ATOM 0 HD2 ARG A 43 13.865 -2.018 -5.209 1.00 0.00 H new ATOM 0 HD3 ARG A 43 12.307 -2.729 -4.836 1.00 0.00 H new ATOM 0 HE ARG A 43 11.863 0.003 -4.574 1.00 0.00 H new ATOM 0 HH11 ARG A 43 13.120 -2.124 -7.104 1.00 0.00 H new ATOM 0 HH12 ARG A 43 12.544 -1.090 -8.415 1.00 0.00 H new ATOM 0 HH21 ARG A 43 11.131 1.319 -6.268 1.00 0.00 H new ATOM 0 HH22 ARG A 43 11.424 0.847 -7.945 1.00 0.00 H new ATOM 120 N LYS A 44 15.532 0.602 -1.400 1.00 0.00 N ATOM 121 CA LYS A 44 15.305 1.993 -1.033 1.00 0.00 C ATOM 122 C LYS A 44 14.271 2.664 -1.929 1.00 0.00 C ATOM 123 O LYS A 44 14.253 2.473 -3.145 1.00 0.00 O ATOM 124 CB LYS A 44 16.614 2.777 -1.064 1.00 0.00 C ATOM 125 CG LYS A 44 16.970 3.372 0.283 1.00 0.00 C ATOM 126 CD LYS A 44 18.303 4.099 0.241 1.00 0.00 C ATOM 127 CE LYS A 44 19.460 3.157 0.532 1.00 0.00 C ATOM 128 NZ LYS A 44 20.739 3.893 0.737 1.00 0.00 N ATOM 0 H LYS A 44 16.352 0.443 -1.986 1.00 0.00 H new ATOM 0 HA LYS A 44 14.909 1.994 -0.017 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.419 2.119 -1.390 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.537 3.576 -1.801 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.187 4.064 0.593 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.010 2.580 1.031 1.00 0.00 H new ATOM 0 HD2 LYS A 44 18.440 4.553 -0.740 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.300 4.909 0.970 1.00 0.00 H new ATOM 0 HE2 LYS A 44 19.234 2.568 1.421 1.00 0.00 H new ATOM 0 HE3 LYS A 44 19.573 2.456 -0.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 21.502 3.214 0.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 20.969 4.435 -0.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.640 4.544 1.542 1.00 0.00 H new ATOM 142 N LEU A 45 13.413 3.458 -1.298 1.00 0.00 N ATOM 143 CA LEU A 45 12.358 4.186 -1.992 1.00 0.00 C ATOM 144 C LEU A 45 12.931 5.346 -2.803 1.00 0.00 C ATOM 145 O LEU A 45 13.841 6.041 -2.348 1.00 0.00 O ATOM 146 CB LEU A 45 11.349 4.718 -0.967 1.00 0.00 C ATOM 147 CG LEU A 45 9.992 5.172 -1.523 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.540 4.289 -2.674 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.947 5.172 -0.420 1.00 0.00 C ATOM 0 H LEU A 45 13.430 3.615 -0.290 1.00 0.00 H new ATOM 0 HA LEU A 45 11.862 3.503 -2.682 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.172 3.939 -0.225 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.804 5.559 -0.444 1.00 0.00 H new ATOM 0 HG LEU A 45 10.109 6.186 -1.905 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.576 4.638 -3.044 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.275 4.334 -3.478 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.444 3.260 -2.327 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.989 5.496 -0.827 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.847 4.166 -0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.254 5.855 0.372 1.00 0.00 H new ATOM 161 N THR A 46 12.390 5.559 -4.000 1.00 0.00 N ATOM 162 CA THR A 46 12.849 6.644 -4.861 1.00 0.00 C ATOM 163 C THR A 46 12.087 7.931 -4.554 1.00 0.00 C ATOM 164 O THR A 46 10.961 7.889 -4.058 1.00 0.00 O ATOM 165 CB THR A 46 12.669 6.279 -6.339 1.00 0.00 C ATOM 166 OG1 THR A 46 11.340 6.539 -6.764 1.00 0.00 O ATOM 167 CG2 THR A 46 12.980 4.828 -6.647 1.00 0.00 C ATOM 0 H THR A 46 11.636 4.996 -4.394 1.00 0.00 H new ATOM 0 HA THR A 46 13.909 6.802 -4.664 1.00 0.00 H new ATOM 0 HB THR A 46 13.383 6.903 -6.876 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.247 6.301 -7.710 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.831 4.642 -7.711 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.016 4.614 -6.383 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.317 4.183 -6.070 1.00 0.00 H new ATOM 175 N PRO A 47 12.688 9.095 -4.850 1.00 0.00 N ATOM 176 CA PRO A 47 12.052 10.392 -4.605 1.00 0.00 C ATOM 177 C PRO A 47 10.747 10.541 -5.376 1.00 0.00 C ATOM 178 O PRO A 47 9.758 11.050 -4.851 1.00 0.00 O ATOM 179 CB PRO A 47 13.089 11.410 -5.098 1.00 0.00 C ATOM 180 CG PRO A 47 13.995 10.637 -5.996 1.00 0.00 C ATOM 181 CD PRO A 47 14.024 9.241 -5.447 1.00 0.00 C ATOM 0 HA PRO A 47 11.785 10.523 -3.556 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.612 12.232 -5.632 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.639 11.848 -4.265 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.628 10.646 -7.022 1.00 0.00 H new ATOM 0 HG3 PRO A 47 14.994 11.072 -6.011 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.200 8.503 -6.229 1.00 0.00 H new ATOM 0 HD3 PRO A 47 14.814 9.114 -4.706 1.00 0.00 H new ATOM 189 N GLU A 48 10.749 10.084 -6.625 1.00 0.00 N ATOM 190 CA GLU A 48 9.561 10.158 -7.465 1.00 0.00 C ATOM 191 C GLU A 48 8.424 9.348 -6.853 1.00 0.00 C ATOM 192 O GLU A 48 7.281 9.806 -6.796 1.00 0.00 O ATOM 193 CB GLU A 48 9.871 9.645 -8.872 1.00 0.00 C ATOM 194 CG GLU A 48 9.184 10.436 -9.973 1.00 0.00 C ATOM 195 CD GLU A 48 10.092 10.697 -11.159 1.00 0.00 C ATOM 196 OE1 GLU A 48 11.321 10.791 -10.956 1.00 0.00 O ATOM 197 OE2 GLU A 48 9.576 10.806 -12.291 1.00 0.00 O ATOM 0 H GLU A 48 11.559 9.659 -7.076 1.00 0.00 H new ATOM 0 HA GLU A 48 9.252 11.201 -7.531 1.00 0.00 H new ATOM 0 HB2 GLU A 48 10.949 9.676 -9.032 1.00 0.00 H new ATOM 0 HB3 GLU A 48 9.568 8.600 -8.944 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.301 9.892 -10.309 1.00 0.00 H new ATOM 0 HG3 GLU A 48 8.838 11.387 -9.569 1.00 0.00 H new ATOM 204 N GLU A 49 8.746 8.143 -6.390 1.00 0.00 N ATOM 205 CA GLU A 49 7.750 7.274 -5.780 1.00 0.00 C ATOM 206 C GLU A 49 7.135 7.928 -4.553 1.00 0.00 C ATOM 207 O GLU A 49 5.939 7.793 -4.298 1.00 0.00 O ATOM 208 CB GLU A 49 8.366 5.927 -5.409 1.00 0.00 C ATOM 209 CG GLU A 49 8.301 4.912 -6.538 1.00 0.00 C ATOM 210 CD GLU A 49 9.349 3.824 -6.406 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.338 4.039 -5.674 1.00 0.00 O ATOM 212 OE2 GLU A 49 9.179 2.757 -7.033 1.00 0.00 O ATOM 0 H GLU A 49 9.686 7.749 -6.426 1.00 0.00 H new ATOM 0 HA GLU A 49 6.959 7.106 -6.511 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.407 6.077 -5.122 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.850 5.526 -4.537 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.311 4.457 -6.556 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.433 5.425 -7.491 1.00 0.00 H new ATOM 219 N ARG A 50 7.955 8.648 -3.797 1.00 0.00 N ATOM 220 CA ARG A 50 7.481 9.327 -2.601 1.00 0.00 C ATOM 221 C ARG A 50 6.676 10.569 -2.969 1.00 0.00 C ATOM 222 O ARG A 50 5.762 10.964 -2.245 1.00 0.00 O ATOM 223 CB ARG A 50 8.660 9.708 -1.705 1.00 0.00 C ATOM 224 CG ARG A 50 8.597 9.070 -0.329 1.00 0.00 C ATOM 225 CD ARG A 50 9.608 9.688 0.616 1.00 0.00 C ATOM 226 NE ARG A 50 10.242 8.682 1.466 1.00 0.00 N ATOM 227 CZ ARG A 50 10.228 8.712 2.798 1.00 0.00 C ATOM 228 NH1 ARG A 50 9.634 9.704 3.451 1.00 0.00 N ATOM 229 NH2 ARG A 50 10.816 7.742 3.481 1.00 0.00 N ATOM 0 H ARG A 50 8.948 8.776 -3.991 1.00 0.00 H new ATOM 0 HA ARG A 50 6.830 8.644 -2.055 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.589 9.413 -2.193 1.00 0.00 H new ATOM 0 HB3 ARG A 50 8.689 10.792 -1.595 1.00 0.00 H new ATOM 0 HG2 ARG A 50 7.594 9.187 0.082 1.00 0.00 H new ATOM 0 HG3 ARG A 50 8.784 7.999 -0.414 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.372 10.211 0.040 1.00 0.00 H new ATOM 0 HD3 ARG A 50 9.114 10.433 1.240 1.00 0.00 H new ATOM 0 HE ARG A 50 10.726 7.908 1.011 1.00 0.00 H new ATOM 0 HH11 ARG A 50 9.180 10.456 2.933 1.00 0.00 H new ATOM 0 HH12 ARG A 50 9.631 9.714 4.471 1.00 0.00 H new ATOM 0 HH21 ARG A 50 11.276 6.977 2.987 1.00 0.00 H new ATOM 0 HH22 ARG A 50 10.809 7.759 4.501 1.00 0.00 H new ATOM 243 N SER A 51 7.020 11.176 -4.099 1.00 0.00 N ATOM 244 CA SER A 51 6.325 12.369 -4.563 1.00 0.00 C ATOM 245 C SER A 51 4.869 12.054 -4.877 1.00 0.00 C ATOM 246 O SER A 51 3.954 12.656 -4.312 1.00 0.00 O ATOM 247 CB SER A 51 7.015 12.941 -5.803 1.00 0.00 C ATOM 248 OG SER A 51 8.406 13.098 -5.585 1.00 0.00 O ATOM 0 H SER A 51 7.775 10.862 -4.709 1.00 0.00 H new ATOM 0 HA SER A 51 6.357 13.113 -3.767 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.849 12.279 -6.653 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.573 13.904 -6.058 1.00 0.00 H new ATOM 0 HG SER A 51 8.853 12.232 -5.688 1.00 0.00 H new ATOM 254 N ALA A 52 4.660 11.105 -5.777 1.00 0.00 N ATOM 255 CA ALA A 52 3.312 10.709 -6.157 1.00 0.00 C ATOM 256 C ALA A 52 2.594 10.046 -4.997 1.00 0.00 C ATOM 257 O ALA A 52 1.429 10.317 -4.753 1.00 0.00 O ATOM 258 CB ALA A 52 3.339 9.787 -7.359 1.00 0.00 C ATOM 0 H ALA A 52 5.403 10.596 -6.256 1.00 0.00 H new ATOM 0 HA ALA A 52 2.763 11.611 -6.428 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.320 9.505 -7.624 1.00 0.00 H new ATOM 0 HB2 ALA A 52 3.804 10.300 -8.201 1.00 0.00 H new ATOM 0 HB3 ALA A 52 3.912 8.892 -7.118 1.00 0.00 H new ATOM 264 N VAL A 53 3.297 9.177 -4.280 1.00 0.00 N ATOM 265 CA VAL A 53 2.706 8.492 -3.135 1.00 0.00 C ATOM 266 C VAL A 53 2.088 9.500 -2.170 1.00 0.00 C ATOM 267 O VAL A 53 0.976 9.305 -1.679 1.00 0.00 O ATOM 268 CB VAL A 53 3.749 7.619 -2.397 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.316 7.321 -0.967 1.00 0.00 C ATOM 270 CG2 VAL A 53 3.982 6.324 -3.158 1.00 0.00 C ATOM 0 H VAL A 53 4.269 8.931 -4.468 1.00 0.00 H new ATOM 0 HA VAL A 53 1.923 7.835 -3.512 1.00 0.00 H new ATOM 0 HB VAL A 53 4.683 8.180 -2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.072 6.706 -0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.200 8.256 -0.420 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.366 6.787 -0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.718 5.718 -2.629 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.045 5.773 -3.233 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.351 6.551 -4.158 1.00 0.00 H new ATOM 280 N GLU A 54 2.810 10.584 -1.914 1.00 0.00 N ATOM 281 CA GLU A 54 2.326 11.627 -1.020 1.00 0.00 C ATOM 282 C GLU A 54 1.119 12.337 -1.633 1.00 0.00 C ATOM 283 O GLU A 54 0.121 12.582 -0.958 1.00 0.00 O ATOM 284 CB GLU A 54 3.452 12.625 -0.702 1.00 0.00 C ATOM 285 CG GLU A 54 3.375 13.936 -1.474 1.00 0.00 C ATOM 286 CD GLU A 54 4.604 14.801 -1.277 1.00 0.00 C ATOM 287 OE1 GLU A 54 5.192 14.756 -0.175 1.00 0.00 O ATOM 288 OE2 GLU A 54 4.978 15.525 -2.223 1.00 0.00 O ATOM 0 H GLU A 54 3.732 10.763 -2.313 1.00 0.00 H new ATOM 0 HA GLU A 54 2.008 11.167 -0.084 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.433 12.846 0.365 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.410 12.150 -0.913 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.252 13.722 -2.536 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.491 14.489 -1.156 1.00 0.00 H new ATOM 295 N ASN A 55 1.224 12.655 -2.919 1.00 0.00 N ATOM 296 CA ASN A 55 0.146 13.330 -3.639 1.00 0.00 C ATOM 297 C ASN A 55 -1.089 12.439 -3.737 1.00 0.00 C ATOM 298 O ASN A 55 -2.222 12.920 -3.772 1.00 0.00 O ATOM 299 CB ASN A 55 0.617 13.714 -5.045 1.00 0.00 C ATOM 300 CG ASN A 55 1.805 14.653 -5.022 1.00 0.00 C ATOM 301 OD1 ASN A 55 1.839 15.614 -4.252 1.00 0.00 O ATOM 302 ND2 ASN A 55 2.792 14.379 -5.868 1.00 0.00 N ATOM 0 H ASN A 55 2.047 12.456 -3.487 1.00 0.00 H new ATOM 0 HA ASN A 55 -0.121 14.230 -3.085 1.00 0.00 H new ATOM 0 HB2 ASN A 55 0.882 12.811 -5.595 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -0.205 14.186 -5.584 1.00 0.00 H new ATOM 0 HD21 ASN A 55 3.619 14.975 -5.897 1.00 0.00 H new ATOM 0 HD22 ASN A 55 2.723 13.572 -6.489 1.00 0.00 H new ATOM 309 N TYR A 56 -0.850 11.135 -3.785 1.00 0.00 N ATOM 310 CA TYR A 56 -1.912 10.147 -3.887 1.00 0.00 C ATOM 311 C TYR A 56 -2.640 10.013 -2.553 1.00 0.00 C ATOM 312 O TYR A 56 -3.871 10.040 -2.495 1.00 0.00 O ATOM 313 CB TYR A 56 -1.305 8.805 -4.333 1.00 0.00 C ATOM 314 CG TYR A 56 -2.054 7.579 -3.863 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.405 6.575 -3.149 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.407 7.428 -4.129 1.00 0.00 C ATOM 317 CE1 TYR A 56 -2.090 5.459 -2.715 1.00 0.00 C ATOM 318 CE2 TYR A 56 -4.097 6.312 -3.699 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.434 5.332 -2.991 1.00 0.00 C ATOM 320 OH TYR A 56 -4.117 4.226 -2.552 1.00 0.00 O ATOM 0 H TYR A 56 0.087 10.734 -3.754 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.645 10.464 -4.628 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -1.258 8.788 -5.422 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -0.279 8.748 -3.968 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.351 6.671 -2.932 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.929 8.195 -4.681 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -1.575 4.688 -2.161 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -5.150 6.207 -3.916 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.346 4.337 -1.606 1.00 0.00 H new ATOM 330 N LEU A 57 -1.868 9.881 -1.482 1.00 0.00 N ATOM 331 CA LEU A 57 -2.430 9.754 -0.146 1.00 0.00 C ATOM 332 C LEU A 57 -3.056 11.072 0.301 1.00 0.00 C ATOM 333 O LEU A 57 -4.040 11.083 1.041 1.00 0.00 O ATOM 334 CB LEU A 57 -1.343 9.326 0.838 1.00 0.00 C ATOM 335 CG LEU A 57 -0.771 7.930 0.588 1.00 0.00 C ATOM 336 CD1 LEU A 57 0.690 7.865 1.004 1.00 0.00 C ATOM 337 CD2 LEU A 57 -1.592 6.883 1.327 1.00 0.00 C ATOM 0 H LEU A 57 -0.849 9.859 -1.514 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.210 8.993 -0.167 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.529 10.050 0.798 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.751 9.361 1.848 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.826 7.719 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.077 6.863 0.818 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.265 8.589 0.427 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.777 8.096 2.066 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.174 5.894 1.140 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.568 7.091 2.397 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.623 6.913 0.974 1.00 0.00 H new ATOM 349 N GLU A 58 -2.487 12.184 -0.162 1.00 0.00 N ATOM 350 CA GLU A 58 -3.002 13.504 0.186 1.00 0.00 C ATOM 351 C GLU A 58 -4.362 13.729 -0.459 1.00 0.00 C ATOM 352 O GLU A 58 -5.319 14.126 0.204 1.00 0.00 O ATOM 353 CB GLU A 58 -2.027 14.599 -0.253 1.00 0.00 C ATOM 354 CG GLU A 58 -1.197 15.165 0.888 1.00 0.00 C ATOM 355 CD GLU A 58 0.274 15.277 0.540 1.00 0.00 C ATOM 356 OE1 GLU A 58 1.112 15.160 1.460 1.00 0.00 O ATOM 357 OE2 GLU A 58 0.588 15.480 -0.651 1.00 0.00 O ATOM 0 H GLU A 58 -1.673 12.196 -0.776 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.112 13.551 1.269 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.358 14.195 -1.013 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.588 15.408 -0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.579 16.150 1.156 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.311 14.529 1.766 1.00 0.00 H new ATOM 364 N SER A 59 -4.442 13.453 -1.754 1.00 0.00 N ATOM 365 CA SER A 59 -5.690 13.607 -2.488 1.00 0.00 C ATOM 366 C SER A 59 -6.728 12.629 -1.952 1.00 0.00 C ATOM 367 O SER A 59 -7.925 12.914 -1.943 1.00 0.00 O ATOM 368 CB SER A 59 -5.466 13.369 -3.983 1.00 0.00 C ATOM 369 OG SER A 59 -6.609 13.737 -4.734 1.00 0.00 O ATOM 0 H SER A 59 -3.658 13.122 -2.317 1.00 0.00 H new ATOM 0 HA SER A 59 -6.053 14.626 -2.352 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.604 13.944 -4.321 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.236 12.318 -4.157 1.00 0.00 H new ATOM 0 HG SER A 59 -6.440 13.577 -5.686 1.00 0.00 H new ATOM 623 N SER A 78 -5.123 8.134 6.342 1.00 0.00 N ATOM 624 CA SER A 78 -3.886 8.425 5.630 1.00 0.00 C ATOM 625 C SER A 78 -2.680 8.058 6.485 1.00 0.00 C ATOM 626 O SER A 78 -2.698 8.235 7.703 1.00 0.00 O ATOM 627 CB SER A 78 -3.827 9.905 5.246 1.00 0.00 C ATOM 628 OG SER A 78 -4.603 10.693 6.132 1.00 0.00 O ATOM 0 HA SER A 78 -3.864 7.825 4.720 1.00 0.00 H new ATOM 0 HB2 SER A 78 -2.792 10.247 5.262 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.190 10.034 4.226 1.00 0.00 H new ATOM 0 HG SER A 78 -5.279 10.130 6.563 1.00 0.00 H new ATOM 634 N LEU A 79 -1.636 7.541 5.847 1.00 0.00 N ATOM 635 CA LEU A 79 -0.429 7.145 6.569 1.00 0.00 C ATOM 636 C LEU A 79 0.670 8.199 6.443 1.00 0.00 C ATOM 637 O LEU A 79 0.924 8.722 5.359 1.00 0.00 O ATOM 638 CB LEU A 79 0.086 5.791 6.071 1.00 0.00 C ATOM 639 CG LEU A 79 -0.201 5.470 4.604 1.00 0.00 C ATOM 640 CD1 LEU A 79 0.716 6.269 3.692 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.046 3.979 4.355 1.00 0.00 C ATOM 0 H LEU A 79 -1.599 7.386 4.839 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.697 7.055 7.622 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.164 5.753 6.228 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.353 5.007 6.688 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.229 5.753 4.379 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.496 6.027 2.652 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.556 7.334 3.858 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.754 6.020 3.911 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.253 3.762 3.307 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.973 3.674 4.595 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.747 3.430 4.984 1.00 0.00 H new ATOM 653 N ALA A 80 1.322 8.498 7.567 1.00 0.00 N ATOM 654 CA ALA A 80 2.400 9.482 7.596 1.00 0.00 C ATOM 655 C ALA A 80 3.743 8.818 7.313 1.00 0.00 C ATOM 656 O ALA A 80 4.042 7.752 7.847 1.00 0.00 O ATOM 657 CB ALA A 80 2.432 10.192 8.941 1.00 0.00 C ATOM 0 H ALA A 80 1.120 8.070 8.471 1.00 0.00 H new ATOM 0 HA ALA A 80 2.212 10.220 6.816 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.241 10.923 8.948 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.482 10.701 9.107 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.596 9.462 9.734 1.00 0.00 H new ATOM 663 N LEU A 81 4.547 9.448 6.463 1.00 0.00 N ATOM 664 CA LEU A 81 5.852 8.904 6.099 1.00 0.00 C ATOM 665 C LEU A 81 6.805 8.868 7.291 1.00 0.00 C ATOM 666 O LEU A 81 6.849 9.794 8.100 1.00 0.00 O ATOM 667 CB LEU A 81 6.470 9.730 4.969 1.00 0.00 C ATOM 668 CG LEU A 81 5.688 9.715 3.654 1.00 0.00 C ATOM 669 CD1 LEU A 81 5.858 11.035 2.918 1.00 0.00 C ATOM 670 CD2 LEU A 81 6.140 8.553 2.783 1.00 0.00 C ATOM 0 H LEU A 81 4.319 10.335 6.013 1.00 0.00 H new ATOM 0 HA LEU A 81 5.697 7.879 5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.567 10.762 5.305 1.00 0.00 H new ATOM 0 HB3 LEU A 81 7.478 9.361 4.779 1.00 0.00 H new ATOM 0 HG LEU A 81 4.630 9.584 3.881 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.295 11.007 1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.487 11.849 3.541 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.914 11.197 2.700 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.575 8.555 1.851 1.00 0.00 H new ATOM 0 HD22 LEU A 81 7.203 8.655 2.563 1.00 0.00 H new ATOM 0 HD23 LEU A 81 5.967 7.615 3.310 1.00 0.00 H new ATOM 682 N ASN A 82 7.568 7.782 7.381 1.00 0.00 N ATOM 683 CA ASN A 82 8.535 7.595 8.457 1.00 0.00 C ATOM 684 C ASN A 82 9.865 7.104 7.898 1.00 0.00 C ATOM 685 O ASN A 82 10.017 6.950 6.687 1.00 0.00 O ATOM 686 CB ASN A 82 8.008 6.595 9.488 1.00 0.00 C ATOM 687 CG ASN A 82 7.155 7.254 10.552 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.715 8.393 10.395 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.917 6.538 11.645 1.00 0.00 N ATOM 0 H ASN A 82 7.534 7.011 6.714 1.00 0.00 H new ATOM 0 HA ASN A 82 8.688 8.557 8.946 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.422 5.829 8.980 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.849 6.090 9.963 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.349 6.929 12.397 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.302 5.598 11.732 1.00 0.00 H new ATOM 696 N ALA A 83 10.828 6.864 8.780 1.00 0.00 N ATOM 697 CA ALA A 83 12.140 6.392 8.356 1.00 0.00 C ATOM 698 C ALA A 83 12.041 5.054 7.630 1.00 0.00 C ATOM 699 O ALA A 83 12.892 4.725 6.803 1.00 0.00 O ATOM 700 CB ALA A 83 13.084 6.285 9.540 1.00 0.00 C ATOM 0 H ALA A 83 10.726 6.988 9.787 1.00 0.00 H new ATOM 0 HA ALA A 83 12.543 7.125 7.657 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.057 5.931 9.199 1.00 0.00 H new ATOM 0 HB2 ALA A 83 13.197 7.264 10.005 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.677 5.583 10.268 1.00 0.00 H new ATOM 706 N GLU A 84 10.993 4.289 7.925 1.00 0.00 N ATOM 707 CA GLU A 84 10.792 3.006 7.275 1.00 0.00 C ATOM 708 C GLU A 84 10.233 3.221 5.874 1.00 0.00 C ATOM 709 O GLU A 84 10.385 2.375 4.994 1.00 0.00 O ATOM 710 CB GLU A 84 9.855 2.124 8.102 1.00 0.00 C ATOM 711 CG GLU A 84 10.342 0.693 8.250 1.00 0.00 C ATOM 712 CD GLU A 84 10.094 -0.139 7.006 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.437 0.370 6.073 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.558 -1.298 6.964 1.00 0.00 O ATOM 0 H GLU A 84 10.276 4.537 8.607 1.00 0.00 H new ATOM 0 HA GLU A 84 11.752 2.495 7.197 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.736 2.563 9.093 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.870 2.118 7.636 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.409 0.697 8.473 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.841 0.228 9.099 1.00 0.00 H new ATOM 721 N SER A 85 9.607 4.382 5.672 1.00 0.00 N ATOM 722 CA SER A 85 9.046 4.738 4.375 1.00 0.00 C ATOM 723 C SER A 85 10.142 4.781 3.314 1.00 0.00 C ATOM 724 O SER A 85 9.860 4.767 2.118 1.00 0.00 O ATOM 725 CB SER A 85 8.336 6.091 4.449 1.00 0.00 C ATOM 726 OG SER A 85 7.297 6.071 5.413 1.00 0.00 O ATOM 0 H SER A 85 9.478 5.091 6.394 1.00 0.00 H new ATOM 0 HA SER A 85 8.317 3.976 4.098 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.056 6.869 4.702 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.924 6.343 3.472 1.00 0.00 H new ATOM 0 HG SER A 85 6.435 5.948 4.963 1.00 0.00 H new ATOM 732 N ASN A 86 11.396 4.828 3.758 1.00 0.00 N ATOM 733 CA ASN A 86 12.529 4.858 2.845 1.00 0.00 C ATOM 734 C ASN A 86 12.905 3.446 2.418 1.00 0.00 C ATOM 735 O ASN A 86 13.590 3.251 1.417 1.00 0.00 O ATOM 736 CB ASN A 86 13.735 5.528 3.501 1.00 0.00 C ATOM 737 CG ASN A 86 13.368 6.791 4.251 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.971 6.748 5.415 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.500 7.927 3.583 1.00 0.00 N ATOM 0 H ASN A 86 11.650 4.846 4.746 1.00 0.00 H new ATOM 0 HA ASN A 86 12.237 5.434 1.967 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.205 4.826 4.189 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.473 5.767 2.735 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.269 8.813 4.033 1.00 0.00 H new ATOM 0 HD22 ASN A 86 13.833 7.916 2.619 1.00 0.00 H new ATOM 746 N ASN A 87 12.455 2.465 3.190 1.00 0.00 N ATOM 747 CA ASN A 87 12.748 1.073 2.894 1.00 0.00 C ATOM 748 C ASN A 87 11.501 0.359 2.389 1.00 0.00 C ATOM 749 O ASN A 87 10.596 0.050 3.165 1.00 0.00 O ATOM 750 CB ASN A 87 13.266 0.371 4.151 1.00 0.00 C ATOM 751 CG ASN A 87 14.193 1.245 4.973 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.236 1.690 4.493 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.812 1.496 6.221 1.00 0.00 N ATOM 0 H ASN A 87 11.887 2.610 4.024 1.00 0.00 H new ATOM 0 HA ASN A 87 13.512 1.039 2.117 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.419 0.067 4.767 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.793 -0.539 3.863 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.392 2.079 6.824 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.939 1.106 6.576 1.00 0.00 H new ATOM 760 N VAL A 88 11.463 0.089 1.089 1.00 0.00 N ATOM 761 CA VAL A 88 10.326 -0.597 0.482 1.00 0.00 C ATOM 762 C VAL A 88 10.432 -2.103 0.680 1.00 0.00 C ATOM 763 O VAL A 88 11.455 -2.712 0.372 1.00 0.00 O ATOM 764 CB VAL A 88 10.212 -0.290 -1.023 1.00 0.00 C ATOM 765 CG1 VAL A 88 8.875 -0.776 -1.563 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.389 1.200 -1.285 1.00 0.00 C ATOM 0 H VAL A 88 12.206 0.334 0.434 1.00 0.00 H new ATOM 0 HA VAL A 88 9.430 -0.227 0.981 1.00 0.00 H new ATOM 0 HB VAL A 88 11.008 -0.822 -1.544 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.809 -0.552 -2.628 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.792 -1.852 -1.413 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.065 -0.272 -1.036 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.305 1.394 -2.354 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.618 1.757 -0.753 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.372 1.517 -0.935 1.00 0.00 H new ATOM 776 N MET A 89 9.364 -2.693 1.208 1.00 0.00 N ATOM 777 CA MET A 89 9.326 -4.130 1.466 1.00 0.00 C ATOM 778 C MET A 89 8.575 -4.871 0.360 1.00 0.00 C ATOM 779 O MET A 89 7.471 -4.484 -0.019 1.00 0.00 O ATOM 780 CB MET A 89 8.670 -4.400 2.825 1.00 0.00 C ATOM 781 CG MET A 89 9.661 -4.787 3.911 1.00 0.00 C ATOM 782 SD MET A 89 10.394 -3.354 4.725 1.00 0.00 S ATOM 783 CE MET A 89 11.263 -4.142 6.079 1.00 0.00 C ATOM 0 H MET A 89 8.511 -2.197 1.466 1.00 0.00 H new ATOM 0 HA MET A 89 10.351 -4.501 1.482 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.127 -3.509 3.141 1.00 0.00 H new ATOM 0 HB3 MET A 89 7.936 -5.198 2.713 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.157 -5.404 4.655 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.452 -5.397 3.475 1.00 0.00 H new ATOM 0 HE1 MET A 89 11.922 -3.418 6.558 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.542 -4.514 6.807 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.854 -4.974 5.697 1.00 0.00 H new ATOM 793 N MET A 90 9.187 -5.939 -0.151 1.00 0.00 N ATOM 794 CA MET A 90 8.581 -6.739 -1.213 1.00 0.00 C ATOM 795 C MET A 90 8.154 -8.105 -0.681 1.00 0.00 C ATOM 796 O MET A 90 8.944 -8.801 -0.042 1.00 0.00 O ATOM 797 CB MET A 90 9.553 -6.933 -2.390 1.00 0.00 C ATOM 798 CG MET A 90 10.700 -5.931 -2.443 1.00 0.00 C ATOM 799 SD MET A 90 10.414 -4.612 -3.637 1.00 0.00 S ATOM 800 CE MET A 90 10.255 -3.204 -2.544 1.00 0.00 C ATOM 0 H MET A 90 10.102 -6.270 0.154 1.00 0.00 H new ATOM 0 HA MET A 90 7.704 -6.198 -1.568 1.00 0.00 H new ATOM 0 HB2 MET A 90 9.970 -7.939 -2.337 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.991 -6.870 -3.322 1.00 0.00 H new ATOM 0 HG2 MET A 90 10.843 -5.496 -1.454 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.622 -6.453 -2.698 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.288 -2.284 -3.128 1.00 0.00 H new ATOM 0 HE2 MET A 90 9.306 -3.262 -2.012 1.00 0.00 H new ATOM 0 HE3 MET A 90 11.075 -3.207 -1.826 1.00 0.00 H new ATOM 810 N LEU A 91 6.906 -8.485 -0.939 1.00 0.00 N ATOM 811 CA LEU A 91 6.398 -9.772 -0.470 1.00 0.00 C ATOM 812 C LEU A 91 5.201 -10.244 -1.278 1.00 0.00 C ATOM 813 O LEU A 91 4.360 -9.446 -1.687 1.00 0.00 O ATOM 814 CB LEU A 91 5.969 -9.668 0.995 1.00 0.00 C ATOM 815 CG LEU A 91 4.865 -8.643 1.262 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.735 -9.267 2.066 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.424 -7.425 1.980 1.00 0.00 C ATOM 0 H LEU A 91 6.233 -7.927 -1.465 1.00 0.00 H new ATOM 0 HA LEU A 91 7.209 -10.491 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.627 -10.647 1.331 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.840 -9.411 1.598 1.00 0.00 H new ATOM 0 HG LEU A 91 4.463 -8.319 0.302 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.961 -8.521 2.245 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.312 -10.103 1.510 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.122 -9.624 3.020 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.622 -6.709 2.160 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.858 -7.731 2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.194 -6.961 1.363 1.00 0.00 H new ATOM 829 N THR A 92 5.095 -11.556 -1.445 1.00 0.00 N ATOM 830 CA THR A 92 3.957 -12.139 -2.132 1.00 0.00 C ATOM 831 C THR A 92 2.924 -12.477 -1.070 1.00 0.00 C ATOM 832 O THR A 92 3.172 -13.318 -0.206 1.00 0.00 O ATOM 833 CB THR A 92 4.365 -13.393 -2.910 1.00 0.00 C ATOM 834 OG1 THR A 92 3.221 -14.114 -3.331 1.00 0.00 O ATOM 835 CG2 THR A 92 5.235 -14.338 -2.110 1.00 0.00 C ATOM 0 H THR A 92 5.783 -12.232 -1.114 1.00 0.00 H new ATOM 0 HA THR A 92 3.550 -11.437 -2.860 1.00 0.00 H new ATOM 0 HB THR A 92 4.940 -13.031 -3.762 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.501 -14.911 -3.828 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.488 -15.205 -2.721 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.150 -13.826 -1.811 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.695 -14.665 -1.221 1.00 0.00 H new ATOM 843 N HIS A 93 1.796 -11.784 -1.089 1.00 0.00 N ATOM 844 CA HIS A 93 0.786 -11.998 -0.065 1.00 0.00 C ATOM 845 C HIS A 93 -0.603 -11.569 -0.526 1.00 0.00 C ATOM 846 O HIS A 93 -0.746 -10.699 -1.386 1.00 0.00 O ATOM 847 CB HIS A 93 1.193 -11.201 1.177 1.00 0.00 C ATOM 848 CG HIS A 93 1.019 -11.932 2.469 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.211 -12.296 2.972 1.00 0.00 N ATOM 850 CD2 HIS A 93 1.934 -12.346 3.374 1.00 0.00 C ATOM 851 CE1 HIS A 93 -0.046 -12.901 4.134 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.246 -12.946 4.401 1.00 0.00 N ATOM 0 H HIS A 93 1.559 -11.081 -1.789 1.00 0.00 H new ATOM 0 HA HIS A 93 0.730 -13.064 0.154 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.238 -10.908 1.078 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.606 -10.283 1.212 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.005 -12.227 3.303 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.834 -13.293 4.760 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.665 -13.359 5.234 1.00 0.00 H new ATOM 861 N ALA A 94 -1.625 -12.178 0.070 1.00 0.00 N ATOM 862 CA ALA A 94 -3.008 -11.856 -0.255 1.00 0.00 C ATOM 863 C ALA A 94 -3.471 -10.646 0.546 1.00 0.00 C ATOM 864 O ALA A 94 -3.375 -10.629 1.774 1.00 0.00 O ATOM 865 CB ALA A 94 -3.910 -13.051 0.018 1.00 0.00 C ATOM 0 H ALA A 94 -1.518 -12.900 0.783 1.00 0.00 H new ATOM 0 HA ALA A 94 -3.068 -11.614 -1.316 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.940 -12.794 -0.230 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.590 -13.895 -0.592 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.847 -13.321 1.072 1.00 0.00 H new ATOM 871 N ILE A 95 -3.956 -9.627 -0.152 1.00 0.00 N ATOM 872 CA ILE A 95 -4.413 -8.405 0.500 1.00 0.00 C ATOM 873 C ILE A 95 -5.883 -8.492 0.893 1.00 0.00 C ATOM 874 O ILE A 95 -6.732 -8.879 0.090 1.00 0.00 O ATOM 875 CB ILE A 95 -4.211 -7.173 -0.406 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.964 -7.343 -1.280 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.104 -5.910 0.435 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.717 -7.698 -0.499 1.00 0.00 C ATOM 0 H ILE A 95 -4.043 -9.622 -1.168 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.810 -8.293 1.401 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.077 -7.082 -1.061 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.153 -8.121 -2.019 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.787 -6.418 -1.829 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.962 -5.049 -0.218 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.019 -5.779 1.013 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.255 -5.995 1.113 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.876 -7.802 -1.184 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.502 -6.909 0.222 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.874 -8.639 0.029 1.00 0.00 H new ATOM 890 N THR A 96 -6.176 -8.115 2.135 1.00 0.00 N ATOM 891 CA THR A 96 -7.544 -8.134 2.641 1.00 0.00 C ATOM 892 C THR A 96 -8.175 -6.754 2.499 1.00 0.00 C ATOM 893 O THR A 96 -7.476 -5.743 2.496 1.00 0.00 O ATOM 894 CB THR A 96 -7.570 -8.580 4.105 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.319 -9.123 4.489 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.629 -9.620 4.395 1.00 0.00 C ATOM 0 H THR A 96 -5.483 -7.792 2.810 1.00 0.00 H new ATOM 0 HA THR A 96 -8.121 -8.848 2.053 1.00 0.00 H new ATOM 0 HB THR A 96 -7.801 -7.680 4.675 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.685 -8.395 4.660 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.593 -9.892 5.450 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.612 -9.214 4.159 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.446 -10.505 3.786 1.00 0.00 H new ATOM 904 N ARG A 97 -9.498 -6.715 2.373 1.00 0.00 N ATOM 905 CA ARG A 97 -10.208 -5.450 2.222 1.00 0.00 C ATOM 906 C ARG A 97 -11.167 -5.209 3.383 1.00 0.00 C ATOM 907 O ARG A 97 -12.160 -5.919 3.539 1.00 0.00 O ATOM 908 CB ARG A 97 -10.977 -5.431 0.898 1.00 0.00 C ATOM 909 CG ARG A 97 -10.457 -4.403 -0.093 1.00 0.00 C ATOM 910 CD ARG A 97 -11.595 -3.673 -0.788 1.00 0.00 C ATOM 911 NE ARG A 97 -11.907 -4.259 -2.089 1.00 0.00 N ATOM 912 CZ ARG A 97 -12.587 -3.626 -3.043 1.00 0.00 C ATOM 913 NH1 ARG A 97 -13.022 -2.387 -2.847 1.00 0.00 N ATOM 914 NH2 ARG A 97 -12.831 -4.234 -4.196 1.00 0.00 N ATOM 0 H ARG A 97 -10.097 -7.540 2.372 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.468 -4.650 2.222 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.925 -6.420 0.443 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.029 -5.228 1.101 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.825 -3.683 0.426 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.832 -4.897 -0.837 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.483 -3.700 -0.156 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.328 -2.624 -0.917 1.00 0.00 H new ATOM 0 HE ARG A 97 -11.585 -5.208 -2.278 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.836 -1.915 -1.962 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.542 -1.907 -3.581 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -12.498 -5.185 -4.351 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.352 -3.750 -4.927 1.00 0.00 H new ATOM 928 N TYR A 98 -10.868 -4.194 4.187 1.00 0.00 N ATOM 929 CA TYR A 98 -11.707 -3.851 5.326 1.00 0.00 C ATOM 930 C TYR A 98 -12.439 -2.533 5.083 1.00 0.00 C ATOM 931 O TYR A 98 -11.880 -1.455 5.284 1.00 0.00 O ATOM 932 CB TYR A 98 -10.856 -3.744 6.594 1.00 0.00 C ATOM 933 CG TYR A 98 -10.512 -5.082 7.207 1.00 0.00 C ATOM 934 CD1 TYR A 98 -11.236 -5.581 8.282 1.00 0.00 C ATOM 935 CD2 TYR A 98 -9.464 -5.846 6.711 1.00 0.00 C ATOM 936 CE1 TYR A 98 -10.925 -6.804 8.846 1.00 0.00 C ATOM 937 CE2 TYR A 98 -9.147 -7.071 7.268 1.00 0.00 C ATOM 938 CZ TYR A 98 -9.880 -7.544 8.336 1.00 0.00 C ATOM 939 OH TYR A 98 -9.567 -8.762 8.893 1.00 0.00 O ATOM 0 H TYR A 98 -10.050 -3.595 4.070 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.447 -4.641 5.454 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.933 -3.214 6.358 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.390 -3.143 7.330 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.056 -5.004 8.684 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -8.887 -5.477 5.876 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -11.498 -7.178 9.682 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -8.330 -7.654 6.869 1.00 0.00 H new ATOM 0 HH TYR A 98 -8.806 -9.154 8.416 1.00 0.00 H new ATOM 949 N GLY A 99 -13.694 -2.629 4.651 1.00 0.00 N ATOM 950 CA GLY A 99 -14.481 -1.438 4.392 1.00 0.00 C ATOM 951 C GLY A 99 -14.898 -0.725 5.661 1.00 0.00 C ATOM 952 O GLY A 99 -15.058 -1.351 6.709 1.00 0.00 O ATOM 0 H GLY A 99 -14.178 -3.510 4.476 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.904 -0.755 3.769 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.371 -1.712 3.825 1.00 0.00 H new ATOM 956 N ILE A 100 -15.072 0.591 5.568 1.00 0.00 N ATOM 957 CA ILE A 100 -15.470 1.393 6.718 1.00 0.00 C ATOM 958 C ILE A 100 -16.045 2.739 6.291 1.00 0.00 C ATOM 959 O ILE A 100 -17.114 3.143 6.749 1.00 0.00 O ATOM 960 CB ILE A 100 -14.285 1.640 7.670 1.00 0.00 C ATOM 961 CG1 ILE A 100 -13.034 2.037 6.878 1.00 0.00 C ATOM 962 CG2 ILE A 100 -14.018 0.402 8.513 1.00 0.00 C ATOM 963 CD1 ILE A 100 -12.703 3.512 6.972 1.00 0.00 C ATOM 0 H ILE A 100 -14.943 1.123 4.707 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.239 0.823 7.239 1.00 0.00 H new ATOM 0 HB ILE A 100 -14.540 2.463 8.338 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.185 1.458 7.241 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.177 1.771 5.831 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.178 0.591 9.181 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -14.904 0.165 9.102 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -13.781 -0.438 7.861 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -11.807 3.722 6.388 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -13.536 4.097 6.582 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -12.528 3.780 8.014 1.00 0.00 H new ATOM 975 N SER A 101 -15.323 3.430 5.421 1.00 0.00 N ATOM 976 CA SER A 101 -15.748 4.739 4.935 1.00 0.00 C ATOM 977 C SER A 101 -17.098 4.659 4.231 1.00 0.00 C ATOM 978 O SER A 101 -17.859 5.626 4.218 1.00 0.00 O ATOM 979 CB SER A 101 -14.702 5.311 3.978 1.00 0.00 C ATOM 980 OG SER A 101 -14.555 6.709 4.159 1.00 0.00 O ATOM 0 H SER A 101 -14.436 3.106 5.035 1.00 0.00 H new ATOM 0 HA SER A 101 -15.851 5.397 5.798 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.745 4.817 4.144 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.994 5.103 2.949 1.00 0.00 H new ATOM 0 HG SER A 101 -14.612 7.159 3.290 1.00 0.00 H new ATOM 986 N THR A 102 -17.386 3.506 3.637 1.00 0.00 N ATOM 987 CA THR A 102 -18.641 3.311 2.920 1.00 0.00 C ATOM 988 C THR A 102 -18.904 1.831 2.662 1.00 0.00 C ATOM 989 O THR A 102 -18.005 0.999 2.792 1.00 0.00 O ATOM 990 CB THR A 102 -18.607 4.070 1.592 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.170 5.403 1.787 1.00 0.00 O ATOM 992 CG2 THR A 102 -19.949 4.125 0.895 1.00 0.00 C ATOM 0 H THR A 102 -16.769 2.694 3.638 1.00 0.00 H new ATOM 0 HA THR A 102 -19.449 3.698 3.541 1.00 0.00 H new ATOM 0 HB THR A 102 -17.913 3.514 0.962 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.511 5.737 2.643 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.851 4.678 -0.039 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.291 3.112 0.683 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.673 4.625 1.538 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.140 1.509 2.291 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.521 0.130 2.007 1.00 0.00 C ATOM 1002 C ASP A 103 -20.485 -0.154 0.506 1.00 0.00 C ATOM 1003 O ASP A 103 -21.092 -1.115 0.034 1.00 0.00 O ATOM 1004 CB ASP A 103 -21.918 -0.158 2.558 1.00 0.00 C ATOM 1005 CG ASP A 103 -21.912 -0.398 4.055 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -21.190 0.328 4.770 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -22.632 -1.310 4.513 1.00 0.00 O ATOM 0 H ASP A 103 -20.895 2.186 2.180 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.800 -0.525 2.497 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.575 0.681 2.330 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.331 -1.032 2.055 1.00 0.00 H new ATOM 1012 N ASP A 104 -19.767 0.684 -0.238 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.648 0.519 -1.683 1.00 0.00 C ATOM 1014 C ASP A 104 -18.184 0.582 -2.105 1.00 0.00 C ATOM 1015 O ASP A 104 -17.438 1.430 -1.619 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.444 1.602 -2.410 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.908 1.239 -2.570 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.203 0.045 -2.784 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.758 2.150 -2.478 1.00 0.00 O ATOM 0 H ASP A 104 -19.259 1.485 0.137 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.052 -0.457 -1.952 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.364 2.539 -1.859 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.006 1.772 -3.393 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.751 -0.314 -3.018 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.371 -0.364 -3.507 1.00 0.00 C ATOM 1026 C PRO A 105 -15.708 1.006 -3.586 1.00 0.00 C ATOM 1027 O PRO A 105 -15.731 1.662 -4.628 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.553 -0.967 -4.892 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.661 -1.945 -4.707 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.579 -1.356 -3.660 1.00 0.00 C ATOM 0 HA PRO A 105 -15.712 -0.928 -2.847 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.809 -0.206 -5.630 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.642 -1.454 -5.240 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.194 -2.109 -5.643 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.276 -2.913 -4.386 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.479 -0.934 -4.108 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -18.903 -2.109 -2.942 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.123 1.432 -2.470 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.459 2.726 -2.404 1.00 0.00 C ATOM 1040 C ASN A 106 -13.367 2.746 -1.334 1.00 0.00 C ATOM 1041 O ASN A 106 -13.005 1.710 -0.777 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.486 3.828 -2.135 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.494 3.964 -3.259 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.157 4.397 -4.362 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -17.739 3.594 -2.985 1.00 0.00 N ATOM 0 H ASN A 106 -15.096 0.899 -1.601 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.980 2.906 -3.366 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.011 3.613 -1.204 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -14.969 4.778 -1.997 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.461 3.663 -3.702 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.974 3.241 -2.057 1.00 0.00 H new ATOM 1052 N LYS A 107 -12.840 3.941 -1.070 1.00 0.00 N ATOM 1053 CA LYS A 107 -11.776 4.136 -0.085 1.00 0.00 C ATOM 1054 C LYS A 107 -12.013 3.327 1.191 1.00 0.00 C ATOM 1055 O LYS A 107 -12.931 3.608 1.959 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.648 5.633 0.235 1.00 0.00 C ATOM 1057 CG LYS A 107 -10.937 5.951 1.545 1.00 0.00 C ATOM 1058 CD LYS A 107 -11.672 7.031 2.324 1.00 0.00 C ATOM 1059 CE LYS A 107 -11.487 6.861 3.823 1.00 0.00 C ATOM 1060 NZ LYS A 107 -10.071 7.066 4.231 1.00 0.00 N ATOM 0 H LYS A 107 -13.138 4.800 -1.532 1.00 0.00 H new ATOM 0 HA LYS A 107 -10.844 3.772 -0.516 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.112 6.119 -0.580 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.646 6.070 0.265 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -10.865 5.048 2.151 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -9.918 6.278 1.338 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.307 8.012 2.020 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.734 6.997 2.081 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.124 7.571 4.351 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -11.810 5.863 4.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -9.988 6.959 5.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -9.468 6.361 3.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -9.766 8.022 3.957 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.158 2.330 1.398 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.226 1.454 2.563 1.00 0.00 C ATOM 1076 C TRP A 108 -9.822 1.068 3.024 1.00 0.00 C ATOM 1077 O TRP A 108 -8.827 1.447 2.404 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.012 0.191 2.240 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.449 0.439 1.911 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.266 1.394 2.437 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.242 -0.305 0.991 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.522 1.289 1.894 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.532 0.249 1.006 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -13.982 -1.385 0.156 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.563 -0.246 0.217 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.003 -1.879 -0.631 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.282 -1.310 -0.595 1.00 0.00 C ATOM 0 H TRP A 108 -10.395 2.106 0.759 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.732 1.997 3.361 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.539 -0.314 1.398 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -11.956 -0.487 3.091 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -13.969 2.126 3.173 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.317 1.888 2.116 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -12.998 -1.830 0.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.549 0.193 0.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -14.812 -2.717 -1.285 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.062 -1.719 -1.220 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.749 0.304 4.109 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.469 -0.145 4.651 1.00 0.00 C ATOM 1100 C ARG A 109 -8.156 -1.560 4.190 1.00 0.00 C ATOM 1101 O ARG A 109 -9.027 -2.427 4.190 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.503 -0.125 6.183 1.00 0.00 C ATOM 1103 CG ARG A 109 -7.711 1.006 6.806 1.00 0.00 C ATOM 1104 CD ARG A 109 -7.914 1.074 8.311 1.00 0.00 C ATOM 1105 NE ARG A 109 -9.013 1.961 8.679 1.00 0.00 N ATOM 1106 CZ ARG A 109 -10.281 1.570 8.786 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -10.621 0.310 8.546 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -11.214 2.446 9.134 1.00 0.00 N ATOM 0 H ARG A 109 -10.563 -0.019 4.632 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.698 0.534 4.288 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.540 -0.052 6.511 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.116 -1.073 6.556 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.652 0.871 6.588 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -8.012 1.952 6.355 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -8.113 0.073 8.695 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.995 1.420 8.785 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.796 2.940 8.866 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.908 -0.368 8.277 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.595 0.020 8.631 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.959 3.416 9.319 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.186 2.150 9.217 1.00 0.00 H new ATOM 1122 N TYR A 110 -6.901 -1.797 3.811 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.491 -3.116 3.369 1.00 0.00 C ATOM 1124 C TYR A 110 -5.655 -3.771 4.447 1.00 0.00 C ATOM 1125 O TYR A 110 -5.210 -3.101 5.376 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.719 -3.032 2.059 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.611 -2.776 0.870 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -6.959 -3.804 0.004 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.105 -1.503 0.611 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -7.775 -3.569 -1.088 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.921 -1.262 -0.476 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.252 -2.297 -1.322 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.065 -2.059 -2.405 1.00 0.00 O ATOM 0 H TYR A 110 -6.161 -1.095 3.803 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.378 -3.723 3.190 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -4.978 -2.236 2.130 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.173 -3.963 1.904 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.587 -4.802 0.186 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.846 -0.689 1.271 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.037 -4.378 -1.754 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.298 -0.267 -0.662 1.00 0.00 H new ATOM 0 HH TYR A 110 -9.314 -1.111 -2.425 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.465 -5.079 4.354 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.701 -5.780 5.373 1.00 0.00 C ATOM 1145 C TYR A 111 -3.803 -6.862 4.795 1.00 0.00 C ATOM 1146 O TYR A 111 -4.263 -7.775 4.109 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.650 -6.377 6.411 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.094 -5.369 7.447 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.672 -5.470 8.766 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -6.922 -4.305 7.100 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.063 -4.538 9.711 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.317 -3.370 8.037 1.00 0.00 C ATOM 1153 CZ TYR A 111 -6.883 -3.490 9.341 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.272 -2.562 10.280 1.00 0.00 O ATOM 0 H TYR A 111 -5.821 -5.666 3.600 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.046 -5.049 5.847 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.527 -6.781 5.905 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.157 -7.211 6.910 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.030 -6.287 9.058 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.262 -4.209 6.079 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -5.728 -4.630 10.734 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -7.961 -2.551 7.751 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.846 -1.890 9.857 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.518 -6.759 5.111 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.532 -7.729 4.668 1.00 0.00 C ATOM 1166 C LEU A 112 -1.273 -8.722 5.793 1.00 0.00 C ATOM 1167 O LEU A 112 -0.596 -8.399 6.769 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.230 -7.026 4.277 1.00 0.00 C ATOM 1169 CG LEU A 112 0.654 -7.795 3.296 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.807 -9.244 3.734 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.072 -7.717 1.895 1.00 0.00 C ATOM 0 H LEU A 112 -2.134 -6.004 5.679 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.912 -8.256 3.793 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.475 -6.058 3.839 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.344 -6.830 5.182 1.00 0.00 H new ATOM 0 HG LEU A 112 1.643 -7.338 3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.440 -9.774 3.022 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.265 -9.279 4.723 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.174 -9.718 3.771 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.710 -8.268 1.205 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.927 -8.152 1.891 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.015 -6.674 1.582 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.834 -9.918 5.671 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.674 -10.928 6.704 1.00 0.00 C ATOM 1185 C ASP A 113 -2.371 -10.452 7.989 1.00 0.00 C ATOM 1186 O ASP A 113 -3.561 -10.138 7.963 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.185 -11.213 6.938 1.00 0.00 C ATOM 1188 CG ASP A 113 0.048 -12.516 7.679 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.850 -13.340 7.192 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.570 -12.710 8.747 1.00 0.00 O ATOM 0 H ASP A 113 -2.399 -10.209 4.873 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.139 -11.862 6.387 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.330 -11.248 5.978 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.254 -10.392 7.506 1.00 0.00 H new ATOM 1195 N SER A 114 -1.643 -10.383 9.102 1.00 0.00 N ATOM 1196 CA SER A 114 -2.220 -9.926 10.360 1.00 0.00 C ATOM 1197 C SER A 114 -1.912 -8.447 10.600 1.00 0.00 C ATOM 1198 O SER A 114 -1.998 -7.966 11.729 1.00 0.00 O ATOM 1199 CB SER A 114 -1.687 -10.764 11.523 1.00 0.00 C ATOM 1200 OG SER A 114 -2.114 -12.112 11.420 1.00 0.00 O ATOM 0 H SER A 114 -0.657 -10.637 9.156 1.00 0.00 H new ATOM 0 HA SER A 114 -3.302 -10.047 10.298 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.598 -10.724 11.534 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.031 -10.342 12.467 1.00 0.00 H new ATOM 0 HG SER A 114 -1.732 -12.515 10.613 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.543 -7.731 9.538 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.214 -6.313 9.654 1.00 0.00 C ATOM 1208 C VAL A 115 -2.053 -5.462 8.705 1.00 0.00 C ATOM 1209 O VAL A 115 -2.530 -5.942 7.678 1.00 0.00 O ATOM 1210 CB VAL A 115 0.278 -6.059 9.367 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.649 -4.620 9.687 1.00 0.00 C ATOM 1212 CG2 VAL A 115 1.145 -7.028 10.157 1.00 0.00 C ATOM 0 H VAL A 115 -1.465 -8.108 8.593 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.438 -6.025 10.681 1.00 0.00 H new ATOM 0 HB VAL A 115 0.457 -6.227 8.305 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.707 -4.462 9.477 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.052 -3.945 9.073 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.454 -4.420 10.741 1.00 0.00 H new ATOM 0 HG21 VAL A 115 2.196 -6.834 9.942 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.962 -6.894 11.223 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.899 -8.051 9.873 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.226 -4.191 9.060 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.003 -3.263 8.244 1.00 0.00 C ATOM 1224 C GLU A 116 -2.120 -2.594 7.194 1.00 0.00 C ATOM 1225 O GLU A 116 -0.986 -2.209 7.479 1.00 0.00 O ATOM 1226 CB GLU A 116 -3.657 -2.198 9.128 1.00 0.00 C ATOM 1227 CG GLU A 116 -2.700 -1.559 10.122 1.00 0.00 C ATOM 1228 CD GLU A 116 -2.756 -2.211 11.489 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -2.258 -3.348 11.626 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.299 -1.584 12.423 1.00 0.00 O ATOM 0 H GLU A 116 -1.838 -3.780 9.909 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.781 -3.830 7.733 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.080 -1.420 8.492 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.486 -2.650 9.673 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -1.683 -1.624 9.734 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.937 -0.500 10.219 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.643 -2.463 5.978 1.00 0.00 N ATOM 1238 CA VAL A 117 -1.894 -1.847 4.891 1.00 0.00 C ATOM 1239 C VAL A 117 -2.782 -0.968 4.009 1.00 0.00 C ATOM 1240 O VAL A 117 -4.020 -1.045 4.054 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.205 -2.912 4.014 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.318 -3.809 4.865 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.235 -3.740 3.259 1.00 0.00 C ATOM 0 H VAL A 117 -3.580 -2.775 5.723 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.137 -1.217 5.358 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.580 -2.400 3.283 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.161 -4.555 4.230 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.446 -3.206 5.355 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.924 -4.310 5.620 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.726 -4.485 2.647 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.891 -4.242 3.971 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.827 -3.087 2.618 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.126 -0.127 3.215 1.00 0.00 N ATOM 1254 CA HIS A 118 -2.814 0.794 2.317 1.00 0.00 C ATOM 1255 C HIS A 118 -2.673 0.365 0.858 1.00 0.00 C ATOM 1256 O HIS A 118 -1.662 0.639 0.213 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.242 2.197 2.498 1.00 0.00 C ATOM 1258 CG HIS A 118 -2.945 3.264 1.712 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -3.732 4.226 2.303 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -2.958 3.536 0.382 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.197 5.042 1.374 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -3.744 4.642 0.202 1.00 0.00 N ATOM 0 H HIS A 118 -1.109 -0.065 3.176 1.00 0.00 H new ATOM 0 HA HIS A 118 -3.875 0.786 2.567 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.281 2.458 3.556 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.190 2.186 2.211 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -3.926 4.298 3.302 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.444 2.983 -0.390 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -4.840 5.893 1.545 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.705 -0.295 0.343 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.715 -0.747 -1.044 1.00 0.00 C ATOM 1273 C LEU A 119 -4.638 0.146 -1.869 1.00 0.00 C ATOM 1274 O LEU A 119 -5.850 0.159 -1.651 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.182 -2.197 -1.123 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.100 -2.824 -2.509 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -3.993 -4.336 -2.408 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.307 -2.423 -3.334 1.00 0.00 C ATOM 0 H LEU A 119 -4.548 -0.529 0.867 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.703 -0.685 -1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.584 -2.794 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.214 -2.250 -0.777 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.202 -2.456 -3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.936 -4.764 -3.409 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.096 -4.601 -1.848 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.870 -4.729 -1.895 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.239 -2.876 -4.323 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.216 -2.766 -2.840 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.335 -1.338 -3.434 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.085 0.925 -2.816 1.00 0.00 N ATOM 1291 CA PRO A 120 -4.878 1.832 -3.642 1.00 0.00 C ATOM 1292 C PRO A 120 -6.088 1.151 -4.282 1.00 0.00 C ATOM 1293 O PRO A 120 -6.004 0.022 -4.758 1.00 0.00 O ATOM 1294 CB PRO A 120 -3.899 2.329 -4.713 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.663 1.509 -4.556 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.656 1.005 -3.141 1.00 0.00 C ATOM 0 HA PRO A 120 -5.301 2.638 -3.043 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.321 2.211 -5.711 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.683 3.389 -4.581 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.657 0.679 -5.262 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.774 2.106 -4.758 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.168 0.034 -3.060 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.127 1.684 -2.473 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.240 1.843 -4.287 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.498 1.327 -4.846 1.00 0.00 C ATOM 1306 C PRO A 121 -8.394 0.794 -6.279 1.00 0.00 C ATOM 1307 O PRO A 121 -9.331 0.164 -6.770 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.437 2.544 -4.809 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.556 3.719 -4.550 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.425 3.192 -3.727 1.00 0.00 C ATOM 0 HA PRO A 121 -8.837 0.466 -4.271 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -9.973 2.655 -5.752 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.188 2.437 -4.026 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.195 4.153 -5.483 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.095 4.505 -4.021 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.528 3.802 -3.829 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.672 3.163 -2.666 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.283 1.054 -6.963 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.139 0.589 -8.344 1.00 0.00 C ATOM 1320 C PHE A 122 -6.541 -0.816 -8.430 1.00 0.00 C ATOM 1321 O PHE A 122 -6.476 -1.392 -9.517 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.307 1.560 -9.200 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.510 2.581 -8.434 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.135 3.559 -7.672 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.127 2.571 -8.496 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.393 4.501 -6.986 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.381 3.507 -7.813 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.014 4.474 -7.056 1.00 0.00 C ATOM 0 H PHE A 122 -6.484 1.572 -6.596 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.152 0.553 -8.746 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.622 0.978 -9.816 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.979 2.085 -9.879 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.213 3.584 -7.615 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.626 1.819 -9.088 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.890 5.257 -6.396 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.303 3.485 -7.869 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.431 5.208 -6.520 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.108 -1.377 -7.304 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.530 -2.718 -7.313 1.00 0.00 C ATOM 1340 C TRP A 123 -6.494 -3.750 -6.733 1.00 0.00 C ATOM 1341 O TRP A 123 -6.227 -4.951 -6.784 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.220 -2.738 -6.532 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.194 -1.799 -7.070 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.138 -1.257 -8.320 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.073 -1.290 -6.358 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.043 -0.426 -8.422 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.375 -0.433 -7.226 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.596 -1.476 -5.063 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.222 0.238 -6.831 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.457 -0.813 -4.676 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.218 0.034 -5.555 1.00 0.00 C ATOM 0 H TRP A 123 -6.145 -0.932 -6.387 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.335 -2.983 -8.352 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.422 -2.485 -5.491 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.816 -3.750 -6.541 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.846 -1.450 -9.112 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.775 0.106 -9.250 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.112 -2.130 -4.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.304 0.895 -7.508 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.078 -0.950 -3.674 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.110 0.541 -5.218 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.617 -3.288 -6.185 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.607 -4.194 -5.610 1.00 0.00 C ATOM 1364 C GLU A 124 -8.965 -5.296 -6.604 1.00 0.00 C ATOM 1365 O GLU A 124 -9.331 -6.404 -6.215 1.00 0.00 O ATOM 1366 CB GLU A 124 -9.866 -3.428 -5.201 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.453 -2.574 -6.311 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.207 -3.393 -7.340 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -11.793 -4.429 -6.961 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -11.215 -2.997 -8.525 1.00 0.00 O ATOM 0 H GLU A 124 -7.862 -2.299 -6.128 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.173 -4.651 -4.721 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.620 -4.140 -4.866 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.631 -2.789 -4.350 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -11.125 -1.834 -5.878 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.651 -2.026 -6.805 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.842 -4.980 -7.889 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.136 -5.937 -8.946 1.00 0.00 C ATOM 1379 C GLN A 125 -7.865 -6.666 -9.373 1.00 0.00 C ATOM 1380 O GLN A 125 -7.916 -7.804 -9.841 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.761 -5.227 -10.148 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.882 -4.133 -10.733 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.615 -2.815 -10.889 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.759 -2.778 -11.343 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -8.959 -1.724 -10.511 1.00 0.00 N ATOM 0 H GLN A 125 -8.540 -4.065 -8.223 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.847 -6.668 -8.560 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.975 -5.963 -10.923 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.715 -4.793 -9.848 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.014 -3.987 -10.090 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.508 -4.454 -11.705 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.012 -1.801 -10.140 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.402 -0.809 -10.592 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.724 -6.001 -9.204 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.438 -6.585 -9.564 1.00 0.00 C ATOM 1396 C TYR A 126 -4.943 -7.549 -8.488 1.00 0.00 C ATOM 1397 O TYR A 126 -3.945 -8.244 -8.678 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.395 -5.488 -9.785 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.854 -4.367 -10.695 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -4.174 -3.157 -10.725 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -5.961 -4.515 -11.524 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -4.581 -2.127 -11.552 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -6.374 -3.489 -12.354 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.681 -2.299 -12.364 1.00 0.00 C ATOM 1405 OH TYR A 126 -6.090 -1.276 -13.189 1.00 0.00 O ATOM 0 H TYR A 126 -6.666 -5.058 -8.820 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.580 -7.143 -10.490 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.118 -5.066 -8.819 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.496 -5.937 -10.206 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -3.311 -3.018 -10.091 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.507 -5.447 -11.519 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -4.040 -1.192 -11.562 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -7.236 -3.620 -12.991 1.00 0.00 H new ATOM 0 HH TYR A 126 -6.879 -1.560 -13.696 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.633 -7.579 -7.349 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.244 -8.447 -6.245 1.00 0.00 C ATOM 1417 C ILE A 127 -5.939 -9.804 -6.306 1.00 0.00 C ATOM 1418 O ILE A 127 -7.162 -9.898 -6.196 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.545 -7.795 -4.883 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -6.990 -7.295 -4.835 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -4.577 -6.654 -4.615 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.668 -7.543 -3.505 1.00 0.00 C ATOM 0 H ILE A 127 -6.462 -7.013 -7.169 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.169 -8.599 -6.347 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.416 -8.547 -4.105 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.004 -6.226 -5.048 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.562 -7.784 -5.623 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.804 -6.204 -3.648 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.557 -7.037 -4.607 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -4.676 -5.902 -5.397 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -8.689 -7.164 -3.541 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.685 -8.613 -3.299 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.118 -7.031 -2.715 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.141 -10.853 -6.466 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.653 -12.219 -6.523 1.00 0.00 C ATOM 1436 C ASN A 128 -5.288 -12.974 -5.246 1.00 0.00 C ATOM 1437 O ASN A 128 -4.845 -12.369 -4.269 1.00 0.00 O ATOM 1438 CB ASN A 128 -5.087 -12.951 -7.743 1.00 0.00 C ATOM 1439 CG ASN A 128 -5.199 -12.129 -9.012 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -6.068 -12.373 -9.850 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -4.315 -11.150 -9.163 1.00 0.00 N ATOM 0 H ASN A 128 -4.128 -10.783 -6.559 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.739 -12.178 -6.611 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -4.040 -13.196 -7.563 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.617 -13.894 -7.876 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.339 -10.565 -9.998 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -3.612 -10.982 -8.444 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.471 -14.295 -5.252 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.149 -15.120 -4.084 1.00 0.00 C ATOM 1450 C ASP A 129 -3.782 -14.737 -3.518 1.00 0.00 C ATOM 1451 O ASP A 129 -3.660 -14.371 -2.350 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.163 -16.603 -4.460 1.00 0.00 C ATOM 1453 CG ASP A 129 -5.400 -17.500 -3.260 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -4.548 -18.374 -2.996 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -6.437 -17.328 -2.586 1.00 0.00 O ATOM 0 H ASP A 129 -5.839 -14.816 -6.048 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.906 -14.943 -3.320 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.942 -16.780 -5.202 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.213 -16.866 -4.925 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.765 -14.800 -4.369 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.407 -14.433 -3.983 1.00 0.00 C ATOM 1462 C GLU A 130 -0.894 -13.359 -4.932 1.00 0.00 C ATOM 1463 O GLU A 130 -0.948 -13.530 -6.150 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.488 -15.657 -4.014 1.00 0.00 C ATOM 1465 CG GLU A 130 0.346 -15.824 -2.754 1.00 0.00 C ATOM 1466 CD GLU A 130 -0.506 -16.003 -1.512 1.00 0.00 C ATOM 1467 OE1 GLU A 130 -0.800 -14.990 -0.843 1.00 0.00 O ATOM 1468 OE2 GLU A 130 -0.876 -17.156 -1.207 1.00 0.00 O ATOM 0 H GLU A 130 -2.856 -15.104 -5.338 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.414 -14.045 -2.964 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.093 -16.552 -4.160 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.178 -15.579 -4.873 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.002 -16.687 -2.868 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.987 -14.951 -2.628 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.432 -12.238 -4.388 1.00 0.00 N ATOM 1476 CA ASN A 131 0.040 -11.146 -5.230 1.00 0.00 C ATOM 1477 C ASN A 131 1.355 -10.563 -4.749 1.00 0.00 C ATOM 1478 O ASN A 131 1.635 -10.517 -3.551 1.00 0.00 O ATOM 1479 CB ASN A 131 -1.006 -10.025 -5.283 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.404 -10.506 -4.952 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.818 -11.581 -5.382 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.138 -9.710 -4.183 1.00 0.00 N ATOM 0 H ASN A 131 -0.375 -12.063 -3.385 1.00 0.00 H new ATOM 0 HA ASN A 131 0.200 -11.568 -6.222 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.723 -9.238 -4.584 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -1.006 -9.582 -6.279 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.087 -9.982 -3.926 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.753 -8.827 -3.849 1.00 0.00 H new ATOM 1489 N THR A 132 2.136 -10.075 -5.703 1.00 0.00 N ATOM 1490 CA THR A 132 3.403 -9.437 -5.400 1.00 0.00 C ATOM 1491 C THR A 132 3.116 -8.025 -4.916 1.00 0.00 C ATOM 1492 O THR A 132 2.663 -7.175 -5.688 1.00 0.00 O ATOM 1493 CB THR A 132 4.304 -9.404 -6.637 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.313 -10.664 -7.283 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.739 -9.037 -6.323 1.00 0.00 C ATOM 0 H THR A 132 1.910 -10.111 -6.697 1.00 0.00 H new ATOM 0 HA THR A 132 3.926 -10.001 -4.628 1.00 0.00 H new ATOM 0 HB THR A 132 3.883 -8.633 -7.282 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.893 -10.623 -8.072 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.323 -9.032 -7.243 1.00 0.00 H new ATOM 0 HG22 THR A 132 5.770 -8.047 -5.868 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.158 -9.768 -5.631 1.00 0.00 H new ATOM 1503 N VAL A 133 3.331 -7.794 -3.627 1.00 0.00 N ATOM 1504 CA VAL A 133 3.047 -6.494 -3.033 1.00 0.00 C ATOM 1505 C VAL A 133 4.292 -5.820 -2.476 1.00 0.00 C ATOM 1506 O VAL A 133 4.961 -6.352 -1.590 1.00 0.00 O ATOM 1507 CB VAL A 133 1.998 -6.602 -1.899 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.665 -6.033 -2.348 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.832 -8.043 -1.431 1.00 0.00 C ATOM 0 H VAL A 133 3.700 -8.487 -2.975 1.00 0.00 H new ATOM 0 HA VAL A 133 2.652 -5.884 -3.845 1.00 0.00 H new ATOM 0 HB VAL A 133 2.361 -6.016 -1.055 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -0.059 -6.118 -1.537 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.789 -4.984 -2.615 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.306 -6.588 -3.215 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.089 -8.084 -0.635 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.503 -8.661 -2.266 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.785 -8.416 -1.057 1.00 0.00 H new ATOM 1519 N GLU A 134 4.567 -4.622 -2.976 1.00 0.00 N ATOM 1520 CA GLU A 134 5.694 -3.835 -2.507 1.00 0.00 C ATOM 1521 C GLU A 134 5.166 -2.643 -1.728 1.00 0.00 C ATOM 1522 O GLU A 134 4.472 -1.787 -2.283 1.00 0.00 O ATOM 1523 CB GLU A 134 6.559 -3.359 -3.671 1.00 0.00 C ATOM 1524 CG GLU A 134 7.312 -4.479 -4.373 1.00 0.00 C ATOM 1525 CD GLU A 134 6.441 -5.247 -5.349 1.00 0.00 C ATOM 1526 OE1 GLU A 134 6.628 -5.075 -6.572 1.00 0.00 O ATOM 1527 OE2 GLU A 134 5.575 -6.022 -4.891 1.00 0.00 O ATOM 0 H GLU A 134 4.019 -4.174 -3.711 1.00 0.00 H new ATOM 0 HA GLU A 134 6.318 -4.457 -1.865 1.00 0.00 H new ATOM 0 HB2 GLU A 134 5.926 -2.848 -4.397 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.277 -2.626 -3.302 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.165 -4.059 -4.906 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.709 -5.168 -3.627 1.00 0.00 H new ATOM 1534 N LEU A 135 5.459 -2.609 -0.436 1.00 0.00 N ATOM 1535 CA LEU A 135 4.967 -1.534 0.418 1.00 0.00 C ATOM 1536 C LEU A 135 6.031 -1.008 1.373 1.00 0.00 C ATOM 1537 O LEU A 135 6.908 -1.745 1.817 1.00 0.00 O ATOM 1538 CB LEU A 135 3.771 -2.029 1.232 1.00 0.00 C ATOM 1539 CG LEU A 135 3.975 -3.376 1.929 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.936 -3.236 3.100 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.640 -3.940 2.393 1.00 0.00 C ATOM 0 H LEU A 135 6.030 -3.306 0.042 1.00 0.00 H new ATOM 0 HA LEU A 135 4.676 -0.714 -0.239 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.529 -1.280 1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.908 -2.106 0.571 1.00 0.00 H new ATOM 0 HG LEU A 135 4.413 -4.072 1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.067 -4.205 3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.900 -2.877 2.739 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.531 -2.525 3.820 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.802 -4.898 2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.175 -3.245 3.092 1.00 0.00 H new ATOM 0 HD23 LEU A 135 1.986 -4.081 1.533 1.00 0.00 H new ATOM 1553 N ILE A 136 5.909 0.270 1.712 1.00 0.00 N ATOM 1554 CA ILE A 136 6.822 0.916 2.646 1.00 0.00 C ATOM 1555 C ILE A 136 6.081 1.183 3.949 1.00 0.00 C ATOM 1556 O ILE A 136 4.947 1.651 3.931 1.00 0.00 O ATOM 1557 CB ILE A 136 7.405 2.242 2.097 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.956 2.503 0.652 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.919 2.205 2.175 1.00 0.00 C ATOM 1560 CD1 ILE A 136 5.871 3.549 0.541 1.00 0.00 C ATOM 0 H ILE A 136 5.179 0.884 1.350 1.00 0.00 H new ATOM 0 HA ILE A 136 7.665 0.243 2.806 1.00 0.00 H new ATOM 0 HB ILE A 136 7.026 3.058 2.712 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.817 2.819 0.063 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.597 1.570 0.217 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.326 3.139 1.788 1.00 0.00 H new ATOM 0 HG22 ILE A 136 9.227 2.077 3.213 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.294 1.372 1.580 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.601 3.684 -0.506 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.995 3.225 1.103 1.00 0.00 H new ATOM 0 HD13 ILE A 136 6.233 4.494 0.947 1.00 0.00 H new ATOM 1572 N HIS A 137 6.701 0.855 5.075 1.00 0.00 N ATOM 1573 CA HIS A 137 6.055 1.029 6.370 1.00 0.00 C ATOM 1574 C HIS A 137 6.056 2.483 6.824 1.00 0.00 C ATOM 1575 O HIS A 137 7.108 3.085 7.035 1.00 0.00 O ATOM 1576 CB HIS A 137 6.727 0.128 7.405 1.00 0.00 C ATOM 1577 CG HIS A 137 6.852 -1.293 6.937 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.118 -2.334 7.467 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.613 -1.837 5.957 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.425 -3.454 6.831 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.328 -3.177 5.914 1.00 0.00 N ATOM 0 H HIS A 137 7.644 0.469 5.119 1.00 0.00 H new ATOM 0 HA HIS A 137 5.009 0.739 6.267 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.718 0.520 7.634 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.152 0.153 8.331 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.445 -2.254 8.229 1.00 0.00 H new ATOM 0 HD2 HIS A 137 8.315 -1.312 5.326 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.006 -4.429 7.031 1.00 0.00 H new ATOM 1590 N THR A 138 4.857 3.039 6.973 1.00 0.00 N ATOM 1591 CA THR A 138 4.700 4.423 7.404 1.00 0.00 C ATOM 1592 C THR A 138 4.615 4.501 8.925 1.00 0.00 C ATOM 1593 O THR A 138 4.947 3.543 9.625 1.00 0.00 O ATOM 1594 CB THR A 138 3.432 5.023 6.794 1.00 0.00 C ATOM 1595 OG1 THR A 138 2.295 4.658 7.557 1.00 0.00 O ATOM 1596 CG2 THR A 138 3.177 4.596 5.367 1.00 0.00 C ATOM 0 H THR A 138 3.978 2.550 6.801 1.00 0.00 H new ATOM 0 HA THR A 138 5.568 4.988 7.066 1.00 0.00 H new ATOM 0 HB THR A 138 3.596 6.101 6.802 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.789 3.968 7.080 1.00 0.00 H new ATOM 0 HG21 THR A 138 2.261 5.063 5.006 1.00 0.00 H new ATOM 0 HG22 THR A 138 4.013 4.905 4.740 1.00 0.00 H new ATOM 0 HG23 THR A 138 3.073 3.512 5.325 1.00 0.00 H new ATOM 1604 N ASP A 139 4.142 5.636 9.432 1.00 0.00 N ATOM 1605 CA ASP A 139 3.985 5.819 10.869 1.00 0.00 C ATOM 1606 C ASP A 139 2.775 5.031 11.364 1.00 0.00 C ATOM 1607 O ASP A 139 2.638 4.759 12.558 1.00 0.00 O ATOM 1608 CB ASP A 139 3.817 7.302 11.204 1.00 0.00 C ATOM 1609 CG ASP A 139 3.974 7.581 12.686 1.00 0.00 C ATOM 1610 OD1 ASP A 139 5.107 7.879 13.117 1.00 0.00 O ATOM 1611 OD2 ASP A 139 2.963 7.503 13.415 1.00 0.00 O ATOM 0 H ASP A 139 3.862 6.440 8.870 1.00 0.00 H new ATOM 0 HA ASP A 139 4.881 5.450 11.368 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.553 7.883 10.648 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.833 7.637 10.876 1.00 0.00 H new ATOM 1616 N SER A 140 1.904 4.664 10.428 1.00 0.00 N ATOM 1617 CA SER A 140 0.702 3.903 10.739 1.00 0.00 C ATOM 1618 C SER A 140 0.798 2.497 10.158 1.00 0.00 C ATOM 1619 O SER A 140 1.027 1.526 10.876 1.00 0.00 O ATOM 1620 CB SER A 140 -0.530 4.618 10.178 1.00 0.00 C ATOM 1621 OG SER A 140 -0.172 5.503 9.126 1.00 0.00 O ATOM 0 H SER A 140 2.012 4.885 9.438 1.00 0.00 H new ATOM 0 HA SER A 140 0.608 3.827 11.822 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.246 3.882 9.811 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.025 5.175 10.974 1.00 0.00 H new ATOM 0 HG SER A 140 0.177 6.337 9.505 1.00 0.00 H new ATOM 1627 N LEU A 141 0.628 2.409 8.844 1.00 0.00 N ATOM 1628 CA LEU A 141 0.700 1.137 8.138 1.00 0.00 C ATOM 1629 C LEU A 141 1.546 1.283 6.878 1.00 0.00 C ATOM 1630 O LEU A 141 1.903 2.393 6.484 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.703 0.638 7.778 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.729 1.730 7.458 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -1.685 2.085 5.980 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -3.128 1.284 7.859 1.00 0.00 C ATOM 0 H LEU A 141 0.438 3.211 8.243 1.00 0.00 H new ATOM 0 HA LEU A 141 1.168 0.404 8.795 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.624 -0.026 6.917 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.081 0.040 8.607 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.475 2.620 8.034 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.420 2.862 5.770 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.690 2.448 5.722 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.913 1.200 5.386 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.843 2.073 7.624 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.393 0.380 7.311 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -3.152 1.080 8.929 1.00 0.00 H new ATOM 1646 N PRO A 142 1.909 0.161 6.242 1.00 0.00 N ATOM 1647 CA PRO A 142 2.734 0.169 5.039 1.00 0.00 C ATOM 1648 C PRO A 142 1.951 0.525 3.782 1.00 0.00 C ATOM 1649 O PRO A 142 0.951 -0.113 3.452 1.00 0.00 O ATOM 1650 CB PRO A 142 3.261 -1.272 4.944 1.00 0.00 C ATOM 1651 CG PRO A 142 2.805 -1.950 6.194 1.00 0.00 C ATOM 1652 CD PRO A 142 1.585 -1.203 6.649 1.00 0.00 C ATOM 0 HA PRO A 142 3.518 0.923 5.105 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.869 -1.775 4.060 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.348 -1.287 4.864 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.573 -2.998 6.007 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.584 -1.927 6.957 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.677 -1.569 6.169 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.432 -1.284 7.725 1.00 0.00 H new ATOM 1660 N LEU A 143 2.436 1.536 3.075 1.00 0.00 N ATOM 1661 CA LEU A 143 1.811 1.975 1.831 1.00 0.00 C ATOM 1662 C LEU A 143 2.295 1.110 0.679 1.00 0.00 C ATOM 1663 O LEU A 143 3.490 1.069 0.384 1.00 0.00 O ATOM 1664 CB LEU A 143 2.145 3.442 1.538 1.00 0.00 C ATOM 1665 CG LEU A 143 1.279 4.120 0.465 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.423 3.431 -0.885 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.176 4.136 0.879 1.00 0.00 C ATOM 0 H LEU A 143 3.263 2.070 3.341 1.00 0.00 H new ATOM 0 HA LEU A 143 0.731 1.877 1.940 1.00 0.00 H new ATOM 0 HB2 LEU A 143 2.053 4.009 2.465 1.00 0.00 H new ATOM 0 HB3 LEU A 143 3.188 3.503 1.229 1.00 0.00 H new ATOM 0 HG LEU A 143 1.632 5.147 0.366 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.797 3.937 -1.620 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.464 3.472 -1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 143 1.111 2.390 -0.797 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -0.770 4.621 0.104 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.526 3.113 1.018 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.282 4.686 1.814 1.00 0.00 H new ATOM 1679 N VAL A 144 1.370 0.424 0.029 1.00 0.00 N ATOM 1680 CA VAL A 144 1.719 -0.432 -1.093 1.00 0.00 C ATOM 1681 C VAL A 144 1.973 0.408 -2.339 1.00 0.00 C ATOM 1682 O VAL A 144 1.038 0.823 -3.023 1.00 0.00 O ATOM 1683 CB VAL A 144 0.617 -1.472 -1.374 1.00 0.00 C ATOM 1684 CG1 VAL A 144 1.120 -2.527 -2.347 1.00 0.00 C ATOM 1685 CG2 VAL A 144 0.142 -2.117 -0.077 1.00 0.00 C ATOM 0 H VAL A 144 0.376 0.442 0.257 1.00 0.00 H new ATOM 0 HA VAL A 144 2.630 -0.969 -0.829 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.232 -0.961 -1.829 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.330 -3.254 -2.535 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.406 -2.050 -3.285 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.985 -3.034 -1.919 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.636 -2.848 -0.298 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.980 -2.615 0.410 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.259 -1.350 0.585 1.00 0.00 H new ATOM 1695 N ILE A 145 3.248 0.673 -2.611 1.00 0.00 N ATOM 1696 CA ILE A 145 3.636 1.484 -3.758 1.00 0.00 C ATOM 1697 C ILE A 145 3.513 0.718 -5.070 1.00 0.00 C ATOM 1698 O ILE A 145 3.379 1.324 -6.133 1.00 0.00 O ATOM 1699 CB ILE A 145 5.081 2.005 -3.615 1.00 0.00 C ATOM 1700 CG1 ILE A 145 6.063 0.837 -3.503 1.00 0.00 C ATOM 1701 CG2 ILE A 145 5.195 2.919 -2.405 1.00 0.00 C ATOM 1702 CD1 ILE A 145 6.762 0.508 -4.804 1.00 0.00 C ATOM 0 H ILE A 145 4.031 0.336 -2.050 1.00 0.00 H new ATOM 0 HA ILE A 145 2.946 2.328 -3.780 1.00 0.00 H new ATOM 0 HB ILE A 145 5.334 2.579 -4.506 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.812 1.074 -2.747 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.527 -0.046 -3.155 1.00 0.00 H new ATOM 0 HG21 ILE A 145 6.220 3.279 -2.316 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.521 3.767 -2.525 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.926 2.366 -1.505 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.443 -0.329 -4.650 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.021 0.240 -5.557 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.326 1.376 -5.144 1.00 0.00 H new ATOM 1714 N SER A 146 3.559 -0.609 -5.003 1.00 0.00 N ATOM 1715 CA SER A 146 3.449 -1.415 -6.213 1.00 0.00 C ATOM 1716 C SER A 146 2.712 -2.727 -5.959 1.00 0.00 C ATOM 1717 O SER A 146 2.586 -3.180 -4.822 1.00 0.00 O ATOM 1718 CB SER A 146 4.837 -1.690 -6.797 1.00 0.00 C ATOM 1719 OG SER A 146 5.280 -3.001 -6.488 1.00 0.00 O ATOM 0 H SER A 146 3.670 -1.141 -4.140 1.00 0.00 H new ATOM 0 HA SER A 146 2.864 -0.844 -6.934 1.00 0.00 H new ATOM 0 HB2 SER A 146 4.810 -1.559 -7.879 1.00 0.00 H new ATOM 0 HB3 SER A 146 5.548 -0.963 -6.406 1.00 0.00 H new ATOM 0 HG SER A 146 6.097 -3.198 -6.992 1.00 0.00 H new ATOM 1725 N LEU A 147 2.233 -3.329 -7.043 1.00 0.00 N ATOM 1726 CA LEU A 147 1.510 -4.588 -6.983 1.00 0.00 C ATOM 1727 C LEU A 147 1.789 -5.398 -8.242 1.00 0.00 C ATOM 1728 O LEU A 147 2.218 -4.850 -9.255 1.00 0.00 O ATOM 1729 CB LEU A 147 0.008 -4.333 -6.846 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.742 -5.328 -5.957 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.888 -4.775 -4.549 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -2.107 -5.650 -6.545 1.00 0.00 C ATOM 0 H LEU A 147 2.337 -2.955 -7.986 1.00 0.00 H new ATOM 0 HA LEU A 147 1.847 -5.149 -6.111 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.139 -3.330 -6.446 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.439 -4.349 -7.840 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.163 -6.250 -5.910 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.423 -5.494 -3.929 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.100 -4.595 -4.125 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.445 -3.839 -4.582 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.624 -6.359 -5.898 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.694 -4.735 -6.623 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.982 -6.087 -7.536 1.00 0.00 H new ATOM 1744 N ASN A 148 1.559 -6.701 -8.173 1.00 0.00 N ATOM 1745 CA ASN A 148 1.802 -7.583 -9.314 1.00 0.00 C ATOM 1746 C ASN A 148 1.276 -6.999 -10.630 1.00 0.00 C ATOM 1747 O ASN A 148 0.090 -7.111 -10.935 1.00 0.00 O ATOM 1748 CB ASN A 148 1.131 -8.934 -9.073 1.00 0.00 C ATOM 1749 CG ASN A 148 -0.296 -8.780 -8.577 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.558 -8.033 -7.635 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -1.228 -9.476 -9.218 1.00 0.00 N ATOM 0 H ASN A 148 1.205 -7.174 -7.342 1.00 0.00 H new ATOM 0 HA ASN A 148 2.882 -7.697 -9.404 1.00 0.00 H new ATOM 0 HB2 ASN A 148 1.133 -9.510 -9.998 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.709 -9.501 -8.343 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -2.205 -9.403 -8.934 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.967 -10.084 -9.994 1.00 0.00 H new ATOM 1758 N GLY A 149 2.176 -6.419 -11.422 1.00 0.00 N ATOM 1759 CA GLY A 149 1.794 -5.871 -12.717 1.00 0.00 C ATOM 1760 C GLY A 149 1.135 -4.503 -12.652 1.00 0.00 C ATOM 1761 O GLY A 149 0.433 -4.110 -13.584 1.00 0.00 O ATOM 0 H GLY A 149 3.164 -6.318 -11.191 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.682 -5.803 -13.345 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.111 -6.567 -13.205 1.00 0.00 H new ATOM 1765 N HIS A 150 1.361 -3.769 -11.569 1.00 0.00 N ATOM 1766 CA HIS A 150 0.781 -2.432 -11.417 1.00 0.00 C ATOM 1767 C HIS A 150 1.554 -1.632 -10.385 1.00 0.00 C ATOM 1768 O HIS A 150 2.174 -2.198 -9.490 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.690 -2.512 -10.999 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.432 -3.646 -11.627 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.190 -3.516 -12.771 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.520 -4.943 -11.262 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.714 -4.688 -13.084 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.321 -5.571 -12.184 1.00 0.00 N ATOM 0 H HIS A 150 1.938 -4.071 -10.784 1.00 0.00 H new ATOM 0 HA HIS A 150 0.844 -1.934 -12.384 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.746 -2.609 -9.915 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.184 -1.577 -11.261 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -1.049 -5.401 -10.405 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.354 -4.889 -13.930 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.572 -6.560 -12.175 1.00 0.00 H new ATOM 1783 N THR A 151 1.518 -0.312 -10.513 1.00 0.00 N ATOM 1784 CA THR A 151 2.226 0.553 -9.580 1.00 0.00 C ATOM 1785 C THR A 151 1.464 1.850 -9.331 1.00 0.00 C ATOM 1786 O THR A 151 0.607 2.243 -10.123 1.00 0.00 O ATOM 1787 CB THR A 151 3.620 0.877 -10.112 1.00 0.00 C ATOM 1788 OG1 THR A 151 3.542 1.451 -11.404 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.533 -0.330 -10.201 1.00 0.00 C ATOM 0 H THR A 151 1.010 0.180 -11.248 1.00 0.00 H new ATOM 0 HA THR A 151 2.310 0.017 -8.635 1.00 0.00 H new ATOM 0 HB THR A 151 4.044 1.576 -9.391 1.00 0.00 H new ATOM 0 HG1 THR A 151 4.445 1.653 -11.727 1.00 0.00 H new ATOM 0 HG21 THR A 151 5.505 -0.023 -10.587 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.657 -0.766 -9.210 1.00 0.00 H new ATOM 0 HG23 THR A 151 4.094 -1.070 -10.870 1.00 0.00 H new ATOM 1797 N LEU A 152 1.805 2.520 -8.235 1.00 0.00 N ATOM 1798 CA LEU A 152 1.184 3.785 -7.881 1.00 0.00 C ATOM 1799 C LEU A 152 1.888 4.908 -8.625 1.00 0.00 C ATOM 1800 O LEU A 152 1.289 5.929 -8.964 1.00 0.00 O ATOM 1801 CB LEU A 152 1.288 4.017 -6.372 1.00 0.00 C ATOM 1802 CG LEU A 152 0.090 3.546 -5.551 1.00 0.00 C ATOM 1803 CD1 LEU A 152 0.390 3.652 -4.065 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.145 4.355 -5.904 1.00 0.00 C ATOM 0 H LEU A 152 2.514 2.202 -7.574 1.00 0.00 H new ATOM 0 HA LEU A 152 0.130 3.763 -8.159 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.180 3.510 -6.005 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.431 5.083 -6.195 1.00 0.00 H new ATOM 0 HG LEU A 152 -0.103 2.500 -5.789 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -0.474 3.312 -3.494 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.252 3.030 -3.823 1.00 0.00 H new ATOM 0 HD13 LEU A 152 0.608 4.689 -3.811 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.990 4.007 -5.310 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.962 5.409 -5.693 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.370 4.231 -6.963 1.00 0.00 H new