USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 782 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 LYS NZ :NH3+ 159:sc= -9.09! (180deg=-10.2!) USER MOD Set 1.2: A 90 MET CE :methyl -121:sc= -17.5! (180deg=-26.5!) USER MOD Set 2.1: A 66 HIS : no HD1:sc= -9.34! C(o=-8.2!,f=-14!) USER MOD Set 2.2: A 82 LYS NZ :NH3+ -159:sc= 1.19 (180deg=0.989) USER MOD Set 3.1: A 15 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 25 ASN : amide:sc=-0.00147 X(o=-0.0015,f=-0.0015) USER MOD Single : A 1 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLN N :NH3+ -165:sc= -0.295 (180deg=-0.895) USER MOD Single : A 7 LYS NZ :NH3+ 155:sc= 0.831 (180deg=0.696) USER MOD Single : A 12 LYS NZ :NH3+ -117:sc= 0.00436 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.113 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -5.53! K(o=-5.5!,f=0.058) USER MOD Single : A 19 GLN : amide:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot -60:sc= -1.21! USER MOD Single : A 27 ASN : amide:sc= -0.386 K(o=-0.39,f=0.75) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -85:sc= 0.524 USER MOD Single : A 34 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00109) USER MOD Single : A 35 ASN : amide:sc= -0.0248 K(o=-0.025,f=-0.58) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 ASN : amide:sc= -14.7! C(o=-15!,f=-8.2!) USER MOD Single : A 49 ASN : amide:sc= -0.0138 X(o=-0.014,f=-0.23) USER MOD Single : A 51 THR OG1 : rot -43:sc= -1.69 USER MOD Single : A 54 THR OG1 : rot 95:sc= -2.75! USER MOD Single : A 57 HIS : no HD1:sc= -4.12! C(o=-4.1!,f=-4.9!) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl -169:sc=-0.00899 (180deg=-0.21) USER MOD Single : A 71 SER OG : rot -52:sc= -1.54 USER MOD Single : A 72 SER OG : rot 9:sc= 0.687! USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.0849 K(o=-0.085,f=-0.67) USER MOD Single : A 78 MET CE :methyl 148:sc= -14.8! (180deg=-17.1!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 100:sc= -5.43! USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -10.3! C(o=-10!,f=-25!) USER MOD Single : A 105 SER OG : rot -6:sc= 0.564! USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 5.325 -8.375 -1.101 1.00 0.00 N ATOM 2 CA GLN A 1 4.105 -7.954 -1.759 1.00 0.00 C ATOM 3 C GLN A 1 4.307 -6.585 -2.394 1.00 0.00 C ATOM 4 O GLN A 1 3.601 -6.222 -3.332 1.00 0.00 O ATOM 5 CB GLN A 1 2.967 -7.916 -0.744 1.00 0.00 C ATOM 6 CG GLN A 1 2.397 -9.320 -0.566 1.00 0.00 C ATOM 7 CD GLN A 1 1.623 -9.430 0.740 1.00 0.00 C ATOM 8 OE1 GLN A 1 1.909 -10.297 1.563 1.00 0.00 O ATOM 9 NE2 GLN A 1 0.638 -8.548 0.928 1.00 0.00 N ATOM 0 H1 GLN A 1 5.274 -9.393 -0.893 1.00 0.00 H new ATOM 0 H2 GLN A 1 6.137 -8.189 -1.723 1.00 0.00 H new ATOM 0 H3 GLN A 1 5.441 -7.846 -0.213 1.00 0.00 H new ATOM 0 HA GLN A 1 3.849 -8.663 -2.546 1.00 0.00 H new ATOM 0 HB2 GLN A 1 3.330 -7.535 0.211 1.00 0.00 H new ATOM 0 HB3 GLN A 1 2.186 -7.235 -1.083 1.00 0.00 H new ATOM 0 HG2 GLN A 1 1.741 -9.560 -1.403 1.00 0.00 H new ATOM 0 HG3 GLN A 1 3.207 -10.050 -0.576 1.00 0.00 H new ATOM 0 HE21 GLN A 1 0.439 -7.846 0.215 1.00 0.00 H new ATOM 0 HE22 GLN A 1 0.085 -8.576 1.785 1.00 0.00 H new ATOM 20 N LEU A 2 5.277 -5.825 -1.880 1.00 0.00 N ATOM 21 CA LEU A 2 5.568 -4.502 -2.397 1.00 0.00 C ATOM 22 C LEU A 2 6.471 -3.756 -1.426 1.00 0.00 C ATOM 23 O LEU A 2 6.253 -2.578 -1.151 1.00 0.00 O ATOM 24 CB LEU A 2 4.262 -3.743 -2.613 1.00 0.00 C ATOM 25 CG LEU A 2 3.301 -4.048 -1.468 1.00 0.00 C ATOM 26 CD1 LEU A 2 3.081 -2.786 -0.638 1.00 0.00 C ATOM 27 CD2 LEU A 2 1.967 -4.522 -2.036 1.00 0.00 C ATOM 0 H LEU A 2 5.872 -6.112 -1.103 1.00 0.00 H new ATOM 0 HA LEU A 2 6.086 -4.586 -3.352 1.00 0.00 H new ATOM 0 HB2 LEU A 2 4.456 -2.672 -2.664 1.00 0.00 H new ATOM 0 HB3 LEU A 2 3.814 -4.031 -3.564 1.00 0.00 H new ATOM 0 HG LEU A 2 3.725 -4.829 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 2 2.394 -3.004 0.180 1.00 0.00 H new ATOM 0 HD12 LEU A 2 4.034 -2.447 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 2 2.657 -2.005 -1.269 1.00 0.00 H new ATOM 0 HD21 LEU A 2 1.280 -4.740 -1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 2 1.543 -3.742 -2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 2 2.124 -5.423 -2.628 1.00 0.00 H new ATOM 39 N PRO A 3 7.489 -4.445 -0.905 1.00 0.00 N ATOM 40 CA PRO A 3 8.450 -3.901 0.030 1.00 0.00 C ATOM 41 C PRO A 3 9.379 -2.938 -0.694 1.00 0.00 C ATOM 42 O PRO A 3 8.956 -1.865 -1.120 1.00 0.00 O ATOM 43 CB PRO A 3 9.217 -5.113 0.554 1.00 0.00 C ATOM 44 CG PRO A 3 9.166 -6.081 -0.627 1.00 0.00 C ATOM 45 CD PRO A 3 7.776 -5.831 -1.206 1.00 0.00 C ATOM 0 HA PRO A 3 7.983 -3.342 0.841 1.00 0.00 H new ATOM 0 HB2 PRO A 3 10.242 -4.858 0.824 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.749 -5.535 1.443 1.00 0.00 H new ATOM 0 HG2 PRO A 3 9.951 -5.874 -1.354 1.00 0.00 H new ATOM 0 HG3 PRO A 3 9.292 -7.116 -0.308 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.757 -6.014 -2.280 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.036 -6.494 -0.757 1.00 0.00 H new ATOM 53 N ARG A 4 10.650 -3.323 -0.832 1.00 0.00 N ATOM 54 CA ARG A 4 11.633 -2.493 -1.499 1.00 0.00 C ATOM 55 C ARG A 4 12.099 -3.174 -2.778 1.00 0.00 C ATOM 56 O ARG A 4 12.635 -4.280 -2.735 1.00 0.00 O ATOM 57 CB ARG A 4 12.809 -2.243 -0.561 1.00 0.00 C ATOM 58 CG ARG A 4 12.310 -1.558 0.708 1.00 0.00 C ATOM 59 CD ARG A 4 13.492 -1.273 1.631 1.00 0.00 C ATOM 60 NE ARG A 4 13.085 -1.316 3.036 1.00 0.00 N ATOM 61 CZ ARG A 4 12.485 -2.380 3.585 1.00 0.00 C ATOM 62 NH1 ARG A 4 12.237 -3.468 2.841 1.00 0.00 N ATOM 63 NH2 ARG A 4 12.134 -2.359 4.878 1.00 0.00 N ATOM 0 H ARG A 4 11.015 -4.210 -0.486 1.00 0.00 H new ATOM 0 HA ARG A 4 11.186 -1.534 -1.762 1.00 0.00 H new ATOM 0 HB2 ARG A 4 13.296 -3.186 -0.311 1.00 0.00 H new ATOM 0 HB3 ARG A 4 13.555 -1.620 -1.054 1.00 0.00 H new ATOM 0 HG2 ARG A 4 11.800 -0.629 0.456 1.00 0.00 H new ATOM 0 HG3 ARG A 4 11.584 -2.193 1.215 1.00 0.00 H new ATOM 0 HD2 ARG A 4 14.280 -2.005 1.455 1.00 0.00 H new ATOM 0 HD3 ARG A 4 13.910 -0.293 1.400 1.00 0.00 H new ATOM 0 HE ARG A 4 13.266 -0.501 3.622 1.00 0.00 H new ATOM 0 HH11 ARG A 4 12.505 -3.485 1.857 1.00 0.00 H new ATOM 0 HH12 ARG A 4 11.780 -4.278 3.259 1.00 0.00 H new ATOM 0 HH21 ARG A 4 12.324 -1.532 5.445 1.00 0.00 H new ATOM 0 HH22 ARG A 4 11.677 -3.170 5.296 1.00 0.00 H new ATOM 77 N LEU A 5 11.895 -2.511 -3.919 1.00 0.00 N ATOM 78 CA LEU A 5 12.295 -3.053 -5.201 1.00 0.00 C ATOM 79 C LEU A 5 13.414 -2.209 -5.793 1.00 0.00 C ATOM 80 O LEU A 5 13.234 -1.018 -6.038 1.00 0.00 O ATOM 81 CB LEU A 5 11.089 -3.084 -6.138 1.00 0.00 C ATOM 82 CG LEU A 5 10.371 -4.423 -5.996 1.00 0.00 C ATOM 83 CD1 LEU A 5 9.184 -4.468 -6.955 1.00 0.00 C ATOM 84 CD2 LEU A 5 11.337 -5.557 -6.329 1.00 0.00 C ATOM 0 H LEU A 5 11.452 -1.594 -3.971 1.00 0.00 H new ATOM 0 HA LEU A 5 12.665 -4.070 -5.070 1.00 0.00 H new ATOM 0 HB2 LEU A 5 10.408 -2.267 -5.900 1.00 0.00 H new ATOM 0 HB3 LEU A 5 11.412 -2.939 -7.169 1.00 0.00 H new ATOM 0 HG LEU A 5 10.016 -4.538 -4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 5 8.671 -5.424 -6.854 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.494 -3.659 -6.718 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.539 -4.353 -7.979 1.00 0.00 H new ATOM 0 HD21 LEU A 5 10.824 -6.513 -6.228 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.693 -5.443 -7.353 1.00 0.00 H new ATOM 0 HD23 LEU A 5 12.185 -5.526 -5.645 1.00 0.00 H new ATOM 96 N CYS A 6 14.573 -2.830 -6.023 1.00 0.00 N ATOM 97 CA CYS A 6 15.715 -2.136 -6.583 1.00 0.00 C ATOM 98 C CYS A 6 16.588 -3.119 -7.353 1.00 0.00 C ATOM 99 O CYS A 6 16.467 -4.329 -7.177 1.00 0.00 O ATOM 100 CB CYS A 6 16.509 -1.474 -5.461 1.00 0.00 C ATOM 101 SG CYS A 6 15.692 -0.031 -4.735 1.00 0.00 S ATOM 0 H CYS A 6 14.737 -3.817 -5.826 1.00 0.00 H new ATOM 0 HA CYS A 6 15.374 -1.364 -7.273 1.00 0.00 H new ATOM 0 HB2 CYS A 6 16.692 -2.208 -4.677 1.00 0.00 H new ATOM 0 HB3 CYS A 6 17.482 -1.172 -5.848 1.00 0.00 H new ATOM 106 N LYS A 7 17.467 -2.595 -8.210 1.00 0.00 N ATOM 107 CA LYS A 7 18.352 -3.427 -9.000 1.00 0.00 C ATOM 108 C LYS A 7 19.296 -4.194 -8.085 1.00 0.00 C ATOM 109 O LYS A 7 19.949 -3.605 -7.226 1.00 0.00 O ATOM 110 CB LYS A 7 19.135 -2.552 -9.975 1.00 0.00 C ATOM 111 CG LYS A 7 18.624 -2.788 -11.392 1.00 0.00 C ATOM 112 CD LYS A 7 17.233 -2.179 -11.541 1.00 0.00 C ATOM 113 CE LYS A 7 17.324 -0.896 -12.361 1.00 0.00 C ATOM 114 NZ LYS A 7 17.237 -1.183 -13.802 1.00 0.00 N ATOM 0 H LYS A 7 17.578 -1.594 -8.369 1.00 0.00 H new ATOM 0 HA LYS A 7 17.766 -4.149 -9.569 1.00 0.00 H new ATOM 0 HB2 LYS A 7 19.024 -1.501 -9.707 1.00 0.00 H new ATOM 0 HB3 LYS A 7 20.198 -2.785 -9.917 1.00 0.00 H new ATOM 0 HG2 LYS A 7 19.307 -2.342 -12.115 1.00 0.00 H new ATOM 0 HG3 LYS A 7 18.589 -3.857 -11.604 1.00 0.00 H new ATOM 0 HD2 LYS A 7 16.564 -2.888 -12.029 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.811 -1.966 -10.559 1.00 0.00 H new ATOM 0 HE2 LYS A 7 16.521 -0.218 -12.073 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.263 -0.387 -12.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 16.881 -0.343 -14.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 18.180 -1.429 -14.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 16.588 -1.980 -13.959 1.00 0.00 H new ATOM 128 N PHE A 8 19.368 -5.513 -8.272 1.00 0.00 N ATOM 129 CA PHE A 8 20.230 -6.353 -7.465 1.00 0.00 C ATOM 130 C PHE A 8 21.109 -7.207 -8.366 1.00 0.00 C ATOM 131 O PHE A 8 20.838 -8.390 -8.562 1.00 0.00 O ATOM 132 CB PHE A 8 19.377 -7.229 -6.553 1.00 0.00 C ATOM 133 CG PHE A 8 20.141 -7.813 -5.390 1.00 0.00 C ATOM 134 CD1 PHE A 8 21.084 -8.826 -5.609 1.00 0.00 C ATOM 135 CD2 PHE A 8 19.910 -7.342 -4.091 1.00 0.00 C ATOM 136 CE1 PHE A 8 21.795 -9.365 -4.530 1.00 0.00 C ATOM 137 CE2 PHE A 8 20.620 -7.881 -3.013 1.00 0.00 C ATOM 138 CZ PHE A 8 21.563 -8.894 -3.232 1.00 0.00 C ATOM 0 H PHE A 8 18.834 -6.017 -8.980 1.00 0.00 H new ATOM 0 HA PHE A 8 20.876 -5.730 -6.847 1.00 0.00 H new ATOM 0 HB2 PHE A 8 18.545 -6.638 -6.170 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.948 -8.041 -7.140 1.00 0.00 H new ATOM 0 HD1 PHE A 8 21.262 -9.191 -6.610 1.00 0.00 H new ATOM 0 HD2 PHE A 8 19.183 -6.562 -3.922 1.00 0.00 H new ATOM 0 HE1 PHE A 8 22.523 -10.145 -4.699 1.00 0.00 H new ATOM 0 HE2 PHE A 8 20.441 -7.516 -2.012 1.00 0.00 H new ATOM 0 HZ PHE A 8 22.111 -9.311 -2.400 1.00 0.00 H new ATOM 148 N CYS A 9 22.167 -6.605 -8.915 1.00 0.00 N ATOM 149 CA CYS A 9 23.081 -7.310 -9.791 1.00 0.00 C ATOM 150 C CYS A 9 24.504 -7.167 -9.273 1.00 0.00 C ATOM 151 O CYS A 9 24.795 -6.266 -8.490 1.00 0.00 O ATOM 152 CB CYS A 9 22.961 -6.752 -11.206 1.00 0.00 C ATOM 153 SG CYS A 9 23.945 -5.260 -11.493 1.00 0.00 S ATOM 0 H CYS A 9 22.405 -5.625 -8.762 1.00 0.00 H new ATOM 0 HA CYS A 9 22.828 -8.370 -9.811 1.00 0.00 H new ATOM 0 HB2 CYS A 9 23.268 -7.520 -11.916 1.00 0.00 H new ATOM 0 HB3 CYS A 9 21.914 -6.529 -11.411 1.00 0.00 H new ATOM 158 N ASP A 10 25.394 -8.061 -9.713 1.00 0.00 N ATOM 159 CA ASP A 10 26.780 -8.030 -9.291 1.00 0.00 C ATOM 160 C ASP A 10 27.474 -6.815 -9.891 1.00 0.00 C ATOM 161 O ASP A 10 26.944 -6.183 -10.803 1.00 0.00 O ATOM 162 CB ASP A 10 27.472 -9.318 -9.727 1.00 0.00 C ATOM 163 CG ASP A 10 26.505 -10.493 -9.693 1.00 0.00 C ATOM 164 OD1 ASP A 10 26.384 -11.097 -8.606 1.00 0.00 O ATOM 165 OD2 ASP A 10 25.904 -10.765 -10.755 1.00 0.00 O ATOM 0 H ASP A 10 25.169 -8.814 -10.363 1.00 0.00 H new ATOM 0 HA ASP A 10 26.833 -7.954 -8.205 1.00 0.00 H new ATOM 0 HB2 ASP A 10 27.870 -9.198 -10.735 1.00 0.00 H new ATOM 0 HB3 ASP A 10 28.319 -9.520 -9.072 1.00 0.00 H new ATOM 170 N VAL A 11 28.662 -6.490 -9.377 1.00 0.00 N ATOM 171 CA VAL A 11 29.421 -5.355 -9.864 1.00 0.00 C ATOM 172 C VAL A 11 30.117 -5.721 -11.167 1.00 0.00 C ATOM 173 O VAL A 11 31.008 -6.569 -11.181 1.00 0.00 O ATOM 174 CB VAL A 11 30.438 -4.933 -8.807 1.00 0.00 C ATOM 175 CG1 VAL A 11 30.958 -6.171 -8.079 1.00 0.00 C ATOM 176 CG2 VAL A 11 31.602 -4.213 -9.480 1.00 0.00 C ATOM 0 H VAL A 11 29.114 -7.004 -8.621 1.00 0.00 H new ATOM 0 HA VAL A 11 28.749 -4.519 -10.057 1.00 0.00 H new ATOM 0 HB VAL A 11 29.962 -4.263 -8.091 1.00 0.00 H new ATOM 0 HG11 VAL A 11 31.684 -5.871 -7.324 1.00 0.00 H new ATOM 0 HG12 VAL A 11 30.127 -6.686 -7.598 1.00 0.00 H new ATOM 0 HG13 VAL A 11 31.435 -6.841 -8.795 1.00 0.00 H new ATOM 0 HG21 VAL A 11 32.328 -3.911 -8.725 1.00 0.00 H new ATOM 0 HG22 VAL A 11 32.079 -4.882 -10.196 1.00 0.00 H new ATOM 0 HG23 VAL A 11 31.232 -3.330 -10.000 1.00 0.00 H new ATOM 186 N LYS A 12 29.709 -5.080 -12.264 1.00 0.00 N ATOM 187 CA LYS A 12 30.295 -5.340 -13.563 1.00 0.00 C ATOM 188 C LYS A 12 30.647 -4.027 -14.246 1.00 0.00 C ATOM 189 O LYS A 12 30.132 -2.973 -13.877 1.00 0.00 O ATOM 190 CB LYS A 12 29.313 -6.144 -14.411 1.00 0.00 C ATOM 191 CG LYS A 12 27.904 -5.979 -13.850 1.00 0.00 C ATOM 192 CD LYS A 12 26.923 -6.793 -14.689 1.00 0.00 C ATOM 193 CE LYS A 12 25.769 -5.898 -15.132 1.00 0.00 C ATOM 194 NZ LYS A 12 24.671 -6.696 -15.699 1.00 0.00 N ATOM 0 H LYS A 12 28.971 -4.376 -12.269 1.00 0.00 H new ATOM 0 HA LYS A 12 31.211 -5.919 -13.442 1.00 0.00 H new ATOM 0 HB2 LYS A 12 29.346 -5.804 -15.446 1.00 0.00 H new ATOM 0 HB3 LYS A 12 29.594 -7.197 -14.413 1.00 0.00 H new ATOM 0 HG2 LYS A 12 27.873 -6.310 -12.812 1.00 0.00 H new ATOM 0 HG3 LYS A 12 27.619 -4.927 -13.857 1.00 0.00 H new ATOM 0 HD2 LYS A 12 27.430 -7.209 -15.560 1.00 0.00 H new ATOM 0 HD3 LYS A 12 26.543 -7.634 -14.110 1.00 0.00 H new ATOM 0 HE2 LYS A 12 25.403 -5.322 -14.282 1.00 0.00 H new ATOM 0 HE3 LYS A 12 26.123 -5.182 -15.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 24.538 -6.442 -16.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 24.903 -7.707 -15.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 23.795 -6.504 -15.173 1.00 0.00 H new ATOM 208 N ALA A 13 31.530 -4.091 -15.246 1.00 0.00 N ATOM 209 CA ALA A 13 31.948 -2.911 -15.974 1.00 0.00 C ATOM 210 C ALA A 13 30.725 -2.114 -16.409 1.00 0.00 C ATOM 211 O ALA A 13 29.997 -2.530 -17.307 1.00 0.00 O ATOM 212 CB ALA A 13 32.778 -3.328 -17.184 1.00 0.00 C ATOM 0 H ALA A 13 31.966 -4.957 -15.564 1.00 0.00 H new ATOM 0 HA ALA A 13 32.560 -2.279 -15.330 1.00 0.00 H new ATOM 0 HB1 ALA A 13 33.093 -2.440 -17.733 1.00 0.00 H new ATOM 0 HB2 ALA A 13 33.657 -3.879 -16.850 1.00 0.00 H new ATOM 0 HB3 ALA A 13 32.178 -3.963 -17.836 1.00 0.00 H new ATOM 218 N THR A 14 30.503 -0.964 -15.768 1.00 0.00 N ATOM 219 CA THR A 14 29.372 -0.119 -16.092 1.00 0.00 C ATOM 220 C THR A 14 29.832 1.061 -16.937 1.00 0.00 C ATOM 221 O THR A 14 31.026 1.343 -17.021 1.00 0.00 O ATOM 222 CB THR A 14 28.712 0.364 -14.804 1.00 0.00 C ATOM 223 OG1 THR A 14 27.648 1.234 -15.119 1.00 0.00 O ATOM 224 CG2 THR A 14 29.739 1.104 -13.952 1.00 0.00 C ATOM 0 H THR A 14 31.098 -0.604 -15.022 1.00 0.00 H new ATOM 0 HA THR A 14 28.643 -0.689 -16.667 1.00 0.00 H new ATOM 0 HB THR A 14 28.329 -0.492 -14.249 1.00 0.00 H new ATOM 0 HG1 THR A 14 27.223 1.543 -14.292 1.00 0.00 H new ATOM 0 HG21 THR A 14 29.268 1.449 -13.032 1.00 0.00 H new ATOM 0 HG22 THR A 14 30.562 0.432 -13.708 1.00 0.00 H new ATOM 0 HG23 THR A 14 30.122 1.960 -14.507 1.00 0.00 H new ATOM 232 N THR A 15 28.879 1.754 -17.565 1.00 0.00 N ATOM 233 CA THR A 15 29.191 2.898 -18.396 1.00 0.00 C ATOM 234 C THR A 15 28.588 4.158 -17.792 1.00 0.00 C ATOM 235 O THR A 15 28.438 5.168 -18.476 1.00 0.00 O ATOM 236 CB THR A 15 28.654 2.663 -19.805 1.00 0.00 C ATOM 237 OG1 THR A 15 27.259 2.466 -19.749 1.00 0.00 O ATOM 238 CG2 THR A 15 29.318 1.427 -20.403 1.00 0.00 C ATOM 0 H THR A 15 27.885 1.534 -17.508 1.00 0.00 H new ATOM 0 HA THR A 15 30.272 3.028 -18.449 1.00 0.00 H new ATOM 0 HB THR A 15 28.874 3.530 -20.427 1.00 0.00 H new ATOM 0 HG1 THR A 15 26.913 2.317 -20.654 1.00 0.00 H new ATOM 0 HG21 THR A 15 28.935 1.259 -21.409 1.00 0.00 H new ATOM 0 HG22 THR A 15 30.397 1.578 -20.446 1.00 0.00 H new ATOM 0 HG23 THR A 15 29.098 0.559 -19.781 1.00 0.00 H new ATOM 246 N CYS A 16 28.241 4.095 -16.504 1.00 0.00 N ATOM 247 CA CYS A 16 27.657 5.227 -15.814 1.00 0.00 C ATOM 248 C CYS A 16 28.741 6.241 -15.478 1.00 0.00 C ATOM 249 O CYS A 16 29.838 5.868 -15.068 1.00 0.00 O ATOM 250 CB CYS A 16 26.959 4.742 -14.545 1.00 0.00 C ATOM 251 SG CYS A 16 25.352 5.518 -14.248 1.00 0.00 S ATOM 0 H CYS A 16 28.359 3.264 -15.924 1.00 0.00 H new ATOM 0 HA CYS A 16 26.921 5.710 -16.457 1.00 0.00 H new ATOM 0 HB2 CYS A 16 26.824 3.662 -14.607 1.00 0.00 H new ATOM 0 HB3 CYS A 16 27.607 4.934 -13.690 1.00 0.00 H new ATOM 256 N SER A 17 28.432 7.527 -15.656 1.00 0.00 N ATOM 257 CA SER A 17 29.380 8.587 -15.371 1.00 0.00 C ATOM 258 C SER A 17 28.970 9.319 -14.101 1.00 0.00 C ATOM 259 O SER A 17 27.783 9.443 -13.808 1.00 0.00 O ATOM 260 CB SER A 17 29.439 9.546 -16.555 1.00 0.00 C ATOM 261 OG SER A 17 30.242 8.991 -17.571 1.00 0.00 O ATOM 0 H SER A 17 27.528 7.852 -15.998 1.00 0.00 H new ATOM 0 HA SER A 17 30.372 8.162 -15.216 1.00 0.00 H new ATOM 0 HB2 SER A 17 28.434 9.735 -16.934 1.00 0.00 H new ATOM 0 HB3 SER A 17 29.847 10.506 -16.239 1.00 0.00 H new ATOM 0 HG SER A 17 30.278 9.607 -18.332 1.00 0.00 H new ATOM 267 N ASN A 18 29.958 9.806 -13.347 1.00 0.00 N ATOM 268 CA ASN A 18 29.696 10.525 -12.117 1.00 0.00 C ATOM 269 C ASN A 18 28.988 11.837 -12.423 1.00 0.00 C ATOM 270 O ASN A 18 29.542 12.911 -12.204 1.00 0.00 O ATOM 271 CB ASN A 18 31.012 10.779 -11.387 1.00 0.00 C ATOM 272 CG ASN A 18 31.981 11.554 -12.268 1.00 0.00 C ATOM 273 OD1 ASN A 18 32.505 12.587 -11.857 1.00 0.00 O ATOM 274 ND2 ASN A 18 32.220 11.053 -13.482 1.00 0.00 N ATOM 0 H ASN A 18 30.947 9.710 -13.575 1.00 0.00 H new ATOM 0 HA ASN A 18 29.048 9.928 -11.476 1.00 0.00 H new ATOM 0 HB2 ASN A 18 30.822 11.337 -10.470 1.00 0.00 H new ATOM 0 HB3 ASN A 18 31.460 9.829 -11.095 1.00 0.00 H new ATOM 0 HD21 ASN A 18 32.862 11.531 -14.114 1.00 0.00 H new ATOM 0 HD22 ASN A 18 31.760 10.192 -13.778 1.00 0.00 H new ATOM 281 N GLN A 19 27.756 11.746 -12.930 1.00 0.00 N ATOM 282 CA GLN A 19 26.979 12.922 -13.263 1.00 0.00 C ATOM 283 C GLN A 19 25.913 13.156 -12.202 1.00 0.00 C ATOM 284 O GLN A 19 25.586 12.250 -11.437 1.00 0.00 O ATOM 285 CB GLN A 19 26.341 12.736 -14.637 1.00 0.00 C ATOM 286 CG GLN A 19 27.275 11.919 -15.526 1.00 0.00 C ATOM 287 CD GLN A 19 27.476 12.599 -16.873 1.00 0.00 C ATOM 288 OE1 GLN A 19 27.051 12.080 -17.902 1.00 0.00 O ATOM 289 NE2 GLN A 19 28.128 13.764 -16.864 1.00 0.00 N ATOM 0 H GLN A 19 27.282 10.862 -13.116 1.00 0.00 H new ATOM 0 HA GLN A 19 27.630 13.795 -13.293 1.00 0.00 H new ATOM 0 HB2 GLN A 19 25.381 12.230 -14.538 1.00 0.00 H new ATOM 0 HB3 GLN A 19 26.144 13.706 -15.093 1.00 0.00 H new ATOM 0 HG2 GLN A 19 28.238 11.793 -15.030 1.00 0.00 H new ATOM 0 HG3 GLN A 19 26.861 10.922 -15.676 1.00 0.00 H new ATOM 0 HE21 GLN A 19 28.462 14.155 -15.983 1.00 0.00 H new ATOM 0 HE22 GLN A 19 28.292 14.263 -17.738 1.00 0.00 H new ATOM 298 N ASP A 20 25.370 14.375 -12.157 1.00 0.00 N ATOM 299 CA ASP A 20 24.347 14.720 -11.191 1.00 0.00 C ATOM 300 C ASP A 20 23.332 13.591 -11.090 1.00 0.00 C ATOM 301 O ASP A 20 22.772 13.353 -10.023 1.00 0.00 O ATOM 302 CB ASP A 20 23.669 16.020 -11.615 1.00 0.00 C ATOM 303 CG ASP A 20 24.618 17.201 -11.470 1.00 0.00 C ATOM 304 OD1 ASP A 20 25.742 17.094 -12.007 1.00 0.00 O ATOM 305 OD2 ASP A 20 24.202 18.188 -10.827 1.00 0.00 O ATOM 0 H ASP A 20 25.629 15.136 -12.785 1.00 0.00 H new ATOM 0 HA ASP A 20 24.800 14.863 -10.210 1.00 0.00 H new ATOM 0 HB2 ASP A 20 23.337 15.941 -12.650 1.00 0.00 H new ATOM 0 HB3 ASP A 20 22.780 16.186 -11.007 1.00 0.00 H new ATOM 310 N GLN A 21 23.097 12.895 -12.204 1.00 0.00 N ATOM 311 CA GLN A 21 22.152 11.796 -12.234 1.00 0.00 C ATOM 312 C GLN A 21 22.691 10.674 -13.109 1.00 0.00 C ATOM 313 O GLN A 21 23.168 10.920 -14.215 1.00 0.00 O ATOM 314 CB GLN A 21 20.810 12.297 -12.761 1.00 0.00 C ATOM 315 CG GLN A 21 19.754 11.211 -12.578 1.00 0.00 C ATOM 316 CD GLN A 21 18.898 11.071 -13.828 1.00 0.00 C ATOM 317 OE1 GLN A 21 17.906 11.779 -13.987 1.00 0.00 O ATOM 318 NE2 GLN A 21 19.282 10.153 -14.718 1.00 0.00 N ATOM 0 H GLN A 21 23.554 13.080 -13.097 1.00 0.00 H new ATOM 0 HA GLN A 21 22.010 11.405 -11.226 1.00 0.00 H new ATOM 0 HB2 GLN A 21 20.513 13.201 -12.229 1.00 0.00 H new ATOM 0 HB3 GLN A 21 20.897 12.561 -13.815 1.00 0.00 H new ATOM 0 HG2 GLN A 21 20.239 10.260 -12.356 1.00 0.00 H new ATOM 0 HG3 GLN A 21 19.121 11.453 -11.724 1.00 0.00 H new ATOM 0 HE21 GLN A 21 20.113 9.589 -14.542 1.00 0.00 H new ATOM 0 HE22 GLN A 21 18.744 10.016 -15.574 1.00 0.00 H new ATOM 327 N CYS A 22 22.613 9.438 -12.611 1.00 0.00 N ATOM 328 CA CYS A 22 23.091 8.285 -13.347 1.00 0.00 C ATOM 329 C CYS A 22 22.099 7.139 -13.210 1.00 0.00 C ATOM 330 O CYS A 22 21.163 7.215 -12.417 1.00 0.00 O ATOM 331 CB CYS A 22 24.463 7.878 -12.819 1.00 0.00 C ATOM 332 SG CYS A 22 25.693 7.585 -14.115 1.00 0.00 S ATOM 0 H CYS A 22 22.220 9.218 -11.696 1.00 0.00 H new ATOM 0 HA CYS A 22 23.183 8.536 -14.404 1.00 0.00 H new ATOM 0 HB2 CYS A 22 24.831 8.658 -12.153 1.00 0.00 H new ATOM 0 HB3 CYS A 22 24.357 6.973 -12.221 1.00 0.00 H new ATOM 337 N THR A 23 22.306 6.072 -13.986 1.00 0.00 N ATOM 338 CA THR A 23 21.429 4.919 -13.943 1.00 0.00 C ATOM 339 C THR A 23 22.170 3.725 -13.358 1.00 0.00 C ATOM 340 O THR A 23 23.398 3.707 -13.324 1.00 0.00 O ATOM 341 CB THR A 23 20.930 4.609 -15.352 1.00 0.00 C ATOM 342 OG1 THR A 23 20.364 5.769 -15.916 1.00 0.00 O ATOM 343 CG2 THR A 23 19.876 3.507 -15.287 1.00 0.00 C ATOM 0 H THR A 23 23.077 5.991 -14.649 1.00 0.00 H new ATOM 0 HA THR A 23 20.571 5.134 -13.306 1.00 0.00 H new ATOM 0 HB THR A 23 21.765 4.277 -15.969 1.00 0.00 H new ATOM 0 HG1 THR A 23 20.045 5.571 -16.821 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.519 3.285 -16.293 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.315 2.609 -14.851 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.040 3.839 -14.671 1.00 0.00 H new ATOM 351 N SER A 24 21.417 2.724 -12.896 1.00 0.00 N ATOM 352 CA SER A 24 22.003 1.532 -12.317 1.00 0.00 C ATOM 353 C SER A 24 22.738 0.743 -13.391 1.00 0.00 C ATOM 354 O SER A 24 23.648 -0.025 -13.089 1.00 0.00 O ATOM 355 CB SER A 24 20.905 0.686 -11.678 1.00 0.00 C ATOM 356 OG SER A 24 20.340 -0.162 -12.654 1.00 0.00 O ATOM 0 H SER A 24 20.397 2.724 -12.916 1.00 0.00 H new ATOM 0 HA SER A 24 22.722 1.812 -11.547 1.00 0.00 H new ATOM 0 HB2 SER A 24 21.316 0.094 -10.860 1.00 0.00 H new ATOM 0 HB3 SER A 24 20.136 1.330 -11.251 1.00 0.00 H new ATOM 0 HG SER A 24 19.956 0.379 -13.375 1.00 0.00 H new ATOM 362 N ASN A 25 22.339 0.936 -14.650 1.00 0.00 N ATOM 363 CA ASN A 25 22.961 0.244 -15.762 1.00 0.00 C ATOM 364 C ASN A 25 22.577 -1.228 -15.737 1.00 0.00 C ATOM 365 O ASN A 25 22.842 -1.960 -16.689 1.00 0.00 O ATOM 366 CB ASN A 25 24.476 0.409 -15.677 1.00 0.00 C ATOM 367 CG ASN A 25 25.133 0.084 -17.011 1.00 0.00 C ATOM 368 OD1 ASN A 25 25.121 0.904 -17.927 1.00 0.00 O ATOM 369 ND2 ASN A 25 25.709 -1.116 -17.119 1.00 0.00 N ATOM 0 H ASN A 25 21.585 1.569 -14.917 1.00 0.00 H new ATOM 0 HA ASN A 25 22.612 0.672 -16.702 1.00 0.00 H new ATOM 0 HB2 ASN A 25 24.719 1.431 -15.387 1.00 0.00 H new ATOM 0 HB3 ASN A 25 24.874 -0.246 -14.902 1.00 0.00 H new ATOM 0 HD21 ASN A 25 26.165 -1.386 -17.990 1.00 0.00 H new ATOM 0 HD22 ASN A 25 25.693 -1.762 -16.330 1.00 0.00 H new ATOM 376 N CYS A 26 21.950 -1.662 -14.642 1.00 0.00 N ATOM 377 CA CYS A 26 21.531 -3.042 -14.495 1.00 0.00 C ATOM 378 C CYS A 26 20.032 -3.154 -14.737 1.00 0.00 C ATOM 379 O CYS A 26 19.320 -2.152 -14.708 1.00 0.00 O ATOM 380 CB CYS A 26 21.891 -3.537 -13.097 1.00 0.00 C ATOM 381 SG CYS A 26 23.176 -4.812 -13.078 1.00 0.00 S ATOM 0 H CYS A 26 21.724 -1.068 -13.844 1.00 0.00 H new ATOM 0 HA CYS A 26 22.046 -3.662 -15.229 1.00 0.00 H new ATOM 0 HB2 CYS A 26 22.224 -2.690 -12.497 1.00 0.00 H new ATOM 0 HB3 CYS A 26 20.994 -3.932 -12.620 1.00 0.00 H new ATOM 386 N ASN A 27 19.554 -4.377 -14.977 1.00 0.00 N ATOM 387 CA ASN A 27 18.145 -4.611 -15.221 1.00 0.00 C ATOM 388 C ASN A 27 17.663 -5.791 -14.389 1.00 0.00 C ATOM 389 O ASN A 27 17.245 -6.810 -14.934 1.00 0.00 O ATOM 390 CB ASN A 27 17.925 -4.873 -16.708 1.00 0.00 C ATOM 391 CG ASN A 27 18.940 -5.876 -17.238 1.00 0.00 C ATOM 392 OD1 ASN A 27 18.809 -7.076 -17.006 1.00 0.00 O ATOM 393 ND2 ASN A 27 19.953 -5.382 -17.954 1.00 0.00 N ATOM 0 H ASN A 27 20.131 -5.218 -15.006 1.00 0.00 H new ATOM 0 HA ASN A 27 17.572 -3.731 -14.930 1.00 0.00 H new ATOM 0 HB2 ASN A 27 16.916 -5.251 -16.869 1.00 0.00 H new ATOM 0 HB3 ASN A 27 18.008 -3.938 -17.262 1.00 0.00 H new ATOM 0 HD21 ASN A 27 20.661 -6.009 -18.335 1.00 0.00 H new ATOM 0 HD22 ASN A 27 20.018 -4.378 -18.120 1.00 0.00 H new ATOM 400 N ILE A 28 17.721 -5.648 -13.062 1.00 0.00 N ATOM 401 CA ILE A 28 17.291 -6.697 -12.160 1.00 0.00 C ATOM 402 C ILE A 28 16.282 -6.138 -11.165 1.00 0.00 C ATOM 403 O ILE A 28 16.317 -4.953 -10.842 1.00 0.00 O ATOM 404 CB ILE A 28 18.503 -7.273 -11.435 1.00 0.00 C ATOM 405 CG1 ILE A 28 19.501 -7.809 -12.457 1.00 0.00 C ATOM 406 CG2 ILE A 28 18.056 -8.409 -10.518 1.00 0.00 C ATOM 407 CD1 ILE A 28 20.505 -8.721 -11.759 1.00 0.00 C ATOM 0 H ILE A 28 18.065 -4.808 -12.596 1.00 0.00 H new ATOM 0 HA ILE A 28 16.811 -7.495 -12.726 1.00 0.00 H new ATOM 0 HB ILE A 28 18.975 -6.490 -10.841 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.977 -8.359 -13.239 1.00 0.00 H new ATOM 0 HG13 ILE A 28 20.020 -6.982 -12.942 1.00 0.00 H new ATOM 0 HG21 ILE A 28 18.922 -8.821 -10.000 1.00 0.00 H new ATOM 0 HG22 ILE A 28 17.343 -8.027 -9.787 1.00 0.00 H new ATOM 0 HG23 ILE A 28 17.583 -9.191 -11.112 1.00 0.00 H new ATOM 0 HD11 ILE A 28 21.218 -9.104 -12.489 1.00 0.00 H new ATOM 0 HD12 ILE A 28 21.038 -8.157 -10.993 1.00 0.00 H new ATOM 0 HD13 ILE A 28 19.978 -9.555 -11.295 1.00 0.00 H new ATOM 419 N THR A 29 15.380 -6.996 -10.681 1.00 0.00 N ATOM 420 CA THR A 29 14.372 -6.580 -9.727 1.00 0.00 C ATOM 421 C THR A 29 14.450 -7.445 -8.478 1.00 0.00 C ATOM 422 O THR A 29 14.116 -8.627 -8.513 1.00 0.00 O ATOM 423 CB THR A 29 12.992 -6.686 -10.371 1.00 0.00 C ATOM 424 OG1 THR A 29 13.000 -6.017 -11.612 1.00 0.00 O ATOM 425 CG2 THR A 29 11.952 -6.046 -9.455 1.00 0.00 C ATOM 0 H THR A 29 15.335 -7.982 -10.940 1.00 0.00 H new ATOM 0 HA THR A 29 14.548 -5.544 -9.437 1.00 0.00 H new ATOM 0 HB THR A 29 12.743 -7.736 -10.525 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.115 -6.086 -12.027 1.00 0.00 H new ATOM 0 HG21 THR A 29 10.967 -6.122 -9.915 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.945 -6.563 -8.495 1.00 0.00 H new ATOM 0 HG23 THR A 29 12.201 -4.996 -9.300 1.00 0.00 H new ATOM 433 N SER A 30 14.897 -6.851 -7.369 1.00 0.00 N ATOM 434 CA SER A 30 15.017 -7.567 -6.115 1.00 0.00 C ATOM 435 C SER A 30 13.973 -7.060 -5.130 1.00 0.00 C ATOM 436 O SER A 30 13.810 -5.855 -4.957 1.00 0.00 O ATOM 437 CB SER A 30 16.424 -7.377 -5.555 1.00 0.00 C ATOM 438 OG SER A 30 16.624 -6.019 -5.236 1.00 0.00 O ATOM 0 H SER A 30 15.181 -5.872 -7.323 1.00 0.00 H new ATOM 0 HA SER A 30 14.846 -8.631 -6.281 1.00 0.00 H new ATOM 0 HB2 SER A 30 16.560 -7.994 -4.667 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.165 -7.703 -6.285 1.00 0.00 H new ATOM 0 HG SER A 30 16.921 -5.536 -6.035 1.00 0.00 H new ATOM 444 N ILE A 31 13.265 -7.988 -4.481 1.00 0.00 N ATOM 445 CA ILE A 31 12.243 -7.637 -3.515 1.00 0.00 C ATOM 446 C ILE A 31 12.784 -7.819 -2.104 1.00 0.00 C ATOM 447 O ILE A 31 13.224 -8.907 -1.741 1.00 0.00 O ATOM 448 CB ILE A 31 11.011 -8.510 -3.739 1.00 0.00 C ATOM 449 CG1 ILE A 31 11.177 -9.304 -5.031 1.00 0.00 C ATOM 450 CG2 ILE A 31 9.773 -7.625 -3.841 1.00 0.00 C ATOM 451 CD1 ILE A 31 11.145 -8.350 -6.221 1.00 0.00 C ATOM 0 H ILE A 31 13.389 -8.992 -4.614 1.00 0.00 H new ATOM 0 HA ILE A 31 11.959 -6.592 -3.642 1.00 0.00 H new ATOM 0 HB ILE A 31 10.897 -9.199 -2.902 1.00 0.00 H new ATOM 0 HG12 ILE A 31 12.119 -9.852 -5.015 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.380 -10.043 -5.122 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.893 -8.248 -4.001 1.00 0.00 H new ATOM 0 HG22 ILE A 31 9.654 -7.058 -2.918 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.887 -6.936 -4.678 1.00 0.00 H new ATOM 0 HD11 ILE A 31 11.264 -8.916 -7.145 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.191 -7.822 -6.239 1.00 0.00 H new ATOM 0 HD13 ILE A 31 11.957 -7.629 -6.131 1.00 0.00 H new ATOM 463 N CYS A 32 12.752 -6.748 -1.308 1.00 0.00 N ATOM 464 CA CYS A 32 13.238 -6.793 0.057 1.00 0.00 C ATOM 465 C CYS A 32 12.061 -6.850 1.020 1.00 0.00 C ATOM 466 O CYS A 32 11.905 -5.973 1.867 1.00 0.00 O ATOM 467 CB CYS A 32 14.101 -5.564 0.330 1.00 0.00 C ATOM 468 SG CYS A 32 15.101 -5.039 -1.085 1.00 0.00 S ATOM 0 H CYS A 32 12.391 -5.838 -1.595 1.00 0.00 H new ATOM 0 HA CYS A 32 13.846 -7.686 0.202 1.00 0.00 H new ATOM 0 HB2 CYS A 32 13.456 -4.739 0.632 1.00 0.00 H new ATOM 0 HB3 CYS A 32 14.762 -5.776 1.171 1.00 0.00 H new ATOM 473 N GLU A 33 11.231 -7.888 0.890 1.00 0.00 N ATOM 474 CA GLU A 33 10.076 -8.053 1.750 1.00 0.00 C ATOM 475 C GLU A 33 10.525 -8.390 3.164 1.00 0.00 C ATOM 476 O GLU A 33 9.703 -8.494 4.072 1.00 0.00 O ATOM 477 CB GLU A 33 9.179 -9.154 1.190 1.00 0.00 C ATOM 478 CG GLU A 33 8.086 -9.483 2.202 1.00 0.00 C ATOM 479 CD GLU A 33 8.507 -10.637 3.099 1.00 0.00 C ATOM 480 OE1 GLU A 33 9.175 -11.552 2.571 1.00 0.00 O ATOM 481 OE2 GLU A 33 8.152 -10.583 4.296 1.00 0.00 O ATOM 0 H GLU A 33 11.345 -8.624 0.193 1.00 0.00 H new ATOM 0 HA GLU A 33 9.510 -7.122 1.785 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.733 -8.831 0.249 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.770 -10.044 0.974 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.871 -8.604 2.810 1.00 0.00 H new ATOM 0 HG3 GLU A 33 7.166 -9.741 1.678 1.00 0.00 H new ATOM 488 N LYS A 34 11.836 -8.562 3.349 1.00 0.00 N ATOM 489 CA LYS A 34 12.387 -8.885 4.649 1.00 0.00 C ATOM 490 C LYS A 34 12.388 -7.647 5.534 1.00 0.00 C ATOM 491 O LYS A 34 12.659 -7.734 6.730 1.00 0.00 O ATOM 492 CB LYS A 34 13.803 -9.429 4.479 1.00 0.00 C ATOM 493 CG LYS A 34 13.814 -10.923 4.789 1.00 0.00 C ATOM 494 CD LYS A 34 15.058 -11.264 5.605 1.00 0.00 C ATOM 495 CE LYS A 34 15.301 -12.771 5.558 1.00 0.00 C ATOM 496 NZ LYS A 34 14.287 -13.494 6.340 1.00 0.00 N ATOM 0 H LYS A 34 12.530 -8.481 2.606 1.00 0.00 H new ATOM 0 HA LYS A 34 11.773 -9.647 5.128 1.00 0.00 H new ATOM 0 HB2 LYS A 34 14.151 -9.255 3.461 1.00 0.00 H new ATOM 0 HB3 LYS A 34 14.488 -8.904 5.144 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.916 -11.197 5.343 1.00 0.00 H new ATOM 0 HG3 LYS A 34 13.805 -11.498 3.863 1.00 0.00 H new ATOM 0 HD2 LYS A 34 15.923 -10.733 5.208 1.00 0.00 H new ATOM 0 HD3 LYS A 34 14.930 -10.938 6.637 1.00 0.00 H new ATOM 0 HE2 LYS A 34 15.280 -13.114 4.524 1.00 0.00 H new ATOM 0 HE3 LYS A 34 16.294 -12.995 5.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.485 -14.514 6.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 14.314 -13.169 7.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 13.345 -13.310 5.940 1.00 0.00 H new ATOM 510 N ASN A 35 12.084 -6.490 4.942 1.00 0.00 N ATOM 511 CA ASN A 35 12.050 -5.242 5.678 1.00 0.00 C ATOM 512 C ASN A 35 13.454 -4.870 6.132 1.00 0.00 C ATOM 513 O ASN A 35 13.848 -3.708 6.056 1.00 0.00 O ATOM 514 CB ASN A 35 11.115 -5.385 6.876 1.00 0.00 C ATOM 515 CG ASN A 35 9.917 -4.456 6.743 1.00 0.00 C ATOM 516 OD1 ASN A 35 10.047 -3.244 6.899 1.00 0.00 O ATOM 517 ND2 ASN A 35 8.746 -5.028 6.450 1.00 0.00 N ATOM 0 H ASN A 35 11.858 -6.400 3.951 1.00 0.00 H new ATOM 0 HA ASN A 35 11.676 -4.446 5.034 1.00 0.00 H new ATOM 0 HB2 ASN A 35 10.773 -6.417 6.955 1.00 0.00 H new ATOM 0 HB3 ASN A 35 11.656 -5.158 7.794 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.910 -4.454 6.346 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.688 -6.039 6.330 1.00 0.00 H new ATOM 524 N ASN A 36 14.211 -5.862 6.607 1.00 0.00 N ATOM 525 CA ASN A 36 15.565 -5.636 7.069 1.00 0.00 C ATOM 526 C ASN A 36 16.514 -5.562 5.881 1.00 0.00 C ATOM 527 O ASN A 36 17.717 -5.764 6.028 1.00 0.00 O ATOM 528 CB ASN A 36 15.973 -6.761 8.016 1.00 0.00 C ATOM 529 CG ASN A 36 16.707 -6.208 9.230 1.00 0.00 C ATOM 530 OD1 ASN A 36 16.081 -5.842 10.222 1.00 0.00 O ATOM 531 ND2 ASN A 36 18.038 -6.151 9.150 1.00 0.00 N ATOM 0 H ASN A 36 13.899 -6.831 6.678 1.00 0.00 H new ATOM 0 HA ASN A 36 15.614 -4.689 7.606 1.00 0.00 H new ATOM 0 HB2 ASN A 36 15.088 -7.309 8.339 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.613 -7.470 7.491 1.00 0.00 H new ATOM 0 HD21 ASN A 36 18.581 -5.791 9.935 1.00 0.00 H new ATOM 0 HD22 ASN A 36 18.512 -6.467 8.304 1.00 0.00 H new ATOM 538 N GLU A 37 15.966 -5.272 4.698 1.00 0.00 N ATOM 539 CA GLU A 37 16.765 -5.173 3.493 1.00 0.00 C ATOM 540 C GLU A 37 16.427 -3.887 2.750 1.00 0.00 C ATOM 541 O GLU A 37 15.267 -3.637 2.431 1.00 0.00 O ATOM 542 CB GLU A 37 16.506 -6.391 2.611 1.00 0.00 C ATOM 543 CG GLU A 37 17.511 -7.488 2.950 1.00 0.00 C ATOM 544 CD GLU A 37 16.859 -8.583 3.782 1.00 0.00 C ATOM 545 OE1 GLU A 37 16.805 -8.401 5.017 1.00 0.00 O ATOM 546 OE2 GLU A 37 16.426 -9.581 3.167 1.00 0.00 O ATOM 0 H GLU A 37 14.970 -5.103 4.558 1.00 0.00 H new ATOM 0 HA GLU A 37 17.823 -5.148 3.756 1.00 0.00 H new ATOM 0 HB2 GLU A 37 15.490 -6.754 2.764 1.00 0.00 H new ATOM 0 HB3 GLU A 37 16.592 -6.117 1.560 1.00 0.00 H new ATOM 0 HG2 GLU A 37 17.914 -7.915 2.031 1.00 0.00 H new ATOM 0 HG3 GLU A 37 18.351 -7.061 3.498 1.00 0.00 H new ATOM 553 N VAL A 38 17.447 -3.072 2.475 1.00 0.00 N ATOM 554 CA VAL A 38 17.257 -1.818 1.772 1.00 0.00 C ATOM 555 C VAL A 38 17.994 -1.857 0.442 1.00 0.00 C ATOM 556 O VAL A 38 18.778 -2.770 0.191 1.00 0.00 O ATOM 557 CB VAL A 38 17.762 -0.668 2.639 1.00 0.00 C ATOM 558 CG1 VAL A 38 16.982 0.600 2.307 1.00 0.00 C ATOM 559 CG2 VAL A 38 17.565 -1.016 4.111 1.00 0.00 C ATOM 0 H VAL A 38 18.415 -3.266 2.733 1.00 0.00 H new ATOM 0 HA VAL A 38 16.197 -1.665 1.572 1.00 0.00 H new ATOM 0 HB VAL A 38 18.822 -0.504 2.443 1.00 0.00 H new ATOM 0 HG11 VAL A 38 17.342 1.422 2.926 1.00 0.00 H new ATOM 0 HG12 VAL A 38 17.123 0.849 1.255 1.00 0.00 H new ATOM 0 HG13 VAL A 38 15.922 0.437 2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 38 17.926 -0.195 4.730 1.00 0.00 H new ATOM 0 HG22 VAL A 38 16.506 -1.181 4.307 1.00 0.00 H new ATOM 0 HG23 VAL A 38 18.123 -1.922 4.349 1.00 0.00 H new ATOM 569 N CYS A 39 17.742 -0.862 -0.411 1.00 0.00 N ATOM 570 CA CYS A 39 18.381 -0.786 -1.709 1.00 0.00 C ATOM 571 C CYS A 39 19.688 -0.013 -1.596 1.00 0.00 C ATOM 572 O CYS A 39 19.700 1.122 -1.124 1.00 0.00 O ATOM 573 CB CYS A 39 17.438 -0.112 -2.702 1.00 0.00 C ATOM 574 SG CYS A 39 15.781 -0.837 -2.750 1.00 0.00 S ATOM 0 H CYS A 39 17.095 -0.098 -0.217 1.00 0.00 H new ATOM 0 HA CYS A 39 18.606 -1.791 -2.067 1.00 0.00 H new ATOM 0 HB2 CYS A 39 17.354 0.945 -2.448 1.00 0.00 H new ATOM 0 HB3 CYS A 39 17.876 -0.167 -3.698 1.00 0.00 H new ATOM 579 N ALA A 40 20.789 -0.631 -2.029 1.00 0.00 N ATOM 580 CA ALA A 40 22.092 0.000 -1.972 1.00 0.00 C ATOM 581 C ALA A 40 22.833 -0.230 -3.282 1.00 0.00 C ATOM 582 O ALA A 40 22.970 -1.367 -3.728 1.00 0.00 O ATOM 583 CB ALA A 40 22.880 -0.569 -0.797 1.00 0.00 C ATOM 0 H ALA A 40 20.795 -1.572 -2.423 1.00 0.00 H new ATOM 0 HA ALA A 40 21.975 1.074 -1.827 1.00 0.00 H new ATOM 0 HB1 ALA A 40 23.861 -0.095 -0.753 1.00 0.00 H new ATOM 0 HB2 ALA A 40 22.341 -0.375 0.130 1.00 0.00 H new ATOM 0 HB3 ALA A 40 23.002 -1.644 -0.927 1.00 0.00 H new ATOM 589 N ALA A 41 23.313 0.854 -3.896 1.00 0.00 N ATOM 590 CA ALA A 41 24.035 0.766 -5.150 1.00 0.00 C ATOM 591 C ALA A 41 25.322 1.572 -5.059 1.00 0.00 C ATOM 592 O ALA A 41 25.290 2.767 -4.773 1.00 0.00 O ATOM 593 CB ALA A 41 23.152 1.282 -6.282 1.00 0.00 C ATOM 0 H ALA A 41 23.210 1.803 -3.537 1.00 0.00 H new ATOM 0 HA ALA A 41 24.293 -0.273 -5.355 1.00 0.00 H new ATOM 0 HB1 ALA A 41 23.694 1.216 -7.225 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.246 0.678 -6.341 1.00 0.00 H new ATOM 0 HB3 ALA A 41 22.884 2.321 -6.090 1.00 0.00 H new ATOM 599 N VAL A 42 26.458 0.914 -5.306 1.00 0.00 N ATOM 600 CA VAL A 42 27.748 1.571 -5.252 1.00 0.00 C ATOM 601 C VAL A 42 28.392 1.556 -6.631 1.00 0.00 C ATOM 602 O VAL A 42 28.608 0.492 -7.207 1.00 0.00 O ATOM 603 CB VAL A 42 28.636 0.862 -4.233 1.00 0.00 C ATOM 604 CG1 VAL A 42 28.180 -0.587 -4.082 1.00 0.00 C ATOM 605 CG2 VAL A 42 30.085 0.891 -4.714 1.00 0.00 C ATOM 0 H VAL A 42 26.501 -0.077 -5.545 1.00 0.00 H new ATOM 0 HA VAL A 42 27.620 2.609 -4.944 1.00 0.00 H new ATOM 0 HB VAL A 42 28.562 1.369 -3.271 1.00 0.00 H new ATOM 0 HG11 VAL A 42 28.814 -1.094 -3.354 1.00 0.00 H new ATOM 0 HG12 VAL A 42 27.145 -0.609 -3.740 1.00 0.00 H new ATOM 0 HG13 VAL A 42 28.255 -1.094 -5.044 1.00 0.00 H new ATOM 0 HG21 VAL A 42 30.720 0.385 -3.987 1.00 0.00 H new ATOM 0 HG22 VAL A 42 30.159 0.384 -5.676 1.00 0.00 H new ATOM 0 HG23 VAL A 42 30.412 1.925 -4.823 1.00 0.00 H new ATOM 615 N TRP A 43 28.699 2.742 -7.161 1.00 0.00 N ATOM 616 CA TRP A 43 29.315 2.855 -8.467 1.00 0.00 C ATOM 617 C TRP A 43 30.777 3.255 -8.317 1.00 0.00 C ATOM 618 O TRP A 43 31.081 4.322 -7.786 1.00 0.00 O ATOM 619 CB TRP A 43 28.556 3.884 -9.300 1.00 0.00 C ATOM 620 CG TRP A 43 29.212 4.256 -10.591 1.00 0.00 C ATOM 621 CD1 TRP A 43 28.921 3.723 -11.798 1.00 0.00 C ATOM 622 CD2 TRP A 43 30.268 5.236 -10.833 1.00 0.00 C ATOM 623 NE1 TRP A 43 29.719 4.301 -12.763 1.00 0.00 N ATOM 624 CE2 TRP A 43 30.570 5.242 -12.221 1.00 0.00 C ATOM 625 CE3 TRP A 43 31.001 6.119 -10.022 1.00 0.00 C ATOM 626 CZ2 TRP A 43 31.545 6.077 -12.775 1.00 0.00 C ATOM 627 CZ3 TRP A 43 31.981 6.961 -10.566 1.00 0.00 C ATOM 628 CH2 TRP A 43 32.255 6.943 -11.939 1.00 0.00 C ATOM 0 H TRP A 43 28.527 3.634 -6.698 1.00 0.00 H new ATOM 0 HA TRP A 43 29.273 1.892 -8.976 1.00 0.00 H new ATOM 0 HB2 TRP A 43 27.561 3.494 -9.514 1.00 0.00 H new ATOM 0 HB3 TRP A 43 28.423 4.786 -8.703 1.00 0.00 H new ATOM 0 HD1 TRP A 43 28.177 2.961 -11.979 1.00 0.00 H new ATOM 0 HE1 TRP A 43 29.684 4.062 -13.754 1.00 0.00 H new ATOM 0 HE3 TRP A 43 30.806 6.150 -8.960 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 31.747 6.053 -13.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 32.530 7.630 -9.920 1.00 0.00 H new ATOM 0 HH2 TRP A 43 33.011 7.595 -12.350 1.00 0.00 H new ATOM 639 N ARG A 44 31.682 2.395 -8.789 1.00 0.00 N ATOM 640 CA ARG A 44 33.104 2.659 -8.704 1.00 0.00 C ATOM 641 C ARG A 44 33.672 2.874 -10.100 1.00 0.00 C ATOM 642 O ARG A 44 33.159 2.325 -11.072 1.00 0.00 O ATOM 643 CB ARG A 44 33.798 1.489 -8.012 1.00 0.00 C ATOM 644 CG ARG A 44 32.757 0.624 -7.308 1.00 0.00 C ATOM 645 CD ARG A 44 33.444 -0.576 -6.663 1.00 0.00 C ATOM 646 NE ARG A 44 34.315 -1.260 -7.619 1.00 0.00 N ATOM 647 CZ ARG A 44 34.645 -2.553 -7.504 1.00 0.00 C ATOM 648 NH1 ARG A 44 34.172 -3.277 -6.480 1.00 0.00 N ATOM 649 NH2 ARG A 44 35.449 -3.123 -8.412 1.00 0.00 N ATOM 0 H ARG A 44 31.445 1.508 -9.234 1.00 0.00 H new ATOM 0 HA ARG A 44 33.276 3.563 -8.120 1.00 0.00 H new ATOM 0 HB2 ARG A 44 34.347 0.894 -8.742 1.00 0.00 H new ATOM 0 HB3 ARG A 44 34.526 1.859 -7.291 1.00 0.00 H new ATOM 0 HG2 ARG A 44 32.235 1.209 -6.550 1.00 0.00 H new ATOM 0 HG3 ARG A 44 32.006 0.286 -8.022 1.00 0.00 H new ATOM 0 HD2 ARG A 44 34.029 -0.246 -5.805 1.00 0.00 H new ATOM 0 HD3 ARG A 44 32.693 -1.271 -6.289 1.00 0.00 H new ATOM 0 HE ARG A 44 34.687 -0.729 -8.407 1.00 0.00 H new ATOM 0 HH11 ARG A 44 33.561 -2.843 -5.788 1.00 0.00 H new ATOM 0 HH12 ARG A 44 34.423 -4.262 -6.393 1.00 0.00 H new ATOM 0 HH21 ARG A 44 35.810 -2.572 -9.191 1.00 0.00 H new ATOM 0 HH22 ARG A 44 35.700 -4.108 -8.324 1.00 0.00 H new ATOM 663 N ARG A 45 34.736 3.675 -10.197 1.00 0.00 N ATOM 664 CA ARG A 45 35.367 3.957 -11.469 1.00 0.00 C ATOM 665 C ARG A 45 36.878 4.010 -11.296 1.00 0.00 C ATOM 666 O ARG A 45 37.405 4.945 -10.698 1.00 0.00 O ATOM 667 CB ARG A 45 34.840 5.282 -12.015 1.00 0.00 C ATOM 668 CG ARG A 45 35.187 6.406 -11.042 1.00 0.00 C ATOM 669 CD ARG A 45 36.287 7.277 -11.643 1.00 0.00 C ATOM 670 NE ARG A 45 35.816 8.646 -11.855 1.00 0.00 N ATOM 671 CZ ARG A 45 36.424 9.713 -11.320 1.00 0.00 C ATOM 672 NH1 ARG A 45 37.513 9.550 -10.556 1.00 0.00 N ATOM 673 NH2 ARG A 45 35.945 10.943 -11.549 1.00 0.00 N ATOM 0 H ARG A 45 35.173 4.137 -9.400 1.00 0.00 H new ATOM 0 HA ARG A 45 35.130 3.165 -12.179 1.00 0.00 H new ATOM 0 HB2 ARG A 45 35.277 5.485 -12.993 1.00 0.00 H new ATOM 0 HB3 ARG A 45 33.760 5.227 -12.154 1.00 0.00 H new ATOM 0 HG2 ARG A 45 34.303 7.009 -10.836 1.00 0.00 H new ATOM 0 HG3 ARG A 45 35.517 5.989 -10.091 1.00 0.00 H new ATOM 0 HD2 ARG A 45 37.152 7.285 -10.980 1.00 0.00 H new ATOM 0 HD3 ARG A 45 36.616 6.851 -12.591 1.00 0.00 H new ATOM 0 HE ARG A 45 34.990 8.794 -12.435 1.00 0.00 H new ATOM 0 HH11 ARG A 45 37.879 8.614 -10.382 1.00 0.00 H new ATOM 0 HH12 ARG A 45 37.976 10.362 -10.148 1.00 0.00 H new ATOM 0 HH21 ARG A 45 35.117 11.068 -12.131 1.00 0.00 H new ATOM 0 HH22 ARG A 45 36.409 11.755 -11.141 1.00 0.00 H new ATOM 687 N ASN A 46 37.576 3.001 -11.822 1.00 0.00 N ATOM 688 CA ASN A 46 39.020 2.938 -11.723 1.00 0.00 C ATOM 689 C ASN A 46 39.646 3.199 -13.085 1.00 0.00 C ATOM 690 O ASN A 46 39.387 2.470 -14.041 1.00 0.00 O ATOM 691 CB ASN A 46 39.434 1.570 -11.191 1.00 0.00 C ATOM 692 CG ASN A 46 38.838 0.455 -12.040 1.00 0.00 C ATOM 693 OD1 ASN A 46 37.801 -0.104 -11.692 1.00 0.00 O ATOM 694 ND2 ASN A 46 39.497 0.134 -13.155 1.00 0.00 N ATOM 0 H ASN A 46 37.154 2.218 -12.321 1.00 0.00 H new ATOM 0 HA ASN A 46 39.373 3.704 -11.032 1.00 0.00 H new ATOM 0 HB2 ASN A 46 40.521 1.490 -11.189 1.00 0.00 H new ATOM 0 HB3 ASN A 46 39.104 1.462 -10.158 1.00 0.00 H new ATOM 0 HD21 ASN A 46 39.143 -0.606 -13.762 1.00 0.00 H new ATOM 0 HD22 ASN A 46 40.355 0.628 -13.401 1.00 0.00 H new ATOM 701 N ASP A 47 40.473 4.243 -13.173 1.00 0.00 N ATOM 702 CA ASP A 47 41.131 4.596 -14.415 1.00 0.00 C ATOM 703 C ASP A 47 40.113 4.625 -15.546 1.00 0.00 C ATOM 704 O ASP A 47 39.372 5.594 -15.693 1.00 0.00 O ATOM 705 CB ASP A 47 42.237 3.585 -14.708 1.00 0.00 C ATOM 706 CG ASP A 47 43.610 4.215 -14.527 1.00 0.00 C ATOM 707 OD1 ASP A 47 43.963 4.482 -13.358 1.00 0.00 O ATOM 708 OD2 ASP A 47 44.283 4.418 -15.562 1.00 0.00 O ATOM 0 H ASP A 47 40.698 4.856 -12.390 1.00 0.00 H new ATOM 0 HA ASP A 47 41.576 5.587 -14.328 1.00 0.00 H new ATOM 0 HB2 ASP A 47 42.136 2.727 -14.044 1.00 0.00 H new ATOM 0 HB3 ASP A 47 42.135 3.213 -15.727 1.00 0.00 H new ATOM 713 N GLU A 48 40.077 3.558 -16.348 1.00 0.00 N ATOM 714 CA GLU A 48 39.151 3.470 -17.458 1.00 0.00 C ATOM 715 C GLU A 48 38.188 2.311 -17.241 1.00 0.00 C ATOM 716 O GLU A 48 37.476 1.910 -18.159 1.00 0.00 O ATOM 717 CB GLU A 48 39.931 3.289 -18.757 1.00 0.00 C ATOM 718 CG GLU A 48 40.629 1.932 -18.747 1.00 0.00 C ATOM 719 CD GLU A 48 41.593 1.808 -19.918 1.00 0.00 C ATOM 720 OE1 GLU A 48 42.750 2.251 -19.750 1.00 0.00 O ATOM 721 OE2 GLU A 48 41.155 1.273 -20.959 1.00 0.00 O ATOM 0 H GLU A 48 40.684 2.745 -16.241 1.00 0.00 H new ATOM 0 HA GLU A 48 38.569 4.390 -17.523 1.00 0.00 H new ATOM 0 HB2 GLU A 48 39.257 3.357 -19.611 1.00 0.00 H new ATOM 0 HB3 GLU A 48 40.666 4.087 -18.867 1.00 0.00 H new ATOM 0 HG2 GLU A 48 41.171 1.804 -17.810 1.00 0.00 H new ATOM 0 HG3 GLU A 48 39.886 1.136 -18.797 1.00 0.00 H new ATOM 728 N ASN A 49 38.168 1.772 -16.019 1.00 0.00 N ATOM 729 CA ASN A 49 37.295 0.665 -15.688 1.00 0.00 C ATOM 730 C ASN A 49 36.328 1.078 -14.587 1.00 0.00 C ATOM 731 O ASN A 49 36.744 1.357 -13.464 1.00 0.00 O ATOM 732 CB ASN A 49 38.136 -0.531 -15.249 1.00 0.00 C ATOM 733 CG ASN A 49 37.906 -1.724 -16.165 1.00 0.00 C ATOM 734 OD1 ASN A 49 36.764 -2.072 -16.458 1.00 0.00 O ATOM 735 ND2 ASN A 49 38.994 -2.348 -16.621 1.00 0.00 N ATOM 0 H ASN A 49 38.752 2.092 -15.247 1.00 0.00 H new ATOM 0 HA ASN A 49 36.713 0.382 -16.565 1.00 0.00 H new ATOM 0 HB2 ASN A 49 39.192 -0.260 -15.257 1.00 0.00 H new ATOM 0 HB3 ASN A 49 37.884 -0.801 -14.224 1.00 0.00 H new ATOM 0 HD21 ASN A 49 38.898 -3.152 -17.242 1.00 0.00 H new ATOM 0 HD22 ASN A 49 39.921 -2.021 -16.349 1.00 0.00 H new ATOM 742 N VAL A 50 35.034 1.115 -14.913 1.00 0.00 N ATOM 743 CA VAL A 50 34.015 1.493 -13.955 1.00 0.00 C ATOM 744 C VAL A 50 33.095 0.310 -13.690 1.00 0.00 C ATOM 745 O VAL A 50 32.553 -0.279 -14.622 1.00 0.00 O ATOM 746 CB VAL A 50 33.226 2.682 -14.494 1.00 0.00 C ATOM 747 CG1 VAL A 50 32.206 3.131 -13.452 1.00 0.00 C ATOM 748 CG2 VAL A 50 34.183 3.832 -14.796 1.00 0.00 C ATOM 0 H VAL A 50 34.675 0.885 -15.840 1.00 0.00 H new ATOM 0 HA VAL A 50 34.483 1.783 -13.014 1.00 0.00 H new ATOM 0 HB VAL A 50 32.708 2.390 -15.407 1.00 0.00 H new ATOM 0 HG11 VAL A 50 31.642 3.981 -13.837 1.00 0.00 H new ATOM 0 HG12 VAL A 50 31.522 2.310 -13.235 1.00 0.00 H new ATOM 0 HG13 VAL A 50 32.724 3.423 -12.538 1.00 0.00 H new ATOM 0 HG21 VAL A 50 33.620 4.682 -15.181 1.00 0.00 H new ATOM 0 HG22 VAL A 50 34.701 4.124 -13.882 1.00 0.00 H new ATOM 0 HG23 VAL A 50 34.912 3.512 -15.540 1.00 0.00 H new ATOM 758 N THR A 51 32.919 -0.038 -12.413 1.00 0.00 N ATOM 759 CA THR A 51 32.066 -1.146 -12.036 1.00 0.00 C ATOM 760 C THR A 51 30.869 -0.634 -11.247 1.00 0.00 C ATOM 761 O THR A 51 31.014 0.222 -10.377 1.00 0.00 O ATOM 762 CB THR A 51 32.868 -2.147 -11.211 1.00 0.00 C ATOM 763 OG1 THR A 51 32.851 -1.761 -9.855 1.00 0.00 O ATOM 764 CG2 THR A 51 34.310 -2.180 -11.712 1.00 0.00 C ATOM 0 H THR A 51 33.361 0.439 -11.627 1.00 0.00 H new ATOM 0 HA THR A 51 31.697 -1.645 -12.932 1.00 0.00 H new ATOM 0 HB THR A 51 32.425 -3.138 -11.312 1.00 0.00 H new ATOM 0 HG1 THR A 51 32.990 -0.793 -9.789 1.00 0.00 H new ATOM 0 HG21 THR A 51 34.884 -2.895 -11.123 1.00 0.00 H new ATOM 0 HG22 THR A 51 34.324 -2.479 -12.760 1.00 0.00 H new ATOM 0 HG23 THR A 51 34.753 -1.189 -11.611 1.00 0.00 H new ATOM 772 N LEU A 52 29.682 -1.163 -11.553 1.00 0.00 N ATOM 773 CA LEU A 52 28.466 -0.761 -10.874 1.00 0.00 C ATOM 774 C LEU A 52 27.872 -1.950 -10.133 1.00 0.00 C ATOM 775 O LEU A 52 27.496 -2.945 -10.749 1.00 0.00 O ATOM 776 CB LEU A 52 27.475 -0.207 -11.893 1.00 0.00 C ATOM 777 CG LEU A 52 26.108 -0.045 -11.235 1.00 0.00 C ATOM 778 CD1 LEU A 52 25.397 -1.395 -11.199 1.00 0.00 C ATOM 779 CD2 LEU A 52 26.286 0.474 -9.812 1.00 0.00 C ATOM 0 H LEU A 52 29.546 -1.874 -12.272 1.00 0.00 H new ATOM 0 HA LEU A 52 28.691 0.018 -10.146 1.00 0.00 H new ATOM 0 HB2 LEU A 52 27.825 0.753 -12.272 1.00 0.00 H new ATOM 0 HB3 LEU A 52 27.402 -0.879 -12.748 1.00 0.00 H new ATOM 0 HG LEU A 52 25.511 0.665 -11.808 1.00 0.00 H new ATOM 0 HD11 LEU A 52 24.420 -1.279 -10.729 1.00 0.00 H new ATOM 0 HD12 LEU A 52 25.269 -1.766 -12.216 1.00 0.00 H new ATOM 0 HD13 LEU A 52 25.993 -2.105 -10.626 1.00 0.00 H new ATOM 0 HD21 LEU A 52 25.309 0.590 -9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 52 26.883 -0.235 -9.238 1.00 0.00 H new ATOM 0 HD23 LEU A 52 26.793 1.439 -9.837 1.00 0.00 H new ATOM 791 N GLU A 53 27.785 -1.844 -8.805 1.00 0.00 N ATOM 792 CA GLU A 53 27.235 -2.908 -7.990 1.00 0.00 C ATOM 793 C GLU A 53 25.863 -2.506 -7.466 1.00 0.00 C ATOM 794 O GLU A 53 25.716 -1.463 -6.834 1.00 0.00 O ATOM 795 CB GLU A 53 28.187 -3.207 -6.836 1.00 0.00 C ATOM 796 CG GLU A 53 28.226 -4.711 -6.585 1.00 0.00 C ATOM 797 CD GLU A 53 27.327 -5.091 -5.417 1.00 0.00 C ATOM 798 OE1 GLU A 53 27.225 -4.263 -4.487 1.00 0.00 O ATOM 799 OE2 GLU A 53 26.760 -6.203 -5.477 1.00 0.00 O ATOM 0 H GLU A 53 28.092 -1.026 -8.278 1.00 0.00 H new ATOM 0 HA GLU A 53 27.120 -3.808 -8.594 1.00 0.00 H new ATOM 0 HB2 GLU A 53 29.186 -2.841 -7.071 1.00 0.00 H new ATOM 0 HB3 GLU A 53 27.860 -2.686 -5.936 1.00 0.00 H new ATOM 0 HG2 GLU A 53 27.907 -5.242 -7.482 1.00 0.00 H new ATOM 0 HG3 GLU A 53 29.250 -5.023 -6.377 1.00 0.00 H new ATOM 806 N THR A 54 24.855 -3.340 -7.732 1.00 0.00 N ATOM 807 CA THR A 54 23.505 -3.068 -7.284 1.00 0.00 C ATOM 808 C THR A 54 22.973 -4.250 -6.486 1.00 0.00 C ATOM 809 O THR A 54 22.994 -5.384 -6.961 1.00 0.00 O ATOM 810 CB THR A 54 22.616 -2.789 -8.495 1.00 0.00 C ATOM 811 OG1 THR A 54 23.425 -2.522 -9.618 1.00 0.00 O ATOM 812 CG2 THR A 54 21.729 -1.581 -8.207 1.00 0.00 C ATOM 0 H THR A 54 24.958 -4.208 -8.257 1.00 0.00 H new ATOM 0 HA THR A 54 23.504 -2.191 -6.636 1.00 0.00 H new ATOM 0 HB THR A 54 21.990 -3.659 -8.696 1.00 0.00 H new ATOM 0 HG1 THR A 54 23.551 -3.346 -10.133 1.00 0.00 H new ATOM 0 HG21 THR A 54 21.095 -1.381 -9.071 1.00 0.00 H new ATOM 0 HG22 THR A 54 21.104 -1.787 -7.338 1.00 0.00 H new ATOM 0 HG23 THR A 54 22.354 -0.710 -8.007 1.00 0.00 H new ATOM 820 N ILE A 55 22.495 -3.981 -5.269 1.00 0.00 N ATOM 821 CA ILE A 55 21.959 -5.018 -4.410 1.00 0.00 C ATOM 822 C ILE A 55 21.179 -4.386 -3.266 1.00 0.00 C ATOM 823 O ILE A 55 21.327 -3.196 -2.995 1.00 0.00 O ATOM 824 CB ILE A 55 23.102 -5.878 -3.878 1.00 0.00 C ATOM 825 CG1 ILE A 55 24.333 -5.005 -3.650 1.00 0.00 C ATOM 826 CG2 ILE A 55 23.432 -6.969 -4.892 1.00 0.00 C ATOM 827 CD1 ILE A 55 24.980 -5.377 -2.320 1.00 0.00 C ATOM 0 H ILE A 55 22.472 -3.046 -4.862 1.00 0.00 H new ATOM 0 HA ILE A 55 21.280 -5.653 -4.979 1.00 0.00 H new ATOM 0 HB ILE A 55 22.803 -6.337 -2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 55 25.045 -5.142 -4.464 1.00 0.00 H new ATOM 0 HG13 ILE A 55 24.050 -3.952 -3.647 1.00 0.00 H new ATOM 0 HG21 ILE A 55 24.248 -7.584 -4.513 1.00 0.00 H new ATOM 0 HG22 ILE A 55 22.553 -7.593 -5.054 1.00 0.00 H new ATOM 0 HG23 ILE A 55 23.731 -6.511 -5.835 1.00 0.00 H new ATOM 0 HD11 ILE A 55 25.859 -4.754 -2.156 1.00 0.00 H new ATOM 0 HD12 ILE A 55 24.267 -5.218 -1.511 1.00 0.00 H new ATOM 0 HD13 ILE A 55 25.277 -6.426 -2.341 1.00 0.00 H new ATOM 839 N CYS A 56 20.349 -5.185 -2.593 1.00 0.00 N ATOM 840 CA CYS A 56 19.552 -4.702 -1.483 1.00 0.00 C ATOM 841 C CYS A 56 20.323 -4.877 -0.182 1.00 0.00 C ATOM 842 O CYS A 56 20.110 -5.846 0.544 1.00 0.00 O ATOM 843 CB CYS A 56 18.231 -5.465 -1.437 1.00 0.00 C ATOM 844 SG CYS A 56 16.831 -4.475 -0.854 1.00 0.00 S ATOM 0 H CYS A 56 20.217 -6.174 -2.805 1.00 0.00 H new ATOM 0 HA CYS A 56 19.339 -3.641 -1.616 1.00 0.00 H new ATOM 0 HB2 CYS A 56 18.006 -5.842 -2.434 1.00 0.00 H new ATOM 0 HB3 CYS A 56 18.346 -6.332 -0.787 1.00 0.00 H new ATOM 849 N HIS A 57 21.220 -3.934 0.113 1.00 0.00 N ATOM 850 CA HIS A 57 22.017 -3.991 1.323 1.00 0.00 C ATOM 851 C HIS A 57 21.551 -2.923 2.302 1.00 0.00 C ATOM 852 O HIS A 57 21.178 -1.825 1.898 1.00 0.00 O ATOM 853 CB HIS A 57 23.489 -3.798 0.971 1.00 0.00 C ATOM 854 CG HIS A 57 24.329 -3.445 2.167 1.00 0.00 C ATOM 855 ND1 HIS A 57 24.984 -4.333 2.990 1.00 0.00 N ATOM 856 CD2 HIS A 57 24.581 -2.182 2.632 1.00 0.00 C ATOM 857 CE1 HIS A 57 25.616 -3.613 3.933 1.00 0.00 C ATOM 858 NE2 HIS A 57 25.401 -2.298 3.758 1.00 0.00 N ATOM 0 H HIS A 57 21.407 -3.123 -0.476 1.00 0.00 H new ATOM 0 HA HIS A 57 21.895 -4.965 1.797 1.00 0.00 H new ATOM 0 HB2 HIS A 57 23.873 -4.712 0.519 1.00 0.00 H new ATOM 0 HB3 HIS A 57 23.579 -3.010 0.223 1.00 0.00 H new ATOM 0 HD2 HIS A 57 24.212 -1.261 2.205 1.00 0.00 H new ATOM 0 HE1 HIS A 57 26.216 -4.035 4.725 1.00 0.00 H new ATOM 0 HE2 HIS A 57 25.764 -1.537 4.332 1.00 0.00 H new ATOM 866 N ASP A 58 21.574 -3.250 3.597 1.00 0.00 N ATOM 867 CA ASP A 58 21.156 -2.321 4.627 1.00 0.00 C ATOM 868 C ASP A 58 22.237 -1.272 4.845 1.00 0.00 C ATOM 869 O ASP A 58 23.415 -1.604 4.946 1.00 0.00 O ATOM 870 CB ASP A 58 20.877 -3.085 5.918 1.00 0.00 C ATOM 871 CG ASP A 58 19.399 -3.428 6.038 1.00 0.00 C ATOM 872 OD1 ASP A 58 18.772 -3.621 4.973 1.00 0.00 O ATOM 873 OD2 ASP A 58 18.923 -3.492 7.192 1.00 0.00 O ATOM 0 H ASP A 58 21.880 -4.157 3.949 1.00 0.00 H new ATOM 0 HA ASP A 58 20.243 -1.814 4.315 1.00 0.00 H new ATOM 0 HB2 ASP A 58 21.469 -4.000 5.939 1.00 0.00 H new ATOM 0 HB3 ASP A 58 21.186 -2.485 6.774 1.00 0.00 H new ATOM 878 N PRO A 59 21.833 -0.001 4.916 1.00 0.00 N ATOM 879 CA PRO A 59 22.717 1.126 5.120 1.00 0.00 C ATOM 880 C PRO A 59 23.216 1.130 6.558 1.00 0.00 C ATOM 881 O PRO A 59 23.289 2.181 7.190 1.00 0.00 O ATOM 882 CB PRO A 59 21.856 2.355 4.836 1.00 0.00 C ATOM 883 CG PRO A 59 20.457 1.889 5.237 1.00 0.00 C ATOM 884 CD PRO A 59 20.454 0.426 4.801 1.00 0.00 C ATOM 0 HA PRO A 59 23.597 1.096 4.478 1.00 0.00 H new ATOM 0 HB2 PRO A 59 22.178 3.218 5.420 1.00 0.00 H new ATOM 0 HB3 PRO A 59 21.900 2.646 3.786 1.00 0.00 H new ATOM 0 HG2 PRO A 59 20.287 1.993 6.309 1.00 0.00 H new ATOM 0 HG3 PRO A 59 19.679 2.463 4.734 1.00 0.00 H new ATOM 0 HD2 PRO A 59 19.801 -0.174 5.435 1.00 0.00 H new ATOM 0 HD3 PRO A 59 20.092 0.319 3.779 1.00 0.00 H new ATOM 892 N GLN A 60 23.559 -0.052 7.075 1.00 0.00 N ATOM 893 CA GLN A 60 24.046 -0.179 8.434 1.00 0.00 C ATOM 894 C GLN A 60 25.564 -0.296 8.431 1.00 0.00 C ATOM 895 O GLN A 60 26.254 0.540 9.011 1.00 0.00 O ATOM 896 CB GLN A 60 23.412 -1.403 9.088 1.00 0.00 C ATOM 897 CG GLN A 60 23.449 -1.248 10.605 1.00 0.00 C ATOM 898 CD GLN A 60 22.104 -1.607 11.221 1.00 0.00 C ATOM 899 OE1 GLN A 60 21.114 -0.913 11.000 1.00 0.00 O ATOM 900 NE2 GLN A 60 22.071 -2.694 11.995 1.00 0.00 N ATOM 0 H GLN A 60 23.505 -0.933 6.564 1.00 0.00 H new ATOM 0 HA GLN A 60 23.771 0.707 9.006 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.382 -1.517 8.749 1.00 0.00 H new ATOM 0 HB3 GLN A 60 23.947 -2.305 8.791 1.00 0.00 H new ATOM 0 HG2 GLN A 60 24.227 -1.889 11.021 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.709 -0.222 10.863 1.00 0.00 H new ATOM 0 HE21 GLN A 60 22.921 -3.237 12.148 1.00 0.00 H new ATOM 0 HE22 GLN A 60 21.196 -2.981 12.434 1.00 0.00 H new ATOM 909 N LYS A 61 26.083 -1.335 7.772 1.00 0.00 N ATOM 910 CA LYS A 61 27.513 -1.553 7.698 1.00 0.00 C ATOM 911 C LYS A 61 28.100 -0.746 6.548 1.00 0.00 C ATOM 912 O LYS A 61 27.379 -0.337 5.641 1.00 0.00 O ATOM 913 CB LYS A 61 27.790 -3.042 7.508 1.00 0.00 C ATOM 914 CG LYS A 61 26.654 -3.853 8.125 1.00 0.00 C ATOM 915 CD LYS A 61 26.966 -5.341 8.006 1.00 0.00 C ATOM 916 CE LYS A 61 28.135 -5.691 8.922 1.00 0.00 C ATOM 917 NZ LYS A 61 27.791 -6.808 9.815 1.00 0.00 N ATOM 0 H LYS A 61 25.525 -2.035 7.284 1.00 0.00 H new ATOM 0 HA LYS A 61 27.983 -1.223 8.625 1.00 0.00 H new ATOM 0 HB2 LYS A 61 27.882 -3.273 6.447 1.00 0.00 H new ATOM 0 HB3 LYS A 61 28.738 -3.309 7.976 1.00 0.00 H new ATOM 0 HG2 LYS A 61 26.526 -3.580 9.173 1.00 0.00 H new ATOM 0 HG3 LYS A 61 25.715 -3.626 7.620 1.00 0.00 H new ATOM 0 HD2 LYS A 61 26.089 -5.930 8.276 1.00 0.00 H new ATOM 0 HD3 LYS A 61 27.212 -5.590 6.974 1.00 0.00 H new ATOM 0 HE2 LYS A 61 29.005 -5.956 8.321 1.00 0.00 H new ATOM 0 HE3 LYS A 61 28.411 -4.819 9.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 28.603 -7.026 10.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 26.975 -6.544 10.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 27.551 -7.645 9.247 1.00 0.00 H new ATOM 931 N ARG A 62 29.414 -0.517 6.591 1.00 0.00 N ATOM 932 CA ARG A 62 30.093 0.239 5.557 1.00 0.00 C ATOM 933 C ARG A 62 30.572 -0.701 4.460 1.00 0.00 C ATOM 934 O ARG A 62 31.251 -1.686 4.737 1.00 0.00 O ATOM 935 CB ARG A 62 31.268 0.996 6.170 1.00 0.00 C ATOM 936 CG ARG A 62 31.587 0.413 7.545 1.00 0.00 C ATOM 937 CD ARG A 62 30.479 0.789 8.526 1.00 0.00 C ATOM 938 NE ARG A 62 30.938 1.808 9.469 1.00 0.00 N ATOM 939 CZ ARG A 62 31.140 1.556 10.769 1.00 0.00 C ATOM 940 NH1 ARG A 62 30.923 0.325 11.255 1.00 0.00 N ATOM 941 NH2 ARG A 62 31.559 2.533 11.586 1.00 0.00 N ATOM 0 H ARG A 62 30.024 -0.849 7.338 1.00 0.00 H new ATOM 0 HA ARG A 62 29.403 0.959 5.116 1.00 0.00 H new ATOM 0 HB2 ARG A 62 32.140 0.923 5.521 1.00 0.00 H new ATOM 0 HB3 ARG A 62 31.025 2.055 6.259 1.00 0.00 H new ATOM 0 HG2 ARG A 62 31.678 -0.671 7.480 1.00 0.00 H new ATOM 0 HG3 ARG A 62 32.545 0.792 7.899 1.00 0.00 H new ATOM 0 HD2 ARG A 62 29.613 1.160 7.978 1.00 0.00 H new ATOM 0 HD3 ARG A 62 30.155 -0.097 9.072 1.00 0.00 H new ATOM 0 HE ARG A 62 31.112 2.751 9.122 1.00 0.00 H new ATOM 0 HH11 ARG A 62 30.604 -0.419 10.635 1.00 0.00 H new ATOM 0 HH12 ARG A 62 31.077 0.133 12.245 1.00 0.00 H new ATOM 0 HH21 ARG A 62 31.724 3.470 11.218 1.00 0.00 H new ATOM 0 HH22 ARG A 62 31.712 2.340 12.576 1.00 0.00 H new ATOM 955 N LEU A 63 30.215 -0.392 3.211 1.00 0.00 N ATOM 956 CA LEU A 63 30.609 -1.208 2.079 1.00 0.00 C ATOM 957 C LEU A 63 31.923 -0.696 1.506 1.00 0.00 C ATOM 958 O LEU A 63 32.112 0.510 1.361 1.00 0.00 O ATOM 959 CB LEU A 63 29.508 -1.176 1.023 1.00 0.00 C ATOM 960 CG LEU A 63 29.977 -1.926 -0.221 1.00 0.00 C ATOM 961 CD1 LEU A 63 29.574 -3.394 -0.112 1.00 0.00 C ATOM 962 CD2 LEU A 63 29.331 -1.310 -1.459 1.00 0.00 C ATOM 0 H LEU A 63 29.652 0.422 2.966 1.00 0.00 H new ATOM 0 HA LEU A 63 30.755 -2.239 2.401 1.00 0.00 H new ATOM 0 HB2 LEU A 63 28.599 -1.632 1.415 1.00 0.00 H new ATOM 0 HB3 LEU A 63 29.263 -0.145 0.769 1.00 0.00 H new ATOM 0 HG LEU A 63 31.061 -1.853 -0.303 1.00 0.00 H new ATOM 0 HD11 LEU A 63 29.909 -3.930 -1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 63 30.035 -3.833 0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 63 28.490 -3.469 -0.030 1.00 0.00 H new ATOM 0 HD21 LEU A 63 29.665 -1.845 -2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 63 28.246 -1.383 -1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 63 29.619 -0.262 -1.536 1.00 0.00 H new ATOM 974 N TYR A 64 32.831 -1.617 1.178 1.00 0.00 N ATOM 975 CA TYR A 64 34.120 -1.254 0.624 1.00 0.00 C ATOM 976 C TYR A 64 34.780 -0.199 1.500 1.00 0.00 C ATOM 977 O TYR A 64 35.583 0.598 1.021 1.00 0.00 O ATOM 978 CB TYR A 64 33.933 -0.735 -0.799 1.00 0.00 C ATOM 979 CG TYR A 64 33.336 -1.755 -1.739 1.00 0.00 C ATOM 980 CD1 TYR A 64 33.998 -2.967 -1.969 1.00 0.00 C ATOM 981 CD2 TYR A 64 32.119 -1.490 -2.378 1.00 0.00 C ATOM 982 CE1 TYR A 64 33.445 -3.912 -2.842 1.00 0.00 C ATOM 983 CE2 TYR A 64 31.565 -2.435 -3.250 1.00 0.00 C ATOM 984 CZ TYR A 64 32.228 -3.647 -3.481 1.00 0.00 C ATOM 985 OH TYR A 64 31.689 -4.568 -4.331 1.00 0.00 O ATOM 0 H TYR A 64 32.689 -2.621 1.290 1.00 0.00 H new ATOM 0 HA TYR A 64 34.767 -2.130 0.595 1.00 0.00 H new ATOM 0 HB2 TYR A 64 33.290 0.145 -0.775 1.00 0.00 H new ATOM 0 HB3 TYR A 64 34.898 -0.414 -1.190 1.00 0.00 H new ATOM 0 HD1 TYR A 64 34.935 -3.173 -1.473 1.00 0.00 H new ATOM 0 HD2 TYR A 64 31.607 -0.556 -2.198 1.00 0.00 H new ATOM 0 HE1 TYR A 64 33.957 -4.845 -3.022 1.00 0.00 H new ATOM 0 HE2 TYR A 64 30.627 -2.230 -3.744 1.00 0.00 H new ATOM 0 HH TYR A 64 30.843 -4.227 -4.689 1.00 0.00 H new ATOM 995 N GLY A 65 34.440 -0.195 2.791 1.00 0.00 N ATOM 996 CA GLY A 65 35.001 0.761 3.724 1.00 0.00 C ATOM 997 C GLY A 65 34.270 2.092 3.619 1.00 0.00 C ATOM 998 O GLY A 65 34.735 3.105 4.136 1.00 0.00 O ATOM 0 H GLY A 65 33.776 -0.849 3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 65 34.924 0.375 4.741 1.00 0.00 H new ATOM 0 HA3 GLY A 65 36.061 0.903 3.516 1.00 0.00 H new ATOM 1002 N HIS A 66 33.118 2.088 2.944 1.00 0.00 N ATOM 1003 CA HIS A 66 32.331 3.293 2.772 1.00 0.00 C ATOM 1004 C HIS A 66 31.015 3.166 3.529 1.00 0.00 C ATOM 1005 O HIS A 66 30.460 2.075 3.639 1.00 0.00 O ATOM 1006 CB HIS A 66 32.078 3.527 1.286 1.00 0.00 C ATOM 1007 CG HIS A 66 33.345 3.524 0.475 1.00 0.00 C ATOM 1008 ND1 HIS A 66 34.605 3.829 0.937 1.00 0.00 N ATOM 1009 CD2 HIS A 66 33.451 3.219 -0.855 1.00 0.00 C ATOM 1010 CE1 HIS A 66 35.451 3.707 -0.101 1.00 0.00 C ATOM 1011 NE2 HIS A 66 34.797 3.338 -1.214 1.00 0.00 N ATOM 0 H HIS A 66 32.716 1.257 2.510 1.00 0.00 H new ATOM 0 HA HIS A 66 32.877 4.147 3.174 1.00 0.00 H new ATOM 0 HB2 HIS A 66 31.408 2.754 0.909 1.00 0.00 H new ATOM 0 HB3 HIS A 66 31.569 4.482 1.154 1.00 0.00 H new ATOM 0 HD2 HIS A 66 32.640 2.937 -1.510 1.00 0.00 H new ATOM 0 HE1 HIS A 66 36.515 3.883 -0.047 1.00 0.00 H new ATOM 0 HE2 HIS A 66 35.201 3.177 -2.137 1.00 0.00 H new ATOM 1019 N MET A 67 30.517 4.288 4.053 1.00 0.00 N ATOM 1020 CA MET A 67 29.273 4.297 4.795 1.00 0.00 C ATOM 1021 C MET A 67 28.279 5.239 4.132 1.00 0.00 C ATOM 1022 O MET A 67 28.599 6.393 3.861 1.00 0.00 O ATOM 1023 CB MET A 67 29.545 4.727 6.235 1.00 0.00 C ATOM 1024 CG MET A 67 30.451 5.955 6.237 1.00 0.00 C ATOM 1025 SD MET A 67 31.068 6.410 7.876 1.00 0.00 S ATOM 1026 CE MET A 67 29.498 6.834 8.670 1.00 0.00 C ATOM 0 H MET A 67 30.965 5.201 3.972 1.00 0.00 H new ATOM 0 HA MET A 67 28.843 3.295 4.801 1.00 0.00 H new ATOM 0 HB2 MET A 67 28.607 4.953 6.742 1.00 0.00 H new ATOM 0 HB3 MET A 67 30.016 3.913 6.786 1.00 0.00 H new ATOM 0 HG2 MET A 67 31.300 5.769 5.579 1.00 0.00 H new ATOM 0 HG3 MET A 67 29.903 6.799 5.819 1.00 0.00 H new ATOM 0 HE1 MET A 67 29.693 7.324 9.624 1.00 0.00 H new ATOM 0 HE2 MET A 67 28.934 7.508 8.025 1.00 0.00 H new ATOM 0 HE3 MET A 67 28.919 5.926 8.840 1.00 0.00 H new ATOM 1036 N LEU A 68 27.068 4.740 3.870 1.00 0.00 N ATOM 1037 CA LEU A 68 26.033 5.536 3.241 1.00 0.00 C ATOM 1038 C LEU A 68 25.590 6.646 4.184 1.00 0.00 C ATOM 1039 O LEU A 68 25.708 6.515 5.399 1.00 0.00 O ATOM 1040 CB LEU A 68 24.855 4.637 2.873 1.00 0.00 C ATOM 1041 CG LEU A 68 25.376 3.352 2.236 1.00 0.00 C ATOM 1042 CD1 LEU A 68 24.424 2.203 2.557 1.00 0.00 C ATOM 1043 CD2 LEU A 68 25.465 3.534 0.724 1.00 0.00 C ATOM 0 H LEU A 68 26.788 3.784 4.088 1.00 0.00 H new ATOM 0 HA LEU A 68 26.423 5.994 2.332 1.00 0.00 H new ATOM 0 HB2 LEU A 68 24.270 4.403 3.763 1.00 0.00 H new ATOM 0 HB3 LEU A 68 24.190 5.155 2.181 1.00 0.00 H new ATOM 0 HG LEU A 68 26.365 3.124 2.632 1.00 0.00 H new ATOM 0 HD11 LEU A 68 24.796 1.285 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 68 24.361 2.073 3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 68 23.434 2.429 2.161 1.00 0.00 H new ATOM 0 HD21 LEU A 68 25.837 2.616 0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 68 24.476 3.762 0.326 1.00 0.00 H new ATOM 0 HD23 LEU A 68 26.146 4.354 0.496 1.00 0.00 H new ATOM 1055 N ASP A 69 25.078 7.741 3.617 1.00 0.00 N ATOM 1056 CA ASP A 69 24.621 8.867 4.407 1.00 0.00 C ATOM 1057 C ASP A 69 23.373 8.477 5.187 1.00 0.00 C ATOM 1058 O ASP A 69 23.297 8.703 6.393 1.00 0.00 O ATOM 1059 CB ASP A 69 24.336 10.050 3.487 1.00 0.00 C ATOM 1060 CG ASP A 69 24.218 11.343 4.283 1.00 0.00 C ATOM 1061 OD1 ASP A 69 25.151 11.612 5.070 1.00 0.00 O ATOM 1062 OD2 ASP A 69 23.197 12.037 4.089 1.00 0.00 O ATOM 0 H ASP A 69 24.973 7.864 2.610 1.00 0.00 H new ATOM 0 HA ASP A 69 25.395 9.155 5.119 1.00 0.00 H new ATOM 0 HB2 ASP A 69 25.134 10.143 2.751 1.00 0.00 H new ATOM 0 HB3 ASP A 69 23.413 9.872 2.935 1.00 0.00 H new ATOM 1067 N ASP A 70 22.395 7.889 4.496 1.00 0.00 N ATOM 1068 CA ASP A 70 21.158 7.474 5.126 1.00 0.00 C ATOM 1069 C ASP A 70 20.121 7.150 4.059 1.00 0.00 C ATOM 1070 O ASP A 70 19.634 8.045 3.372 1.00 0.00 O ATOM 1071 CB ASP A 70 20.658 8.583 6.046 1.00 0.00 C ATOM 1072 CG ASP A 70 20.787 8.175 7.507 1.00 0.00 C ATOM 1073 OD1 ASP A 70 20.153 7.161 7.871 1.00 0.00 O ATOM 1074 OD2 ASP A 70 21.516 8.886 8.232 1.00 0.00 O ATOM 0 H ASP A 70 22.444 7.692 3.496 1.00 0.00 H new ATOM 0 HA ASP A 70 21.332 6.578 5.722 1.00 0.00 H new ATOM 0 HB2 ASP A 70 21.228 9.495 5.867 1.00 0.00 H new ATOM 0 HB3 ASP A 70 19.616 8.809 5.818 1.00 0.00 H new ATOM 1079 N SER A 71 19.783 5.865 3.922 1.00 0.00 N ATOM 1080 CA SER A 71 18.807 5.433 2.943 1.00 0.00 C ATOM 1081 C SER A 71 17.441 6.005 3.288 1.00 0.00 C ATOM 1082 O SER A 71 16.455 5.719 2.611 1.00 0.00 O ATOM 1083 CB SER A 71 18.763 3.908 2.909 1.00 0.00 C ATOM 1084 OG SER A 71 17.850 3.443 3.878 1.00 0.00 O ATOM 0 H SER A 71 20.178 5.110 4.483 1.00 0.00 H new ATOM 0 HA SER A 71 19.091 5.797 1.956 1.00 0.00 H new ATOM 0 HB2 SER A 71 18.465 3.564 1.918 1.00 0.00 H new ATOM 0 HB3 SER A 71 19.755 3.500 3.103 1.00 0.00 H new ATOM 0 HG SER A 71 18.062 3.844 4.747 1.00 0.00 H new ATOM 1090 N SER A 72 17.382 6.817 4.346 1.00 0.00 N ATOM 1091 CA SER A 72 16.140 7.427 4.774 1.00 0.00 C ATOM 1092 C SER A 72 15.767 8.559 3.829 1.00 0.00 C ATOM 1093 O SER A 72 14.705 9.163 3.967 1.00 0.00 O ATOM 1094 CB SER A 72 16.292 7.942 6.203 1.00 0.00 C ATOM 1095 OG SER A 72 15.281 8.887 6.471 1.00 0.00 O ATOM 0 H SER A 72 18.189 7.063 4.919 1.00 0.00 H new ATOM 0 HA SER A 72 15.341 6.686 4.752 1.00 0.00 H new ATOM 0 HB2 SER A 72 16.227 7.114 6.908 1.00 0.00 H new ATOM 0 HB3 SER A 72 17.274 8.396 6.335 1.00 0.00 H new ATOM 0 HG SER A 72 14.635 8.893 5.734 1.00 0.00 H new ATOM 1101 N SER A 73 16.643 8.844 2.863 1.00 0.00 N ATOM 1102 CA SER A 73 16.402 9.900 1.900 1.00 0.00 C ATOM 1103 C SER A 73 15.401 9.426 0.854 1.00 0.00 C ATOM 1104 O SER A 73 15.189 8.226 0.693 1.00 0.00 O ATOM 1105 CB SER A 73 17.720 10.300 1.244 1.00 0.00 C ATOM 1106 OG SER A 73 18.525 10.976 2.184 1.00 0.00 O ATOM 0 H SER A 73 17.527 8.351 2.734 1.00 0.00 H new ATOM 0 HA SER A 73 15.984 10.770 2.406 1.00 0.00 H new ATOM 0 HB2 SER A 73 18.238 9.415 0.875 1.00 0.00 H new ATOM 0 HB3 SER A 73 17.531 10.941 0.383 1.00 0.00 H new ATOM 0 HG SER A 73 19.373 11.232 1.764 1.00 0.00 H new ATOM 1112 N GLU A 74 14.787 10.374 0.143 1.00 0.00 N ATOM 1113 CA GLU A 74 13.816 10.048 -0.882 1.00 0.00 C ATOM 1114 C GLU A 74 14.527 9.757 -2.196 1.00 0.00 C ATOM 1115 O GLU A 74 13.906 9.303 -3.155 1.00 0.00 O ATOM 1116 CB GLU A 74 12.838 11.208 -1.041 1.00 0.00 C ATOM 1117 CG GLU A 74 11.485 10.817 -0.456 1.00 0.00 C ATOM 1118 CD GLU A 74 10.354 11.545 -1.166 1.00 0.00 C ATOM 1119 OE1 GLU A 74 10.138 11.235 -2.358 1.00 0.00 O ATOM 1120 OE2 GLU A 74 9.725 12.400 -0.505 1.00 0.00 O ATOM 0 H GLU A 74 14.951 11.373 0.265 1.00 0.00 H new ATOM 0 HA GLU A 74 13.260 9.157 -0.590 1.00 0.00 H new ATOM 0 HB2 GLU A 74 13.223 12.094 -0.535 1.00 0.00 H new ATOM 0 HB3 GLU A 74 12.730 11.465 -2.095 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.343 9.740 -0.547 1.00 0.00 H new ATOM 0 HG3 GLU A 74 11.463 11.053 0.608 1.00 0.00 H new ATOM 1127 N GLN A 75 15.835 10.020 -2.239 1.00 0.00 N ATOM 1128 CA GLN A 75 16.623 9.787 -3.432 1.00 0.00 C ATOM 1129 C GLN A 75 18.007 9.283 -3.048 1.00 0.00 C ATOM 1130 O GLN A 75 18.559 9.694 -2.029 1.00 0.00 O ATOM 1131 CB GLN A 75 16.722 11.080 -4.235 1.00 0.00 C ATOM 1132 CG GLN A 75 15.383 11.367 -4.907 1.00 0.00 C ATOM 1133 CD GLN A 75 15.185 10.478 -6.126 1.00 0.00 C ATOM 1134 OE1 GLN A 75 16.107 10.291 -6.916 1.00 0.00 O ATOM 1135 NE2 GLN A 75 13.977 9.930 -6.277 1.00 0.00 N ATOM 0 H GLN A 75 16.365 10.396 -1.453 1.00 0.00 H new ATOM 0 HA GLN A 75 16.141 9.028 -4.048 1.00 0.00 H new ATOM 0 HB2 GLN A 75 16.997 11.907 -3.580 1.00 0.00 H new ATOM 0 HB3 GLN A 75 17.507 10.994 -4.986 1.00 0.00 H new ATOM 0 HG2 GLN A 75 14.573 11.203 -4.197 1.00 0.00 H new ATOM 0 HG3 GLN A 75 15.338 12.415 -5.205 1.00 0.00 H new ATOM 0 HE21 GLN A 75 13.244 10.116 -5.593 1.00 0.00 H new ATOM 0 HE22 GLN A 75 13.788 9.325 -7.076 1.00 0.00 H new ATOM 1144 N CYS A 76 18.567 8.390 -3.866 1.00 0.00 N ATOM 1145 CA CYS A 76 19.880 7.834 -3.610 1.00 0.00 C ATOM 1146 C CYS A 76 20.944 8.705 -4.265 1.00 0.00 C ATOM 1147 O CYS A 76 20.858 9.003 -5.453 1.00 0.00 O ATOM 1148 CB CYS A 76 19.944 6.407 -4.148 1.00 0.00 C ATOM 1149 SG CYS A 76 21.042 5.316 -3.211 1.00 0.00 S ATOM 0 H CYS A 76 18.122 8.040 -4.714 1.00 0.00 H new ATOM 0 HA CYS A 76 20.066 7.811 -2.536 1.00 0.00 H new ATOM 0 HB2 CYS A 76 18.940 5.984 -4.146 1.00 0.00 H new ATOM 0 HB3 CYS A 76 20.276 6.435 -5.186 1.00 0.00 H new ATOM 1154 N VAL A 77 21.946 9.114 -3.483 1.00 0.00 N ATOM 1155 CA VAL A 77 23.019 9.948 -3.989 1.00 0.00 C ATOM 1156 C VAL A 77 24.348 9.221 -3.842 1.00 0.00 C ATOM 1157 O VAL A 77 24.583 8.545 -2.842 1.00 0.00 O ATOM 1158 CB VAL A 77 23.037 11.269 -3.226 1.00 0.00 C ATOM 1159 CG1 VAL A 77 23.759 11.079 -1.896 1.00 0.00 C ATOM 1160 CG2 VAL A 77 23.766 12.323 -4.054 1.00 0.00 C ATOM 0 H VAL A 77 22.029 8.876 -2.495 1.00 0.00 H new ATOM 0 HA VAL A 77 22.857 10.157 -5.046 1.00 0.00 H new ATOM 0 HB VAL A 77 22.014 11.595 -3.040 1.00 0.00 H new ATOM 0 HG11 VAL A 77 23.772 12.023 -1.351 1.00 0.00 H new ATOM 0 HG12 VAL A 77 23.239 10.325 -1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 77 24.782 10.753 -2.081 1.00 0.00 H new ATOM 0 HG21 VAL A 77 23.780 13.268 -3.510 1.00 0.00 H new ATOM 0 HG22 VAL A 77 24.789 11.996 -4.240 1.00 0.00 H new ATOM 0 HG23 VAL A 77 23.251 12.459 -5.005 1.00 0.00 H new ATOM 1170 N MET A 78 25.221 9.362 -4.843 1.00 0.00 N ATOM 1171 CA MET A 78 26.519 8.717 -4.818 1.00 0.00 C ATOM 1172 C MET A 78 27.497 9.554 -4.006 1.00 0.00 C ATOM 1173 O MET A 78 27.761 10.707 -4.341 1.00 0.00 O ATOM 1174 CB MET A 78 27.021 8.534 -6.247 1.00 0.00 C ATOM 1175 CG MET A 78 26.216 7.434 -6.933 1.00 0.00 C ATOM 1176 SD MET A 78 25.988 5.951 -5.920 1.00 0.00 S ATOM 1177 CE MET A 78 27.232 4.883 -6.687 1.00 0.00 C ATOM 0 H MET A 78 25.044 9.920 -5.678 1.00 0.00 H new ATOM 0 HA MET A 78 26.434 7.738 -4.347 1.00 0.00 H new ATOM 0 HB2 MET A 78 26.925 9.468 -6.800 1.00 0.00 H new ATOM 0 HB3 MET A 78 28.080 8.275 -6.241 1.00 0.00 H new ATOM 0 HG2 MET A 78 25.238 7.830 -7.206 1.00 0.00 H new ATOM 0 HG3 MET A 78 26.717 7.155 -7.860 1.00 0.00 H new ATOM 0 HE1 MET A 78 27.648 4.211 -5.936 1.00 0.00 H new ATOM 0 HE2 MET A 78 26.769 4.298 -7.481 1.00 0.00 H new ATOM 0 HE3 MET A 78 28.030 5.496 -7.106 1.00 0.00 H new ATOM 1187 N LYS A 79 28.038 8.969 -2.935 1.00 0.00 N ATOM 1188 CA LYS A 79 28.983 9.661 -2.083 1.00 0.00 C ATOM 1189 C LYS A 79 30.403 9.241 -2.436 1.00 0.00 C ATOM 1190 O LYS A 79 30.697 8.051 -2.534 1.00 0.00 O ATOM 1191 CB LYS A 79 28.674 9.346 -0.622 1.00 0.00 C ATOM 1192 CG LYS A 79 27.775 10.437 -0.046 1.00 0.00 C ATOM 1193 CD LYS A 79 28.628 11.457 0.704 1.00 0.00 C ATOM 1194 CE LYS A 79 28.781 12.715 -0.146 1.00 0.00 C ATOM 1195 NZ LYS A 79 28.599 13.926 0.668 1.00 0.00 N ATOM 0 H LYS A 79 27.831 8.014 -2.644 1.00 0.00 H new ATOM 0 HA LYS A 79 28.896 10.737 -2.237 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.183 8.376 -0.544 1.00 0.00 H new ATOM 0 HB3 LYS A 79 29.599 9.282 -0.049 1.00 0.00 H new ATOM 0 HG2 LYS A 79 27.222 10.928 -0.847 1.00 0.00 H new ATOM 0 HG3 LYS A 79 27.038 9.998 0.627 1.00 0.00 H new ATOM 0 HD2 LYS A 79 28.163 11.704 1.658 1.00 0.00 H new ATOM 0 HD3 LYS A 79 29.608 11.034 0.927 1.00 0.00 H new ATOM 0 HE2 LYS A 79 29.768 12.728 -0.608 1.00 0.00 H new ATOM 0 HE3 LYS A 79 28.050 12.703 -0.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 28.708 14.768 0.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 27.648 13.922 1.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 29.312 13.946 1.425 1.00 0.00 H new ATOM 1209 N GLU A 80 31.285 10.224 -2.628 1.00 0.00 N ATOM 1210 CA GLU A 80 32.668 9.951 -2.967 1.00 0.00 C ATOM 1211 C GLU A 80 33.450 9.591 -1.712 1.00 0.00 C ATOM 1212 O GLU A 80 33.523 10.380 -0.772 1.00 0.00 O ATOM 1213 CB GLU A 80 33.274 11.175 -3.649 1.00 0.00 C ATOM 1214 CG GLU A 80 33.442 12.295 -2.626 1.00 0.00 C ATOM 1215 CD GLU A 80 34.847 12.290 -2.041 1.00 0.00 C ATOM 1216 OE1 GLU A 80 35.776 11.929 -2.797 1.00 0.00 O ATOM 1217 OE2 GLU A 80 34.967 12.645 -0.848 1.00 0.00 O ATOM 0 H GLU A 80 31.058 11.215 -2.552 1.00 0.00 H new ATOM 0 HA GLU A 80 32.716 9.106 -3.653 1.00 0.00 H new ATOM 0 HB2 GLU A 80 34.239 10.920 -4.087 1.00 0.00 H new ATOM 0 HB3 GLU A 80 32.631 11.506 -4.465 1.00 0.00 H new ATOM 0 HG2 GLU A 80 33.244 13.257 -3.098 1.00 0.00 H new ATOM 0 HG3 GLU A 80 32.711 12.176 -1.827 1.00 0.00 H new ATOM 1224 N LYS A 81 34.037 8.391 -1.698 1.00 0.00 N ATOM 1225 CA LYS A 81 34.810 7.933 -0.561 1.00 0.00 C ATOM 1226 C LYS A 81 36.268 7.762 -0.962 1.00 0.00 C ATOM 1227 O LYS A 81 36.574 7.566 -2.136 1.00 0.00 O ATOM 1228 CB LYS A 81 34.231 6.616 -0.051 1.00 0.00 C ATOM 1229 CG LYS A 81 32.707 6.670 -0.119 1.00 0.00 C ATOM 1230 CD LYS A 81 32.169 7.409 1.103 1.00 0.00 C ATOM 1231 CE LYS A 81 30.861 6.764 1.551 1.00 0.00 C ATOM 1232 NZ LYS A 81 30.907 6.414 2.980 1.00 0.00 N ATOM 0 H LYS A 81 33.986 7.724 -2.468 1.00 0.00 H new ATOM 0 HA LYS A 81 34.759 8.672 0.239 1.00 0.00 H new ATOM 0 HB2 LYS A 81 34.603 5.786 -0.651 1.00 0.00 H new ATOM 0 HB3 LYS A 81 34.554 6.437 0.975 1.00 0.00 H new ATOM 0 HG2 LYS A 81 32.391 7.176 -1.031 1.00 0.00 H new ATOM 0 HG3 LYS A 81 32.298 5.660 -0.156 1.00 0.00 H new ATOM 0 HD2 LYS A 81 32.899 7.376 1.912 1.00 0.00 H new ATOM 0 HD3 LYS A 81 32.006 8.460 0.863 1.00 0.00 H new ATOM 0 HE2 LYS A 81 30.033 7.448 1.367 1.00 0.00 H new ATOM 0 HE3 LYS A 81 30.672 5.868 0.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 29.938 6.317 3.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 31.414 5.514 3.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 31.402 7.163 3.505 1.00 0.00 H new ATOM 1246 N LYS A 82 37.169 7.836 0.020 1.00 0.00 N ATOM 1247 CA LYS A 82 38.588 7.689 -0.233 1.00 0.00 C ATOM 1248 C LYS A 82 38.855 6.364 -0.933 1.00 0.00 C ATOM 1249 O LYS A 82 38.854 5.311 -0.300 1.00 0.00 O ATOM 1250 CB LYS A 82 39.350 7.766 1.086 1.00 0.00 C ATOM 1251 CG LYS A 82 38.621 6.942 2.144 1.00 0.00 C ATOM 1252 CD LYS A 82 39.382 5.643 2.392 1.00 0.00 C ATOM 1253 CE LYS A 82 38.391 4.489 2.513 1.00 0.00 C ATOM 1254 NZ LYS A 82 38.652 3.459 1.495 1.00 0.00 N ATOM 0 H LYS A 82 36.931 7.998 0.999 1.00 0.00 H new ATOM 0 HA LYS A 82 38.929 8.495 -0.883 1.00 0.00 H new ATOM 0 HB2 LYS A 82 40.365 7.392 0.954 1.00 0.00 H new ATOM 0 HB3 LYS A 82 39.432 8.803 1.411 1.00 0.00 H new ATOM 0 HG2 LYS A 82 38.540 7.511 3.070 1.00 0.00 H new ATOM 0 HG3 LYS A 82 37.605 6.723 1.814 1.00 0.00 H new ATOM 0 HD2 LYS A 82 40.078 5.455 1.574 1.00 0.00 H new ATOM 0 HD3 LYS A 82 39.975 5.724 3.303 1.00 0.00 H new ATOM 0 HE2 LYS A 82 38.461 4.048 3.507 1.00 0.00 H new ATOM 0 HE3 LYS A 82 37.374 4.865 2.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 37.796 2.885 1.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 38.913 3.916 0.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 39.431 2.847 1.812 1.00 0.00 H new ATOM 1268 N ASP A 83 39.084 6.419 -2.248 1.00 0.00 N ATOM 1269 CA ASP A 83 39.349 5.228 -3.028 1.00 0.00 C ATOM 1270 C ASP A 83 40.674 5.378 -3.762 1.00 0.00 C ATOM 1271 O ASP A 83 40.830 6.274 -4.588 1.00 0.00 O ATOM 1272 CB ASP A 83 38.206 5.001 -4.014 1.00 0.00 C ATOM 1273 CG ASP A 83 36.894 4.764 -3.280 1.00 0.00 C ATOM 1274 OD1 ASP A 83 36.858 3.808 -2.475 1.00 0.00 O ATOM 1275 OD2 ASP A 83 35.952 5.544 -3.537 1.00 0.00 O ATOM 0 H ASP A 83 39.089 7.284 -2.788 1.00 0.00 H new ATOM 0 HA ASP A 83 39.418 4.363 -2.368 1.00 0.00 H new ATOM 0 HB2 ASP A 83 38.109 5.866 -4.670 1.00 0.00 H new ATOM 0 HB3 ASP A 83 38.432 4.144 -4.648 1.00 0.00 H new ATOM 1280 N ASP A 84 41.629 4.496 -3.460 1.00 0.00 N ATOM 1281 CA ASP A 84 42.934 4.535 -4.091 1.00 0.00 C ATOM 1282 C ASP A 84 42.941 3.632 -5.315 1.00 0.00 C ATOM 1283 O ASP A 84 42.575 2.462 -5.229 1.00 0.00 O ATOM 1284 CB ASP A 84 43.996 4.097 -3.087 1.00 0.00 C ATOM 1285 CG ASP A 84 45.209 5.015 -3.142 1.00 0.00 C ATOM 1286 OD1 ASP A 84 45.880 5.007 -4.197 1.00 0.00 O ATOM 1287 OD2 ASP A 84 45.441 5.708 -2.129 1.00 0.00 O ATOM 0 H ASP A 84 41.514 3.746 -2.778 1.00 0.00 H new ATOM 0 HA ASP A 84 43.157 5.552 -4.414 1.00 0.00 H new ATOM 0 HB2 ASP A 84 43.576 4.103 -2.081 1.00 0.00 H new ATOM 0 HB3 ASP A 84 44.301 3.072 -3.298 1.00 0.00 H new ATOM 1292 N GLY A 85 43.359 4.177 -6.460 1.00 0.00 N ATOM 1293 CA GLY A 85 43.409 3.417 -7.692 1.00 0.00 C ATOM 1294 C GLY A 85 42.160 3.675 -8.523 1.00 0.00 C ATOM 1295 O GLY A 85 42.094 3.291 -9.689 1.00 0.00 O ATOM 0 H GLY A 85 43.667 5.145 -6.550 1.00 0.00 H new ATOM 0 HA2 GLY A 85 44.296 3.693 -8.262 1.00 0.00 H new ATOM 0 HA3 GLY A 85 43.492 2.353 -7.468 1.00 0.00 H new ATOM 1299 N GLY A 86 41.166 4.329 -7.918 1.00 0.00 N ATOM 1300 CA GLY A 86 39.926 4.633 -8.606 1.00 0.00 C ATOM 1301 C GLY A 86 38.933 5.272 -7.644 1.00 0.00 C ATOM 1302 O GLY A 86 39.244 5.481 -6.473 1.00 0.00 O ATOM 0 H GLY A 86 41.203 4.655 -6.952 1.00 0.00 H new ATOM 0 HA2 GLY A 86 40.120 5.307 -9.440 1.00 0.00 H new ATOM 0 HA3 GLY A 86 39.501 3.721 -9.026 1.00 0.00 H new ATOM 1306 N LEU A 87 37.735 5.581 -8.144 1.00 0.00 N ATOM 1307 CA LEU A 87 36.703 6.194 -7.332 1.00 0.00 C ATOM 1308 C LEU A 87 35.604 5.180 -7.043 1.00 0.00 C ATOM 1309 O LEU A 87 35.234 4.396 -7.913 1.00 0.00 O ATOM 1310 CB LEU A 87 36.138 7.410 -8.059 1.00 0.00 C ATOM 1311 CG LEU A 87 36.734 8.681 -7.462 1.00 0.00 C ATOM 1312 CD1 LEU A 87 36.549 8.668 -5.947 1.00 0.00 C ATOM 1313 CD2 LEU A 87 38.222 8.750 -7.792 1.00 0.00 C ATOM 0 H LEU A 87 37.463 5.413 -9.112 1.00 0.00 H new ATOM 0 HA LEU A 87 37.129 6.521 -6.383 1.00 0.00 H new ATOM 0 HB2 LEU A 87 36.370 7.351 -9.122 1.00 0.00 H new ATOM 0 HB3 LEU A 87 35.052 7.428 -7.970 1.00 0.00 H new ATOM 0 HG LEU A 87 36.228 9.550 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 87 36.975 9.576 -5.521 1.00 0.00 H new ATOM 0 HD12 LEU A 87 35.486 8.620 -5.711 1.00 0.00 H new ATOM 0 HD13 LEU A 87 37.054 7.798 -5.526 1.00 0.00 H new ATOM 0 HD21 LEU A 87 38.648 9.658 -7.365 1.00 0.00 H new ATOM 0 HD22 LEU A 87 38.728 7.880 -7.373 1.00 0.00 H new ATOM 0 HD23 LEU A 87 38.355 8.761 -8.874 1.00 0.00 H new ATOM 1325 N MET A 88 35.082 5.198 -5.814 1.00 0.00 N ATOM 1326 CA MET A 88 34.032 4.282 -5.419 1.00 0.00 C ATOM 1327 C MET A 88 32.951 5.033 -4.654 1.00 0.00 C ATOM 1328 O MET A 88 33.209 5.586 -3.587 1.00 0.00 O ATOM 1329 CB MET A 88 34.625 3.169 -4.561 1.00 0.00 C ATOM 1330 CG MET A 88 35.981 2.757 -5.129 1.00 0.00 C ATOM 1331 SD MET A 88 36.855 1.529 -4.127 1.00 0.00 S ATOM 1332 CE MET A 88 37.932 0.829 -5.403 1.00 0.00 C ATOM 0 H MET A 88 35.377 5.842 -5.080 1.00 0.00 H new ATOM 0 HA MET A 88 33.580 3.838 -6.306 1.00 0.00 H new ATOM 0 HB2 MET A 88 34.738 3.510 -3.532 1.00 0.00 H new ATOM 0 HB3 MET A 88 33.951 2.312 -4.541 1.00 0.00 H new ATOM 0 HG2 MET A 88 35.837 2.356 -6.132 1.00 0.00 H new ATOM 0 HG3 MET A 88 36.607 3.644 -5.227 1.00 0.00 H new ATOM 0 HE1 MET A 88 38.552 0.046 -4.966 1.00 0.00 H new ATOM 0 HE2 MET A 88 37.323 0.406 -6.202 1.00 0.00 H new ATOM 0 HE3 MET A 88 38.570 1.613 -5.810 1.00 0.00 H new ATOM 1342 N PHE A 89 31.733 5.049 -5.203 1.00 0.00 N ATOM 1343 CA PHE A 89 30.621 5.729 -4.570 1.00 0.00 C ATOM 1344 C PHE A 89 29.582 4.712 -4.121 1.00 0.00 C ATOM 1345 O PHE A 89 29.316 3.739 -4.824 1.00 0.00 O ATOM 1346 CB PHE A 89 30.013 6.727 -5.551 1.00 0.00 C ATOM 1347 CG PHE A 89 30.906 7.911 -5.838 1.00 0.00 C ATOM 1348 CD1 PHE A 89 32.206 7.708 -6.312 1.00 0.00 C ATOM 1349 CD2 PHE A 89 30.434 9.212 -5.626 1.00 0.00 C ATOM 1350 CE1 PHE A 89 33.035 8.804 -6.576 1.00 0.00 C ATOM 1351 CE2 PHE A 89 31.263 10.309 -5.890 1.00 0.00 C ATOM 1352 CZ PHE A 89 32.564 10.105 -6.365 1.00 0.00 C ATOM 0 H PHE A 89 31.501 4.595 -6.086 1.00 0.00 H new ATOM 0 HA PHE A 89 30.972 6.270 -3.692 1.00 0.00 H new ATOM 0 HB2 PHE A 89 29.791 6.215 -6.487 1.00 0.00 H new ATOM 0 HB3 PHE A 89 29.065 7.086 -5.151 1.00 0.00 H new ATOM 0 HD1 PHE A 89 32.570 6.704 -6.474 1.00 0.00 H new ATOM 0 HD2 PHE A 89 29.431 9.369 -5.259 1.00 0.00 H new ATOM 0 HE1 PHE A 89 34.038 8.646 -6.943 1.00 0.00 H new ATOM 0 HE2 PHE A 89 30.899 11.313 -5.727 1.00 0.00 H new ATOM 0 HZ PHE A 89 33.204 10.951 -6.568 1.00 0.00 H new ATOM 1362 N MET A 90 28.992 4.939 -2.945 1.00 0.00 N ATOM 1363 CA MET A 90 27.987 4.042 -2.410 1.00 0.00 C ATOM 1364 C MET A 90 26.766 4.836 -1.968 1.00 0.00 C ATOM 1365 O MET A 90 26.897 5.874 -1.324 1.00 0.00 O ATOM 1366 CB MET A 90 28.577 3.261 -1.239 1.00 0.00 C ATOM 1367 CG MET A 90 29.221 4.232 -0.253 1.00 0.00 C ATOM 1368 SD MET A 90 28.150 4.687 1.135 1.00 0.00 S ATOM 1369 CE MET A 90 28.154 6.484 0.924 1.00 0.00 C ATOM 0 H MET A 90 29.200 5.741 -2.350 1.00 0.00 H new ATOM 0 HA MET A 90 27.676 3.338 -3.181 1.00 0.00 H new ATOM 0 HB2 MET A 90 27.796 2.685 -0.742 1.00 0.00 H new ATOM 0 HB3 MET A 90 29.318 2.548 -1.600 1.00 0.00 H new ATOM 0 HG2 MET A 90 30.135 3.785 0.138 1.00 0.00 H new ATOM 0 HG3 MET A 90 29.512 5.137 -0.787 1.00 0.00 H new ATOM 0 HE1 MET A 90 28.543 6.955 1.827 1.00 0.00 H new ATOM 0 HE2 MET A 90 28.785 6.749 0.075 1.00 0.00 H new ATOM 0 HE3 MET A 90 27.137 6.831 0.743 1.00 0.00 H new ATOM 1379 N CYS A 91 25.576 4.341 -2.315 1.00 0.00 N ATOM 1380 CA CYS A 91 24.338 5.003 -1.955 1.00 0.00 C ATOM 1381 C CYS A 91 23.281 3.964 -1.607 1.00 0.00 C ATOM 1382 O CYS A 91 23.298 2.856 -2.140 1.00 0.00 O ATOM 1383 CB CYS A 91 23.874 5.880 -3.114 1.00 0.00 C ATOM 1384 SG CYS A 91 22.755 5.045 -4.266 1.00 0.00 S ATOM 0 H CYS A 91 25.452 3.480 -2.847 1.00 0.00 H new ATOM 0 HA CYS A 91 24.500 5.635 -1.082 1.00 0.00 H new ATOM 0 HB2 CYS A 91 23.374 6.761 -2.712 1.00 0.00 H new ATOM 0 HB3 CYS A 91 24.748 6.232 -3.663 1.00 0.00 H new ATOM 1389 N SER A 92 22.359 4.323 -0.712 1.00 0.00 N ATOM 1390 CA SER A 92 21.301 3.423 -0.300 1.00 0.00 C ATOM 1391 C SER A 92 19.960 4.139 -0.361 1.00 0.00 C ATOM 1392 O SER A 92 19.903 5.334 -0.638 1.00 0.00 O ATOM 1393 CB SER A 92 21.583 2.919 1.112 1.00 0.00 C ATOM 1394 OG SER A 92 22.411 3.843 1.782 1.00 0.00 O ATOM 0 H SER A 92 22.331 5.238 -0.261 1.00 0.00 H new ATOM 0 HA SER A 92 21.263 2.568 -0.975 1.00 0.00 H new ATOM 0 HB2 SER A 92 20.648 2.789 1.657 1.00 0.00 H new ATOM 0 HB3 SER A 92 22.067 1.943 1.072 1.00 0.00 H new ATOM 0 HG SER A 92 21.865 4.405 2.371 1.00 0.00 H new ATOM 1400 N CYS A 93 18.877 3.403 -0.098 1.00 0.00 N ATOM 1401 CA CYS A 93 17.543 3.968 -0.121 1.00 0.00 C ATOM 1402 C CYS A 93 16.512 2.861 0.047 1.00 0.00 C ATOM 1403 O CYS A 93 16.637 1.795 -0.553 1.00 0.00 O ATOM 1404 CB CYS A 93 17.329 4.711 -1.439 1.00 0.00 C ATOM 1405 SG CYS A 93 17.771 3.747 -2.906 1.00 0.00 S ATOM 0 H CYS A 93 18.908 2.410 0.134 1.00 0.00 H new ATOM 0 HA CYS A 93 17.428 4.673 0.702 1.00 0.00 H new ATOM 0 HB2 CYS A 93 16.282 5.006 -1.512 1.00 0.00 H new ATOM 0 HB3 CYS A 93 17.919 5.628 -1.428 1.00 0.00 H new ATOM 1410 N THR A 94 15.490 3.116 0.866 1.00 0.00 N ATOM 1411 CA THR A 94 14.446 2.140 1.106 1.00 0.00 C ATOM 1412 C THR A 94 13.358 2.274 0.050 1.00 0.00 C ATOM 1413 O THR A 94 12.347 1.575 0.100 1.00 0.00 O ATOM 1414 CB THR A 94 13.869 2.346 2.504 1.00 0.00 C ATOM 1415 OG1 THR A 94 12.848 3.317 2.452 1.00 0.00 O ATOM 1416 CG2 THR A 94 14.974 2.818 3.444 1.00 0.00 C ATOM 0 H THR A 94 15.370 3.994 1.371 1.00 0.00 H new ATOM 0 HA THR A 94 14.863 1.135 1.043 1.00 0.00 H new ATOM 0 HB THR A 94 13.457 1.406 2.871 1.00 0.00 H new ATOM 0 HG1 THR A 94 12.476 3.449 3.349 1.00 0.00 H new ATOM 0 HG21 THR A 94 14.564 2.966 4.443 1.00 0.00 H new ATOM 0 HG22 THR A 94 15.763 2.067 3.483 1.00 0.00 H new ATOM 0 HG23 THR A 94 15.386 3.759 3.078 1.00 0.00 H new ATOM 1424 N GLY A 95 13.568 3.176 -0.912 1.00 0.00 N ATOM 1425 CA GLY A 95 12.605 3.396 -1.973 1.00 0.00 C ATOM 1426 C GLY A 95 12.716 2.296 -3.020 1.00 0.00 C ATOM 1427 O GLY A 95 13.291 1.242 -2.761 1.00 0.00 O ATOM 0 H GLY A 95 14.400 3.763 -0.971 1.00 0.00 H new ATOM 0 HA2 GLY A 95 11.596 3.415 -1.560 1.00 0.00 H new ATOM 0 HA3 GLY A 95 12.778 4.368 -2.436 1.00 0.00 H new ATOM 1431 N GLU A 96 12.160 2.548 -4.208 1.00 0.00 N ATOM 1432 CA GLU A 96 12.200 1.580 -5.287 1.00 0.00 C ATOM 1433 C GLU A 96 13.180 2.037 -6.358 1.00 0.00 C ATOM 1434 O GLU A 96 13.072 3.150 -6.871 1.00 0.00 O ATOM 1435 CB GLU A 96 10.800 1.414 -5.870 1.00 0.00 C ATOM 1436 CG GLU A 96 10.890 0.694 -7.212 1.00 0.00 C ATOM 1437 CD GLU A 96 9.505 0.471 -7.803 1.00 0.00 C ATOM 1438 OE1 GLU A 96 8.987 1.431 -8.413 1.00 0.00 O ATOM 1439 OE2 GLU A 96 8.990 -0.655 -7.634 1.00 0.00 O ATOM 0 H GLU A 96 11.679 3.417 -4.439 1.00 0.00 H new ATOM 0 HA GLU A 96 12.538 0.617 -4.904 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.173 0.847 -5.182 1.00 0.00 H new ATOM 0 HB3 GLU A 96 10.330 2.389 -5.999 1.00 0.00 H new ATOM 0 HG2 GLU A 96 11.495 1.280 -7.904 1.00 0.00 H new ATOM 0 HG3 GLU A 96 11.393 -0.264 -7.082 1.00 0.00 H new ATOM 1446 N GLU A 97 14.139 1.174 -6.698 1.00 0.00 N ATOM 1447 CA GLU A 97 15.130 1.491 -7.706 1.00 0.00 C ATOM 1448 C GLU A 97 15.842 2.787 -7.344 1.00 0.00 C ATOM 1449 O GLU A 97 16.737 3.229 -8.061 1.00 0.00 O ATOM 1450 CB GLU A 97 14.449 1.610 -9.066 1.00 0.00 C ATOM 1451 CG GLU A 97 13.896 0.250 -9.479 1.00 0.00 C ATOM 1452 CD GLU A 97 13.698 0.178 -10.986 1.00 0.00 C ATOM 1453 OE1 GLU A 97 12.676 0.728 -11.452 1.00 0.00 O ATOM 1454 OE2 GLU A 97 14.573 -0.425 -11.645 1.00 0.00 O ATOM 0 H GLU A 97 14.243 0.248 -6.283 1.00 0.00 H new ATOM 0 HA GLU A 97 15.873 0.695 -7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 97 13.643 2.343 -9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 97 15.160 1.967 -9.811 1.00 0.00 H new ATOM 0 HG2 GLU A 97 14.580 -0.537 -9.160 1.00 0.00 H new ATOM 0 HG3 GLU A 97 12.946 0.071 -8.975 1.00 0.00 H new ATOM 1461 N CYS A 98 15.441 3.395 -6.225 1.00 0.00 N ATOM 1462 CA CYS A 98 16.041 4.634 -5.771 1.00 0.00 C ATOM 1463 C CYS A 98 17.555 4.550 -5.897 1.00 0.00 C ATOM 1464 O CYS A 98 18.207 5.530 -6.252 1.00 0.00 O ATOM 1465 CB CYS A 98 15.632 4.896 -4.324 1.00 0.00 C ATOM 1466 SG CYS A 98 15.654 3.422 -3.275 1.00 0.00 S ATOM 0 H CYS A 98 14.700 3.041 -5.620 1.00 0.00 H new ATOM 0 HA CYS A 98 15.690 5.461 -6.389 1.00 0.00 H new ATOM 0 HB2 CYS A 98 16.301 5.643 -3.898 1.00 0.00 H new ATOM 0 HB3 CYS A 98 14.629 5.323 -4.312 1.00 0.00 H new ATOM 1471 N ASN A 99 18.116 3.374 -5.603 1.00 0.00 N ATOM 1472 CA ASN A 99 19.548 3.170 -5.686 1.00 0.00 C ATOM 1473 C ASN A 99 19.974 3.064 -7.143 1.00 0.00 C ATOM 1474 O ASN A 99 21.035 3.556 -7.521 1.00 0.00 O ATOM 1475 CB ASN A 99 19.925 1.905 -4.918 1.00 0.00 C ATOM 1476 CG ASN A 99 19.088 0.721 -5.379 1.00 0.00 C ATOM 1477 OD1 ASN A 99 18.030 0.902 -5.979 1.00 0.00 O ATOM 1478 ND2 ASN A 99 19.563 -0.494 -5.098 1.00 0.00 N ATOM 0 H ASN A 99 17.591 2.552 -5.305 1.00 0.00 H new ATOM 0 HA ASN A 99 20.066 4.019 -5.240 1.00 0.00 H new ATOM 0 HB2 ASN A 99 20.983 1.687 -5.065 1.00 0.00 H new ATOM 0 HB3 ASN A 99 19.778 2.066 -3.850 1.00 0.00 H new ATOM 0 HD21 ASN A 99 19.043 -1.324 -5.384 1.00 0.00 H new ATOM 0 HD22 ASN A 99 20.446 -0.593 -4.598 1.00 0.00 H new ATOM 1485 N ASP A 100 19.142 2.417 -7.961 1.00 0.00 N ATOM 1486 CA ASP A 100 19.434 2.248 -9.371 1.00 0.00 C ATOM 1487 C ASP A 100 20.028 3.532 -9.931 1.00 0.00 C ATOM 1488 O ASP A 100 21.016 3.494 -10.662 1.00 0.00 O ATOM 1489 CB ASP A 100 18.154 1.874 -10.114 1.00 0.00 C ATOM 1490 CG ASP A 100 17.493 0.659 -9.480 1.00 0.00 C ATOM 1491 OD1 ASP A 100 17.997 0.227 -8.420 1.00 0.00 O ATOM 1492 OD2 ASP A 100 16.497 0.184 -10.067 1.00 0.00 O ATOM 0 H ASP A 100 18.259 2.003 -7.662 1.00 0.00 H new ATOM 0 HA ASP A 100 20.161 1.447 -9.503 1.00 0.00 H new ATOM 0 HB2 ASP A 100 17.463 2.717 -10.102 1.00 0.00 H new ATOM 0 HB3 ASP A 100 18.383 1.664 -11.159 1.00 0.00 H new ATOM 1497 N VAL A 101 19.422 4.671 -9.588 1.00 0.00 N ATOM 1498 CA VAL A 101 19.893 5.959 -10.057 1.00 0.00 C ATOM 1499 C VAL A 101 20.935 6.510 -9.094 1.00 0.00 C ATOM 1500 O VAL A 101 20.605 6.905 -7.978 1.00 0.00 O ATOM 1501 CB VAL A 101 18.711 6.918 -10.181 1.00 0.00 C ATOM 1502 CG1 VAL A 101 19.141 8.157 -10.960 1.00 0.00 C ATOM 1503 CG2 VAL A 101 17.570 6.223 -10.918 1.00 0.00 C ATOM 0 H VAL A 101 18.601 4.718 -8.984 1.00 0.00 H new ATOM 0 HA VAL A 101 20.357 5.846 -11.037 1.00 0.00 H new ATOM 0 HB VAL A 101 18.375 7.213 -9.187 1.00 0.00 H new ATOM 0 HG11 VAL A 101 18.298 8.842 -11.049 1.00 0.00 H new ATOM 0 HG12 VAL A 101 19.957 8.653 -10.434 1.00 0.00 H new ATOM 0 HG13 VAL A 101 19.476 7.863 -11.955 1.00 0.00 H new ATOM 0 HG21 VAL A 101 16.725 6.906 -11.008 1.00 0.00 H new ATOM 0 HG22 VAL A 101 17.905 5.928 -11.912 1.00 0.00 H new ATOM 0 HG23 VAL A 101 17.263 5.338 -10.361 1.00 0.00 H new ATOM 1513 N LEU A 102 22.198 6.533 -9.528 1.00 0.00 N ATOM 1514 CA LEU A 102 23.279 7.035 -8.704 1.00 0.00 C ATOM 1515 C LEU A 102 23.552 8.494 -9.041 1.00 0.00 C ATOM 1516 O LEU A 102 24.083 8.799 -10.106 1.00 0.00 O ATOM 1517 CB LEU A 102 24.527 6.185 -8.933 1.00 0.00 C ATOM 1518 CG LEU A 102 24.347 5.348 -10.196 1.00 0.00 C ATOM 1519 CD1 LEU A 102 25.710 5.079 -10.827 1.00 0.00 C ATOM 1520 CD2 LEU A 102 23.682 4.022 -9.837 1.00 0.00 C ATOM 0 H LEU A 102 22.489 6.207 -10.450 1.00 0.00 H new ATOM 0 HA LEU A 102 22.999 6.973 -7.652 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.404 6.826 -9.030 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.700 5.536 -8.075 1.00 0.00 H new ATOM 0 HG LEU A 102 23.720 5.889 -10.904 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.582 4.481 -11.729 1.00 0.00 H new ATOM 0 HD12 LEU A 102 26.185 6.026 -11.084 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.338 4.538 -10.119 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.553 3.424 -10.739 1.00 0.00 H new ATOM 0 HD22 LEU A 102 24.309 3.480 -9.129 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.708 4.214 -9.387 1.00 0.00 H new ATOM 1532 N ILE A 103 23.186 9.396 -8.127 1.00 0.00 N ATOM 1533 CA ILE A 103 23.392 10.817 -8.327 1.00 0.00 C ATOM 1534 C ILE A 103 24.801 11.198 -7.894 1.00 0.00 C ATOM 1535 O ILE A 103 25.212 10.896 -6.776 1.00 0.00 O ATOM 1536 CB ILE A 103 22.350 11.598 -7.532 1.00 0.00 C ATOM 1537 CG1 ILE A 103 21.058 11.689 -8.338 1.00 0.00 C ATOM 1538 CG2 ILE A 103 22.874 13.004 -7.252 1.00 0.00 C ATOM 1539 CD1 ILE A 103 19.918 11.057 -7.544 1.00 0.00 C ATOM 0 H ILE A 103 22.744 9.157 -7.239 1.00 0.00 H new ATOM 0 HA ILE A 103 23.280 11.061 -9.383 1.00 0.00 H new ATOM 0 HB ILE A 103 22.155 11.087 -6.589 1.00 0.00 H new ATOM 0 HG12 ILE A 103 20.827 12.731 -8.559 1.00 0.00 H new ATOM 0 HG13 ILE A 103 21.176 11.179 -9.294 1.00 0.00 H new ATOM 0 HG21 ILE A 103 22.130 13.563 -6.684 1.00 0.00 H new ATOM 0 HG22 ILE A 103 23.797 12.940 -6.676 1.00 0.00 H new ATOM 0 HG23 ILE A 103 23.069 13.514 -8.195 1.00 0.00 H new ATOM 0 HD11 ILE A 103 18.994 11.122 -8.119 1.00 0.00 H new ATOM 0 HD12 ILE A 103 20.149 10.011 -7.345 1.00 0.00 H new ATOM 0 HD13 ILE A 103 19.795 11.587 -6.599 1.00 0.00 H new ATOM 1551 N PHE A 104 25.541 11.864 -8.783 1.00 0.00 N ATOM 1552 CA PHE A 104 26.897 12.282 -8.486 1.00 0.00 C ATOM 1553 C PHE A 104 26.974 13.801 -8.455 1.00 0.00 C ATOM 1554 O PHE A 104 26.775 14.457 -9.475 1.00 0.00 O ATOM 1555 CB PHE A 104 27.845 11.712 -9.538 1.00 0.00 C ATOM 1556 CG PHE A 104 27.778 10.209 -9.661 1.00 0.00 C ATOM 1557 CD1 PHE A 104 26.700 9.608 -10.321 1.00 0.00 C ATOM 1558 CD2 PHE A 104 28.794 9.416 -9.115 1.00 0.00 C ATOM 1559 CE1 PHE A 104 26.638 8.214 -10.436 1.00 0.00 C ATOM 1560 CE2 PHE A 104 28.734 8.022 -9.230 1.00 0.00 C ATOM 1561 CZ PHE A 104 27.656 7.422 -9.891 1.00 0.00 C ATOM 0 H PHE A 104 25.216 12.122 -9.715 1.00 0.00 H new ATOM 0 HA PHE A 104 27.193 11.905 -7.507 1.00 0.00 H new ATOM 0 HB2 PHE A 104 27.612 12.158 -10.505 1.00 0.00 H new ATOM 0 HB3 PHE A 104 28.866 12.003 -9.291 1.00 0.00 H new ATOM 0 HD1 PHE A 104 25.916 10.220 -10.742 1.00 0.00 H new ATOM 0 HD2 PHE A 104 29.625 9.880 -8.605 1.00 0.00 H new ATOM 0 HE1 PHE A 104 25.806 7.750 -10.945 1.00 0.00 H new ATOM 0 HE2 PHE A 104 29.518 7.410 -8.809 1.00 0.00 H new ATOM 0 HZ PHE A 104 27.609 6.347 -9.981 1.00 0.00 H new ATOM 1571 N SER A 105 27.264 14.362 -7.278 1.00 0.00 N ATOM 1572 CA SER A 105 27.367 15.798 -7.121 1.00 0.00 C ATOM 1573 C SER A 105 28.612 16.142 -6.314 1.00 0.00 C ATOM 1574 O SER A 105 28.842 15.572 -5.250 1.00 0.00 O ATOM 1575 CB SER A 105 26.112 16.325 -6.431 1.00 0.00 C ATOM 1576 OG SER A 105 26.239 16.158 -5.037 1.00 0.00 O ATOM 0 H SER A 105 27.431 13.833 -6.422 1.00 0.00 H new ATOM 0 HA SER A 105 27.452 16.269 -8.100 1.00 0.00 H new ATOM 0 HB2 SER A 105 25.967 17.378 -6.670 1.00 0.00 H new ATOM 0 HB3 SER A 105 25.233 15.792 -6.794 1.00 0.00 H new ATOM 0 HG SER A 105 27.055 15.652 -4.841 1.00 0.00 H new ATOM 1582 N ALA A 106 29.415 17.078 -6.825 1.00 0.00 N ATOM 1583 CA ALA A 106 30.629 17.493 -6.152 1.00 0.00 C ATOM 1584 C ALA A 106 30.280 18.287 -4.901 1.00 0.00 C ATOM 1585 O ALA A 106 31.016 18.255 -3.917 1.00 0.00 O ATOM 1586 CB ALA A 106 31.477 18.331 -7.106 1.00 0.00 C ATOM 0 H ALA A 106 29.238 17.559 -7.707 1.00 0.00 H new ATOM 0 HA ALA A 106 31.202 16.615 -5.853 1.00 0.00 H new ATOM 0 HB1 ALA A 106 32.391 18.644 -6.601 1.00 0.00 H new ATOM 0 HB2 ALA A 106 31.733 17.737 -7.983 1.00 0.00 H new ATOM 0 HB3 ALA A 106 30.914 19.211 -7.416 1.00 0.00 H new ATOM 1592 N ILE A 107 29.153 19.002 -4.942 1.00 0.00 N ATOM 1593 CA ILE A 107 28.710 19.798 -3.815 1.00 0.00 C ATOM 1594 C ILE A 107 28.609 18.923 -2.574 1.00 0.00 C ATOM 1595 O ILE A 107 29.561 18.824 -1.803 1.00 0.00 O ATOM 1596 CB ILE A 107 27.362 20.434 -4.141 1.00 0.00 C ATOM 1597 CG1 ILE A 107 26.932 21.338 -2.989 1.00 0.00 C ATOM 1598 CG2 ILE A 107 26.319 19.340 -4.345 1.00 0.00 C ATOM 1599 CD1 ILE A 107 27.219 22.793 -3.350 1.00 0.00 C ATOM 1600 OXT ILE A 107 27.527 18.325 -2.387 1.00 0.00 O ATOM 0 H ILE A 107 28.534 19.040 -5.752 1.00 0.00 H new ATOM 0 HA ILE A 107 29.432 20.591 -3.618 1.00 0.00 H new ATOM 0 HB ILE A 107 27.452 21.025 -5.052 1.00 0.00 H new ATOM 0 HG12 ILE A 107 25.869 21.205 -2.786 1.00 0.00 H new ATOM 0 HG13 ILE A 107 27.467 21.065 -2.079 1.00 0.00 H new ATOM 0 HG21 ILE A 107 25.356 19.794 -4.578 1.00 0.00 H new ATOM 0 HG22 ILE A 107 26.625 18.695 -5.169 1.00 0.00 H new ATOM 0 HG23 ILE A 107 26.230 18.748 -3.434 1.00 0.00 H new ATOM 0 HD11 ILE A 107 26.912 23.439 -2.528 1.00 0.00 H new ATOM 0 HD12 ILE A 107 28.286 22.919 -3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 107 26.664 23.061 -4.249 1.00 0.00 H new TER 1612 ILE A 107