USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1151 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 127 GLN : amide:sc= 0 K(o=-0.44,f=-1.7!) USER MOD Set 1.2: A 135 MET CE :methyl -179:sc= -0.444 (180deg=-0.446) USER MOD Set 2.1: A 40 SER OG : rot 51:sc= 0.399 USER MOD Set 2.2: A 72 SER OG : rot 83:sc= 1.24 USER MOD Set 3.1: A 69 MET CE :methyl 163:sc= 0 (180deg=-0.157) USER MOD Set 3.2: A 108 ASN : amide:sc= 0.114 K(o=0.11,f=-2.9!) USER MOD Set 4.1: A 50 GLN : amide:sc= 2.14 K(o=5.7,f=-6.9!) USER MOD Set 4.2: A 57 LYS NZ :NH3+ 180:sc= 3.55 (180deg=2.36) USER MOD Set 5.1: A 45 LYS NZ :NH3+ 179:sc= 0.982 (180deg=0) USER MOD Set 5.2: A 48 MET CE :methyl -160:sc= -3.48 (180deg=-1.25) USER MOD Set 5.3: A 88 HIS : no HE2:sc= -0.841 K(o=-3.3,f=-6.8!) USER MOD Set 6.1: A 35 HIS : no HE2:sc= -3.48! C(o=-4.8!,f=-9.4!) USER MOD Set 6.2: A 92 GLN : amide:sc= -1.27 K(o=-4.8,f=-6) USER MOD Set 7.1: A 30 LYS NZ :NH3+ -140:sc= 1.81 (180deg=0.911) USER MOD Set 7.2: A 32 THR OG1 : rot 160:sc= 0 USER MOD Set 7.3: A 63 ASN : amide:sc= 0.75 K(o=2.6,f=-1.1) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.5!) USER MOD Single : A 7 MET CE :methyl 172:sc= -0.845 (180deg=-0.963) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 160:sc= 1.2 (180deg=0.951) USER MOD Single : A 18 ASN : amide:sc= 0.754 K(o=0.75,f=-0.1) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 38 SER OG : rot -59:sc= 0.752 USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 CYS SG : rot 156:sc= -0.978 USER MOD Single : A 52 ASN : amide:sc= 0.948 K(o=0.95,f=-2.1) USER MOD Single : A 58 TYR OH : rot 30:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0.548 K(o=0.55,f=-0.3) USER MOD Single : A 61 GLN : amide:sc= 0.388 X(o=0.39,f=0) USER MOD Single : A 68 HIS : no HE2:sc= -3.7! C(o=-3.7!,f=-11!) USER MOD Single : A 80 LYS NZ :NH3+ 177:sc= 1.28 (180deg=1.21) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 87:sc= 1.12 USER MOD Single : A 91 THR OG1 : rot -75:sc= 1.68 USER MOD Single : A 98 SER OG : rot 180:sc= 0.00589 USER MOD Single : A 100 HIS : no HE2:sc= -0.852 K(o=-0.85,f=-2.9!) USER MOD Single : A 103 THR OG1 : rot 163:sc= 1.27 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 15:sc= 0.439 USER MOD Single : A 115 TYR OH : rot 51:sc= 1.56 USER MOD Single : A 119 LYS NZ :NH3+ 146:sc= 0.928 (180deg=0.319) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.0577 USER MOD Single : A 122 GLN : amide:sc= 2.11 K(o=2.1,f=-7.6!) USER MOD Single : A 125 HIS : no HD1:sc= -0.727 K(o=-0.73,f=-0.22) USER MOD Single : A 131 SER OG : rot 180:sc= 0.0172 USER MOD Single : A 133 MET CE :methyl 179:sc= -0.685 (180deg=-0.688) USER MOD Single : A 134 LYS NZ :NH3+ -179:sc= 1.16 (180deg=1.1) USER MOD Single : A 138 LYS NZ :NH3+ -179:sc= 1.96 (180deg=1.9) USER MOD Single : A 141 ASN : amide:sc= -0.549 X(o=-0.55,f=-0.55) USER MOD Single : A 147 THR OG1 : rot 95:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 20 N LYS A 2 5.226 -2.069 -3.463 1.00 0.00 N ATOM 21 CA LYS A 2 6.408 -2.790 -3.925 1.00 0.00 C ATOM 22 C LYS A 2 7.569 -1.802 -3.989 1.00 0.00 C ATOM 23 O LYS A 2 7.369 -0.590 -4.098 1.00 0.00 O ATOM 24 CB LYS A 2 6.153 -3.437 -5.303 1.00 0.00 C ATOM 25 CG LYS A 2 5.027 -4.485 -5.327 1.00 0.00 C ATOM 26 CD LYS A 2 5.304 -5.702 -4.433 1.00 0.00 C ATOM 27 CE LYS A 2 4.199 -6.752 -4.622 1.00 0.00 C ATOM 28 NZ LYS A 2 4.423 -7.963 -3.793 1.00 0.00 N ATOM 0 HA LYS A 2 6.647 -3.598 -3.234 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.913 -2.651 -6.019 1.00 0.00 H new ATOM 0 HB3 LYS A 2 7.075 -3.908 -5.644 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.097 -4.015 -5.009 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.878 -4.824 -6.352 1.00 0.00 H new ATOM 0 HD2 LYS A 2 6.274 -6.133 -4.681 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.350 -5.394 -3.388 1.00 0.00 H new ATOM 0 HE2 LYS A 2 3.235 -6.312 -4.365 1.00 0.00 H new ATOM 0 HE3 LYS A 2 4.149 -7.038 -5.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 3.652 -8.642 -3.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 5.330 -8.400 -4.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.444 -7.697 -2.788 1.00 0.00 H new ATOM 42 N LEU A 3 8.784 -2.327 -3.941 1.00 0.00 N ATOM 43 CA LEU A 3 9.996 -1.552 -4.162 1.00 0.00 C ATOM 44 C LEU A 3 10.134 -1.212 -5.642 1.00 0.00 C ATOM 45 O LEU A 3 9.519 -1.827 -6.515 1.00 0.00 O ATOM 46 CB LEU A 3 11.232 -2.293 -3.617 1.00 0.00 C ATOM 47 CG LEU A 3 11.144 -2.633 -2.114 1.00 0.00 C ATOM 48 CD1 LEU A 3 12.489 -3.177 -1.626 1.00 0.00 C ATOM 49 CD2 LEU A 3 10.720 -1.431 -1.258 1.00 0.00 C ATOM 0 H LEU A 3 8.958 -3.313 -3.746 1.00 0.00 H new ATOM 0 HA LEU A 3 9.925 -0.615 -3.610 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.368 -3.216 -4.181 1.00 0.00 H new ATOM 0 HB3 LEU A 3 12.117 -1.680 -3.790 1.00 0.00 H new ATOM 0 HG LEU A 3 10.371 -3.393 -2.000 1.00 0.00 H new ATOM 0 HD11 LEU A 3 12.422 -3.415 -0.565 1.00 0.00 H new ATOM 0 HD12 LEU A 3 12.741 -4.078 -2.185 1.00 0.00 H new ATOM 0 HD13 LEU A 3 13.263 -2.425 -1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 3 10.675 -1.728 -0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.446 -0.626 -1.376 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.738 -1.084 -1.579 1.00 0.00 H new ATOM 61 N ARG A 4 10.962 -0.199 -5.895 1.00 0.00 N ATOM 62 CA ARG A 4 11.216 0.463 -7.169 1.00 0.00 C ATOM 63 C ARG A 4 9.956 0.981 -7.868 1.00 0.00 C ATOM 64 O ARG A 4 10.034 1.346 -9.041 1.00 0.00 O ATOM 65 CB ARG A 4 12.115 -0.408 -8.065 1.00 0.00 C ATOM 66 CG ARG A 4 13.405 -0.828 -7.334 1.00 0.00 C ATOM 67 CD ARG A 4 14.439 -1.429 -8.295 1.00 0.00 C ATOM 68 NE ARG A 4 14.934 -0.421 -9.249 1.00 0.00 N ATOM 69 CZ ARG A 4 15.674 -0.641 -10.339 1.00 0.00 C ATOM 70 NH1 ARG A 4 16.097 -1.862 -10.651 1.00 0.00 N ATOM 71 NH2 ARG A 4 15.976 0.398 -11.107 1.00 0.00 N ATOM 0 H ARG A 4 11.519 0.213 -5.147 1.00 0.00 H new ATOM 0 HA ARG A 4 11.769 1.376 -6.948 1.00 0.00 H new ATOM 0 HB2 ARG A 4 11.567 -1.297 -8.377 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.371 0.143 -8.970 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.836 0.038 -6.833 1.00 0.00 H new ATOM 0 HG3 ARG A 4 13.163 -1.556 -6.560 1.00 0.00 H new ATOM 0 HD2 ARG A 4 15.275 -1.835 -7.725 1.00 0.00 H new ATOM 0 HD3 ARG A 4 13.992 -2.260 -8.840 1.00 0.00 H new ATOM 0 HE ARG A 4 14.685 0.549 -9.056 1.00 0.00 H new ATOM 0 HH11 ARG A 4 15.857 -2.653 -10.053 1.00 0.00 H new ATOM 0 HH12 ARG A 4 16.661 -2.008 -11.488 1.00 0.00 H new ATOM 0 HH21 ARG A 4 15.645 1.330 -10.858 1.00 0.00 H new ATOM 0 HH22 ARG A 4 16.539 0.265 -11.947 1.00 0.00 H new ATOM 85 N GLN A 5 8.810 1.065 -7.178 1.00 0.00 N ATOM 86 CA GLN A 5 7.659 1.761 -7.743 1.00 0.00 C ATOM 87 C GLN A 5 7.986 3.247 -7.791 1.00 0.00 C ATOM 88 O GLN A 5 8.594 3.742 -6.842 1.00 0.00 O ATOM 89 CB GLN A 5 6.432 1.593 -6.854 1.00 0.00 C ATOM 90 CG GLN A 5 5.930 0.145 -6.857 1.00 0.00 C ATOM 91 CD GLN A 5 4.668 0.054 -6.021 1.00 0.00 C ATOM 92 OE1 GLN A 5 3.649 -0.461 -6.461 1.00 0.00 O ATOM 93 NE2 GLN A 5 4.713 0.584 -4.805 1.00 0.00 N ATOM 0 H GLN A 5 8.662 0.668 -6.250 1.00 0.00 H new ATOM 0 HA GLN A 5 7.450 1.352 -8.731 1.00 0.00 H new ATOM 0 HB2 GLN A 5 6.676 1.892 -5.835 1.00 0.00 H new ATOM 0 HB3 GLN A 5 5.638 2.255 -7.199 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.729 -0.181 -7.878 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.695 -0.519 -6.455 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.577 1.007 -4.465 1.00 0.00 H new ATOM 0 HE22 GLN A 5 3.884 0.569 -4.211 1.00 0.00 H new ATOM 102 N PRO A 6 7.571 3.990 -8.821 1.00 0.00 N ATOM 103 CA PRO A 6 7.679 5.430 -8.776 1.00 0.00 C ATOM 104 C PRO A 6 6.621 5.997 -7.816 1.00 0.00 C ATOM 105 O PRO A 6 5.545 5.415 -7.648 1.00 0.00 O ATOM 106 CB PRO A 6 7.464 5.876 -10.218 1.00 0.00 C ATOM 107 CG PRO A 6 6.506 4.822 -10.779 1.00 0.00 C ATOM 108 CD PRO A 6 6.904 3.545 -10.035 1.00 0.00 C ATOM 0 HA PRO A 6 8.639 5.786 -8.402 1.00 0.00 H new ATOM 0 HB2 PRO A 6 7.034 6.876 -10.269 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.401 5.903 -10.774 1.00 0.00 H new ATOM 0 HG2 PRO A 6 5.465 5.087 -10.594 1.00 0.00 H new ATOM 0 HG3 PRO A 6 6.619 4.710 -11.857 1.00 0.00 H new ATOM 0 HD2 PRO A 6 6.029 2.939 -9.801 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.566 2.928 -10.642 1.00 0.00 H new ATOM 116 N MET A 7 6.928 7.150 -7.216 1.00 0.00 N ATOM 117 CA MET A 7 5.991 7.974 -6.445 1.00 0.00 C ATOM 118 C MET A 7 4.634 8.040 -7.164 1.00 0.00 C ATOM 119 O MET A 7 4.620 8.437 -8.335 1.00 0.00 O ATOM 120 CB MET A 7 6.529 9.404 -6.336 1.00 0.00 C ATOM 121 CG MET A 7 7.681 9.446 -5.346 1.00 0.00 C ATOM 122 SD MET A 7 8.464 11.060 -5.178 1.00 0.00 S ATOM 123 CE MET A 7 9.598 10.501 -3.905 1.00 0.00 C ATOM 0 H MET A 7 7.866 7.549 -7.254 1.00 0.00 H new ATOM 0 HA MET A 7 5.876 7.529 -5.456 1.00 0.00 H new ATOM 0 HB2 MET A 7 6.864 9.752 -7.313 1.00 0.00 H new ATOM 0 HB3 MET A 7 5.735 10.077 -6.013 1.00 0.00 H new ATOM 0 HG2 MET A 7 7.315 9.130 -4.369 1.00 0.00 H new ATOM 0 HG3 MET A 7 8.435 8.721 -5.654 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.326 11.285 -3.697 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.041 10.273 -2.996 1.00 0.00 H new ATOM 0 HE3 MET A 7 10.116 9.605 -4.247 1.00 0.00 H new ATOM 133 N PRO A 8 3.502 7.699 -6.525 1.00 0.00 N ATOM 134 CA PRO A 8 2.188 7.936 -7.102 1.00 0.00 C ATOM 135 C PRO A 8 1.833 9.424 -6.959 1.00 0.00 C ATOM 136 O PRO A 8 2.705 10.286 -6.836 1.00 0.00 O ATOM 137 CB PRO A 8 1.256 6.986 -6.338 1.00 0.00 C ATOM 138 CG PRO A 8 1.859 6.979 -4.937 1.00 0.00 C ATOM 139 CD PRO A 8 3.367 7.117 -5.196 1.00 0.00 C ATOM 0 HA PRO A 8 2.118 7.734 -8.171 1.00 0.00 H new ATOM 0 HB2 PRO A 8 0.227 7.345 -6.334 1.00 0.00 H new ATOM 0 HB3 PRO A 8 1.244 5.989 -6.779 1.00 0.00 H new ATOM 0 HG2 PRO A 8 1.479 7.802 -4.332 1.00 0.00 H new ATOM 0 HG3 PRO A 8 1.626 6.057 -4.404 1.00 0.00 H new ATOM 0 HD2 PRO A 8 3.834 7.753 -4.444 1.00 0.00 H new ATOM 0 HD3 PRO A 8 3.861 6.147 -5.144 1.00 0.00 H new ATOM 147 N GLU A 9 0.542 9.726 -6.989 1.00 0.00 N ATOM 148 CA GLU A 9 -0.030 11.029 -6.696 1.00 0.00 C ATOM 149 C GLU A 9 0.350 11.459 -5.279 1.00 0.00 C ATOM 150 O GLU A 9 0.023 10.757 -4.319 1.00 0.00 O ATOM 151 CB GLU A 9 -1.550 10.892 -6.759 1.00 0.00 C ATOM 152 CG GLU A 9 -2.091 10.437 -8.110 1.00 0.00 C ATOM 153 CD GLU A 9 -1.888 11.483 -9.222 1.00 0.00 C ATOM 154 OE1 GLU A 9 -2.716 12.413 -9.347 1.00 0.00 O ATOM 155 OE2 GLU A 9 -0.911 11.374 -9.997 1.00 0.00 O ATOM 0 H GLU A 9 -0.167 9.034 -7.230 1.00 0.00 H new ATOM 0 HA GLU A 9 0.338 11.765 -7.410 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.869 10.182 -5.997 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.999 11.853 -6.508 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.599 9.508 -8.398 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -3.154 10.218 -8.014 1.00 0.00 H new ATOM 162 N LEU A 10 0.985 12.625 -5.137 1.00 0.00 N ATOM 163 CA LEU A 10 1.406 13.173 -3.851 1.00 0.00 C ATOM 164 C LEU A 10 0.678 14.508 -3.712 1.00 0.00 C ATOM 165 O LEU A 10 1.214 15.548 -4.100 1.00 0.00 O ATOM 166 CB LEU A 10 2.941 13.332 -3.767 1.00 0.00 C ATOM 167 CG LEU A 10 3.807 12.120 -4.165 1.00 0.00 C ATOM 168 CD1 LEU A 10 5.261 12.422 -3.793 1.00 0.00 C ATOM 169 CD2 LEU A 10 3.378 10.792 -3.533 1.00 0.00 C ATOM 0 H LEU A 10 1.224 13.223 -5.928 1.00 0.00 H new ATOM 0 HA LEU A 10 1.152 12.502 -3.031 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.227 14.172 -4.400 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.195 13.604 -2.743 1.00 0.00 H new ATOM 0 HG LEU A 10 3.680 11.983 -5.239 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.890 11.575 -4.067 1.00 0.00 H new ATOM 0 HD12 LEU A 10 5.596 13.311 -4.327 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.333 12.595 -2.719 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.043 9.997 -3.870 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.429 10.873 -2.447 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.356 10.560 -3.832 1.00 0.00 H new ATOM 181 N THR A 11 -0.590 14.479 -3.288 1.00 0.00 N ATOM 182 CA THR A 11 -1.437 15.665 -3.330 1.00 0.00 C ATOM 183 C THR A 11 -2.604 15.493 -2.356 1.00 0.00 C ATOM 184 O THR A 11 -2.987 14.367 -2.016 1.00 0.00 O ATOM 185 CB THR A 11 -1.873 15.932 -4.793 1.00 0.00 C ATOM 186 OG1 THR A 11 -2.444 17.221 -4.899 1.00 0.00 O ATOM 187 CG2 THR A 11 -2.855 14.894 -5.352 1.00 0.00 C ATOM 0 H THR A 11 -1.047 13.647 -2.914 1.00 0.00 H new ATOM 0 HA THR A 11 -0.893 16.551 -3.003 1.00 0.00 H new ATOM 0 HB THR A 11 -0.966 15.857 -5.393 1.00 0.00 H new ATOM 0 HG1 THR A 11 -2.715 17.383 -5.827 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.111 15.152 -6.380 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.393 13.907 -5.330 1.00 0.00 H new ATOM 0 HG23 THR A 11 -3.760 14.885 -4.744 1.00 0.00 H new ATOM 195 N GLY A 12 -3.161 16.619 -1.908 1.00 0.00 N ATOM 196 CA GLY A 12 -4.180 16.699 -0.881 1.00 0.00 C ATOM 197 C GLY A 12 -4.697 18.131 -0.760 1.00 0.00 C ATOM 198 O GLY A 12 -4.123 19.049 -1.352 1.00 0.00 O ATOM 0 H GLY A 12 -2.897 17.535 -2.272 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -5.003 16.027 -1.123 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.770 16.371 0.074 1.00 0.00 H new ATOM 202 N GLU A 13 -5.768 18.319 0.013 1.00 0.00 N ATOM 203 CA GLU A 13 -6.522 19.569 0.063 1.00 0.00 C ATOM 204 C GLU A 13 -6.854 20.037 1.492 1.00 0.00 C ATOM 205 O GLU A 13 -7.407 21.129 1.647 1.00 0.00 O ATOM 206 CB GLU A 13 -7.825 19.368 -0.745 1.00 0.00 C ATOM 207 CG GLU A 13 -7.581 19.222 -2.255 1.00 0.00 C ATOM 208 CD GLU A 13 -8.906 19.152 -3.036 1.00 0.00 C ATOM 209 OE1 GLU A 13 -9.447 20.213 -3.424 1.00 0.00 O ATOM 210 OE2 GLU A 13 -9.414 18.036 -3.294 1.00 0.00 O ATOM 0 H GLU A 13 -6.140 17.596 0.630 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.898 20.354 -0.364 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.339 18.480 -0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -8.488 20.215 -0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -6.991 20.066 -2.613 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -6.997 18.321 -2.445 1.00 0.00 H new ATOM 217 N LYS A 14 -6.554 19.257 2.542 1.00 0.00 N ATOM 218 CA LYS A 14 -7.047 19.566 3.891 1.00 0.00 C ATOM 219 C LYS A 14 -6.092 20.497 4.644 1.00 0.00 C ATOM 220 O LYS A 14 -6.569 21.441 5.275 1.00 0.00 O ATOM 221 CB LYS A 14 -7.363 18.267 4.648 1.00 0.00 C ATOM 222 CG LYS A 14 -8.090 18.503 5.975 1.00 0.00 C ATOM 223 CD LYS A 14 -8.556 17.178 6.589 1.00 0.00 C ATOM 224 CE LYS A 14 -8.981 17.412 8.044 1.00 0.00 C ATOM 225 NZ LYS A 14 -9.810 16.302 8.577 1.00 0.00 N ATOM 0 H LYS A 14 -5.979 18.417 2.484 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.981 20.122 3.809 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -7.976 17.625 4.015 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -6.434 17.731 4.841 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.427 19.017 6.671 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -8.949 19.155 5.813 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.390 16.772 6.016 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -7.753 16.443 6.547 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.093 17.529 8.665 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.541 18.345 8.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.791 16.323 9.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.790 16.411 8.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.431 15.394 8.242 1.00 0.00 H new ATOM 239 N ALA A 15 -4.774 20.284 4.563 1.00 0.00 N ATOM 240 CA ALA A 15 -3.762 21.220 5.058 1.00 0.00 C ATOM 241 C ALA A 15 -2.436 20.969 4.332 1.00 0.00 C ATOM 242 O ALA A 15 -2.229 19.901 3.752 1.00 0.00 O ATOM 243 CB ALA A 15 -3.582 21.106 6.588 1.00 0.00 C ATOM 0 H ALA A 15 -4.376 19.443 4.145 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.099 22.236 4.851 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.823 21.815 6.919 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.527 21.328 7.083 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -3.268 20.094 6.843 1.00 0.00 H new ATOM 249 N TRP A 16 -1.530 21.943 4.413 1.00 0.00 N ATOM 250 CA TRP A 16 -0.219 21.980 3.760 1.00 0.00 C ATOM 251 C TRP A 16 0.787 22.604 4.738 1.00 0.00 C ATOM 252 O TRP A 16 1.413 23.632 4.472 1.00 0.00 O ATOM 253 CB TRP A 16 -0.310 22.691 2.396 1.00 0.00 C ATOM 254 CG TRP A 16 -1.378 23.737 2.185 1.00 0.00 C ATOM 255 CD1 TRP A 16 -2.139 23.816 1.070 1.00 0.00 C ATOM 256 CD2 TRP A 16 -1.846 24.828 3.051 1.00 0.00 C ATOM 257 NE1 TRP A 16 -3.036 24.857 1.177 1.00 0.00 N ATOM 258 CE2 TRP A 16 -2.908 25.512 2.380 1.00 0.00 C ATOM 259 CE3 TRP A 16 -1.505 25.310 4.336 1.00 0.00 C ATOM 260 CZ2 TRP A 16 -3.587 26.601 2.950 1.00 0.00 C ATOM 261 CZ3 TRP A 16 -2.179 26.401 4.918 1.00 0.00 C ATOM 262 CH2 TRP A 16 -3.219 27.048 4.228 1.00 0.00 C ATOM 0 H TRP A 16 -1.701 22.780 4.971 1.00 0.00 H new ATOM 0 HA TRP A 16 0.137 20.977 3.525 1.00 0.00 H new ATOM 0 HB2 TRP A 16 0.654 23.162 2.206 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -0.446 21.924 1.634 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -2.056 23.158 0.218 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -3.710 25.110 0.455 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -0.708 24.830 4.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -4.385 27.090 2.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -1.895 26.743 5.902 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -3.732 27.885 4.679 1.00 0.00 H new ATOM 273 N LEU A 17 0.817 22.045 5.949 1.00 0.00 N ATOM 274 CA LEU A 17 1.552 22.542 7.101 1.00 0.00 C ATOM 275 C LEU A 17 3.036 22.692 6.755 1.00 0.00 C ATOM 276 O LEU A 17 3.683 21.738 6.326 1.00 0.00 O ATOM 277 CB LEU A 17 1.304 21.577 8.271 1.00 0.00 C ATOM 278 CG LEU A 17 2.165 21.841 9.519 1.00 0.00 C ATOM 279 CD1 LEU A 17 1.890 23.219 10.127 1.00 0.00 C ATOM 280 CD2 LEU A 17 1.857 20.757 10.554 1.00 0.00 C ATOM 0 H LEU A 17 0.301 21.190 6.158 1.00 0.00 H new ATOM 0 HA LEU A 17 1.208 23.534 7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.253 21.633 8.554 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.488 20.559 7.929 1.00 0.00 H new ATOM 0 HG LEU A 17 3.215 21.819 9.226 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.520 23.362 11.005 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.112 23.992 9.392 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.842 23.286 10.418 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.458 20.926 11.448 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.799 20.794 10.815 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.094 19.778 10.137 1.00 0.00 H new ATOM 292 N ASN A 18 3.559 23.908 6.931 1.00 0.00 N ATOM 293 CA ASN A 18 4.911 24.388 6.608 1.00 0.00 C ATOM 294 C ASN A 18 5.087 24.582 5.103 1.00 0.00 C ATOM 295 O ASN A 18 5.776 25.509 4.678 1.00 0.00 O ATOM 296 CB ASN A 18 6.042 23.500 7.141 1.00 0.00 C ATOM 297 CG ASN A 18 5.964 23.229 8.637 1.00 0.00 C ATOM 298 OD1 ASN A 18 5.855 24.142 9.452 1.00 0.00 O ATOM 299 ND2 ASN A 18 6.031 21.970 9.025 1.00 0.00 N ATOM 0 H ASN A 18 2.996 24.653 7.341 1.00 0.00 H new ATOM 0 HA ASN A 18 4.993 25.346 7.122 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.025 22.549 6.609 1.00 0.00 H new ATOM 0 HB3 ASN A 18 6.998 23.974 6.917 1.00 0.00 H new ATOM 0 HD21 ASN A 18 5.992 21.740 10.018 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.121 21.227 8.332 1.00 0.00 H new ATOM 306 N GLY A 19 4.455 23.730 4.300 1.00 0.00 N ATOM 307 CA GLY A 19 4.412 23.804 2.850 1.00 0.00 C ATOM 308 C GLY A 19 4.025 22.448 2.272 1.00 0.00 C ATOM 309 O GLY A 19 3.911 21.462 3.002 1.00 0.00 O ATOM 0 H GLY A 19 3.935 22.932 4.665 1.00 0.00 H new ATOM 0 HA2 GLY A 19 3.693 24.561 2.537 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.384 24.109 2.464 1.00 0.00 H new ATOM 313 N GLU A 20 3.872 22.385 0.951 1.00 0.00 N ATOM 314 CA GLU A 20 3.626 21.175 0.186 1.00 0.00 C ATOM 315 C GLU A 20 4.479 21.206 -1.089 1.00 0.00 C ATOM 316 O GLU A 20 4.997 22.261 -1.469 1.00 0.00 O ATOM 317 CB GLU A 20 2.118 21.046 -0.072 1.00 0.00 C ATOM 318 CG GLU A 20 1.425 22.191 -0.837 1.00 0.00 C ATOM 319 CD GLU A 20 1.795 22.295 -2.329 1.00 0.00 C ATOM 320 OE1 GLU A 20 1.724 21.279 -3.056 1.00 0.00 O ATOM 321 OE2 GLU A 20 2.098 23.414 -2.802 1.00 0.00 O ATOM 0 H GLU A 20 3.919 23.217 0.362 1.00 0.00 H new ATOM 0 HA GLU A 20 3.924 20.282 0.735 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.949 20.122 -0.625 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.620 20.936 0.892 1.00 0.00 H new ATOM 0 HG2 GLU A 20 0.346 22.062 -0.754 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.672 23.135 -0.350 1.00 0.00 H new ATOM 328 N VAL A 21 4.654 20.050 -1.732 1.00 0.00 N ATOM 329 CA VAL A 21 5.550 19.856 -2.868 1.00 0.00 C ATOM 330 C VAL A 21 5.049 18.638 -3.664 1.00 0.00 C ATOM 331 O VAL A 21 4.297 17.816 -3.129 1.00 0.00 O ATOM 332 CB VAL A 21 6.999 19.734 -2.332 1.00 0.00 C ATOM 333 CG1 VAL A 21 7.214 18.552 -1.376 1.00 0.00 C ATOM 334 CG2 VAL A 21 8.047 19.681 -3.444 1.00 0.00 C ATOM 0 H VAL A 21 4.160 19.198 -1.466 1.00 0.00 H new ATOM 0 HA VAL A 21 5.555 20.698 -3.561 1.00 0.00 H new ATOM 0 HB VAL A 21 7.138 20.653 -1.762 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.253 18.536 -1.045 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.560 18.660 -0.511 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.983 17.620 -1.892 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.041 19.596 -3.004 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.857 18.818 -4.082 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.991 20.592 -4.040 1.00 0.00 H new ATOM 344 N THR A 22 5.449 18.517 -4.930 1.00 0.00 N ATOM 345 CA THR A 22 4.903 17.548 -5.879 1.00 0.00 C ATOM 346 C THR A 22 5.954 16.531 -6.310 1.00 0.00 C ATOM 347 O THR A 22 7.155 16.776 -6.207 1.00 0.00 O ATOM 348 CB THR A 22 4.401 18.313 -7.118 1.00 0.00 C ATOM 349 OG1 THR A 22 5.376 19.264 -7.517 1.00 0.00 O ATOM 350 CG2 THR A 22 3.084 19.027 -6.841 1.00 0.00 C ATOM 0 H THR A 22 6.179 19.104 -5.333 1.00 0.00 H new ATOM 0 HA THR A 22 4.091 17.005 -5.396 1.00 0.00 H new ATOM 0 HB THR A 22 4.233 17.588 -7.914 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.056 19.749 -8.306 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.761 19.556 -7.738 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.326 18.296 -6.558 1.00 0.00 H new ATOM 0 HG23 THR A 22 3.221 19.741 -6.029 1.00 0.00 H new ATOM 358 N ARG A 23 5.507 15.434 -6.926 1.00 0.00 N ATOM 359 CA ARG A 23 6.335 14.425 -7.592 1.00 0.00 C ATOM 360 C ARG A 23 7.124 14.946 -8.804 1.00 0.00 C ATOM 361 O ARG A 23 7.674 14.147 -9.556 1.00 0.00 O ATOM 362 CB ARG A 23 5.443 13.222 -7.966 1.00 0.00 C ATOM 363 CG ARG A 23 4.424 13.533 -9.083 1.00 0.00 C ATOM 364 CD ARG A 23 3.365 12.434 -9.253 1.00 0.00 C ATOM 365 NE ARG A 23 3.945 11.117 -9.575 1.00 0.00 N ATOM 366 CZ ARG A 23 4.367 10.702 -10.777 1.00 0.00 C ATOM 367 NH1 ARG A 23 4.306 11.498 -11.843 1.00 0.00 N ATOM 368 NH2 ARG A 23 4.852 9.473 -10.898 1.00 0.00 N ATOM 0 H ARG A 23 4.512 15.215 -6.976 1.00 0.00 H new ATOM 0 HA ARG A 23 7.107 14.121 -6.885 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.077 12.395 -8.284 1.00 0.00 H new ATOM 0 HB3 ARG A 23 4.906 12.888 -7.078 1.00 0.00 H new ATOM 0 HG2 ARG A 23 3.927 14.477 -8.861 1.00 0.00 H new ATOM 0 HG3 ARG A 23 4.956 13.666 -10.025 1.00 0.00 H new ATOM 0 HD2 ARG A 23 2.783 12.353 -8.335 1.00 0.00 H new ATOM 0 HD3 ARG A 23 2.674 12.723 -10.044 1.00 0.00 H new ATOM 0 HE ARG A 23 4.034 10.455 -8.804 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.933 12.443 -11.753 1.00 0.00 H new ATOM 0 HH12 ARG A 23 4.633 11.163 -12.749 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.899 8.861 -10.084 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.178 9.140 -11.806 1.00 0.00 H new ATOM 382 N GLU A 24 7.182 16.259 -9.028 1.00 0.00 N ATOM 383 CA GLU A 24 8.044 16.862 -10.049 1.00 0.00 C ATOM 384 C GLU A 24 8.925 17.990 -9.485 1.00 0.00 C ATOM 385 O GLU A 24 9.688 18.606 -10.230 1.00 0.00 O ATOM 386 CB GLU A 24 7.174 17.324 -11.230 1.00 0.00 C ATOM 387 CG GLU A 24 6.186 18.439 -10.846 1.00 0.00 C ATOM 388 CD GLU A 24 5.389 18.931 -12.067 1.00 0.00 C ATOM 389 OE1 GLU A 24 4.307 18.374 -12.361 1.00 0.00 O ATOM 390 OE2 GLU A 24 5.826 19.892 -12.740 1.00 0.00 O ATOM 0 H GLU A 24 6.630 16.939 -8.505 1.00 0.00 H new ATOM 0 HA GLU A 24 8.747 16.109 -10.406 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.820 17.679 -12.033 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.618 16.472 -11.620 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.498 18.071 -10.085 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.731 19.274 -10.405 1.00 0.00 H new ATOM 397 N GLN A 25 8.845 18.246 -8.175 1.00 0.00 N ATOM 398 CA GLN A 25 9.596 19.285 -7.474 1.00 0.00 C ATOM 399 C GLN A 25 10.318 18.700 -6.247 1.00 0.00 C ATOM 400 O GLN A 25 11.387 19.178 -5.868 1.00 0.00 O ATOM 401 CB GLN A 25 8.593 20.398 -7.121 1.00 0.00 C ATOM 402 CG GLN A 25 9.247 21.633 -6.499 1.00 0.00 C ATOM 403 CD GLN A 25 8.232 22.758 -6.281 1.00 0.00 C ATOM 404 OE1 GLN A 25 7.763 22.992 -5.171 1.00 0.00 O ATOM 405 NE2 GLN A 25 7.858 23.477 -7.327 1.00 0.00 N ATOM 0 H GLN A 25 8.233 17.715 -7.555 1.00 0.00 H new ATOM 0 HA GLN A 25 10.388 19.703 -8.095 1.00 0.00 H new ATOM 0 HB2 GLN A 25 8.059 20.695 -8.024 1.00 0.00 H new ATOM 0 HB3 GLN A 25 7.851 20.001 -6.428 1.00 0.00 H new ATOM 0 HG2 GLN A 25 9.703 21.363 -5.546 1.00 0.00 H new ATOM 0 HG3 GLN A 25 10.049 21.986 -7.147 1.00 0.00 H new ATOM 0 HE21 GLN A 25 8.250 23.280 -8.248 1.00 0.00 H new ATOM 0 HE22 GLN A 25 7.178 24.229 -7.212 1.00 0.00 H new ATOM 414 N LEU A 26 9.774 17.626 -5.664 1.00 0.00 N ATOM 415 CA LEU A 26 10.371 16.827 -4.595 1.00 0.00 C ATOM 416 C LEU A 26 11.560 16.014 -5.111 1.00 0.00 C ATOM 417 O LEU A 26 12.464 15.687 -4.348 1.00 0.00 O ATOM 418 CB LEU A 26 9.258 15.892 -4.083 1.00 0.00 C ATOM 419 CG LEU A 26 9.579 14.997 -2.880 1.00 0.00 C ATOM 420 CD1 LEU A 26 10.035 15.814 -1.672 1.00 0.00 C ATOM 421 CD2 LEU A 26 8.306 14.216 -2.521 1.00 0.00 C ATOM 0 H LEU A 26 8.858 17.275 -5.942 1.00 0.00 H new ATOM 0 HA LEU A 26 10.753 17.466 -3.799 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.396 16.507 -3.824 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.954 15.249 -4.909 1.00 0.00 H new ATOM 0 HG LEU A 26 10.395 14.324 -3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 26 10.253 15.144 -0.841 1.00 0.00 H new ATOM 0 HD12 LEU A 26 10.933 16.375 -1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.245 16.507 -1.382 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.505 13.569 -1.666 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.509 14.915 -2.269 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.000 13.608 -3.372 1.00 0.00 H new ATOM 433 N ILE A 27 11.573 15.720 -6.412 1.00 0.00 N ATOM 434 CA ILE A 27 12.522 14.835 -7.068 1.00 0.00 C ATOM 435 C ILE A 27 13.098 15.514 -8.311 1.00 0.00 C ATOM 436 O ILE A 27 12.612 16.562 -8.748 1.00 0.00 O ATOM 437 CB ILE A 27 11.875 13.466 -7.399 1.00 0.00 C ATOM 438 CG1 ILE A 27 10.350 13.500 -7.662 1.00 0.00 C ATOM 439 CG2 ILE A 27 12.225 12.462 -6.286 1.00 0.00 C ATOM 440 CD1 ILE A 27 9.855 12.189 -8.284 1.00 0.00 C ATOM 0 H ILE A 27 10.890 16.112 -7.061 1.00 0.00 H new ATOM 0 HA ILE A 27 13.346 14.634 -6.384 1.00 0.00 H new ATOM 0 HB ILE A 27 12.298 13.151 -8.353 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.823 13.681 -6.725 1.00 0.00 H new ATOM 0 HG13 ILE A 27 10.113 14.331 -8.327 1.00 0.00 H new ATOM 0 HG21 ILE A 27 11.773 11.496 -6.512 1.00 0.00 H new ATOM 0 HG22 ILE A 27 13.307 12.351 -6.224 1.00 0.00 H new ATOM 0 HG23 ILE A 27 11.843 12.827 -5.333 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.780 12.250 -8.454 1.00 0.00 H new ATOM 0 HD12 ILE A 27 10.364 12.022 -9.233 1.00 0.00 H new ATOM 0 HD13 ILE A 27 10.069 11.362 -7.607 1.00 0.00 H new ATOM 452 N GLY A 28 14.164 14.916 -8.849 1.00 0.00 N ATOM 453 CA GLY A 28 14.975 15.451 -9.933 1.00 0.00 C ATOM 454 C GLY A 28 16.374 15.843 -9.451 1.00 0.00 C ATOM 455 O GLY A 28 17.242 16.096 -10.286 1.00 0.00 O ATOM 0 H GLY A 28 14.495 14.008 -8.524 1.00 0.00 H new ATOM 0 HA2 GLY A 28 15.058 14.708 -10.727 1.00 0.00 H new ATOM 0 HA3 GLY A 28 14.480 16.322 -10.362 1.00 0.00 H new ATOM 459 N GLU A 29 16.636 15.829 -8.136 1.00 0.00 N ATOM 460 CA GLU A 29 17.856 16.405 -7.568 1.00 0.00 C ATOM 461 C GLU A 29 18.507 15.532 -6.494 1.00 0.00 C ATOM 462 O GLU A 29 19.697 15.232 -6.604 1.00 0.00 O ATOM 463 CB GLU A 29 17.456 17.777 -6.987 1.00 0.00 C ATOM 464 CG GLU A 29 18.590 18.549 -6.297 1.00 0.00 C ATOM 465 CD GLU A 29 18.061 19.832 -5.632 1.00 0.00 C ATOM 466 OE1 GLU A 29 17.459 19.742 -4.536 1.00 0.00 O ATOM 467 OE2 GLU A 29 18.256 20.938 -6.190 1.00 0.00 O ATOM 0 H GLU A 29 16.010 15.420 -7.443 1.00 0.00 H new ATOM 0 HA GLU A 29 18.611 16.490 -8.350 1.00 0.00 H new ATOM 0 HB2 GLU A 29 17.056 18.393 -7.793 1.00 0.00 H new ATOM 0 HB3 GLU A 29 16.649 17.629 -6.269 1.00 0.00 H new ATOM 0 HG2 GLU A 29 19.062 17.915 -5.547 1.00 0.00 H new ATOM 0 HG3 GLU A 29 19.358 18.804 -7.028 1.00 0.00 H new ATOM 474 N LYS A 30 17.761 15.121 -5.465 1.00 0.00 N ATOM 475 CA LYS A 30 18.312 14.414 -4.309 1.00 0.00 C ATOM 476 C LYS A 30 17.258 13.449 -3.756 1.00 0.00 C ATOM 477 O LYS A 30 16.073 13.677 -4.015 1.00 0.00 O ATOM 478 CB LYS A 30 18.815 15.435 -3.267 1.00 0.00 C ATOM 479 CG LYS A 30 17.726 16.319 -2.639 1.00 0.00 C ATOM 480 CD LYS A 30 18.358 17.516 -1.918 1.00 0.00 C ATOM 481 CE LYS A 30 17.341 18.400 -1.179 1.00 0.00 C ATOM 482 NZ LYS A 30 16.350 19.037 -2.083 1.00 0.00 N ATOM 0 H LYS A 30 16.753 15.271 -5.412 1.00 0.00 H new ATOM 0 HA LYS A 30 19.174 13.812 -4.596 1.00 0.00 H new ATOM 0 HB2 LYS A 30 19.326 14.895 -2.470 1.00 0.00 H new ATOM 0 HB3 LYS A 30 19.555 16.080 -3.741 1.00 0.00 H new ATOM 0 HG2 LYS A 30 17.044 16.671 -3.413 1.00 0.00 H new ATOM 0 HG3 LYS A 30 17.135 15.733 -1.935 1.00 0.00 H new ATOM 0 HD2 LYS A 30 19.095 17.150 -1.203 1.00 0.00 H new ATOM 0 HD3 LYS A 30 18.894 18.125 -2.646 1.00 0.00 H new ATOM 0 HE2 LYS A 30 16.813 17.796 -0.441 1.00 0.00 H new ATOM 0 HE3 LYS A 30 17.875 19.177 -0.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 16.175 20.014 -1.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 16.720 19.043 -3.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 15.460 18.500 -2.055 1.00 0.00 H new ATOM 496 N PRO A 31 17.661 12.358 -3.073 1.00 0.00 N ATOM 497 CA PRO A 31 16.744 11.387 -2.485 1.00 0.00 C ATOM 498 C PRO A 31 15.674 12.013 -1.588 1.00 0.00 C ATOM 499 O PRO A 31 15.728 13.187 -1.210 1.00 0.00 O ATOM 500 CB PRO A 31 17.627 10.385 -1.730 1.00 0.00 C ATOM 501 CG PRO A 31 18.937 10.428 -2.508 1.00 0.00 C ATOM 502 CD PRO A 31 19.037 11.904 -2.889 1.00 0.00 C ATOM 0 HA PRO A 31 16.160 10.900 -3.266 1.00 0.00 H new ATOM 0 HB2 PRO A 31 17.766 10.675 -0.689 1.00 0.00 H new ATOM 0 HB3 PRO A 31 17.192 9.386 -1.727 1.00 0.00 H new ATOM 0 HG2 PRO A 31 19.782 10.106 -1.900 1.00 0.00 H new ATOM 0 HG3 PRO A 31 18.911 9.782 -3.385 1.00 0.00 H new ATOM 0 HD2 PRO A 31 19.537 12.477 -2.108 1.00 0.00 H new ATOM 0 HD3 PRO A 31 19.618 12.034 -3.802 1.00 0.00 H new ATOM 510 N THR A 32 14.690 11.207 -1.217 1.00 0.00 N ATOM 511 CA THR A 32 13.518 11.650 -0.477 1.00 0.00 C ATOM 512 C THR A 32 13.146 10.620 0.589 1.00 0.00 C ATOM 513 O THR A 32 13.399 9.424 0.437 1.00 0.00 O ATOM 514 CB THR A 32 12.387 11.885 -1.492 1.00 0.00 C ATOM 515 OG1 THR A 32 12.722 12.974 -2.328 1.00 0.00 O ATOM 516 CG2 THR A 32 11.029 12.193 -0.863 1.00 0.00 C ATOM 0 H THR A 32 14.684 10.209 -1.426 1.00 0.00 H new ATOM 0 HA THR A 32 13.714 12.581 0.054 1.00 0.00 H new ATOM 0 HB THR A 32 12.291 10.948 -2.041 1.00 0.00 H new ATOM 0 HG1 THR A 32 12.190 12.931 -3.150 1.00 0.00 H new ATOM 0 HG21 THR A 32 10.290 12.345 -1.649 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.722 11.358 -0.233 1.00 0.00 H new ATOM 0 HG23 THR A 32 11.105 13.096 -0.257 1.00 0.00 H new ATOM 524 N LEU A 33 12.504 11.093 1.655 1.00 0.00 N ATOM 525 CA LEU A 33 11.860 10.297 2.683 1.00 0.00 C ATOM 526 C LEU A 33 10.458 10.879 2.822 1.00 0.00 C ATOM 527 O LEU A 33 10.327 12.063 3.136 1.00 0.00 O ATOM 528 CB LEU A 33 12.638 10.386 4.011 1.00 0.00 C ATOM 529 CG LEU A 33 11.836 9.920 5.246 1.00 0.00 C ATOM 530 CD1 LEU A 33 11.316 8.486 5.121 1.00 0.00 C ATOM 531 CD2 LEU A 33 12.704 10.005 6.502 1.00 0.00 C ATOM 0 H LEU A 33 12.418 12.094 1.829 1.00 0.00 H new ATOM 0 HA LEU A 33 11.829 9.239 2.422 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.543 9.783 3.930 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.955 11.417 4.165 1.00 0.00 H new ATOM 0 HG LEU A 33 10.977 10.587 5.315 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.762 8.220 6.021 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.659 8.412 4.255 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.157 7.803 4.998 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.127 9.674 7.366 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.579 9.366 6.383 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.025 11.036 6.653 1.00 0.00 H new ATOM 543 N ILE A 34 9.433 10.062 2.583 1.00 0.00 N ATOM 544 CA ILE A 34 8.051 10.403 2.889 1.00 0.00 C ATOM 545 C ILE A 34 7.698 9.538 4.098 1.00 0.00 C ATOM 546 O ILE A 34 7.993 8.337 4.088 1.00 0.00 O ATOM 547 CB ILE A 34 7.098 10.139 1.701 1.00 0.00 C ATOM 548 CG1 ILE A 34 7.652 10.721 0.379 1.00 0.00 C ATOM 549 CG2 ILE A 34 5.705 10.718 2.031 1.00 0.00 C ATOM 550 CD1 ILE A 34 6.735 10.520 -0.831 1.00 0.00 C ATOM 0 H ILE A 34 9.543 9.137 2.168 1.00 0.00 H new ATOM 0 HA ILE A 34 7.940 11.468 3.095 1.00 0.00 H new ATOM 0 HB ILE A 34 7.013 9.063 1.552 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.830 11.788 0.512 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.617 10.260 0.169 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.028 10.535 1.197 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.314 10.237 2.928 1.00 0.00 H new ATOM 0 HG23 ILE A 34 5.788 11.791 2.202 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.198 10.957 -1.715 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.576 9.454 -0.994 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.777 11.006 -0.646 1.00 0.00 H new ATOM 562 N HIS A 35 7.050 10.107 5.116 1.00 0.00 N ATOM 563 CA HIS A 35 6.493 9.302 6.198 1.00 0.00 C ATOM 564 C HIS A 35 5.017 9.621 6.431 1.00 0.00 C ATOM 565 O HIS A 35 4.527 10.693 6.072 1.00 0.00 O ATOM 566 CB HIS A 35 7.372 9.367 7.459 1.00 0.00 C ATOM 567 CG HIS A 35 7.237 10.605 8.303 1.00 0.00 C ATOM 568 ND1 HIS A 35 6.622 10.676 9.532 1.00 0.00 N ATOM 569 CD2 HIS A 35 7.743 11.847 8.030 1.00 0.00 C ATOM 570 CE1 HIS A 35 6.733 11.937 9.978 1.00 0.00 C ATOM 571 NE2 HIS A 35 7.415 12.691 9.100 1.00 0.00 N ATOM 0 H HIS A 35 6.900 11.111 5.212 1.00 0.00 H new ATOM 0 HA HIS A 35 6.510 8.254 5.897 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.142 8.502 8.081 1.00 0.00 H new ATOM 0 HB3 HIS A 35 8.414 9.273 7.155 1.00 0.00 H new ATOM 0 HD1 HIS A 35 6.163 9.906 10.018 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.297 12.127 7.146 1.00 0.00 H new ATOM 0 HE1 HIS A 35 6.330 12.296 10.913 1.00 0.00 H new ATOM 579 N PHE A 36 4.316 8.662 7.030 1.00 0.00 N ATOM 580 CA PHE A 36 2.873 8.598 7.193 1.00 0.00 C ATOM 581 C PHE A 36 2.666 8.400 8.687 1.00 0.00 C ATOM 582 O PHE A 36 3.207 7.442 9.239 1.00 0.00 O ATOM 583 CB PHE A 36 2.306 7.444 6.355 1.00 0.00 C ATOM 584 CG PHE A 36 2.483 7.670 4.864 1.00 0.00 C ATOM 585 CD1 PHE A 36 3.725 7.405 4.255 1.00 0.00 C ATOM 586 CD2 PHE A 36 1.428 8.195 4.095 1.00 0.00 C ATOM 587 CE1 PHE A 36 3.926 7.701 2.896 1.00 0.00 C ATOM 588 CE2 PHE A 36 1.630 8.489 2.734 1.00 0.00 C ATOM 589 CZ PHE A 36 2.883 8.258 2.141 1.00 0.00 C ATOM 0 H PHE A 36 4.779 7.852 7.443 1.00 0.00 H new ATOM 0 HA PHE A 36 2.353 9.492 6.848 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.800 6.515 6.640 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.246 7.323 6.578 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.527 6.972 4.835 1.00 0.00 H new ATOM 0 HD2 PHE A 36 0.464 8.372 4.549 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.881 7.500 2.434 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.821 8.893 2.144 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.043 8.510 1.103 1.00 0.00 H new ATOM 599 N TRP A 37 1.964 9.310 9.360 1.00 0.00 N ATOM 600 CA TRP A 37 1.906 9.342 10.826 1.00 0.00 C ATOM 601 C TRP A 37 0.589 9.946 11.320 1.00 0.00 C ATOM 602 O TRP A 37 -0.152 10.540 10.536 1.00 0.00 O ATOM 603 CB TRP A 37 3.112 10.144 11.357 1.00 0.00 C ATOM 604 CG TRP A 37 3.263 11.517 10.774 1.00 0.00 C ATOM 605 CD1 TRP A 37 3.573 11.785 9.487 1.00 0.00 C ATOM 606 CD2 TRP A 37 3.104 12.820 11.414 1.00 0.00 C ATOM 607 NE1 TRP A 37 3.523 13.140 9.268 1.00 0.00 N ATOM 608 CE2 TRP A 37 3.268 13.832 10.423 1.00 0.00 C ATOM 609 CE3 TRP A 37 2.834 13.262 12.724 1.00 0.00 C ATOM 610 CZ2 TRP A 37 3.153 15.196 10.706 1.00 0.00 C ATOM 611 CZ3 TRP A 37 2.721 14.635 13.020 1.00 0.00 C ATOM 612 CH2 TRP A 37 2.877 15.604 12.016 1.00 0.00 C ATOM 0 H TRP A 37 1.420 10.045 8.909 1.00 0.00 H new ATOM 0 HA TRP A 37 1.951 8.321 11.206 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.022 10.233 12.440 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.022 9.578 11.158 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.823 11.045 8.742 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.659 13.578 8.357 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.712 12.536 13.515 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 3.276 15.928 9.921 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.512 14.946 14.033 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.785 16.654 12.252 1.00 0.00 H new ATOM 623 N SER A 38 0.326 9.798 12.621 1.00 0.00 N ATOM 624 CA SER A 38 -0.900 10.190 13.307 1.00 0.00 C ATOM 625 C SER A 38 -0.522 10.618 14.729 1.00 0.00 C ATOM 626 O SER A 38 0.124 9.840 15.434 1.00 0.00 O ATOM 627 CB SER A 38 -1.846 8.984 13.342 1.00 0.00 C ATOM 628 OG SER A 38 -2.370 8.714 12.056 1.00 0.00 O ATOM 0 H SER A 38 1.004 9.377 13.257 1.00 0.00 H new ATOM 0 HA SER A 38 -1.399 11.014 12.797 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.312 8.109 13.712 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.662 9.177 14.038 1.00 0.00 H new ATOM 0 HG SER A 38 -2.855 9.500 11.729 1.00 0.00 H new ATOM 634 N ILE A 39 -0.874 11.838 15.159 1.00 0.00 N ATOM 635 CA ILE A 39 -0.513 12.345 16.488 1.00 0.00 C ATOM 636 C ILE A 39 -1.058 11.459 17.625 1.00 0.00 C ATOM 637 O ILE A 39 -0.507 11.477 18.725 1.00 0.00 O ATOM 638 CB ILE A 39 -0.890 13.838 16.682 1.00 0.00 C ATOM 639 CG1 ILE A 39 -2.393 14.183 16.556 1.00 0.00 C ATOM 640 CG2 ILE A 39 -0.055 14.734 15.748 1.00 0.00 C ATOM 641 CD1 ILE A 39 -2.670 15.655 16.900 1.00 0.00 C ATOM 0 H ILE A 39 -1.414 12.497 14.598 1.00 0.00 H new ATOM 0 HA ILE A 39 0.574 12.291 16.543 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.651 14.040 17.726 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.729 13.977 15.540 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.971 13.539 17.219 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.334 15.777 15.899 1.00 0.00 H new ATOM 0 HG22 ILE A 39 1.004 14.606 15.972 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.243 14.454 14.711 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.736 15.858 16.800 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.358 15.854 17.925 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.113 16.299 16.220 1.00 0.00 H new ATOM 653 N SER A 40 -2.102 10.668 17.380 1.00 0.00 N ATOM 654 CA SER A 40 -2.730 9.804 18.372 1.00 0.00 C ATOM 655 C SER A 40 -1.846 8.653 18.882 1.00 0.00 C ATOM 656 O SER A 40 -2.205 8.046 19.895 1.00 0.00 O ATOM 657 CB SER A 40 -4.017 9.229 17.773 1.00 0.00 C ATOM 658 OG SER A 40 -4.847 10.272 17.320 1.00 0.00 O ATOM 0 H SER A 40 -2.544 10.611 16.462 1.00 0.00 H new ATOM 0 HA SER A 40 -2.924 10.429 19.243 1.00 0.00 H new ATOM 0 HB2 SER A 40 -3.776 8.560 16.947 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.542 8.635 18.521 1.00 0.00 H new ATOM 0 HG SER A 40 -4.331 10.874 16.745 1.00 0.00 H new ATOM 664 N CYS A 41 -0.723 8.321 18.227 1.00 0.00 N ATOM 665 CA CYS A 41 0.041 7.112 18.533 1.00 0.00 C ATOM 666 C CYS A 41 1.395 7.491 19.133 1.00 0.00 C ATOM 667 O CYS A 41 2.088 8.364 18.608 1.00 0.00 O ATOM 668 CB CYS A 41 0.218 6.277 17.255 1.00 0.00 C ATOM 669 SG CYS A 41 -1.381 5.944 16.449 1.00 0.00 S ATOM 0 H CYS A 41 -0.324 8.883 17.475 1.00 0.00 H new ATOM 0 HA CYS A 41 -0.499 6.512 19.265 1.00 0.00 H new ATOM 0 HB2 CYS A 41 0.873 6.805 16.562 1.00 0.00 H new ATOM 0 HB3 CYS A 41 0.707 5.334 17.500 1.00 0.00 H new ATOM 0 HG CYS A 41 -1.187 5.239 15.374 1.00 0.00 H new ATOM 675 N HIS A 42 1.803 6.820 20.213 1.00 0.00 N ATOM 676 CA HIS A 42 3.021 7.186 20.933 1.00 0.00 C ATOM 677 C HIS A 42 4.276 6.963 20.087 1.00 0.00 C ATOM 678 O HIS A 42 5.200 7.770 20.142 1.00 0.00 O ATOM 679 CB HIS A 42 3.097 6.421 22.261 1.00 0.00 C ATOM 680 CG HIS A 42 4.304 6.784 23.094 1.00 0.00 C ATOM 681 ND1 HIS A 42 4.473 7.934 23.835 1.00 0.00 N ATOM 682 CD2 HIS A 42 5.446 6.040 23.240 1.00 0.00 C ATOM 683 CE1 HIS A 42 5.686 7.881 24.412 1.00 0.00 C ATOM 684 NE2 HIS A 42 6.320 6.739 24.084 1.00 0.00 N ATOM 0 H HIS A 42 1.306 6.021 20.607 1.00 0.00 H new ATOM 0 HA HIS A 42 2.977 8.254 21.148 1.00 0.00 H new ATOM 0 HB2 HIS A 42 2.194 6.619 22.838 1.00 0.00 H new ATOM 0 HB3 HIS A 42 3.116 5.351 22.055 1.00 0.00 H new ATOM 0 HD2 HIS A 42 5.639 5.081 22.783 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.096 8.649 25.051 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.248 6.443 24.388 1.00 0.00 H new ATOM 692 N LEU A 43 4.312 5.912 19.258 1.00 0.00 N ATOM 693 CA LEU A 43 5.449 5.685 18.362 1.00 0.00 C ATOM 694 C LEU A 43 5.584 6.845 17.372 1.00 0.00 C ATOM 695 O LEU A 43 6.711 7.238 17.070 1.00 0.00 O ATOM 696 CB LEU A 43 5.329 4.338 17.618 1.00 0.00 C ATOM 697 CG LEU A 43 6.017 3.135 18.294 1.00 0.00 C ATOM 698 CD1 LEU A 43 7.548 3.236 18.213 1.00 0.00 C ATOM 699 CD2 LEU A 43 5.581 2.935 19.750 1.00 0.00 C ATOM 0 H LEU A 43 3.573 5.212 19.190 1.00 0.00 H new ATOM 0 HA LEU A 43 6.351 5.638 18.972 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.271 4.105 17.495 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.748 4.458 16.619 1.00 0.00 H new ATOM 0 HG LEU A 43 5.692 2.259 17.733 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.996 2.370 18.700 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.856 3.264 17.168 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.880 4.146 18.713 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.100 2.073 20.170 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.827 3.825 20.329 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.505 2.764 19.787 1.00 0.00 H new ATOM 711 N CYS A 44 4.470 7.441 16.919 1.00 0.00 N ATOM 712 CA CYS A 44 4.529 8.679 16.154 1.00 0.00 C ATOM 713 C CYS A 44 5.185 9.760 17.004 1.00 0.00 C ATOM 714 O CYS A 44 6.135 10.368 16.539 1.00 0.00 O ATOM 715 CB CYS A 44 3.153 9.137 15.660 1.00 0.00 C ATOM 716 SG CYS A 44 2.363 7.866 14.634 1.00 0.00 S ATOM 0 H CYS A 44 3.527 7.082 17.072 1.00 0.00 H new ATOM 0 HA CYS A 44 5.126 8.493 15.261 1.00 0.00 H new ATOM 0 HB2 CYS A 44 2.515 9.366 16.514 1.00 0.00 H new ATOM 0 HB3 CYS A 44 3.258 10.057 15.085 1.00 0.00 H new ATOM 0 HG CYS A 44 1.073 8.029 14.658 1.00 0.00 H new ATOM 722 N LYS A 45 4.762 9.971 18.254 1.00 0.00 N ATOM 723 CA LYS A 45 5.338 11.026 19.097 1.00 0.00 C ATOM 724 C LYS A 45 6.822 10.864 19.405 1.00 0.00 C ATOM 725 O LYS A 45 7.427 11.817 19.886 1.00 0.00 O ATOM 726 CB LYS A 45 4.612 11.140 20.438 1.00 0.00 C ATOM 727 CG LYS A 45 3.109 11.464 20.369 1.00 0.00 C ATOM 728 CD LYS A 45 2.789 12.565 19.341 1.00 0.00 C ATOM 729 CE LYS A 45 1.572 13.422 19.716 1.00 0.00 C ATOM 730 NZ LYS A 45 1.893 14.446 20.746 1.00 0.00 N ATOM 0 H LYS A 45 4.025 9.428 18.704 1.00 0.00 H new ATOM 0 HA LYS A 45 5.211 11.924 18.493 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.736 10.200 20.976 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.103 11.913 21.029 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.557 10.560 20.112 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.763 11.779 21.353 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.659 13.213 19.232 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.612 12.103 18.370 1.00 0.00 H new ATOM 0 HE2 LYS A 45 1.191 13.917 18.823 1.00 0.00 H new ATOM 0 HE3 LYS A 45 0.776 12.775 20.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.043 15.009 20.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.216 13.975 21.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.645 15.071 20.392 1.00 0.00 H new ATOM 744 N GLU A 46 7.407 9.697 19.175 1.00 0.00 N ATOM 745 CA GLU A 46 8.839 9.468 19.347 1.00 0.00 C ATOM 746 C GLU A 46 9.551 9.696 18.001 1.00 0.00 C ATOM 747 O GLU A 46 10.592 10.364 17.914 1.00 0.00 O ATOM 748 CB GLU A 46 9.021 8.035 19.869 1.00 0.00 C ATOM 749 CG GLU A 46 8.384 7.826 21.259 1.00 0.00 C ATOM 750 CD GLU A 46 9.277 8.368 22.391 1.00 0.00 C ATOM 751 OE1 GLU A 46 10.168 7.631 22.873 1.00 0.00 O ATOM 752 OE2 GLU A 46 9.103 9.534 22.811 1.00 0.00 O ATOM 0 H GLU A 46 6.897 8.872 18.860 1.00 0.00 H new ATOM 0 HA GLU A 46 9.279 10.160 20.065 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.578 7.335 19.161 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.085 7.804 19.922 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.415 8.324 21.292 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.202 6.763 21.418 1.00 0.00 H new ATOM 759 N ALA A 47 8.940 9.209 16.917 1.00 0.00 N ATOM 760 CA ALA A 47 9.433 9.451 15.578 1.00 0.00 C ATOM 761 C ALA A 47 9.427 10.942 15.275 1.00 0.00 C ATOM 762 O ALA A 47 10.395 11.418 14.716 1.00 0.00 O ATOM 763 CB ALA A 47 8.590 8.674 14.560 1.00 0.00 C ATOM 0 H ALA A 47 8.094 8.640 16.953 1.00 0.00 H new ATOM 0 HA ALA A 47 10.462 9.099 15.507 1.00 0.00 H new ATOM 0 HB1 ALA A 47 8.968 8.862 13.555 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.650 7.607 14.776 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.552 8.999 14.624 1.00 0.00 H new ATOM 769 N MET A 48 8.401 11.690 15.671 1.00 0.00 N ATOM 770 CA MET A 48 8.209 13.102 15.389 1.00 0.00 C ATOM 771 C MET A 48 9.387 13.994 15.835 1.00 0.00 C ATOM 772 O MET A 48 9.923 14.718 14.996 1.00 0.00 O ATOM 773 CB MET A 48 6.864 13.497 16.002 1.00 0.00 C ATOM 774 CG MET A 48 5.706 13.000 15.111 1.00 0.00 C ATOM 775 SD MET A 48 4.098 12.894 15.936 1.00 0.00 S ATOM 776 CE MET A 48 3.989 14.622 16.407 1.00 0.00 C ATOM 0 H MET A 48 7.641 11.301 16.229 1.00 0.00 H new ATOM 0 HA MET A 48 8.189 13.268 14.312 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.772 13.071 17.001 1.00 0.00 H new ATOM 0 HB3 MET A 48 6.810 14.580 16.111 1.00 0.00 H new ATOM 0 HG2 MET A 48 5.615 13.667 14.254 1.00 0.00 H new ATOM 0 HG3 MET A 48 5.964 12.015 14.722 1.00 0.00 H new ATOM 0 HE1 MET A 48 3.271 14.733 17.220 1.00 0.00 H new ATOM 0 HE2 MET A 48 4.967 14.972 16.737 1.00 0.00 H new ATOM 0 HE3 MET A 48 3.662 15.213 15.551 1.00 0.00 H new ATOM 786 N PRO A 49 9.875 13.944 17.088 1.00 0.00 N ATOM 787 CA PRO A 49 11.106 14.628 17.451 1.00 0.00 C ATOM 788 C PRO A 49 12.298 14.085 16.664 1.00 0.00 C ATOM 789 O PRO A 49 13.168 14.874 16.277 1.00 0.00 O ATOM 790 CB PRO A 49 11.288 14.446 18.960 1.00 0.00 C ATOM 791 CG PRO A 49 10.312 13.345 19.356 1.00 0.00 C ATOM 792 CD PRO A 49 9.256 13.360 18.255 1.00 0.00 C ATOM 0 HA PRO A 49 11.047 15.688 17.203 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.314 14.167 19.201 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.075 15.371 19.496 1.00 0.00 H new ATOM 0 HG2 PRO A 49 10.809 12.377 19.417 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.870 13.539 20.333 1.00 0.00 H new ATOM 0 HD2 PRO A 49 8.906 12.350 18.042 1.00 0.00 H new ATOM 0 HD3 PRO A 49 8.386 13.941 18.562 1.00 0.00 H new ATOM 800 N GLN A 50 12.352 12.776 16.374 1.00 0.00 N ATOM 801 CA GLN A 50 13.454 12.300 15.547 1.00 0.00 C ATOM 802 C GLN A 50 13.367 12.872 14.127 1.00 0.00 C ATOM 803 O GLN A 50 14.404 13.230 13.593 1.00 0.00 O ATOM 804 CB GLN A 50 13.640 10.774 15.593 1.00 0.00 C ATOM 805 CG GLN A 50 15.139 10.395 15.645 1.00 0.00 C ATOM 806 CD GLN A 50 15.785 10.066 14.294 1.00 0.00 C ATOM 807 OE1 GLN A 50 16.568 10.831 13.739 1.00 0.00 O ATOM 808 NE2 GLN A 50 15.531 8.885 13.763 1.00 0.00 N ATOM 0 H GLN A 50 11.684 12.069 16.682 1.00 0.00 H new ATOM 0 HA GLN A 50 14.374 12.689 15.984 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.129 10.369 16.466 1.00 0.00 H new ATOM 0 HB3 GLN A 50 13.178 10.322 14.715 1.00 0.00 H new ATOM 0 HG2 GLN A 50 15.689 11.219 16.099 1.00 0.00 H new ATOM 0 HG3 GLN A 50 15.255 9.534 16.303 1.00 0.00 H new ATOM 0 HE21 GLN A 50 14.881 8.248 14.223 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.985 8.609 12.892 1.00 0.00 H new ATOM 817 N VAL A 51 12.177 13.072 13.549 1.00 0.00 N ATOM 818 CA VAL A 51 11.968 13.760 12.275 1.00 0.00 C ATOM 819 C VAL A 51 12.566 15.166 12.360 1.00 0.00 C ATOM 820 O VAL A 51 13.146 15.610 11.374 1.00 0.00 O ATOM 821 CB VAL A 51 10.469 13.781 11.866 1.00 0.00 C ATOM 822 CG1 VAL A 51 10.209 14.591 10.593 1.00 0.00 C ATOM 823 CG2 VAL A 51 9.877 12.384 11.608 1.00 0.00 C ATOM 0 H VAL A 51 11.307 12.748 13.971 1.00 0.00 H new ATOM 0 HA VAL A 51 12.481 13.210 11.486 1.00 0.00 H new ATOM 0 HB VAL A 51 9.988 14.241 12.729 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.145 14.568 10.358 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.525 15.623 10.747 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.772 14.159 9.766 1.00 0.00 H new ATOM 0 HG21 VAL A 51 8.828 12.479 11.327 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.426 11.900 10.801 1.00 0.00 H new ATOM 0 HG23 VAL A 51 9.957 11.782 12.513 1.00 0.00 H new ATOM 833 N ASN A 52 12.502 15.851 13.514 1.00 0.00 N ATOM 834 CA ASN A 52 13.166 17.149 13.660 1.00 0.00 C ATOM 835 C ASN A 52 14.677 17.011 13.433 1.00 0.00 C ATOM 836 O ASN A 52 15.246 17.730 12.603 1.00 0.00 O ATOM 837 CB ASN A 52 12.799 17.830 14.998 1.00 0.00 C ATOM 838 CG ASN A 52 13.990 18.200 15.887 1.00 0.00 C ATOM 839 OD1 ASN A 52 14.549 19.286 15.786 1.00 0.00 O ATOM 840 ND2 ASN A 52 14.409 17.314 16.774 1.00 0.00 N ATOM 0 H ASN A 52 12.005 15.531 14.345 1.00 0.00 H new ATOM 0 HA ASN A 52 12.797 17.820 12.885 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.231 18.735 14.783 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.141 17.165 15.557 1.00 0.00 H new ATOM 0 HD21 ASN A 52 15.201 17.533 17.378 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.940 16.412 16.854 1.00 0.00 H new ATOM 847 N GLU A 53 15.353 16.065 14.093 1.00 0.00 N ATOM 848 CA GLU A 53 16.793 15.942 13.858 1.00 0.00 C ATOM 849 C GLU A 53 17.080 15.315 12.487 1.00 0.00 C ATOM 850 O GLU A 53 18.115 15.605 11.900 1.00 0.00 O ATOM 851 CB GLU A 53 17.537 15.259 15.016 1.00 0.00 C ATOM 852 CG GLU A 53 17.107 13.821 15.295 1.00 0.00 C ATOM 853 CD GLU A 53 18.069 13.127 16.272 1.00 0.00 C ATOM 854 OE1 GLU A 53 19.060 12.523 15.802 1.00 0.00 O ATOM 855 OE2 GLU A 53 17.841 13.175 17.502 1.00 0.00 O ATOM 0 H GLU A 53 14.952 15.405 14.760 1.00 0.00 H new ATOM 0 HA GLU A 53 17.203 16.952 13.831 1.00 0.00 H new ATOM 0 HB2 GLU A 53 18.605 15.268 14.798 1.00 0.00 H new ATOM 0 HB3 GLU A 53 17.391 15.849 15.921 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.099 13.815 15.709 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.071 13.263 14.360 1.00 0.00 H new ATOM 862 N PHE A 54 16.168 14.522 11.921 1.00 0.00 N ATOM 863 CA PHE A 54 16.299 13.905 10.607 1.00 0.00 C ATOM 864 C PHE A 54 16.316 15.006 9.556 1.00 0.00 C ATOM 865 O PHE A 54 17.174 15.035 8.673 1.00 0.00 O ATOM 866 CB PHE A 54 15.122 12.942 10.374 1.00 0.00 C ATOM 867 CG PHE A 54 15.465 11.714 9.572 1.00 0.00 C ATOM 868 CD1 PHE A 54 15.523 11.774 8.171 1.00 0.00 C ATOM 869 CD2 PHE A 54 15.699 10.496 10.237 1.00 0.00 C ATOM 870 CE1 PHE A 54 15.836 10.619 7.439 1.00 0.00 C ATOM 871 CE2 PHE A 54 15.974 9.333 9.502 1.00 0.00 C ATOM 872 CZ PHE A 54 16.049 9.395 8.101 1.00 0.00 C ATOM 0 H PHE A 54 15.290 14.286 12.383 1.00 0.00 H new ATOM 0 HA PHE A 54 17.225 13.334 10.542 1.00 0.00 H new ATOM 0 HB2 PHE A 54 14.728 12.630 11.341 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.324 13.482 9.864 1.00 0.00 H new ATOM 0 HD1 PHE A 54 15.328 12.705 7.659 1.00 0.00 H new ATOM 0 HD2 PHE A 54 15.667 10.456 11.316 1.00 0.00 H new ATOM 0 HE1 PHE A 54 15.914 10.669 6.363 1.00 0.00 H new ATOM 0 HE2 PHE A 54 16.127 8.393 10.012 1.00 0.00 H new ATOM 0 HZ PHE A 54 16.270 8.504 7.532 1.00 0.00 H new ATOM 882 N ARG A 55 15.392 15.960 9.703 1.00 0.00 N ATOM 883 CA ARG A 55 15.321 17.150 8.886 1.00 0.00 C ATOM 884 C ARG A 55 16.643 17.893 8.957 1.00 0.00 C ATOM 885 O ARG A 55 17.151 18.259 7.909 1.00 0.00 O ATOM 886 CB ARG A 55 14.075 17.971 9.285 1.00 0.00 C ATOM 887 CG ARG A 55 14.036 19.451 8.833 1.00 0.00 C ATOM 888 CD ARG A 55 13.707 20.411 9.990 1.00 0.00 C ATOM 889 NE ARG A 55 14.634 20.231 11.123 1.00 0.00 N ATOM 890 CZ ARG A 55 14.562 20.835 12.318 1.00 0.00 C ATOM 891 NH1 ARG A 55 13.719 21.826 12.549 1.00 0.00 N ATOM 892 NH2 ARG A 55 15.331 20.415 13.309 1.00 0.00 N ATOM 0 H ARG A 55 14.661 15.915 10.413 1.00 0.00 H new ATOM 0 HA ARG A 55 15.184 16.911 7.831 1.00 0.00 H new ATOM 0 HB2 ARG A 55 13.195 17.470 8.881 1.00 0.00 H new ATOM 0 HB3 ARG A 55 13.986 17.946 10.371 1.00 0.00 H new ATOM 0 HG2 ARG A 55 15.000 19.722 8.403 1.00 0.00 H new ATOM 0 HG3 ARG A 55 13.292 19.568 8.045 1.00 0.00 H new ATOM 0 HD2 ARG A 55 13.759 21.441 9.636 1.00 0.00 H new ATOM 0 HD3 ARG A 55 12.684 20.241 10.325 1.00 0.00 H new ATOM 0 HE ARG A 55 15.408 19.581 10.983 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.099 22.152 11.807 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.688 22.265 13.469 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.973 19.637 13.161 1.00 0.00 H new ATOM 0 HH22 ARG A 55 15.282 20.870 14.221 1.00 0.00 H new ATOM 906 N ASP A 56 17.240 18.086 10.135 1.00 0.00 N ATOM 907 CA ASP A 56 18.483 18.853 10.218 1.00 0.00 C ATOM 908 C ASP A 56 19.638 18.079 9.592 1.00 0.00 C ATOM 909 O ASP A 56 20.418 18.641 8.819 1.00 0.00 O ATOM 910 CB ASP A 56 18.812 19.171 11.670 1.00 0.00 C ATOM 911 CG ASP A 56 20.150 19.921 11.777 1.00 0.00 C ATOM 912 OD1 ASP A 56 20.199 21.122 11.429 1.00 0.00 O ATOM 913 OD2 ASP A 56 21.150 19.324 12.231 1.00 0.00 O ATOM 0 H ASP A 56 16.892 17.731 11.026 1.00 0.00 H new ATOM 0 HA ASP A 56 18.343 19.784 9.668 1.00 0.00 H new ATOM 0 HB2 ASP A 56 18.016 19.776 12.104 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.861 18.247 12.247 1.00 0.00 H new ATOM 918 N LYS A 57 19.717 16.776 9.883 1.00 0.00 N ATOM 919 CA LYS A 57 20.798 15.922 9.416 1.00 0.00 C ATOM 920 C LYS A 57 20.833 15.840 7.892 1.00 0.00 C ATOM 921 O LYS A 57 21.920 15.719 7.321 1.00 0.00 O ATOM 922 CB LYS A 57 20.681 14.508 10.022 1.00 0.00 C ATOM 923 CG LYS A 57 21.139 14.461 11.492 1.00 0.00 C ATOM 924 CD LYS A 57 20.946 13.095 12.174 1.00 0.00 C ATOM 925 CE LYS A 57 19.473 12.657 12.205 1.00 0.00 C ATOM 926 NZ LYS A 57 19.205 11.609 13.215 1.00 0.00 N ATOM 0 H LYS A 57 19.026 16.288 10.453 1.00 0.00 H new ATOM 0 HA LYS A 57 21.733 16.372 9.750 1.00 0.00 H new ATOM 0 HB2 LYS A 57 19.646 14.171 9.955 1.00 0.00 H new ATOM 0 HB3 LYS A 57 21.281 13.813 9.435 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.194 14.732 11.540 1.00 0.00 H new ATOM 0 HG3 LYS A 57 20.590 15.216 12.055 1.00 0.00 H new ATOM 0 HD2 LYS A 57 21.534 12.343 11.648 1.00 0.00 H new ATOM 0 HD3 LYS A 57 21.329 13.144 13.193 1.00 0.00 H new ATOM 0 HE2 LYS A 57 18.846 13.524 12.413 1.00 0.00 H new ATOM 0 HE3 LYS A 57 19.189 12.287 11.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 18.197 11.353 13.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 19.781 10.769 13.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 19.448 11.968 14.160 1.00 0.00 H new ATOM 940 N TYR A 58 19.676 15.935 7.230 1.00 0.00 N ATOM 941 CA TYR A 58 19.577 15.642 5.808 1.00 0.00 C ATOM 942 C TYR A 58 18.966 16.764 4.971 1.00 0.00 C ATOM 943 O TYR A 58 18.872 16.565 3.766 1.00 0.00 O ATOM 944 CB TYR A 58 18.861 14.293 5.620 1.00 0.00 C ATOM 945 CG TYR A 58 19.518 13.134 6.360 1.00 0.00 C ATOM 946 CD1 TYR A 58 20.817 12.715 6.013 1.00 0.00 C ATOM 947 CD2 TYR A 58 18.851 12.502 7.424 1.00 0.00 C ATOM 948 CE1 TYR A 58 21.452 11.690 6.738 1.00 0.00 C ATOM 949 CE2 TYR A 58 19.468 11.465 8.145 1.00 0.00 C ATOM 950 CZ TYR A 58 20.782 11.064 7.813 1.00 0.00 C ATOM 951 OH TYR A 58 21.392 10.092 8.547 1.00 0.00 O ATOM 0 H TYR A 58 18.796 16.214 7.663 1.00 0.00 H new ATOM 0 HA TYR A 58 20.592 15.567 5.417 1.00 0.00 H new ATOM 0 HB2 TYR A 58 17.830 14.390 5.960 1.00 0.00 H new ATOM 0 HB3 TYR A 58 18.825 14.058 4.556 1.00 0.00 H new ATOM 0 HD1 TYR A 58 21.329 13.183 5.185 1.00 0.00 H new ATOM 0 HD2 TYR A 58 17.853 12.817 7.691 1.00 0.00 H new ATOM 0 HE1 TYR A 58 22.452 11.381 6.473 1.00 0.00 H new ATOM 0 HE2 TYR A 58 18.940 10.976 8.950 1.00 0.00 H new ATOM 0 HH TYR A 58 22.359 10.250 8.560 1.00 0.00 H new ATOM 961 N GLN A 59 18.629 17.945 5.512 1.00 0.00 N ATOM 962 CA GLN A 59 18.055 19.040 4.704 1.00 0.00 C ATOM 963 C GLN A 59 18.901 19.479 3.492 1.00 0.00 C ATOM 964 O GLN A 59 18.371 20.100 2.569 1.00 0.00 O ATOM 965 CB GLN A 59 17.637 20.257 5.562 1.00 0.00 C ATOM 966 CG GLN A 59 18.628 20.769 6.626 1.00 0.00 C ATOM 967 CD GLN A 59 20.017 21.117 6.099 1.00 0.00 C ATOM 968 OE1 GLN A 59 20.178 21.999 5.261 1.00 0.00 O ATOM 969 NE2 GLN A 59 21.045 20.437 6.586 1.00 0.00 N ATOM 0 H GLN A 59 18.742 18.169 6.501 1.00 0.00 H new ATOM 0 HA GLN A 59 17.156 18.595 4.278 1.00 0.00 H new ATOM 0 HB2 GLN A 59 17.418 21.083 4.885 1.00 0.00 H new ATOM 0 HB3 GLN A 59 16.705 20.004 6.068 1.00 0.00 H new ATOM 0 HG2 GLN A 59 18.204 21.654 7.100 1.00 0.00 H new ATOM 0 HG3 GLN A 59 18.730 20.010 7.401 1.00 0.00 H new ATOM 0 HE21 GLN A 59 20.890 19.708 7.282 1.00 0.00 H new ATOM 0 HE22 GLN A 59 21.991 20.643 6.265 1.00 0.00 H new ATOM 978 N ASP A 60 20.191 19.138 3.464 1.00 0.00 N ATOM 979 CA ASP A 60 21.128 19.467 2.381 1.00 0.00 C ATOM 980 C ASP A 60 21.495 18.220 1.557 1.00 0.00 C ATOM 981 O ASP A 60 22.397 18.260 0.721 1.00 0.00 O ATOM 982 CB ASP A 60 22.376 20.131 2.989 1.00 0.00 C ATOM 983 CG ASP A 60 23.345 20.685 1.928 1.00 0.00 C ATOM 984 OD1 ASP A 60 22.924 21.499 1.076 1.00 0.00 O ATOM 985 OD2 ASP A 60 24.555 20.365 1.982 1.00 0.00 O ATOM 0 H ASP A 60 20.629 18.608 4.217 1.00 0.00 H new ATOM 0 HA ASP A 60 20.652 20.164 1.691 1.00 0.00 H new ATOM 0 HB2 ASP A 60 22.064 20.943 3.646 1.00 0.00 H new ATOM 0 HB3 ASP A 60 22.902 19.404 3.608 1.00 0.00 H new ATOM 990 N GLN A 61 20.808 17.095 1.792 1.00 0.00 N ATOM 991 CA GLN A 61 21.168 15.780 1.266 1.00 0.00 C ATOM 992 C GLN A 61 19.955 15.006 0.731 1.00 0.00 C ATOM 993 O GLN A 61 20.118 14.191 -0.173 1.00 0.00 O ATOM 994 CB GLN A 61 21.861 14.956 2.369 1.00 0.00 C ATOM 995 CG GLN A 61 23.057 15.668 3.027 1.00 0.00 C ATOM 996 CD GLN A 61 23.891 14.714 3.882 1.00 0.00 C ATOM 997 OE1 GLN A 61 24.750 13.998 3.375 1.00 0.00 O ATOM 998 NE2 GLN A 61 23.676 14.670 5.188 1.00 0.00 N ATOM 0 H GLN A 61 19.966 17.078 2.368 1.00 0.00 H new ATOM 0 HA GLN A 61 21.845 15.940 0.427 1.00 0.00 H new ATOM 0 HB2 GLN A 61 21.129 14.711 3.139 1.00 0.00 H new ATOM 0 HB3 GLN A 61 22.203 14.013 1.943 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.687 16.107 2.254 1.00 0.00 H new ATOM 0 HG3 GLN A 61 22.695 16.488 3.647 1.00 0.00 H new ATOM 0 HE21 GLN A 61 22.962 15.265 5.608 1.00 0.00 H new ATOM 0 HE22 GLN A 61 24.224 14.041 5.774 1.00 0.00 H new ATOM 1007 N LEU A 62 18.748 15.239 1.254 1.00 0.00 N ATOM 1008 CA LEU A 62 17.534 14.493 0.968 1.00 0.00 C ATOM 1009 C LEU A 62 16.364 15.402 1.360 1.00 0.00 C ATOM 1010 O LEU A 62 16.527 16.359 2.117 1.00 0.00 O ATOM 1011 CB LEU A 62 17.574 13.124 1.701 1.00 0.00 C ATOM 1012 CG LEU A 62 16.241 12.498 2.176 1.00 0.00 C ATOM 1013 CD1 LEU A 62 16.316 10.971 2.196 1.00 0.00 C ATOM 1014 CD2 LEU A 62 15.878 12.985 3.582 1.00 0.00 C ATOM 0 H LEU A 62 18.590 15.994 1.922 1.00 0.00 H new ATOM 0 HA LEU A 62 17.423 14.236 -0.086 1.00 0.00 H new ATOM 0 HB2 LEU A 62 18.058 12.407 1.037 1.00 0.00 H new ATOM 0 HB3 LEU A 62 18.217 13.235 2.574 1.00 0.00 H new ATOM 0 HG LEU A 62 15.475 12.812 1.467 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.363 10.564 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.531 10.604 1.192 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.107 10.654 2.875 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.937 12.531 3.893 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.666 12.702 4.280 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.772 14.070 3.575 1.00 0.00 H new ATOM 1026 N ASN A 63 15.183 15.131 0.824 1.00 0.00 N ATOM 1027 CA ASN A 63 13.968 15.871 1.128 1.00 0.00 C ATOM 1028 C ASN A 63 13.201 15.070 2.173 1.00 0.00 C ATOM 1029 O ASN A 63 12.789 13.946 1.876 1.00 0.00 O ATOM 1030 CB ASN A 63 13.089 16.017 -0.122 1.00 0.00 C ATOM 1031 CG ASN A 63 13.781 16.623 -1.333 1.00 0.00 C ATOM 1032 OD1 ASN A 63 13.674 17.813 -1.613 1.00 0.00 O ATOM 1033 ND2 ASN A 63 14.524 15.829 -2.081 1.00 0.00 N ATOM 0 H ASN A 63 15.040 14.376 0.153 1.00 0.00 H new ATOM 0 HA ASN A 63 14.224 16.868 1.486 1.00 0.00 H new ATOM 0 HB2 ASN A 63 12.708 15.033 -0.396 1.00 0.00 H new ATOM 0 HB3 ASN A 63 12.226 16.634 0.130 1.00 0.00 H new ATOM 0 HD21 ASN A 63 15.012 16.204 -2.895 1.00 0.00 H new ATOM 0 HD22 ASN A 63 14.611 14.840 -1.845 1.00 0.00 H new ATOM 1040 N VAL A 64 13.016 15.602 3.380 1.00 0.00 N ATOM 1041 CA VAL A 64 12.096 14.998 4.341 1.00 0.00 C ATOM 1042 C VAL A 64 10.751 15.658 4.056 1.00 0.00 C ATOM 1043 O VAL A 64 10.684 16.889 4.023 1.00 0.00 O ATOM 1044 CB VAL A 64 12.524 15.228 5.811 1.00 0.00 C ATOM 1045 CG1 VAL A 64 11.851 14.167 6.690 1.00 0.00 C ATOM 1046 CG2 VAL A 64 14.041 15.105 6.031 1.00 0.00 C ATOM 0 H VAL A 64 13.487 16.443 3.714 1.00 0.00 H new ATOM 0 HA VAL A 64 12.070 13.914 4.227 1.00 0.00 H new ATOM 0 HB VAL A 64 12.225 16.244 6.068 1.00 0.00 H new ATOM 0 HG11 VAL A 64 12.144 14.317 7.729 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.768 14.255 6.602 1.00 0.00 H new ATOM 0 HG13 VAL A 64 12.162 13.174 6.365 1.00 0.00 H new ATOM 0 HG21 VAL A 64 14.271 15.278 7.082 1.00 0.00 H new ATOM 0 HG22 VAL A 64 14.370 14.105 5.747 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.558 15.845 5.420 1.00 0.00 H new ATOM 1056 N VAL A 65 9.703 14.868 3.836 1.00 0.00 N ATOM 1057 CA VAL A 65 8.332 15.351 3.751 1.00 0.00 C ATOM 1058 C VAL A 65 7.420 14.320 4.418 1.00 0.00 C ATOM 1059 O VAL A 65 7.834 13.184 4.688 1.00 0.00 O ATOM 1060 CB VAL A 65 7.916 15.631 2.290 1.00 0.00 C ATOM 1061 CG1 VAL A 65 8.754 16.730 1.629 1.00 0.00 C ATOM 1062 CG2 VAL A 65 7.962 14.386 1.395 1.00 0.00 C ATOM 0 H VAL A 65 9.786 13.859 3.710 1.00 0.00 H new ATOM 0 HA VAL A 65 8.244 16.304 4.273 1.00 0.00 H new ATOM 0 HB VAL A 65 6.883 15.967 2.374 1.00 0.00 H new ATOM 0 HG11 VAL A 65 8.414 16.880 0.604 1.00 0.00 H new ATOM 0 HG12 VAL A 65 8.642 17.659 2.188 1.00 0.00 H new ATOM 0 HG13 VAL A 65 9.803 16.434 1.623 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.658 14.654 0.383 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.977 13.989 1.376 1.00 0.00 H new ATOM 0 HG23 VAL A 65 7.284 13.629 1.789 1.00 0.00 H new ATOM 1072 N ALA A 66 6.162 14.684 4.672 1.00 0.00 N ATOM 1073 CA ALA A 66 5.245 13.769 5.333 1.00 0.00 C ATOM 1074 C ALA A 66 3.777 13.980 4.995 1.00 0.00 C ATOM 1075 O ALA A 66 3.387 14.988 4.401 1.00 0.00 O ATOM 1076 CB ALA A 66 5.452 13.896 6.833 1.00 0.00 C ATOM 0 H ALA A 66 5.764 15.592 4.433 1.00 0.00 H new ATOM 0 HA ALA A 66 5.478 12.769 4.968 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.774 13.218 7.352 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.482 13.640 7.081 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.248 14.921 7.143 1.00 0.00 H new ATOM 1082 N VAL A 67 2.969 13.022 5.443 1.00 0.00 N ATOM 1083 CA VAL A 67 1.555 12.915 5.152 1.00 0.00 C ATOM 1084 C VAL A 67 0.888 12.567 6.482 1.00 0.00 C ATOM 1085 O VAL A 67 1.181 11.520 7.068 1.00 0.00 O ATOM 1086 CB VAL A 67 1.335 11.843 4.063 1.00 0.00 C ATOM 1087 CG1 VAL A 67 -0.129 11.833 3.614 1.00 0.00 C ATOM 1088 CG2 VAL A 67 2.222 12.063 2.825 1.00 0.00 C ATOM 0 H VAL A 67 3.304 12.270 6.045 1.00 0.00 H new ATOM 0 HA VAL A 67 1.124 13.834 4.755 1.00 0.00 H new ATOM 0 HB VAL A 67 1.607 10.889 4.514 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.269 11.072 2.846 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.770 11.610 4.467 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.392 12.810 3.209 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.025 11.280 2.093 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.999 13.035 2.386 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.271 12.030 3.119 1.00 0.00 H new ATOM 1098 N HIS A 68 0.054 13.465 7.006 1.00 0.00 N ATOM 1099 CA HIS A 68 -0.598 13.225 8.284 1.00 0.00 C ATOM 1100 C HIS A 68 -1.904 12.482 8.039 1.00 0.00 C ATOM 1101 O HIS A 68 -2.811 13.025 7.410 1.00 0.00 O ATOM 1102 CB HIS A 68 -0.851 14.526 9.044 1.00 0.00 C ATOM 1103 CG HIS A 68 -0.975 14.214 10.506 1.00 0.00 C ATOM 1104 ND1 HIS A 68 0.074 14.141 11.385 1.00 0.00 N ATOM 1105 CD2 HIS A 68 -2.082 13.734 11.157 1.00 0.00 C ATOM 1106 CE1 HIS A 68 -0.387 13.629 12.527 1.00 0.00 C ATOM 1107 NE2 HIS A 68 -1.708 13.398 12.461 1.00 0.00 N ATOM 0 H HIS A 68 -0.182 14.355 6.567 1.00 0.00 H new ATOM 0 HA HIS A 68 0.061 12.619 8.905 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.033 15.227 8.875 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.761 15.004 8.681 1.00 0.00 H new ATOM 0 HD1 HIS A 68 1.035 14.427 11.199 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.071 13.633 10.735 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.224 13.426 13.394 1.00 0.00 H new ATOM 1115 N MET A 69 -2.015 11.253 8.530 1.00 0.00 N ATOM 1116 CA MET A 69 -3.211 10.439 8.363 1.00 0.00 C ATOM 1117 C MET A 69 -4.230 10.793 9.461 1.00 0.00 C ATOM 1118 O MET A 69 -3.904 10.633 10.641 1.00 0.00 O ATOM 1119 CB MET A 69 -2.804 8.960 8.415 1.00 0.00 C ATOM 1120 CG MET A 69 -3.917 8.012 7.967 1.00 0.00 C ATOM 1121 SD MET A 69 -4.470 8.255 6.260 1.00 0.00 S ATOM 1122 CE MET A 69 -5.091 6.584 5.954 1.00 0.00 C ATOM 0 H MET A 69 -1.274 10.792 9.058 1.00 0.00 H new ATOM 0 HA MET A 69 -3.685 10.634 7.401 1.00 0.00 H new ATOM 0 HB2 MET A 69 -1.930 8.808 7.782 1.00 0.00 H new ATOM 0 HB3 MET A 69 -2.508 8.707 9.433 1.00 0.00 H new ATOM 0 HG2 MET A 69 -3.569 6.985 8.080 1.00 0.00 H new ATOM 0 HG3 MET A 69 -4.771 8.135 8.633 1.00 0.00 H new ATOM 0 HE1 MET A 69 -5.742 6.592 5.080 1.00 0.00 H new ATOM 0 HE2 MET A 69 -4.252 5.911 5.775 1.00 0.00 H new ATOM 0 HE3 MET A 69 -5.653 6.240 6.822 1.00 0.00 H new ATOM 1132 N PRO A 70 -5.463 11.236 9.127 1.00 0.00 N ATOM 1133 CA PRO A 70 -6.539 11.491 10.088 1.00 0.00 C ATOM 1134 C PRO A 70 -7.170 10.165 10.560 1.00 0.00 C ATOM 1135 O PRO A 70 -8.359 9.905 10.362 1.00 0.00 O ATOM 1136 CB PRO A 70 -7.516 12.412 9.352 1.00 0.00 C ATOM 1137 CG PRO A 70 -7.404 11.939 7.906 1.00 0.00 C ATOM 1138 CD PRO A 70 -5.919 11.598 7.790 1.00 0.00 C ATOM 0 HA PRO A 70 -6.194 11.968 11.005 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.532 12.311 9.733 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -7.240 13.461 9.457 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -8.037 11.073 7.711 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -7.700 12.715 7.200 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -5.765 10.774 7.093 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -5.356 12.449 7.407 1.00 0.00 H new ATOM 1146 N ARG A 71 -6.347 9.272 11.112 1.00 0.00 N ATOM 1147 CA ARG A 71 -6.727 7.890 11.410 1.00 0.00 C ATOM 1148 C ARG A 71 -7.662 7.787 12.620 1.00 0.00 C ATOM 1149 O ARG A 71 -8.383 6.795 12.741 1.00 0.00 O ATOM 1150 CB ARG A 71 -5.447 7.056 11.596 1.00 0.00 C ATOM 1151 CG ARG A 71 -5.641 5.578 11.219 1.00 0.00 C ATOM 1152 CD ARG A 71 -4.291 4.858 11.291 1.00 0.00 C ATOM 1153 NE ARG A 71 -4.337 3.480 10.768 1.00 0.00 N ATOM 1154 CZ ARG A 71 -4.691 2.374 11.435 1.00 0.00 C ATOM 1155 NH1 ARG A 71 -5.153 2.439 12.681 1.00 0.00 N ATOM 1156 NH2 ARG A 71 -4.564 1.202 10.826 1.00 0.00 N ATOM 0 H ARG A 71 -5.384 9.491 11.368 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.298 7.492 10.571 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.650 7.481 10.986 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.123 7.122 12.635 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.354 5.108 11.897 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -6.056 5.498 10.214 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.552 5.428 10.728 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -3.954 4.835 12.327 1.00 0.00 H new ATOM 0 HE ARG A 71 -4.070 3.356 9.791 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.243 3.343 13.145 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.417 1.585 13.172 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -4.204 1.159 9.873 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -4.826 0.344 11.311 1.00 0.00 H new ATOM 1170 N SER A 72 -7.683 8.802 13.481 1.00 0.00 N ATOM 1171 CA SER A 72 -8.417 8.827 14.740 1.00 0.00 C ATOM 1172 C SER A 72 -9.037 10.211 14.926 1.00 0.00 C ATOM 1173 O SER A 72 -8.658 11.161 14.237 1.00 0.00 O ATOM 1174 CB SER A 72 -7.461 8.538 15.911 1.00 0.00 C ATOM 1175 OG SER A 72 -6.330 7.771 15.537 1.00 0.00 O ATOM 0 H SER A 72 -7.167 9.665 13.311 1.00 0.00 H new ATOM 0 HA SER A 72 -9.197 8.066 14.720 1.00 0.00 H new ATOM 0 HB2 SER A 72 -7.125 9.483 16.338 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.006 8.010 16.694 1.00 0.00 H new ATOM 0 HG SER A 72 -5.644 8.362 15.162 1.00 0.00 H new ATOM 1181 N GLU A 73 -9.947 10.360 15.890 1.00 0.00 N ATOM 1182 CA GLU A 73 -10.607 11.635 16.158 1.00 0.00 C ATOM 1183 C GLU A 73 -9.618 12.714 16.624 1.00 0.00 C ATOM 1184 O GLU A 73 -9.807 13.888 16.302 1.00 0.00 O ATOM 1185 CB GLU A 73 -11.791 11.405 17.104 1.00 0.00 C ATOM 1186 CG GLU A 73 -12.551 12.688 17.465 1.00 0.00 C ATOM 1187 CD GLU A 73 -13.811 12.381 18.293 1.00 0.00 C ATOM 1188 OE1 GLU A 73 -13.724 12.305 19.540 1.00 0.00 O ATOM 1189 OE2 GLU A 73 -14.910 12.230 17.711 1.00 0.00 O ATOM 0 H GLU A 73 -10.245 9.602 16.504 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.014 12.038 15.231 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -12.483 10.702 16.641 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.428 10.939 18.020 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.897 13.354 18.028 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.833 13.215 16.553 1.00 0.00 H new ATOM 1196 N ASP A 74 -8.524 12.346 17.301 1.00 0.00 N ATOM 1197 CA ASP A 74 -7.500 13.328 17.675 1.00 0.00 C ATOM 1198 C ASP A 74 -6.589 13.682 16.488 1.00 0.00 C ATOM 1199 O ASP A 74 -5.940 14.720 16.515 1.00 0.00 O ATOM 1200 CB ASP A 74 -6.687 12.863 18.892 1.00 0.00 C ATOM 1201 CG ASP A 74 -5.923 14.024 19.549 1.00 0.00 C ATOM 1202 OD1 ASP A 74 -6.582 14.979 20.023 1.00 0.00 O ATOM 1203 OD2 ASP A 74 -4.682 13.943 19.683 1.00 0.00 O ATOM 0 H ASP A 74 -8.326 11.390 17.597 1.00 0.00 H new ATOM 0 HA ASP A 74 -8.022 14.241 17.963 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.356 12.409 19.623 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.981 12.092 18.584 1.00 0.00 H new ATOM 1208 N ASP A 75 -6.572 12.884 15.412 1.00 0.00 N ATOM 1209 CA ASP A 75 -5.811 13.183 14.191 1.00 0.00 C ATOM 1210 C ASP A 75 -6.688 13.910 13.163 1.00 0.00 C ATOM 1211 O ASP A 75 -6.203 14.375 12.134 1.00 0.00 O ATOM 1212 CB ASP A 75 -5.344 11.895 13.492 1.00 0.00 C ATOM 1213 CG ASP A 75 -4.660 10.861 14.371 1.00 0.00 C ATOM 1214 OD1 ASP A 75 -3.760 11.210 15.166 1.00 0.00 O ATOM 1215 OD2 ASP A 75 -5.065 9.681 14.292 1.00 0.00 O ATOM 0 H ASP A 75 -7.090 12.006 15.364 1.00 0.00 H new ATOM 0 HA ASP A 75 -4.965 13.793 14.507 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.210 11.427 13.024 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.658 12.170 12.691 1.00 0.00 H new ATOM 1220 N LEU A 76 -7.998 13.969 13.407 1.00 0.00 N ATOM 1221 CA LEU A 76 -9.017 14.400 12.456 1.00 0.00 C ATOM 1222 C LEU A 76 -9.044 15.914 12.195 1.00 0.00 C ATOM 1223 O LEU A 76 -9.879 16.363 11.408 1.00 0.00 O ATOM 1224 CB LEU A 76 -10.388 13.870 12.941 1.00 0.00 C ATOM 1225 CG LEU A 76 -11.111 12.923 11.961 1.00 0.00 C ATOM 1226 CD1 LEU A 76 -12.384 12.357 12.610 1.00 0.00 C ATOM 1227 CD2 LEU A 76 -11.489 13.616 10.648 1.00 0.00 C ATOM 0 H LEU A 76 -8.391 13.706 14.311 1.00 0.00 H new ATOM 0 HA LEU A 76 -8.767 13.975 11.484 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -10.243 13.347 13.886 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -11.037 14.722 13.144 1.00 0.00 H new ATOM 0 HG LEU A 76 -10.412 12.119 11.730 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.885 11.690 11.908 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -12.118 11.803 13.510 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -13.053 13.176 12.873 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -11.995 12.906 9.994 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -12.154 14.454 10.857 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -10.587 13.982 10.157 1.00 0.00 H new ATOM 1239 N ASP A 77 -8.164 16.710 12.811 1.00 0.00 N ATOM 1240 CA ASP A 77 -8.235 18.172 12.798 1.00 0.00 C ATOM 1241 C ASP A 77 -6.856 18.779 12.494 1.00 0.00 C ATOM 1242 O ASP A 77 -5.882 18.444 13.171 1.00 0.00 O ATOM 1243 CB ASP A 77 -8.738 18.672 14.154 1.00 0.00 C ATOM 1244 CG ASP A 77 -8.844 20.201 14.163 1.00 0.00 C ATOM 1245 OD1 ASP A 77 -7.810 20.865 14.385 1.00 0.00 O ATOM 1246 OD2 ASP A 77 -9.953 20.734 13.936 1.00 0.00 O ATOM 0 H ASP A 77 -7.370 16.349 13.341 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.927 18.483 12.016 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.712 18.234 14.370 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.060 18.345 14.942 1.00 0.00 H new ATOM 1251 N PRO A 78 -6.736 19.675 11.498 1.00 0.00 N ATOM 1252 CA PRO A 78 -5.449 20.219 11.081 1.00 0.00 C ATOM 1253 C PRO A 78 -4.862 21.235 12.060 1.00 0.00 C ATOM 1254 O PRO A 78 -3.642 21.403 12.087 1.00 0.00 O ATOM 1255 CB PRO A 78 -5.706 20.865 9.722 1.00 0.00 C ATOM 1256 CG PRO A 78 -7.182 21.256 9.769 1.00 0.00 C ATOM 1257 CD PRO A 78 -7.800 20.157 10.631 1.00 0.00 C ATOM 0 HA PRO A 78 -4.706 19.422 11.040 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -5.068 21.735 9.567 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -5.503 20.171 8.906 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -7.324 22.243 10.210 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -7.624 21.285 8.773 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -8.634 20.544 11.216 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.193 19.351 10.011 1.00 0.00 H new ATOM 1265 N GLY A 79 -5.686 21.900 12.873 1.00 0.00 N ATOM 1266 CA GLY A 79 -5.215 22.826 13.887 1.00 0.00 C ATOM 1267 C GLY A 79 -4.519 22.049 14.997 1.00 0.00 C ATOM 1268 O GLY A 79 -3.464 22.475 15.468 1.00 0.00 O ATOM 0 H GLY A 79 -6.701 21.806 12.841 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.527 23.547 13.446 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.052 23.393 14.294 1.00 0.00 H new ATOM 1272 N LYS A 80 -5.046 20.869 15.354 1.00 0.00 N ATOM 1273 CA LYS A 80 -4.360 19.982 16.295 1.00 0.00 C ATOM 1274 C LYS A 80 -3.000 19.601 15.737 1.00 0.00 C ATOM 1275 O LYS A 80 -2.005 19.701 16.455 1.00 0.00 O ATOM 1276 CB LYS A 80 -5.137 18.688 16.574 1.00 0.00 C ATOM 1277 CG LYS A 80 -6.407 18.844 17.414 1.00 0.00 C ATOM 1278 CD LYS A 80 -7.025 17.449 17.593 1.00 0.00 C ATOM 1279 CE LYS A 80 -8.282 17.459 18.471 1.00 0.00 C ATOM 1280 NZ LYS A 80 -7.951 17.388 19.914 1.00 0.00 N ATOM 0 H LYS A 80 -5.937 20.512 15.008 1.00 0.00 H new ATOM 0 HA LYS A 80 -4.270 20.533 17.231 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.408 18.236 15.620 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.472 17.989 17.081 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.173 19.285 18.383 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -7.112 19.514 16.921 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -7.275 17.040 16.614 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.284 16.784 18.036 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -8.855 18.365 18.274 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -8.918 16.616 18.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -8.825 17.448 20.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -7.472 16.487 20.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -7.323 18.178 20.166 1.00 0.00 H new ATOM 1294 N ILE A 81 -2.958 19.165 14.474 1.00 0.00 N ATOM 1295 CA ILE A 81 -1.732 18.704 13.835 1.00 0.00 C ATOM 1296 C ILE A 81 -0.717 19.848 13.851 1.00 0.00 C ATOM 1297 O ILE A 81 0.365 19.660 14.403 1.00 0.00 O ATOM 1298 CB ILE A 81 -2.027 18.155 12.420 1.00 0.00 C ATOM 1299 CG1 ILE A 81 -2.923 16.899 12.512 1.00 0.00 C ATOM 1300 CG2 ILE A 81 -0.719 17.796 11.683 1.00 0.00 C ATOM 1301 CD1 ILE A 81 -3.604 16.549 11.183 1.00 0.00 C ATOM 0 H ILE A 81 -3.778 19.124 13.869 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.298 17.868 14.384 1.00 0.00 H new ATOM 0 HB ILE A 81 -2.544 18.934 11.859 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.319 16.052 12.838 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.686 17.059 13.274 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.954 17.412 10.690 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.098 18.687 11.590 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.180 17.035 12.248 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.219 15.658 11.313 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.233 17.381 10.866 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.845 16.359 10.424 1.00 0.00 H new ATOM 1313 N LYS A 82 -1.066 21.031 13.329 1.00 0.00 N ATOM 1314 CA LYS A 82 -0.216 22.212 13.358 1.00 0.00 C ATOM 1315 C LYS A 82 0.328 22.507 14.754 1.00 0.00 C ATOM 1316 O LYS A 82 1.543 22.627 14.910 1.00 0.00 O ATOM 1317 CB LYS A 82 -1.061 23.359 12.798 1.00 0.00 C ATOM 1318 CG LYS A 82 -0.374 24.728 12.808 1.00 0.00 C ATOM 1319 CD LYS A 82 -1.321 25.704 12.109 1.00 0.00 C ATOM 1320 CE LYS A 82 -0.722 27.117 12.083 1.00 0.00 C ATOM 1321 NZ LYS A 82 -1.619 28.097 11.420 1.00 0.00 N ATOM 0 H LYS A 82 -1.963 21.189 12.869 1.00 0.00 H new ATOM 0 HA LYS A 82 0.678 22.062 12.752 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.343 23.117 11.773 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.984 23.427 13.375 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.171 25.051 13.829 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.585 24.683 12.291 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -1.513 25.366 11.091 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.281 25.720 12.625 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -0.522 27.443 13.104 1.00 0.00 H new ATOM 0 HE3 LYS A 82 0.235 27.094 11.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -1.172 29.036 11.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.790 27.802 10.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.524 28.140 11.931 1.00 0.00 H new ATOM 1335 N GLU A 83 -0.540 22.612 15.761 1.00 0.00 N ATOM 1336 CA GLU A 83 -0.137 23.018 17.105 1.00 0.00 C ATOM 1337 C GLU A 83 0.826 21.987 17.709 1.00 0.00 C ATOM 1338 O GLU A 83 1.823 22.344 18.335 1.00 0.00 O ATOM 1339 CB GLU A 83 -1.405 23.183 17.960 1.00 0.00 C ATOM 1340 CG GLU A 83 -1.155 23.790 19.347 1.00 0.00 C ATOM 1341 CD GLU A 83 -0.782 25.283 19.279 1.00 0.00 C ATOM 1342 OE1 GLU A 83 -1.692 26.143 19.335 1.00 0.00 O ATOM 1343 OE2 GLU A 83 0.420 25.618 19.191 1.00 0.00 O ATOM 0 H GLU A 83 -1.537 22.419 15.667 1.00 0.00 H new ATOM 0 HA GLU A 83 0.396 23.968 17.072 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.113 23.814 17.422 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.876 22.208 18.082 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.049 23.670 19.959 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.354 23.241 19.841 1.00 0.00 H new ATOM 1350 N THR A 84 0.547 20.703 17.493 1.00 0.00 N ATOM 1351 CA THR A 84 1.328 19.601 18.028 1.00 0.00 C ATOM 1352 C THR A 84 2.694 19.536 17.332 1.00 0.00 C ATOM 1353 O THR A 84 3.739 19.579 17.981 1.00 0.00 O ATOM 1354 CB THR A 84 0.482 18.329 17.828 1.00 0.00 C ATOM 1355 OG1 THR A 84 -0.744 18.437 18.524 1.00 0.00 O ATOM 1356 CG2 THR A 84 1.194 17.065 18.282 1.00 0.00 C ATOM 0 H THR A 84 -0.246 20.398 16.929 1.00 0.00 H new ATOM 0 HA THR A 84 1.547 19.723 19.089 1.00 0.00 H new ATOM 0 HB THR A 84 0.307 18.247 16.755 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.404 18.887 17.956 1.00 0.00 H new ATOM 0 HG21 THR A 84 0.547 16.203 18.116 1.00 0.00 H new ATOM 0 HG22 THR A 84 2.116 16.942 17.713 1.00 0.00 H new ATOM 0 HG23 THR A 84 1.430 17.142 19.343 1.00 0.00 H new ATOM 1364 N ALA A 85 2.708 19.474 16.002 1.00 0.00 N ATOM 1365 CA ALA A 85 3.902 19.412 15.186 1.00 0.00 C ATOM 1366 C ALA A 85 4.846 20.582 15.453 1.00 0.00 C ATOM 1367 O ALA A 85 6.055 20.376 15.517 1.00 0.00 O ATOM 1368 CB ALA A 85 3.430 19.395 13.738 1.00 0.00 C ATOM 0 H ALA A 85 1.851 19.466 15.449 1.00 0.00 H new ATOM 0 HA ALA A 85 4.480 18.519 15.423 1.00 0.00 H new ATOM 0 HB1 ALA A 85 4.293 19.348 13.074 1.00 0.00 H new ATOM 0 HB2 ALA A 85 2.797 18.523 13.572 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.861 20.301 13.530 1.00 0.00 H new ATOM 1374 N ALA A 86 4.311 21.786 15.667 1.00 0.00 N ATOM 1375 CA ALA A 86 5.106 22.960 16.010 1.00 0.00 C ATOM 1376 C ALA A 86 5.946 22.728 17.272 1.00 0.00 C ATOM 1377 O ALA A 86 7.075 23.209 17.359 1.00 0.00 O ATOM 1378 CB ALA A 86 4.178 24.153 16.240 1.00 0.00 C ATOM 0 H ALA A 86 3.310 21.971 15.606 1.00 0.00 H new ATOM 0 HA ALA A 86 5.785 23.157 15.181 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.771 25.031 16.496 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.609 24.352 15.332 1.00 0.00 H new ATOM 0 HB3 ALA A 86 3.491 23.928 17.056 1.00 0.00 H new ATOM 1384 N GLU A 87 5.405 21.996 18.245 1.00 0.00 N ATOM 1385 CA GLU A 87 6.037 21.780 19.541 1.00 0.00 C ATOM 1386 C GLU A 87 7.098 20.682 19.420 1.00 0.00 C ATOM 1387 O GLU A 87 8.181 20.808 19.993 1.00 0.00 O ATOM 1388 CB GLU A 87 4.954 21.440 20.581 1.00 0.00 C ATOM 1389 CG GLU A 87 4.178 22.678 21.058 1.00 0.00 C ATOM 1390 CD GLU A 87 5.034 23.614 21.932 1.00 0.00 C ATOM 1391 OE1 GLU A 87 5.183 23.353 23.148 1.00 0.00 O ATOM 1392 OE2 GLU A 87 5.552 24.633 21.422 1.00 0.00 O ATOM 0 H GLU A 87 4.502 21.531 18.151 1.00 0.00 H new ATOM 0 HA GLU A 87 6.546 22.684 19.876 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.256 20.722 20.150 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.420 20.956 21.439 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.813 23.229 20.192 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.303 22.358 21.624 1.00 0.00 H new ATOM 1399 N HIS A 88 6.832 19.649 18.615 1.00 0.00 N ATOM 1400 CA HIS A 88 7.811 18.632 18.224 1.00 0.00 C ATOM 1401 C HIS A 88 8.805 19.139 17.152 1.00 0.00 C ATOM 1402 O HIS A 88 9.644 18.369 16.682 1.00 0.00 O ATOM 1403 CB HIS A 88 7.059 17.376 17.764 1.00 0.00 C ATOM 1404 CG HIS A 88 6.050 16.875 18.765 1.00 0.00 C ATOM 1405 ND1 HIS A 88 6.300 16.480 20.059 1.00 0.00 N ATOM 1406 CD2 HIS A 88 4.698 16.786 18.570 1.00 0.00 C ATOM 1407 CE1 HIS A 88 5.124 16.163 20.623 1.00 0.00 C ATOM 1408 NE2 HIS A 88 4.113 16.298 19.747 1.00 0.00 N ATOM 0 H HIS A 88 5.910 19.494 18.208 1.00 0.00 H new ATOM 0 HA HIS A 88 8.427 18.389 19.090 1.00 0.00 H new ATOM 0 HB2 HIS A 88 6.550 17.591 16.825 1.00 0.00 H new ATOM 0 HB3 HIS A 88 7.781 16.585 17.561 1.00 0.00 H new ATOM 0 HD1 HIS A 88 7.214 16.436 20.509 1.00 0.00 H new ATOM 0 HD2 HIS A 88 4.172 17.047 17.664 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.005 15.841 21.647 1.00 0.00 H new ATOM 1416 N ASP A 89 8.724 20.420 16.773 1.00 0.00 N ATOM 1417 CA ASP A 89 9.592 21.144 15.832 1.00 0.00 C ATOM 1418 C ASP A 89 9.531 20.625 14.389 1.00 0.00 C ATOM 1419 O ASP A 89 10.434 20.872 13.586 1.00 0.00 O ATOM 1420 CB ASP A 89 11.036 21.254 16.363 1.00 0.00 C ATOM 1421 CG ASP A 89 11.826 22.375 15.653 1.00 0.00 C ATOM 1422 OD1 ASP A 89 11.342 23.531 15.625 1.00 0.00 O ATOM 1423 OD2 ASP A 89 12.961 22.134 15.184 1.00 0.00 O ATOM 0 H ASP A 89 7.993 21.026 17.145 1.00 0.00 H new ATOM 0 HA ASP A 89 9.185 22.153 15.774 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.015 21.448 17.435 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.549 20.303 16.221 1.00 0.00 H new ATOM 1428 N ILE A 90 8.473 19.888 14.037 1.00 0.00 N ATOM 1429 CA ILE A 90 8.291 19.318 12.710 1.00 0.00 C ATOM 1430 C ILE A 90 8.065 20.468 11.711 1.00 0.00 C ATOM 1431 O ILE A 90 6.977 21.046 11.637 1.00 0.00 O ATOM 1432 CB ILE A 90 7.148 18.277 12.703 1.00 0.00 C ATOM 1433 CG1 ILE A 90 7.063 17.468 14.009 1.00 0.00 C ATOM 1434 CG2 ILE A 90 7.358 17.319 11.519 1.00 0.00 C ATOM 1435 CD1 ILE A 90 5.891 16.499 14.019 1.00 0.00 C ATOM 0 H ILE A 90 7.711 19.671 14.679 1.00 0.00 H new ATOM 0 HA ILE A 90 9.184 18.772 12.407 1.00 0.00 H new ATOM 0 HB ILE A 90 6.209 18.821 12.608 1.00 0.00 H new ATOM 0 HG12 ILE A 90 7.990 16.913 14.150 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.971 18.153 14.852 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.558 16.579 11.503 1.00 0.00 H new ATOM 0 HG22 ILE A 90 7.348 17.885 10.587 1.00 0.00 H new ATOM 0 HG23 ILE A 90 8.317 16.813 11.626 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.878 15.954 14.963 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.959 17.054 13.907 1.00 0.00 H new ATOM 0 HD13 ILE A 90 5.995 15.794 13.194 1.00 0.00 H new ATOM 1447 N THR A 91 9.103 20.792 10.941 1.00 0.00 N ATOM 1448 CA THR A 91 9.178 21.981 10.088 1.00 0.00 C ATOM 1449 C THR A 91 9.358 21.641 8.597 1.00 0.00 C ATOM 1450 O THR A 91 9.293 22.535 7.751 1.00 0.00 O ATOM 1451 CB THR A 91 10.252 22.924 10.656 1.00 0.00 C ATOM 1452 OG1 THR A 91 11.311 22.187 11.239 1.00 0.00 O ATOM 1453 CG2 THR A 91 9.671 23.797 11.769 1.00 0.00 C ATOM 0 H THR A 91 9.943 20.216 10.891 1.00 0.00 H new ATOM 0 HA THR A 91 8.223 22.505 10.109 1.00 0.00 H new ATOM 0 HB THR A 91 10.609 23.532 9.824 1.00 0.00 H new ATOM 0 HG1 THR A 91 11.019 21.819 12.099 1.00 0.00 H new ATOM 0 HG21 THR A 91 10.447 24.456 12.157 1.00 0.00 H new ATOM 0 HG22 THR A 91 8.851 24.396 11.371 1.00 0.00 H new ATOM 0 HG23 THR A 91 9.299 23.162 12.573 1.00 0.00 H new ATOM 1461 N GLN A 92 9.551 20.358 8.261 1.00 0.00 N ATOM 1462 CA GLN A 92 9.502 19.837 6.895 1.00 0.00 C ATOM 1463 C GLN A 92 8.144 20.163 6.239 1.00 0.00 C ATOM 1464 O GLN A 92 7.175 20.393 6.967 1.00 0.00 O ATOM 1465 CB GLN A 92 9.643 18.299 6.951 1.00 0.00 C ATOM 1466 CG GLN A 92 8.732 17.663 8.028 1.00 0.00 C ATOM 1467 CD GLN A 92 8.390 16.191 7.820 1.00 0.00 C ATOM 1468 OE1 GLN A 92 8.841 15.543 6.889 1.00 0.00 O ATOM 1469 NE2 GLN A 92 7.568 15.635 8.695 1.00 0.00 N ATOM 0 H GLN A 92 9.751 19.637 8.954 1.00 0.00 H new ATOM 0 HA GLN A 92 10.305 20.292 6.315 1.00 0.00 H new ATOM 0 HB2 GLN A 92 9.397 17.878 5.976 1.00 0.00 H new ATOM 0 HB3 GLN A 92 10.681 18.039 7.157 1.00 0.00 H new ATOM 0 HG2 GLN A 92 9.218 17.771 8.998 1.00 0.00 H new ATOM 0 HG3 GLN A 92 7.802 18.230 8.072 1.00 0.00 H new ATOM 0 HE21 GLN A 92 7.198 16.187 9.469 1.00 0.00 H new ATOM 0 HE22 GLN A 92 7.305 14.655 8.596 1.00 0.00 H new ATOM 1478 N PRO A 93 8.023 20.157 4.899 1.00 0.00 N ATOM 1479 CA PRO A 93 6.727 20.213 4.230 1.00 0.00 C ATOM 1480 C PRO A 93 5.871 19.015 4.676 1.00 0.00 C ATOM 1481 O PRO A 93 6.362 17.881 4.722 1.00 0.00 O ATOM 1482 CB PRO A 93 7.031 20.153 2.726 1.00 0.00 C ATOM 1483 CG PRO A 93 8.485 20.608 2.619 1.00 0.00 C ATOM 1484 CD PRO A 93 9.107 20.137 3.932 1.00 0.00 C ATOM 0 HA PRO A 93 6.168 21.117 4.474 1.00 0.00 H new ATOM 0 HB2 PRO A 93 6.899 19.145 2.333 1.00 0.00 H new ATOM 0 HB3 PRO A 93 6.367 20.805 2.159 1.00 0.00 H new ATOM 0 HG2 PRO A 93 8.982 20.162 1.757 1.00 0.00 H new ATOM 0 HG3 PRO A 93 8.559 21.690 2.506 1.00 0.00 H new ATOM 0 HD2 PRO A 93 9.526 19.136 3.832 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.921 20.794 4.240 1.00 0.00 H new ATOM 1492 N ILE A 94 4.595 19.235 4.987 1.00 0.00 N ATOM 1493 CA ILE A 94 3.665 18.217 5.462 1.00 0.00 C ATOM 1494 C ILE A 94 2.359 18.529 4.749 1.00 0.00 C ATOM 1495 O ILE A 94 1.991 19.698 4.626 1.00 0.00 O ATOM 1496 CB ILE A 94 3.474 18.312 7.000 1.00 0.00 C ATOM 1497 CG1 ILE A 94 4.789 18.103 7.776 1.00 0.00 C ATOM 1498 CG2 ILE A 94 2.404 17.329 7.520 1.00 0.00 C ATOM 1499 CD1 ILE A 94 4.747 18.592 9.229 1.00 0.00 C ATOM 0 H ILE A 94 4.168 20.158 4.912 1.00 0.00 H new ATOM 0 HA ILE A 94 4.025 17.209 5.257 1.00 0.00 H new ATOM 0 HB ILE A 94 3.129 19.330 7.183 1.00 0.00 H new ATOM 0 HG12 ILE A 94 5.037 17.042 7.769 1.00 0.00 H new ATOM 0 HG13 ILE A 94 5.593 18.622 7.253 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.308 17.434 8.601 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.447 17.550 7.047 1.00 0.00 H new ATOM 0 HG23 ILE A 94 2.700 16.308 7.280 1.00 0.00 H new ATOM 0 HD11 ILE A 94 5.711 18.408 9.703 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.532 19.660 9.247 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.968 18.056 9.771 1.00 0.00 H new ATOM 1511 N PHE A 95 1.617 17.508 4.330 1.00 0.00 N ATOM 1512 CA PHE A 95 0.263 17.724 3.853 1.00 0.00 C ATOM 1513 C PHE A 95 -0.682 16.745 4.535 1.00 0.00 C ATOM 1514 O PHE A 95 -0.271 15.732 5.106 1.00 0.00 O ATOM 1515 CB PHE A 95 0.195 17.750 2.318 1.00 0.00 C ATOM 1516 CG PHE A 95 0.074 16.413 1.613 1.00 0.00 C ATOM 1517 CD1 PHE A 95 -1.204 15.894 1.343 1.00 0.00 C ATOM 1518 CD2 PHE A 95 1.216 15.726 1.159 1.00 0.00 C ATOM 1519 CE1 PHE A 95 -1.341 14.701 0.618 1.00 0.00 C ATOM 1520 CE2 PHE A 95 1.075 14.529 0.428 1.00 0.00 C ATOM 1521 CZ PHE A 95 -0.207 14.013 0.160 1.00 0.00 C ATOM 0 H PHE A 95 1.929 16.537 4.312 1.00 0.00 H new ATOM 0 HA PHE A 95 -0.080 18.718 4.138 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -0.656 18.365 2.027 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.090 18.249 1.947 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.082 16.415 1.694 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.200 16.116 1.371 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -2.326 14.309 0.411 1.00 0.00 H new ATOM 0 HE2 PHE A 95 1.951 14.007 0.073 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.317 13.093 -0.395 1.00 0.00 H new ATOM 1531 N VAL A 96 -1.957 17.101 4.513 1.00 0.00 N ATOM 1532 CA VAL A 96 -3.052 16.395 5.140 1.00 0.00 C ATOM 1533 C VAL A 96 -4.167 16.435 4.107 1.00 0.00 C ATOM 1534 O VAL A 96 -4.349 17.444 3.414 1.00 0.00 O ATOM 1535 CB VAL A 96 -3.473 17.109 6.447 1.00 0.00 C ATOM 1536 CG1 VAL A 96 -4.429 16.238 7.275 1.00 0.00 C ATOM 1537 CG2 VAL A 96 -2.269 17.529 7.311 1.00 0.00 C ATOM 0 H VAL A 96 -2.268 17.942 4.026 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.793 15.374 5.421 1.00 0.00 H new ATOM 0 HB VAL A 96 -3.991 18.017 6.140 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.706 16.767 8.187 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.325 16.026 6.692 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.935 15.302 7.535 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.625 18.025 8.214 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.692 16.646 7.585 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.637 18.214 6.746 1.00 0.00 H new ATOM 1547 N ASP A 97 -4.943 15.367 4.019 1.00 0.00 N ATOM 1548 CA ASP A 97 -6.094 15.289 3.149 1.00 0.00 C ATOM 1549 C ASP A 97 -7.154 14.404 3.783 1.00 0.00 C ATOM 1550 O ASP A 97 -6.840 13.519 4.582 1.00 0.00 O ATOM 1551 CB ASP A 97 -5.687 14.723 1.795 1.00 0.00 C ATOM 1552 CG ASP A 97 -6.853 14.854 0.825 1.00 0.00 C ATOM 1553 OD1 ASP A 97 -7.270 16.001 0.564 1.00 0.00 O ATOM 1554 OD2 ASP A 97 -7.373 13.806 0.396 1.00 0.00 O ATOM 0 H ASP A 97 -4.784 14.518 4.561 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.501 16.290 3.004 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -4.818 15.257 1.411 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.399 13.677 1.897 1.00 0.00 H new ATOM 1559 N SER A 98 -8.410 14.640 3.421 1.00 0.00 N ATOM 1560 CA SER A 98 -9.547 13.864 3.883 1.00 0.00 C ATOM 1561 C SER A 98 -9.534 12.423 3.330 1.00 0.00 C ATOM 1562 O SER A 98 -10.272 11.578 3.839 1.00 0.00 O ATOM 1563 CB SER A 98 -10.827 14.612 3.483 1.00 0.00 C ATOM 1564 OG SER A 98 -10.705 16.006 3.739 1.00 0.00 O ATOM 0 H SER A 98 -8.668 15.394 2.784 1.00 0.00 H new ATOM 0 HA SER A 98 -9.498 13.762 4.967 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.031 14.450 2.425 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.675 14.210 4.037 1.00 0.00 H new ATOM 0 HG SER A 98 -11.532 16.461 3.474 1.00 0.00 H new ATOM 1570 N ASP A 99 -8.710 12.126 2.313 1.00 0.00 N ATOM 1571 CA ASP A 99 -8.680 10.837 1.619 1.00 0.00 C ATOM 1572 C ASP A 99 -7.252 10.354 1.320 1.00 0.00 C ATOM 1573 O ASP A 99 -6.987 9.165 1.482 1.00 0.00 O ATOM 1574 CB ASP A 99 -9.472 10.968 0.312 1.00 0.00 C ATOM 1575 CG ASP A 99 -9.497 9.646 -0.472 1.00 0.00 C ATOM 1576 OD1 ASP A 99 -10.061 8.648 0.032 1.00 0.00 O ATOM 1577 OD2 ASP A 99 -9.016 9.620 -1.626 1.00 0.00 O ATOM 0 H ASP A 99 -8.032 12.793 1.945 1.00 0.00 H new ATOM 0 HA ASP A 99 -9.129 10.091 2.275 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -10.493 11.279 0.535 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.029 11.749 -0.306 1.00 0.00 H new ATOM 1582 N HIS A 100 -6.333 11.266 0.975 1.00 0.00 N ATOM 1583 CA HIS A 100 -4.987 11.067 0.461 1.00 0.00 C ATOM 1584 C HIS A 100 -5.020 10.398 -0.903 1.00 0.00 C ATOM 1585 O HIS A 100 -5.522 9.289 -1.069 1.00 0.00 O ATOM 1586 CB HIS A 100 -4.046 10.369 1.455 1.00 0.00 C ATOM 1587 CG HIS A 100 -3.832 11.184 2.696 1.00 0.00 C ATOM 1588 ND1 HIS A 100 -4.287 10.892 3.959 1.00 0.00 N ATOM 1589 CD2 HIS A 100 -3.225 12.408 2.752 1.00 0.00 C ATOM 1590 CE1 HIS A 100 -3.964 11.926 4.749 1.00 0.00 C ATOM 1591 NE2 HIS A 100 -3.308 12.877 4.064 1.00 0.00 N ATOM 0 H HIS A 100 -6.544 12.260 1.061 1.00 0.00 H new ATOM 0 HA HIS A 100 -4.550 12.056 0.327 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -4.461 9.398 1.726 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -3.086 10.182 0.974 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -4.779 10.045 4.243 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -2.761 12.923 1.924 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.201 11.986 5.801 1.00 0.00 H new ATOM 1599 N ALA A 101 -4.408 11.057 -1.889 1.00 0.00 N ATOM 1600 CA ALA A 101 -4.306 10.506 -3.231 1.00 0.00 C ATOM 1601 C ALA A 101 -3.473 9.215 -3.256 1.00 0.00 C ATOM 1602 O ALA A 101 -3.603 8.422 -4.188 1.00 0.00 O ATOM 1603 CB ALA A 101 -3.707 11.564 -4.150 1.00 0.00 C ATOM 0 H ALA A 101 -3.976 11.974 -1.777 1.00 0.00 H new ATOM 0 HA ALA A 101 -5.303 10.238 -3.581 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.625 11.164 -5.161 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -4.350 12.444 -4.159 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -2.717 11.842 -3.788 1.00 0.00 H new ATOM 1609 N LEU A 102 -2.666 8.961 -2.216 1.00 0.00 N ATOM 1610 CA LEU A 102 -1.956 7.685 -2.093 1.00 0.00 C ATOM 1611 C LEU A 102 -2.949 6.565 -1.893 1.00 0.00 C ATOM 1612 O LEU A 102 -2.763 5.494 -2.449 1.00 0.00 O ATOM 1613 CB LEU A 102 -0.963 7.602 -0.916 1.00 0.00 C ATOM 1614 CG LEU A 102 0.496 7.591 -1.401 1.00 0.00 C ATOM 1615 CD1 LEU A 102 1.074 9.008 -1.397 1.00 0.00 C ATOM 1616 CD2 LEU A 102 1.353 6.658 -0.546 1.00 0.00 C ATOM 0 H LEU A 102 -2.491 9.617 -1.455 1.00 0.00 H new ATOM 0 HA LEU A 102 -1.388 7.599 -3.019 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.118 8.450 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -1.160 6.700 -0.336 1.00 0.00 H new ATOM 0 HG LEU A 102 0.508 7.215 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 102 2.107 8.980 -1.743 1.00 0.00 H new ATOM 0 HD12 LEU A 102 0.486 9.643 -2.060 1.00 0.00 H new ATOM 0 HD13 LEU A 102 1.041 9.412 -0.385 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.380 6.670 -0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 102 1.333 6.994 0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 102 0.958 5.644 -0.607 1.00 0.00 H new ATOM 1628 N THR A 103 -3.999 6.778 -1.113 1.00 0.00 N ATOM 1629 CA THR A 103 -5.014 5.777 -0.850 1.00 0.00 C ATOM 1630 C THR A 103 -5.717 5.376 -2.148 1.00 0.00 C ATOM 1631 O THR A 103 -6.222 4.261 -2.241 1.00 0.00 O ATOM 1632 CB THR A 103 -6.013 6.366 0.143 1.00 0.00 C ATOM 1633 OG1 THR A 103 -5.339 7.110 1.135 1.00 0.00 O ATOM 1634 CG2 THR A 103 -6.905 5.354 0.865 1.00 0.00 C ATOM 0 H THR A 103 -4.169 7.665 -0.640 1.00 0.00 H new ATOM 0 HA THR A 103 -4.558 4.880 -0.432 1.00 0.00 H new ATOM 0 HB THR A 103 -6.663 6.982 -0.478 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.975 7.702 1.588 1.00 0.00 H new ATOM 0 HG21 THR A 103 -7.575 5.880 1.545 1.00 0.00 H new ATOM 0 HG22 THR A 103 -7.493 4.800 0.133 1.00 0.00 H new ATOM 0 HG23 THR A 103 -6.284 4.661 1.432 1.00 0.00 H new ATOM 1642 N ASP A 104 -5.704 6.224 -3.180 1.00 0.00 N ATOM 1643 CA ASP A 104 -6.328 5.869 -4.450 1.00 0.00 C ATOM 1644 C ASP A 104 -5.446 4.925 -5.255 1.00 0.00 C ATOM 1645 O ASP A 104 -5.926 4.231 -6.153 1.00 0.00 O ATOM 1646 CB ASP A 104 -6.595 7.132 -5.276 1.00 0.00 C ATOM 1647 CG ASP A 104 -7.381 6.815 -6.559 1.00 0.00 C ATOM 1648 OD1 ASP A 104 -8.558 6.400 -6.467 1.00 0.00 O ATOM 1649 OD2 ASP A 104 -6.846 7.026 -7.672 1.00 0.00 O ATOM 0 H ASP A 104 -5.273 7.148 -3.159 1.00 0.00 H new ATOM 0 HA ASP A 104 -7.268 5.364 -4.227 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.154 7.849 -4.675 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -5.648 7.604 -5.536 1.00 0.00 H new ATOM 1654 N ALA A 105 -4.158 4.878 -4.908 1.00 0.00 N ATOM 1655 CA ALA A 105 -3.172 4.069 -5.606 1.00 0.00 C ATOM 1656 C ALA A 105 -2.732 2.878 -4.753 1.00 0.00 C ATOM 1657 O ALA A 105 -2.336 1.855 -5.315 1.00 0.00 O ATOM 1658 CB ALA A 105 -1.980 4.958 -5.980 1.00 0.00 C ATOM 0 H ALA A 105 -3.772 5.408 -4.126 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.615 3.660 -6.514 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -1.233 4.363 -6.505 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -2.319 5.767 -6.627 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -1.540 5.377 -5.075 1.00 0.00 H new ATOM 1664 N PHE A 106 -2.837 2.981 -3.420 1.00 0.00 N ATOM 1665 CA PHE A 106 -2.251 2.021 -2.489 1.00 0.00 C ATOM 1666 C PHE A 106 -3.118 1.794 -1.252 1.00 0.00 C ATOM 1667 O PHE A 106 -2.709 1.025 -0.382 1.00 0.00 O ATOM 1668 CB PHE A 106 -0.826 2.474 -2.121 1.00 0.00 C ATOM 1669 CG PHE A 106 0.113 2.292 -3.293 1.00 0.00 C ATOM 1670 CD1 PHE A 106 0.494 0.992 -3.674 1.00 0.00 C ATOM 1671 CD2 PHE A 106 0.486 3.393 -4.086 1.00 0.00 C ATOM 1672 CE1 PHE A 106 1.227 0.790 -4.854 1.00 0.00 C ATOM 1673 CE2 PHE A 106 1.228 3.188 -5.263 1.00 0.00 C ATOM 1674 CZ PHE A 106 1.592 1.888 -5.651 1.00 0.00 C ATOM 0 H PHE A 106 -3.337 3.742 -2.959 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.198 1.052 -2.985 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.839 3.521 -1.818 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.466 1.900 -1.267 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.222 0.148 -3.057 1.00 0.00 H new ATOM 0 HD2 PHE A 106 0.203 4.393 -3.792 1.00 0.00 H new ATOM 0 HE1 PHE A 106 1.510 -0.209 -5.149 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.519 4.032 -5.870 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.152 1.733 -6.561 1.00 0.00 H new ATOM 1684 N GLU A 107 -4.313 2.405 -1.172 1.00 0.00 N ATOM 1685 CA GLU A 107 -5.297 2.127 -0.122 1.00 0.00 C ATOM 1686 C GLU A 107 -4.679 2.220 1.291 1.00 0.00 C ATOM 1687 O GLU A 107 -4.940 1.398 2.171 1.00 0.00 O ATOM 1688 CB GLU A 107 -6.016 0.814 -0.465 1.00 0.00 C ATOM 1689 CG GLU A 107 -6.968 0.969 -1.661 1.00 0.00 C ATOM 1690 CD GLU A 107 -7.700 -0.348 -1.971 1.00 0.00 C ATOM 1691 OE1 GLU A 107 -7.190 -1.164 -2.773 1.00 0.00 O ATOM 1692 OE2 GLU A 107 -8.806 -0.578 -1.431 1.00 0.00 O ATOM 0 H GLU A 107 -4.621 3.110 -1.841 1.00 0.00 H new ATOM 0 HA GLU A 107 -6.066 2.899 -0.090 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -5.277 0.045 -0.688 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -6.579 0.472 0.404 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.697 1.751 -1.448 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -6.404 1.289 -2.537 1.00 0.00 H new ATOM 1699 N ASN A 108 -3.825 3.238 1.465 1.00 0.00 N ATOM 1700 CA ASN A 108 -3.145 3.625 2.697 1.00 0.00 C ATOM 1701 C ASN A 108 -4.058 3.530 3.924 1.00 0.00 C ATOM 1702 O ASN A 108 -5.150 4.099 3.937 1.00 0.00 O ATOM 1703 CB ASN A 108 -2.602 5.058 2.529 1.00 0.00 C ATOM 1704 CG ASN A 108 -2.125 5.679 3.848 1.00 0.00 C ATOM 1705 OD1 ASN A 108 -1.665 5.003 4.759 1.00 0.00 O ATOM 1706 ND2 ASN A 108 -2.257 6.986 3.999 1.00 0.00 N ATOM 0 H ASN A 108 -3.577 3.853 0.690 1.00 0.00 H new ATOM 0 HA ASN A 108 -2.325 2.929 2.873 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -1.774 5.046 1.820 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.381 5.687 2.099 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.976 7.429 4.873 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -2.640 7.551 3.241 1.00 0.00 H new ATOM 1713 N GLU A 109 -3.576 2.848 4.965 1.00 0.00 N ATOM 1714 CA GLU A 109 -4.181 2.796 6.292 1.00 0.00 C ATOM 1715 C GLU A 109 -3.079 2.518 7.336 1.00 0.00 C ATOM 1716 O GLU A 109 -3.346 1.918 8.380 1.00 0.00 O ATOM 1717 CB GLU A 109 -5.301 1.732 6.293 1.00 0.00 C ATOM 1718 CG GLU A 109 -6.354 1.989 7.382 1.00 0.00 C ATOM 1719 CD GLU A 109 -7.479 0.940 7.336 1.00 0.00 C ATOM 1720 OE1 GLU A 109 -7.322 -0.158 7.916 1.00 0.00 O ATOM 1721 OE2 GLU A 109 -8.544 1.208 6.735 1.00 0.00 O ATOM 0 H GLU A 109 -2.720 2.296 4.901 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.642 3.747 6.557 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -5.787 1.720 5.317 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -4.861 0.746 6.443 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -5.878 1.971 8.362 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -6.778 2.985 7.252 1.00 0.00 H new ATOM 1728 N TYR A 110 -1.828 2.917 7.073 1.00 0.00 N ATOM 1729 CA TYR A 110 -0.652 2.556 7.825 1.00 0.00 C ATOM 1730 C TYR A 110 -0.063 3.820 8.427 1.00 0.00 C ATOM 1731 O TYR A 110 0.116 4.838 7.764 1.00 0.00 O ATOM 1732 CB TYR A 110 0.367 1.847 6.911 1.00 0.00 C ATOM 1733 CG TYR A 110 0.578 2.441 5.517 1.00 0.00 C ATOM 1734 CD1 TYR A 110 1.294 3.643 5.346 1.00 0.00 C ATOM 1735 CD2 TYR A 110 0.034 1.801 4.385 1.00 0.00 C ATOM 1736 CE1 TYR A 110 1.395 4.257 4.087 1.00 0.00 C ATOM 1737 CE2 TYR A 110 0.176 2.376 3.109 1.00 0.00 C ATOM 1738 CZ TYR A 110 0.832 3.621 2.957 1.00 0.00 C ATOM 1739 OH TYR A 110 0.914 4.188 1.723 1.00 0.00 O ATOM 0 H TYR A 110 -1.614 3.531 6.287 1.00 0.00 H new ATOM 0 HA TYR A 110 -0.912 1.863 8.625 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.329 1.833 7.423 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.053 0.810 6.794 1.00 0.00 H new ATOM 0 HD1 TYR A 110 1.774 4.100 6.199 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.494 0.866 4.498 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.898 5.207 3.983 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -0.217 1.866 2.242 1.00 0.00 H new ATOM 0 HH TYR A 110 0.473 3.609 1.067 1.00 0.00 H new ATOM 1749 N VAL A 111 0.237 3.708 9.708 1.00 0.00 N ATOM 1750 CA VAL A 111 1.008 4.656 10.509 1.00 0.00 C ATOM 1751 C VAL A 111 1.623 3.936 11.730 1.00 0.00 C ATOM 1752 O VAL A 111 1.005 2.992 12.234 1.00 0.00 O ATOM 1753 CB VAL A 111 0.144 5.832 11.034 1.00 0.00 C ATOM 1754 CG1 VAL A 111 -0.432 6.722 9.929 1.00 0.00 C ATOM 1755 CG2 VAL A 111 -0.992 5.387 11.968 1.00 0.00 C ATOM 0 H VAL A 111 -0.068 2.904 10.256 1.00 0.00 H new ATOM 0 HA VAL A 111 1.782 5.058 9.855 1.00 0.00 H new ATOM 0 HB VAL A 111 0.854 6.426 11.609 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.024 7.521 10.376 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.383 7.155 9.349 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.066 6.124 9.274 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.555 6.260 12.297 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.656 4.707 11.435 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.572 4.878 12.835 1.00 0.00 H new ATOM 1765 N PRO A 112 2.807 4.338 12.226 1.00 0.00 N ATOM 1766 CA PRO A 112 3.733 5.259 11.581 1.00 0.00 C ATOM 1767 C PRO A 112 4.503 4.449 10.531 1.00 0.00 C ATOM 1768 O PRO A 112 4.925 3.325 10.818 1.00 0.00 O ATOM 1769 CB PRO A 112 4.671 5.764 12.677 1.00 0.00 C ATOM 1770 CG PRO A 112 4.630 4.670 13.740 1.00 0.00 C ATOM 1771 CD PRO A 112 3.257 4.020 13.572 1.00 0.00 C ATOM 0 HA PRO A 112 3.244 6.104 11.097 1.00 0.00 H new ATOM 0 HB2 PRO A 112 5.682 5.913 12.298 1.00 0.00 H new ATOM 0 HB3 PRO A 112 4.336 6.721 13.078 1.00 0.00 H new ATOM 0 HG2 PRO A 112 5.432 3.946 13.595 1.00 0.00 H new ATOM 0 HG3 PRO A 112 4.752 5.085 14.741 1.00 0.00 H new ATOM 0 HD2 PRO A 112 3.319 2.941 13.715 1.00 0.00 H new ATOM 0 HD3 PRO A 112 2.555 4.400 14.315 1.00 0.00 H new ATOM 1779 N ALA A 113 4.704 4.987 9.329 1.00 0.00 N ATOM 1780 CA ALA A 113 5.399 4.269 8.265 1.00 0.00 C ATOM 1781 C ALA A 113 6.279 5.224 7.490 1.00 0.00 C ATOM 1782 O ALA A 113 5.942 6.399 7.355 1.00 0.00 O ATOM 1783 CB ALA A 113 4.403 3.592 7.324 1.00 0.00 C ATOM 0 H ALA A 113 4.393 5.923 9.068 1.00 0.00 H new ATOM 0 HA ALA A 113 6.019 3.496 8.719 1.00 0.00 H new ATOM 0 HB1 ALA A 113 4.945 3.064 6.540 1.00 0.00 H new ATOM 0 HB2 ALA A 113 3.795 2.883 7.886 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.757 4.346 6.874 1.00 0.00 H new ATOM 1789 N TYR A 114 7.380 4.707 6.956 1.00 0.00 N ATOM 1790 CA TYR A 114 8.447 5.504 6.368 1.00 0.00 C ATOM 1791 C TYR A 114 8.890 4.840 5.064 1.00 0.00 C ATOM 1792 O TYR A 114 9.056 3.618 5.012 1.00 0.00 O ATOM 1793 CB TYR A 114 9.616 5.639 7.368 1.00 0.00 C ATOM 1794 CG TYR A 114 9.297 5.303 8.819 1.00 0.00 C ATOM 1795 CD1 TYR A 114 8.693 6.258 9.658 1.00 0.00 C ATOM 1796 CD2 TYR A 114 9.550 4.010 9.309 1.00 0.00 C ATOM 1797 CE1 TYR A 114 8.305 5.912 10.964 1.00 0.00 C ATOM 1798 CE2 TYR A 114 9.168 3.653 10.612 1.00 0.00 C ATOM 1799 CZ TYR A 114 8.529 4.601 11.441 1.00 0.00 C ATOM 1800 OH TYR A 114 8.134 4.236 12.692 1.00 0.00 O ATOM 0 H TYR A 114 7.558 3.703 6.920 1.00 0.00 H new ATOM 0 HA TYR A 114 8.094 6.511 6.145 1.00 0.00 H new ATOM 0 HB2 TYR A 114 10.428 4.992 7.036 1.00 0.00 H new ATOM 0 HB3 TYR A 114 9.987 6.663 7.326 1.00 0.00 H new ATOM 0 HD1 TYR A 114 8.527 7.262 9.296 1.00 0.00 H new ATOM 0 HD2 TYR A 114 10.042 3.285 8.678 1.00 0.00 H new ATOM 0 HE1 TYR A 114 7.836 6.647 11.602 1.00 0.00 H new ATOM 0 HE2 TYR A 114 9.362 2.656 10.979 1.00 0.00 H new ATOM 0 HH TYR A 114 7.508 4.902 13.045 1.00 0.00 H new ATOM 1810 N TYR A 115 9.083 5.643 4.018 1.00 0.00 N ATOM 1811 CA TYR A 115 9.308 5.192 2.653 1.00 0.00 C ATOM 1812 C TYR A 115 10.442 6.036 2.081 1.00 0.00 C ATOM 1813 O TYR A 115 10.349 7.267 2.074 1.00 0.00 O ATOM 1814 CB TYR A 115 8.020 5.382 1.834 1.00 0.00 C ATOM 1815 CG TYR A 115 6.845 4.514 2.245 1.00 0.00 C ATOM 1816 CD1 TYR A 115 6.024 4.890 3.326 1.00 0.00 C ATOM 1817 CD2 TYR A 115 6.552 3.343 1.525 1.00 0.00 C ATOM 1818 CE1 TYR A 115 4.921 4.098 3.691 1.00 0.00 C ATOM 1819 CE2 TYR A 115 5.467 2.534 1.899 1.00 0.00 C ATOM 1820 CZ TYR A 115 4.640 2.907 2.980 1.00 0.00 C ATOM 1821 OH TYR A 115 3.601 2.101 3.329 1.00 0.00 O ATOM 0 H TYR A 115 9.086 6.659 4.105 1.00 0.00 H new ATOM 0 HA TYR A 115 9.574 4.135 2.620 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.718 6.427 1.903 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.245 5.184 0.786 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.243 5.792 3.878 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.164 3.064 0.680 1.00 0.00 H new ATOM 0 HE1 TYR A 115 4.289 4.398 4.513 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.264 1.622 1.357 1.00 0.00 H new ATOM 0 HH TYR A 115 2.783 2.635 3.403 1.00 0.00 H new ATOM 1831 N VAL A 116 11.515 5.394 1.627 1.00 0.00 N ATOM 1832 CA VAL A 116 12.738 6.062 1.191 1.00 0.00 C ATOM 1833 C VAL A 116 12.760 5.930 -0.322 1.00 0.00 C ATOM 1834 O VAL A 116 12.598 4.826 -0.841 1.00 0.00 O ATOM 1835 CB VAL A 116 13.989 5.423 1.840 1.00 0.00 C ATOM 1836 CG1 VAL A 116 15.256 6.230 1.517 1.00 0.00 C ATOM 1837 CG2 VAL A 116 13.868 5.327 3.367 1.00 0.00 C ATOM 0 H VAL A 116 11.560 4.378 1.550 1.00 0.00 H new ATOM 0 HA VAL A 116 12.754 7.109 1.495 1.00 0.00 H new ATOM 0 HB VAL A 116 14.061 4.419 1.421 1.00 0.00 H new ATOM 0 HG11 VAL A 116 16.118 5.757 1.987 1.00 0.00 H new ATOM 0 HG12 VAL A 116 15.402 6.261 0.437 1.00 0.00 H new ATOM 0 HG13 VAL A 116 15.147 7.246 1.898 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.770 4.872 3.776 1.00 0.00 H new ATOM 0 HG22 VAL A 116 13.744 6.326 3.786 1.00 0.00 H new ATOM 0 HG23 VAL A 116 13.004 4.715 3.626 1.00 0.00 H new ATOM 1847 N PHE A 117 12.972 7.031 -1.035 1.00 0.00 N ATOM 1848 CA PHE A 117 12.908 7.076 -2.481 1.00 0.00 C ATOM 1849 C PHE A 117 14.198 7.694 -2.990 1.00 0.00 C ATOM 1850 O PHE A 117 14.766 8.604 -2.385 1.00 0.00 O ATOM 1851 CB PHE A 117 11.715 7.913 -2.958 1.00 0.00 C ATOM 1852 CG PHE A 117 10.336 7.467 -2.506 1.00 0.00 C ATOM 1853 CD1 PHE A 117 9.861 7.824 -1.232 1.00 0.00 C ATOM 1854 CD2 PHE A 117 9.487 6.773 -3.389 1.00 0.00 C ATOM 1855 CE1 PHE A 117 8.554 7.482 -0.847 1.00 0.00 C ATOM 1856 CE2 PHE A 117 8.174 6.446 -3.010 1.00 0.00 C ATOM 1857 CZ PHE A 117 7.705 6.799 -1.735 1.00 0.00 C ATOM 0 H PHE A 117 13.197 7.931 -0.611 1.00 0.00 H new ATOM 0 HA PHE A 117 12.781 6.065 -2.867 1.00 0.00 H new ATOM 0 HB2 PHE A 117 11.866 8.939 -2.623 1.00 0.00 H new ATOM 0 HB3 PHE A 117 11.726 7.928 -4.048 1.00 0.00 H new ATOM 0 HD1 PHE A 117 10.501 8.362 -0.549 1.00 0.00 H new ATOM 0 HD2 PHE A 117 9.848 6.489 -4.367 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.199 7.746 0.138 1.00 0.00 H new ATOM 0 HE2 PHE A 117 7.527 5.924 -3.699 1.00 0.00 H new ATOM 0 HZ PHE A 117 6.698 6.547 -1.438 1.00 0.00 H new ATOM 1867 N ASP A 118 14.638 7.198 -4.134 1.00 0.00 N ATOM 1868 CA ASP A 118 15.741 7.756 -4.911 1.00 0.00 C ATOM 1869 C ASP A 118 15.366 9.154 -5.427 1.00 0.00 C ATOM 1870 O ASP A 118 14.182 9.498 -5.479 1.00 0.00 O ATOM 1871 CB ASP A 118 15.944 6.800 -6.083 1.00 0.00 C ATOM 1872 CG ASP A 118 17.293 6.859 -6.797 1.00 0.00 C ATOM 1873 OD1 ASP A 118 17.960 7.913 -6.796 1.00 0.00 O ATOM 1874 OD2 ASP A 118 17.666 5.790 -7.338 1.00 0.00 O ATOM 0 H ASP A 118 14.227 6.370 -4.564 1.00 0.00 H new ATOM 0 HA ASP A 118 16.647 7.859 -4.313 1.00 0.00 H new ATOM 0 HB2 ASP A 118 15.796 5.783 -5.721 1.00 0.00 H new ATOM 0 HB3 ASP A 118 15.162 6.993 -6.818 1.00 0.00 H new ATOM 1879 N LYS A 119 16.338 9.941 -5.899 1.00 0.00 N ATOM 1880 CA LYS A 119 16.089 11.230 -6.559 1.00 0.00 C ATOM 1881 C LYS A 119 15.228 11.132 -7.821 1.00 0.00 C ATOM 1882 O LYS A 119 14.825 12.171 -8.340 1.00 0.00 O ATOM 1883 CB LYS A 119 17.391 11.997 -6.847 1.00 0.00 C ATOM 1884 CG LYS A 119 18.306 11.395 -7.926 1.00 0.00 C ATOM 1885 CD LYS A 119 18.800 12.437 -8.951 1.00 0.00 C ATOM 1886 CE LYS A 119 17.785 12.620 -10.091 1.00 0.00 C ATOM 1887 NZ LYS A 119 18.282 13.536 -11.152 1.00 0.00 N ATOM 0 H LYS A 119 17.327 9.701 -5.834 1.00 0.00 H new ATOM 0 HA LYS A 119 15.506 11.799 -5.835 1.00 0.00 H new ATOM 0 HB2 LYS A 119 17.132 13.013 -7.145 1.00 0.00 H new ATOM 0 HB3 LYS A 119 17.958 12.071 -5.919 1.00 0.00 H new ATOM 0 HG2 LYS A 119 19.167 10.930 -7.446 1.00 0.00 H new ATOM 0 HG3 LYS A 119 17.768 10.605 -8.450 1.00 0.00 H new ATOM 0 HD2 LYS A 119 18.966 13.392 -8.452 1.00 0.00 H new ATOM 0 HD3 LYS A 119 19.759 12.121 -9.362 1.00 0.00 H new ATOM 0 HE2 LYS A 119 17.558 11.649 -10.531 1.00 0.00 H new ATOM 0 HE3 LYS A 119 16.853 13.012 -9.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 17.926 13.221 -12.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 17.946 14.502 -10.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 19.322 13.526 -11.160 1.00 0.00 H new ATOM 1901 N THR A 120 14.972 9.936 -8.343 1.00 0.00 N ATOM 1902 CA THR A 120 14.068 9.711 -9.461 1.00 0.00 C ATOM 1903 C THR A 120 12.618 9.605 -8.997 1.00 0.00 C ATOM 1904 O THR A 120 11.694 9.850 -9.773 1.00 0.00 O ATOM 1905 CB THR A 120 14.416 8.368 -10.102 1.00 0.00 C ATOM 1906 OG1 THR A 120 14.478 7.355 -9.114 1.00 0.00 O ATOM 1907 CG2 THR A 120 15.762 8.371 -10.817 1.00 0.00 C ATOM 0 H THR A 120 15.398 9.079 -7.991 1.00 0.00 H new ATOM 0 HA THR A 120 14.175 10.549 -10.150 1.00 0.00 H new ATOM 0 HB THR A 120 13.628 8.181 -10.832 1.00 0.00 H new ATOM 0 HG1 THR A 120 14.700 6.499 -9.537 1.00 0.00 H new ATOM 0 HG21 THR A 120 15.947 7.387 -11.249 1.00 0.00 H new ATOM 0 HG22 THR A 120 15.751 9.119 -11.609 1.00 0.00 H new ATOM 0 HG23 THR A 120 16.552 8.608 -10.104 1.00 0.00 H new ATOM 1915 N GLY A 121 12.425 9.181 -7.746 1.00 0.00 N ATOM 1916 CA GLY A 121 11.144 8.810 -7.187 1.00 0.00 C ATOM 1917 C GLY A 121 10.965 7.301 -7.110 1.00 0.00 C ATOM 1918 O GLY A 121 9.869 6.884 -6.747 1.00 0.00 O ATOM 0 H GLY A 121 13.191 9.087 -7.079 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.048 9.237 -6.189 1.00 0.00 H new ATOM 0 HA3 GLY A 121 10.347 9.238 -7.795 1.00 0.00 H new ATOM 1922 N GLN A 122 11.965 6.477 -7.462 1.00 0.00 N ATOM 1923 CA GLN A 122 11.827 5.029 -7.345 1.00 0.00 C ATOM 1924 C GLN A 122 11.944 4.659 -5.857 1.00 0.00 C ATOM 1925 O GLN A 122 12.912 5.031 -5.188 1.00 0.00 O ATOM 1926 CB GLN A 122 12.786 4.286 -8.308 1.00 0.00 C ATOM 1927 CG GLN A 122 14.233 4.107 -7.831 1.00 0.00 C ATOM 1928 CD GLN A 122 15.147 3.440 -8.864 1.00 0.00 C ATOM 1929 OE1 GLN A 122 14.782 2.455 -9.503 1.00 0.00 O ATOM 1930 NE2 GLN A 122 16.366 3.930 -9.040 1.00 0.00 N ATOM 0 H GLN A 122 12.865 6.790 -7.825 1.00 0.00 H new ATOM 0 HA GLN A 122 10.845 4.691 -7.675 1.00 0.00 H new ATOM 0 HB2 GLN A 122 12.369 3.299 -8.510 1.00 0.00 H new ATOM 0 HB3 GLN A 122 12.803 4.825 -9.255 1.00 0.00 H new ATOM 0 HG2 GLN A 122 14.644 5.083 -7.573 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.234 3.509 -6.919 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.669 4.747 -8.510 1.00 0.00 H new ATOM 0 HE22 GLN A 122 17.001 3.490 -9.706 1.00 0.00 H new ATOM 1939 N LEU A 123 10.922 3.980 -5.335 1.00 0.00 N ATOM 1940 CA LEU A 123 10.774 3.554 -3.942 1.00 0.00 C ATOM 1941 C LEU A 123 11.880 2.570 -3.545 1.00 0.00 C ATOM 1942 O LEU A 123 11.768 1.378 -3.814 1.00 0.00 O ATOM 1943 CB LEU A 123 9.363 2.972 -3.742 1.00 0.00 C ATOM 1944 CG LEU A 123 9.085 2.429 -2.326 1.00 0.00 C ATOM 1945 CD1 LEU A 123 9.566 3.351 -1.203 1.00 0.00 C ATOM 1946 CD2 LEU A 123 7.582 2.202 -2.149 1.00 0.00 C ATOM 0 H LEU A 123 10.127 3.695 -5.908 1.00 0.00 H new ATOM 0 HA LEU A 123 10.885 4.413 -3.280 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.630 3.746 -3.970 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.211 2.167 -4.461 1.00 0.00 H new ATOM 0 HG LEU A 123 9.648 1.499 -2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.335 2.900 -0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.643 3.496 -1.287 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.063 4.315 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 123 7.387 1.818 -1.148 1.00 0.00 H new ATOM 0 HD22 LEU A 123 7.053 3.145 -2.285 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.233 1.481 -2.888 1.00 0.00 H new ATOM 1958 N ARG A 124 12.962 3.041 -2.927 1.00 0.00 N ATOM 1959 CA ARG A 124 14.102 2.195 -2.579 1.00 0.00 C ATOM 1960 C ARG A 124 13.789 1.243 -1.426 1.00 0.00 C ATOM 1961 O ARG A 124 14.226 0.095 -1.487 1.00 0.00 O ATOM 1962 CB ARG A 124 15.329 3.058 -2.224 1.00 0.00 C ATOM 1963 CG ARG A 124 15.937 3.845 -3.394 1.00 0.00 C ATOM 1964 CD ARG A 124 16.255 2.973 -4.617 1.00 0.00 C ATOM 1965 NE ARG A 124 17.307 3.572 -5.460 1.00 0.00 N ATOM 1966 CZ ARG A 124 18.611 3.276 -5.439 1.00 0.00 C ATOM 1967 NH1 ARG A 124 19.084 2.310 -4.660 1.00 0.00 N ATOM 1968 NH2 ARG A 124 19.432 3.974 -6.210 1.00 0.00 N ATOM 0 H ARG A 124 13.073 4.018 -2.654 1.00 0.00 H new ATOM 0 HA ARG A 124 14.324 1.589 -3.457 1.00 0.00 H new ATOM 0 HB2 ARG A 124 15.044 3.763 -1.443 1.00 0.00 H new ATOM 0 HB3 ARG A 124 16.099 2.411 -1.804 1.00 0.00 H new ATOM 0 HG2 ARG A 124 15.245 4.634 -3.690 1.00 0.00 H new ATOM 0 HG3 ARG A 124 16.852 4.333 -3.057 1.00 0.00 H new ATOM 0 HD2 ARG A 124 16.574 1.985 -4.285 1.00 0.00 H new ATOM 0 HD3 ARG A 124 15.350 2.834 -5.209 1.00 0.00 H new ATOM 0 HE ARG A 124 17.010 4.284 -6.127 1.00 0.00 H new ATOM 0 HH11 ARG A 124 18.449 1.779 -4.064 1.00 0.00 H new ATOM 0 HH12 ARG A 124 20.082 2.099 -4.658 1.00 0.00 H new ATOM 0 HH21 ARG A 124 19.065 4.719 -6.803 1.00 0.00 H new ATOM 0 HH22 ARG A 124 20.431 3.766 -6.211 1.00 0.00 H new ATOM 1982 N HIS A 125 13.085 1.686 -0.379 1.00 0.00 N ATOM 1983 CA HIS A 125 12.883 0.891 0.833 1.00 0.00 C ATOM 1984 C HIS A 125 11.648 1.385 1.587 1.00 0.00 C ATOM 1985 O HIS A 125 11.260 2.545 1.439 1.00 0.00 O ATOM 1986 CB HIS A 125 14.136 1.019 1.718 1.00 0.00 C ATOM 1987 CG HIS A 125 14.128 0.149 2.950 1.00 0.00 C ATOM 1988 ND1 HIS A 125 14.511 -1.172 3.026 1.00 0.00 N ATOM 1989 CD2 HIS A 125 13.778 0.539 4.216 1.00 0.00 C ATOM 1990 CE1 HIS A 125 14.402 -1.563 4.307 1.00 0.00 C ATOM 1991 NE2 HIS A 125 13.975 -0.546 5.079 1.00 0.00 N ATOM 0 H HIS A 125 12.641 2.604 -0.349 1.00 0.00 H new ATOM 0 HA HIS A 125 12.724 -0.155 0.569 1.00 0.00 H new ATOM 0 HB2 HIS A 125 15.013 0.771 1.120 1.00 0.00 H new ATOM 0 HB3 HIS A 125 14.243 2.059 2.025 1.00 0.00 H new ATOM 0 HD2 HIS A 125 13.413 1.515 4.499 1.00 0.00 H new ATOM 0 HE1 HIS A 125 14.626 -2.556 4.668 1.00 0.00 H new ATOM 0 HE2 HIS A 125 13.825 -0.562 6.088 1.00 0.00 H new ATOM 1999 N PHE A 126 11.078 0.538 2.446 1.00 0.00 N ATOM 2000 CA PHE A 126 9.985 0.875 3.351 1.00 0.00 C ATOM 2001 C PHE A 126 10.196 0.142 4.676 1.00 0.00 C ATOM 2002 O PHE A 126 10.684 -0.991 4.695 1.00 0.00 O ATOM 2003 CB PHE A 126 8.630 0.509 2.710 1.00 0.00 C ATOM 2004 CG PHE A 126 7.562 -0.022 3.655 1.00 0.00 C ATOM 2005 CD1 PHE A 126 6.780 0.864 4.419 1.00 0.00 C ATOM 2006 CD2 PHE A 126 7.359 -1.412 3.781 1.00 0.00 C ATOM 2007 CE1 PHE A 126 5.782 0.365 5.275 1.00 0.00 C ATOM 2008 CE2 PHE A 126 6.377 -1.908 4.658 1.00 0.00 C ATOM 2009 CZ PHE A 126 5.585 -1.018 5.403 1.00 0.00 C ATOM 0 H PHE A 126 11.377 -0.433 2.531 1.00 0.00 H new ATOM 0 HA PHE A 126 9.975 1.948 3.543 1.00 0.00 H new ATOM 0 HB2 PHE A 126 8.237 1.395 2.211 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.807 -0.240 1.938 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.946 1.929 4.348 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.960 -2.098 3.202 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.164 1.050 5.837 1.00 0.00 H new ATOM 0 HE2 PHE A 126 6.232 -2.973 4.759 1.00 0.00 H new ATOM 0 HZ PHE A 126 4.827 -1.398 6.072 1.00 0.00 H new ATOM 2019 N GLN A 127 9.777 0.781 5.767 1.00 0.00 N ATOM 2020 CA GLN A 127 9.695 0.227 7.111 1.00 0.00 C ATOM 2021 C GLN A 127 8.474 0.880 7.779 1.00 0.00 C ATOM 2022 O GLN A 127 8.042 1.957 7.365 1.00 0.00 O ATOM 2023 CB GLN A 127 11.022 0.517 7.850 1.00 0.00 C ATOM 2024 CG GLN A 127 11.055 0.041 9.313 1.00 0.00 C ATOM 2025 CD GLN A 127 12.414 0.268 9.978 1.00 0.00 C ATOM 2026 OE1 GLN A 127 12.947 1.373 9.992 1.00 0.00 O ATOM 2027 NE2 GLN A 127 12.996 -0.766 10.567 1.00 0.00 N ATOM 0 H GLN A 127 9.469 1.753 5.731 1.00 0.00 H new ATOM 0 HA GLN A 127 9.564 -0.855 7.123 1.00 0.00 H new ATOM 0 HB2 GLN A 127 11.837 0.039 7.307 1.00 0.00 H new ATOM 0 HB3 GLN A 127 11.209 1.591 7.826 1.00 0.00 H new ATOM 0 HG2 GLN A 127 10.286 0.567 9.879 1.00 0.00 H new ATOM 0 HG3 GLN A 127 10.809 -1.020 9.351 1.00 0.00 H new ATOM 0 HE21 GLN A 127 12.547 -1.681 10.551 1.00 0.00 H new ATOM 0 HE22 GLN A 127 13.894 -0.647 11.037 1.00 0.00 H new ATOM 2036 N ALA A 128 7.931 0.271 8.834 1.00 0.00 N ATOM 2037 CA ALA A 128 6.900 0.877 9.663 1.00 0.00 C ATOM 2038 C ALA A 128 7.122 0.482 11.121 1.00 0.00 C ATOM 2039 O ALA A 128 7.723 -0.560 11.397 1.00 0.00 O ATOM 2040 CB ALA A 128 5.516 0.421 9.184 1.00 0.00 C ATOM 0 H ALA A 128 8.200 -0.665 9.136 1.00 0.00 H new ATOM 0 HA ALA A 128 6.954 1.963 9.582 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.747 0.877 9.807 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.371 0.726 8.148 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.445 -0.664 9.256 1.00 0.00 H new ATOM 2046 N GLY A 129 6.602 1.299 12.039 1.00 0.00 N ATOM 2047 CA GLY A 129 6.595 1.022 13.473 1.00 0.00 C ATOM 2048 C GLY A 129 7.995 0.761 14.035 1.00 0.00 C ATOM 2049 O GLY A 129 8.180 -0.202 14.783 1.00 0.00 O ATOM 0 H GLY A 129 6.166 2.189 11.799 1.00 0.00 H new ATOM 0 HA2 GLY A 129 6.149 1.866 13.999 1.00 0.00 H new ATOM 0 HA3 GLY A 129 5.963 0.155 13.668 1.00 0.00 H new ATOM 2053 N GLY A 130 8.981 1.579 13.654 1.00 0.00 N ATOM 2054 CA GLY A 130 10.368 1.438 14.078 1.00 0.00 C ATOM 2055 C GLY A 130 10.684 2.497 15.126 1.00 0.00 C ATOM 2056 O GLY A 130 10.402 3.679 14.915 1.00 0.00 O ATOM 0 H GLY A 130 8.829 2.372 13.030 1.00 0.00 H new ATOM 0 HA2 GLY A 130 10.535 0.442 14.489 1.00 0.00 H new ATOM 0 HA3 GLY A 130 11.035 1.546 13.222 1.00 0.00 H new ATOM 2060 N SER A 131 11.259 2.071 16.252 1.00 0.00 N ATOM 2061 CA SER A 131 11.519 2.888 17.430 1.00 0.00 C ATOM 2062 C SER A 131 12.260 4.177 17.057 1.00 0.00 C ATOM 2063 O SER A 131 13.426 4.136 16.657 1.00 0.00 O ATOM 2064 CB SER A 131 12.301 2.051 18.452 1.00 0.00 C ATOM 2065 OG SER A 131 11.678 0.785 18.639 1.00 0.00 O ATOM 0 H SER A 131 11.568 1.106 16.369 1.00 0.00 H new ATOM 0 HA SER A 131 10.574 3.196 17.878 1.00 0.00 H new ATOM 0 HB2 SER A 131 13.326 1.912 18.109 1.00 0.00 H new ATOM 0 HB3 SER A 131 12.353 2.582 19.403 1.00 0.00 H new ATOM 0 HG SER A 131 12.189 0.262 19.292 1.00 0.00 H new ATOM 2071 N GLY A 132 11.563 5.315 17.154 1.00 0.00 N ATOM 2072 CA GLY A 132 12.090 6.640 16.848 1.00 0.00 C ATOM 2073 C GLY A 132 12.748 6.744 15.471 1.00 0.00 C ATOM 2074 O GLY A 132 13.659 7.550 15.316 1.00 0.00 O ATOM 0 H GLY A 132 10.589 5.335 17.457 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.279 7.365 16.907 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.820 6.915 17.610 1.00 0.00 H new ATOM 2078 N MET A 133 12.349 5.934 14.480 1.00 0.00 N ATOM 2079 CA MET A 133 12.998 5.830 13.165 1.00 0.00 C ATOM 2080 C MET A 133 14.523 5.579 13.236 1.00 0.00 C ATOM 2081 O MET A 133 15.252 5.940 12.310 1.00 0.00 O ATOM 2082 CB MET A 133 12.697 7.063 12.291 1.00 0.00 C ATOM 2083 CG MET A 133 11.257 7.577 12.309 1.00 0.00 C ATOM 2084 SD MET A 133 10.880 8.793 11.009 1.00 0.00 S ATOM 2085 CE MET A 133 12.299 9.918 11.147 1.00 0.00 C ATOM 0 H MET A 133 11.543 5.316 14.574 1.00 0.00 H new ATOM 0 HA MET A 133 12.563 4.946 12.699 1.00 0.00 H new ATOM 0 HB2 MET A 133 13.353 7.874 12.608 1.00 0.00 H new ATOM 0 HB3 MET A 133 12.961 6.824 11.261 1.00 0.00 H new ATOM 0 HG2 MET A 133 10.580 6.729 12.205 1.00 0.00 H new ATOM 0 HG3 MET A 133 11.057 8.028 13.281 1.00 0.00 H new ATOM 0 HE1 MET A 133 12.213 10.705 10.398 1.00 0.00 H new ATOM 0 HE2 MET A 133 12.315 10.363 12.142 1.00 0.00 H new ATOM 0 HE3 MET A 133 13.222 9.361 10.984 1.00 0.00 H new ATOM 2095 N LYS A 134 15.056 5.020 14.330 1.00 0.00 N ATOM 2096 CA LYS A 134 16.509 4.960 14.541 1.00 0.00 C ATOM 2097 C LYS A 134 17.216 4.063 13.514 1.00 0.00 C ATOM 2098 O LYS A 134 18.379 4.316 13.190 1.00 0.00 O ATOM 2099 CB LYS A 134 16.778 4.531 15.998 1.00 0.00 C ATOM 2100 CG LYS A 134 18.239 4.599 16.484 1.00 0.00 C ATOM 2101 CD LYS A 134 18.793 5.998 16.816 1.00 0.00 C ATOM 2102 CE LYS A 134 19.013 6.902 15.593 1.00 0.00 C ATOM 2103 NZ LYS A 134 19.913 8.048 15.883 1.00 0.00 N ATOM 0 H LYS A 134 14.505 4.604 15.081 1.00 0.00 H new ATOM 0 HA LYS A 134 16.936 5.950 14.381 1.00 0.00 H new ATOM 0 HB2 LYS A 134 16.172 5.157 16.654 1.00 0.00 H new ATOM 0 HB3 LYS A 134 16.426 3.507 16.121 1.00 0.00 H new ATOM 0 HG2 LYS A 134 18.331 3.977 17.374 1.00 0.00 H new ATOM 0 HG3 LYS A 134 18.874 4.155 15.717 1.00 0.00 H new ATOM 0 HD2 LYS A 134 18.105 6.495 17.500 1.00 0.00 H new ATOM 0 HD3 LYS A 134 19.740 5.884 17.343 1.00 0.00 H new ATOM 0 HE2 LYS A 134 19.434 6.311 14.780 1.00 0.00 H new ATOM 0 HE3 LYS A 134 18.051 7.279 15.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 20.014 8.635 15.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 19.509 8.621 16.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 20.847 7.692 16.171 1.00 0.00 H new ATOM 2117 N MET A 135 16.533 3.047 12.981 1.00 0.00 N ATOM 2118 CA MET A 135 17.061 2.208 11.902 1.00 0.00 C ATOM 2119 C MET A 135 16.990 2.970 10.572 1.00 0.00 C ATOM 2120 O MET A 135 17.915 2.916 9.770 1.00 0.00 O ATOM 2121 CB MET A 135 16.261 0.891 11.852 1.00 0.00 C ATOM 2122 CG MET A 135 16.972 -0.284 11.156 1.00 0.00 C ATOM 2123 SD MET A 135 17.452 -0.127 9.406 1.00 0.00 S ATOM 2124 CE MET A 135 15.889 0.368 8.632 1.00 0.00 C ATOM 0 H MET A 135 15.596 2.782 13.286 1.00 0.00 H new ATOM 0 HA MET A 135 18.107 1.965 12.086 1.00 0.00 H new ATOM 0 HB2 MET A 135 16.017 0.594 12.872 1.00 0.00 H new ATOM 0 HB3 MET A 135 15.317 1.078 11.340 1.00 0.00 H new ATOM 0 HG2 MET A 135 17.876 -0.503 11.725 1.00 0.00 H new ATOM 0 HG3 MET A 135 16.323 -1.156 11.240 1.00 0.00 H new ATOM 0 HE1 MET A 135 16.035 0.481 7.558 1.00 0.00 H new ATOM 0 HE2 MET A 135 15.133 -0.396 8.817 1.00 0.00 H new ATOM 0 HE3 MET A 135 15.558 1.316 9.055 1.00 0.00 H new ATOM 2134 N LEU A 136 15.916 3.725 10.328 1.00 0.00 N ATOM 2135 CA LEU A 136 15.688 4.438 9.069 1.00 0.00 C ATOM 2136 C LEU A 136 16.816 5.412 8.727 1.00 0.00 C ATOM 2137 O LEU A 136 17.147 5.586 7.558 1.00 0.00 O ATOM 2138 CB LEU A 136 14.374 5.209 9.184 1.00 0.00 C ATOM 2139 CG LEU A 136 13.895 5.831 7.866 1.00 0.00 C ATOM 2140 CD1 LEU A 136 13.566 4.754 6.826 1.00 0.00 C ATOM 2141 CD2 LEU A 136 12.692 6.708 8.200 1.00 0.00 C ATOM 0 H LEU A 136 15.169 3.860 11.010 1.00 0.00 H new ATOM 0 HA LEU A 136 15.650 3.700 8.268 1.00 0.00 H new ATOM 0 HB2 LEU A 136 13.602 4.536 9.557 1.00 0.00 H new ATOM 0 HB3 LEU A 136 14.493 6.000 9.924 1.00 0.00 H new ATOM 0 HG LEU A 136 14.680 6.437 7.412 1.00 0.00 H new ATOM 0 HD11 LEU A 136 13.230 5.229 5.904 1.00 0.00 H new ATOM 0 HD12 LEU A 136 14.457 4.159 6.624 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.777 4.107 7.209 1.00 0.00 H new ATOM 0 HD21 LEU A 136 12.316 7.173 7.288 1.00 0.00 H new ATOM 0 HD22 LEU A 136 11.908 6.096 8.645 1.00 0.00 H new ATOM 0 HD23 LEU A 136 12.991 7.483 8.906 1.00 0.00 H new ATOM 2153 N GLU A 137 17.432 6.012 9.745 1.00 0.00 N ATOM 2154 CA GLU A 137 18.631 6.844 9.625 1.00 0.00 C ATOM 2155 C GLU A 137 19.760 6.099 8.893 1.00 0.00 C ATOM 2156 O GLU A 137 20.502 6.676 8.093 1.00 0.00 O ATOM 2157 CB GLU A 137 19.034 7.204 11.061 1.00 0.00 C ATOM 2158 CG GLU A 137 20.284 8.077 11.200 1.00 0.00 C ATOM 2159 CD GLU A 137 20.694 8.130 12.673 1.00 0.00 C ATOM 2160 OE1 GLU A 137 21.252 7.127 13.176 1.00 0.00 O ATOM 2161 OE2 GLU A 137 20.391 9.139 13.352 1.00 0.00 O ATOM 0 H GLU A 137 17.101 5.931 10.706 1.00 0.00 H new ATOM 0 HA GLU A 137 18.437 7.738 9.033 1.00 0.00 H new ATOM 0 HB2 GLU A 137 18.199 7.719 11.535 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.195 6.280 11.616 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.096 7.670 10.598 1.00 0.00 H new ATOM 0 HG3 GLU A 137 20.084 9.082 10.828 1.00 0.00 H new ATOM 2168 N LYS A 138 19.884 4.792 9.141 1.00 0.00 N ATOM 2169 CA LYS A 138 20.874 3.942 8.496 1.00 0.00 C ATOM 2170 C LYS A 138 20.498 3.786 7.034 1.00 0.00 C ATOM 2171 O LYS A 138 21.348 3.962 6.163 1.00 0.00 O ATOM 2172 CB LYS A 138 20.986 2.572 9.197 1.00 0.00 C ATOM 2173 CG LYS A 138 21.033 2.637 10.733 1.00 0.00 C ATOM 2174 CD LYS A 138 22.186 3.505 11.258 1.00 0.00 C ATOM 2175 CE LYS A 138 22.254 3.494 12.790 1.00 0.00 C ATOM 2176 NZ LYS A 138 21.239 4.368 13.432 1.00 0.00 N ATOM 0 H LYS A 138 19.290 4.294 9.804 1.00 0.00 H new ATOM 0 HA LYS A 138 21.856 4.409 8.572 1.00 0.00 H new ATOM 0 HB2 LYS A 138 20.137 1.956 8.899 1.00 0.00 H new ATOM 0 HB3 LYS A 138 21.885 2.069 8.841 1.00 0.00 H new ATOM 0 HG2 LYS A 138 20.088 3.033 11.104 1.00 0.00 H new ATOM 0 HG3 LYS A 138 21.134 1.628 11.132 1.00 0.00 H new ATOM 0 HD2 LYS A 138 23.129 3.142 10.850 1.00 0.00 H new ATOM 0 HD3 LYS A 138 22.059 4.529 10.907 1.00 0.00 H new ATOM 0 HE2 LYS A 138 22.119 2.472 13.145 1.00 0.00 H new ATOM 0 HE3 LYS A 138 23.248 3.812 13.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 21.350 4.328 14.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 21.369 5.347 13.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 20.286 4.041 13.174 1.00 0.00 H new ATOM 2190 N ARG A 139 19.220 3.515 6.748 1.00 0.00 N ATOM 2191 CA ARG A 139 18.774 3.320 5.380 1.00 0.00 C ATOM 2192 C ARG A 139 18.943 4.582 4.556 1.00 0.00 C ATOM 2193 O ARG A 139 19.491 4.500 3.462 1.00 0.00 O ATOM 2194 CB ARG A 139 17.337 2.791 5.359 1.00 0.00 C ATOM 2195 CG ARG A 139 16.831 2.535 3.928 1.00 0.00 C ATOM 2196 CD ARG A 139 17.639 1.500 3.126 1.00 0.00 C ATOM 2197 NE ARG A 139 17.590 0.164 3.748 1.00 0.00 N ATOM 2198 CZ ARG A 139 18.285 -0.912 3.354 1.00 0.00 C ATOM 2199 NH1 ARG A 139 19.077 -0.854 2.285 1.00 0.00 N ATOM 2200 NH2 ARG A 139 18.184 -2.048 4.036 1.00 0.00 N ATOM 0 H ARG A 139 18.484 3.428 7.449 1.00 0.00 H new ATOM 0 HA ARG A 139 19.406 2.565 4.912 1.00 0.00 H new ATOM 0 HB2 ARG A 139 17.284 1.865 5.932 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.681 3.508 5.851 1.00 0.00 H new ATOM 0 HG2 ARG A 139 15.794 2.203 3.980 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.836 3.479 3.383 1.00 0.00 H new ATOM 0 HD2 ARG A 139 17.248 1.442 2.110 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.676 1.828 3.051 1.00 0.00 H new ATOM 0 HE ARG A 139 16.971 0.048 4.551 1.00 0.00 H new ATOM 0 HH11 ARG A 139 19.159 0.015 1.758 1.00 0.00 H new ATOM 0 HH12 ARG A 139 19.602 -1.679 1.994 1.00 0.00 H new ATOM 0 HH21 ARG A 139 17.579 -2.099 4.856 1.00 0.00 H new ATOM 0 HH22 ARG A 139 18.711 -2.869 3.740 1.00 0.00 H new ATOM 2214 N VAL A 140 18.515 5.737 5.056 1.00 0.00 N ATOM 2215 CA VAL A 140 18.676 6.988 4.337 1.00 0.00 C ATOM 2216 C VAL A 140 20.153 7.236 4.059 1.00 0.00 C ATOM 2217 O VAL A 140 20.496 7.524 2.912 1.00 0.00 O ATOM 2218 CB VAL A 140 17.966 8.116 5.112 1.00 0.00 C ATOM 2219 CG1 VAL A 140 18.576 9.506 4.877 1.00 0.00 C ATOM 2220 CG2 VAL A 140 16.483 8.078 4.702 1.00 0.00 C ATOM 0 H VAL A 140 18.053 5.828 5.961 1.00 0.00 H new ATOM 0 HA VAL A 140 18.198 6.949 3.358 1.00 0.00 H new ATOM 0 HB VAL A 140 18.089 7.944 6.181 1.00 0.00 H new ATOM 0 HG11 VAL A 140 18.024 10.248 5.455 1.00 0.00 H new ATOM 0 HG12 VAL A 140 19.619 9.503 5.192 1.00 0.00 H new ATOM 0 HG13 VAL A 140 18.518 9.755 3.817 1.00 0.00 H new ATOM 0 HG21 VAL A 140 15.940 8.863 5.229 1.00 0.00 H new ATOM 0 HG22 VAL A 140 16.399 8.237 3.627 1.00 0.00 H new ATOM 0 HG23 VAL A 140 16.059 7.107 4.960 1.00 0.00 H new ATOM 2230 N ASN A 141 21.046 7.071 5.044 1.00 0.00 N ATOM 2231 CA ASN A 141 22.447 7.373 4.776 1.00 0.00 C ATOM 2232 C ASN A 141 23.070 6.327 3.854 1.00 0.00 C ATOM 2233 O ASN A 141 23.971 6.678 3.097 1.00 0.00 O ATOM 2234 CB ASN A 141 23.267 7.689 6.029 1.00 0.00 C ATOM 2235 CG ASN A 141 23.957 6.493 6.655 1.00 0.00 C ATOM 2236 OD1 ASN A 141 24.972 5.995 6.180 1.00 0.00 O ATOM 2237 ND2 ASN A 141 23.426 6.053 7.774 1.00 0.00 N ATOM 0 H ASN A 141 20.834 6.746 5.987 1.00 0.00 H new ATOM 0 HA ASN A 141 22.471 8.315 4.228 1.00 0.00 H new ATOM 0 HB2 ASN A 141 24.021 8.434 5.774 1.00 0.00 H new ATOM 0 HB3 ASN A 141 22.610 8.142 6.772 1.00 0.00 H new ATOM 0 HD21 ASN A 141 23.859 5.276 8.273 1.00 0.00 H new ATOM 0 HD22 ASN A 141 22.581 6.489 8.143 1.00 0.00 H new ATOM 2244 N ARG A 142 22.561 5.087 3.818 1.00 0.00 N ATOM 2245 CA ARG A 142 22.967 4.123 2.802 1.00 0.00 C ATOM 2246 C ARG A 142 22.492 4.587 1.424 1.00 0.00 C ATOM 2247 O ARG A 142 23.289 4.560 0.493 1.00 0.00 O ATOM 2248 CB ARG A 142 22.458 2.719 3.173 1.00 0.00 C ATOM 2249 CG ARG A 142 22.432 1.723 2.005 1.00 0.00 C ATOM 2250 CD ARG A 142 23.779 1.515 1.287 1.00 0.00 C ATOM 2251 NE ARG A 142 23.581 0.721 0.067 1.00 0.00 N ATOM 2252 CZ ARG A 142 23.878 -0.562 -0.149 1.00 0.00 C ATOM 2253 NH1 ARG A 142 24.467 -1.314 0.778 1.00 0.00 N ATOM 2254 NH2 ARG A 142 23.554 -1.065 -1.331 1.00 0.00 N ATOM 0 H ARG A 142 21.870 4.735 4.481 1.00 0.00 H new ATOM 0 HA ARG A 142 24.054 4.061 2.758 1.00 0.00 H new ATOM 0 HB2 ARG A 142 23.089 2.315 3.965 1.00 0.00 H new ATOM 0 HB3 ARG A 142 21.451 2.807 3.581 1.00 0.00 H new ATOM 0 HG2 ARG A 142 22.086 0.759 2.378 1.00 0.00 H new ATOM 0 HG3 ARG A 142 21.699 2.064 1.274 1.00 0.00 H new ATOM 0 HD2 ARG A 142 24.219 2.480 1.035 1.00 0.00 H new ATOM 0 HD3 ARG A 142 24.480 1.008 1.951 1.00 0.00 H new ATOM 0 HE ARG A 142 23.161 1.216 -0.720 1.00 0.00 H new ATOM 0 HH11 ARG A 142 24.705 -0.912 1.685 1.00 0.00 H new ATOM 0 HH12 ARG A 142 24.681 -2.292 0.581 1.00 0.00 H new ATOM 0 HH21 ARG A 142 23.098 -0.476 -2.028 1.00 0.00 H new ATOM 0 HH22 ARG A 142 23.760 -2.041 -1.544 1.00 0.00 H new ATOM 2268 N VAL A 143 21.241 5.021 1.261 1.00 0.00 N ATOM 2269 CA VAL A 143 20.763 5.500 -0.036 1.00 0.00 C ATOM 2270 C VAL A 143 21.645 6.669 -0.492 1.00 0.00 C ATOM 2271 O VAL A 143 22.090 6.670 -1.637 1.00 0.00 O ATOM 2272 CB VAL A 143 19.250 5.806 0.006 1.00 0.00 C ATOM 2273 CG1 VAL A 143 18.741 6.500 -1.269 1.00 0.00 C ATOM 2274 CG2 VAL A 143 18.459 4.494 0.171 1.00 0.00 C ATOM 0 H VAL A 143 20.545 5.051 2.006 1.00 0.00 H new ATOM 0 HA VAL A 143 20.859 4.722 -0.794 1.00 0.00 H new ATOM 0 HB VAL A 143 19.097 6.480 0.849 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.671 6.688 -1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 143 19.266 7.446 -1.403 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.925 5.858 -2.131 1.00 0.00 H new ATOM 0 HG21 VAL A 143 17.392 4.714 0.200 1.00 0.00 H new ATOM 0 HG22 VAL A 143 18.671 3.833 -0.670 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.754 4.005 1.099 1.00 0.00 H new ATOM 2284 N LEU A 144 21.997 7.603 0.398 1.00 0.00 N ATOM 2285 CA LEU A 144 22.930 8.688 0.081 1.00 0.00 C ATOM 2286 C LEU A 144 24.279 8.109 -0.342 1.00 0.00 C ATOM 2287 O LEU A 144 24.824 8.514 -1.364 1.00 0.00 O ATOM 2288 CB LEU A 144 23.137 9.632 1.279 1.00 0.00 C ATOM 2289 CG LEU A 144 21.882 10.409 1.701 1.00 0.00 C ATOM 2290 CD1 LEU A 144 22.142 11.173 3.000 1.00 0.00 C ATOM 2291 CD2 LEU A 144 21.416 11.390 0.626 1.00 0.00 C ATOM 0 H LEU A 144 21.644 7.628 1.355 1.00 0.00 H new ATOM 0 HA LEU A 144 22.496 9.264 -0.736 1.00 0.00 H new ATOM 0 HB2 LEU A 144 23.490 9.048 2.129 1.00 0.00 H new ATOM 0 HB3 LEU A 144 23.924 10.344 1.032 1.00 0.00 H new ATOM 0 HG LEU A 144 21.092 9.673 1.850 1.00 0.00 H new ATOM 0 HD11 LEU A 144 21.243 11.719 3.287 1.00 0.00 H new ATOM 0 HD12 LEU A 144 22.406 10.469 3.789 1.00 0.00 H new ATOM 0 HD13 LEU A 144 22.962 11.876 2.851 1.00 0.00 H new ATOM 0 HD21 LEU A 144 20.526 11.914 0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 144 22.207 12.112 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 144 21.182 10.844 -0.288 1.00 0.00 H new ATOM 2303 N ALA A 145 24.789 7.129 0.407 1.00 0.00 N ATOM 2304 CA ALA A 145 26.036 6.427 0.129 1.00 0.00 C ATOM 2305 C ALA A 145 26.025 5.624 -1.181 1.00 0.00 C ATOM 2306 O ALA A 145 27.073 5.080 -1.536 1.00 0.00 O ATOM 2307 CB ALA A 145 26.427 5.533 1.313 1.00 0.00 C ATOM 0 H ALA A 145 24.326 6.794 1.252 1.00 0.00 H new ATOM 0 HA ALA A 145 26.791 7.202 -0.007 1.00 0.00 H new ATOM 0 HB1 ALA A 145 27.360 5.017 1.087 1.00 0.00 H new ATOM 0 HB2 ALA A 145 26.558 6.146 2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 145 25.641 4.799 1.490 1.00 0.00 H new ATOM 2313 N GLU A 146 24.911 5.558 -1.922 1.00 0.00 N ATOM 2314 CA GLU A 146 24.893 4.988 -3.266 1.00 0.00 C ATOM 2315 C GLU A 146 24.265 5.954 -4.287 1.00 0.00 C ATOM 2316 O GLU A 146 24.032 5.580 -5.439 1.00 0.00 O ATOM 2317 CB GLU A 146 24.278 3.583 -3.255 1.00 0.00 C ATOM 2318 CG GLU A 146 22.770 3.508 -3.007 1.00 0.00 C ATOM 2319 CD GLU A 146 22.270 2.087 -3.292 1.00 0.00 C ATOM 2320 OE1 GLU A 146 22.381 1.211 -2.405 1.00 0.00 O ATOM 2321 OE2 GLU A 146 21.765 1.839 -4.411 1.00 0.00 O ATOM 0 H GLU A 146 24.003 5.898 -1.604 1.00 0.00 H new ATOM 0 HA GLU A 146 25.920 4.857 -3.607 1.00 0.00 H new ATOM 0 HB2 GLU A 146 24.492 3.108 -4.212 1.00 0.00 H new ATOM 0 HB3 GLU A 146 24.781 2.995 -2.488 1.00 0.00 H new ATOM 0 HG2 GLU A 146 22.547 3.782 -1.976 1.00 0.00 H new ATOM 0 HG3 GLU A 146 22.251 4.222 -3.646 1.00 0.00 H new ATOM 2328 N THR A 147 24.029 7.204 -3.876 1.00 0.00 N ATOM 2329 CA THR A 147 23.370 8.244 -4.657 1.00 0.00 C ATOM 2330 C THR A 147 24.075 9.592 -4.405 1.00 0.00 C ATOM 2331 O THR A 147 23.462 10.634 -4.163 1.00 0.00 O ATOM 2332 CB THR A 147 21.862 8.277 -4.346 1.00 0.00 C ATOM 2333 OG1 THR A 147 21.300 6.995 -4.146 1.00 0.00 O ATOM 2334 CG2 THR A 147 21.133 8.905 -5.527 1.00 0.00 C ATOM 0 H THR A 147 24.306 7.528 -2.949 1.00 0.00 H new ATOM 0 HA THR A 147 23.453 8.028 -5.722 1.00 0.00 H new ATOM 0 HB THR A 147 21.748 8.846 -3.424 1.00 0.00 H new ATOM 0 HG1 THR A 147 21.282 6.792 -3.188 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.063 8.935 -5.320 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.501 9.919 -5.684 1.00 0.00 H new ATOM 0 HG23 THR A 147 21.313 8.311 -6.423 1.00 0.00 H new ATOM 2342 N GLU A 148 25.402 9.547 -4.434 1.00 0.00 N ATOM 2343 CA GLU A 148 26.322 10.660 -4.269 1.00 0.00 C ATOM 2344 C GLU A 148 27.536 10.346 -5.143 1.00 0.00 C ATOM 2345 O GLU A 148 28.013 9.191 -5.111 1.00 0.00 O ATOM 2346 CB GLU A 148 26.688 10.812 -2.781 1.00 0.00 C ATOM 2347 CG GLU A 148 27.698 11.943 -2.551 1.00 0.00 C ATOM 2348 CD GLU A 148 27.995 12.161 -1.052 1.00 0.00 C ATOM 2349 OE1 GLU A 148 28.898 11.491 -0.497 1.00 0.00 O ATOM 2350 OE2 GLU A 148 27.351 13.027 -0.416 1.00 0.00 O ATOM 2351 OXT GLU A 148 27.961 11.228 -5.917 1.00 0.00 O ATOM 0 H GLU A 148 25.896 8.667 -4.584 1.00 0.00 H new ATOM 0 HA GLU A 148 25.887 11.611 -4.575 1.00 0.00 H new ATOM 0 HB2 GLU A 148 25.785 11.009 -2.204 1.00 0.00 H new ATOM 0 HB3 GLU A 148 27.103 9.874 -2.412 1.00 0.00 H new ATOM 0 HG2 GLU A 148 28.626 11.712 -3.074 1.00 0.00 H new ATOM 0 HG3 GLU A 148 27.311 12.867 -2.982 1.00 0.00 H new