USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1110 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 69 GLN : amide:sc=-0.00287 X(o=-2.1,f=-2.4) USER MOD Set 1.2: A 103 MET CE :methyl 176:sc= -2.1! (180deg=-2.19) USER MOD Set 2.1: A 32 THR OG1 : rot 41:sc= 0.875 USER MOD Set 2.2: A 65 ASN : amide:sc= 1.12 K(o=2,f=0.99) USER MOD Set 3.1: A 31 TYR OH : rot 156:sc= 1.16 USER MOD Set 3.2: A 50 CYS SG : rot 140:sc= 0.713 USER MOD Set 3.3: A 55 SER OG : rot 80:sc= 1.29 USER MOD Single : A 10 GLN : amide:sc= 2.02 K(o=2,f=-4.1!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 22 LYS NZ :NH3+ -158:sc= 1.3 (180deg=1.22) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 CYS SG : rot 61:sc= 0.367 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 HIS : no HE2:sc= -0.704 X(o=-0.7,f=-0.85) USER MOD Single : A 43 GLN : amide:sc= 0.0874 X(o=0.087,f=-0.4) USER MOD Single : A 44 THR OG1 : rot 93:sc= 1.29 USER MOD Single : A 47 GLN : amide:sc= -1.53 X(o=-1.5,f=-1.3) USER MOD Single : A 48 ASN : amide:sc= 1.41 K(o=1.4,f=-4!) USER MOD Single : A 62 THR OG1 : rot 114:sc= 0.0105 USER MOD Single : A 64 THR OG1 : rot -170:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0.391 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0.528 K(o=0.53,f=-2.6!) USER MOD Single : A 79 GLN : amide:sc= 0.977 K(o=0.98,f=-5.1!) USER MOD Single : A 81 GLN : amide:sc= -1.29 K(o=-1.3,f=-3.7!) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.146 USER MOD Single : A 84 SER OG : rot 180:sc= 0.00945 USER MOD Single : A 87 TYR OH : rot -160:sc= -0.39 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.652 K(o=-0.65,f=-1.3) USER MOD Single : A 109 CYS SG : rot -130:sc= -0.0822 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 HIS : no HE2:sc= -3.03! C(o=-3!,f=-11!) USER MOD Single : A 124 MET CE :methyl -171:sc= -0.294 (180deg=-0.607) USER MOD Single : A 126 CYS SG : rot 180:sc= -0.387 USER MOD Single : A 135 GLN : amide:sc=-0.00604 X(o=-0.006,f=-0.42) USER MOD Single : A 136 GLN : amide:sc= -0.46 X(o=-0.46,f=-0.19) USER MOD Single : A 142 GLN : amide:sc= -0.264 X(o=-0.26,f=-0.26) USER MOD Single : A 143 GLN : amide:sc= -0.393 X(o=-0.39,f=0) USER MOD ----------------------------------------------------------------- ATOM 36 N PRO A 4 19.153 -4.898 -9.955 1.00 1.00 N ATOM 37 CA PRO A 4 18.631 -4.038 -8.910 1.00 1.00 C ATOM 38 C PRO A 4 17.454 -4.696 -8.184 1.00 1.00 C ATOM 39 O PRO A 4 16.757 -5.570 -8.712 1.00 1.00 O ATOM 40 CB PRO A 4 18.212 -2.751 -9.617 1.00 1.00 C ATOM 41 CG PRO A 4 17.793 -3.240 -11.001 1.00 1.00 C ATOM 42 CD PRO A 4 18.747 -4.409 -11.257 1.00 1.00 C ATOM 0 HA PRO A 4 19.375 -3.842 -8.138 1.00 1.00 H new ATOM 0 HB2 PRO A 4 17.391 -2.255 -9.099 1.00 1.00 H new ATOM 0 HB3 PRO A 4 19.033 -2.036 -9.673 1.00 1.00 H new ATOM 0 HG2 PRO A 4 16.751 -3.559 -11.018 1.00 1.00 H new ATOM 0 HG3 PRO A 4 17.900 -2.459 -11.754 1.00 1.00 H new ATOM 0 HD2 PRO A 4 18.254 -5.194 -11.830 1.00 1.00 H new ATOM 0 HD3 PRO A 4 19.611 -4.085 -11.837 1.00 1.00 H new ATOM 50 N ARG A 5 17.199 -4.207 -6.973 1.00 1.00 N ATOM 51 CA ARG A 5 15.997 -4.467 -6.186 1.00 1.00 C ATOM 52 C ARG A 5 15.852 -3.396 -5.109 1.00 1.00 C ATOM 53 O ARG A 5 14.741 -3.010 -4.766 1.00 1.00 O ATOM 54 CB ARG A 5 16.121 -5.855 -5.524 1.00 1.00 C ATOM 55 CG ARG A 5 14.796 -6.374 -4.943 1.00 1.00 C ATOM 56 CD ARG A 5 14.040 -7.340 -5.863 1.00 1.00 C ATOM 57 NE ARG A 5 13.837 -6.850 -7.240 1.00 1.00 N ATOM 58 CZ ARG A 5 12.974 -7.387 -8.116 1.00 1.00 C ATOM 59 NH1 ARG A 5 12.209 -8.422 -7.779 1.00 1.00 N ATOM 60 NH2 ARG A 5 12.860 -6.892 -9.343 1.00 1.00 N ATOM 0 H ARG A 5 17.854 -3.591 -6.492 1.00 1.00 H new ATOM 0 HA ARG A 5 15.120 -4.446 -6.833 1.00 1.00 H new ATOM 0 HB2 ARG A 5 16.491 -6.569 -6.260 1.00 1.00 H new ATOM 0 HB3 ARG A 5 16.864 -5.805 -4.728 1.00 1.00 H new ATOM 0 HG2 ARG A 5 14.999 -6.876 -3.997 1.00 1.00 H new ATOM 0 HG3 ARG A 5 14.152 -5.523 -4.721 1.00 1.00 H new ATOM 0 HD2 ARG A 5 14.586 -8.283 -5.904 1.00 1.00 H new ATOM 0 HD3 ARG A 5 13.067 -7.554 -5.421 1.00 1.00 H new ATOM 0 HE ARG A 5 14.390 -6.049 -7.546 1.00 1.00 H new ATOM 0 HH11 ARG A 5 12.273 -8.820 -6.842 1.00 1.00 H new ATOM 0 HH12 ARG A 5 11.558 -8.818 -8.458 1.00 1.00 H new ATOM 0 HH21 ARG A 5 13.431 -6.096 -9.627 1.00 1.00 H new ATOM 0 HH22 ARG A 5 12.201 -7.308 -10.001 1.00 1.00 H new ATOM 74 N VAL A 6 16.979 -2.823 -4.704 1.00 1.00 N ATOM 75 CA VAL A 6 17.096 -1.692 -3.802 1.00 1.00 C ATOM 76 C VAL A 6 18.046 -0.676 -4.451 1.00 1.00 C ATOM 77 O VAL A 6 18.747 -1.011 -5.418 1.00 1.00 O ATOM 78 CB VAL A 6 17.561 -2.167 -2.404 1.00 1.00 C ATOM 79 CG1 VAL A 6 16.564 -3.138 -1.744 1.00 1.00 C ATOM 80 CG2 VAL A 6 18.935 -2.853 -2.435 1.00 1.00 C ATOM 0 H VAL A 6 17.889 -3.159 -5.018 1.00 1.00 H new ATOM 0 HA VAL A 6 16.134 -1.206 -3.640 1.00 1.00 H new ATOM 0 HB VAL A 6 17.624 -1.251 -1.816 1.00 1.00 H new ATOM 0 HG11 VAL A 6 16.941 -3.438 -0.766 1.00 1.00 H new ATOM 0 HG12 VAL A 6 15.600 -2.644 -1.625 1.00 1.00 H new ATOM 0 HG13 VAL A 6 16.444 -4.020 -2.373 1.00 1.00 H new ATOM 0 HG21 VAL A 6 19.209 -3.165 -1.427 1.00 1.00 H new ATOM 0 HG22 VAL A 6 18.891 -3.727 -3.085 1.00 1.00 H new ATOM 0 HG23 VAL A 6 19.682 -2.155 -2.815 1.00 1.00 H new ATOM 90 N VAL A 7 18.080 0.558 -3.952 1.00 1.00 N ATOM 91 CA VAL A 7 19.124 1.535 -4.275 1.00 1.00 C ATOM 92 C VAL A 7 20.375 1.286 -3.403 1.00 1.00 C ATOM 93 O VAL A 7 20.327 0.423 -2.523 1.00 1.00 O ATOM 94 CB VAL A 7 18.560 2.962 -4.117 1.00 1.00 C ATOM 95 CG1 VAL A 7 17.361 3.206 -5.040 1.00 1.00 C ATOM 96 CG2 VAL A 7 18.147 3.283 -2.680 1.00 1.00 C ATOM 0 H VAL A 7 17.377 0.914 -3.305 1.00 1.00 H new ATOM 0 HA VAL A 7 19.438 1.421 -5.313 1.00 1.00 H new ATOM 0 HB VAL A 7 19.379 3.625 -4.397 1.00 1.00 H new ATOM 0 HG11 VAL A 7 16.993 4.222 -4.898 1.00 1.00 H new ATOM 0 HG12 VAL A 7 17.667 3.073 -6.077 1.00 1.00 H new ATOM 0 HG13 VAL A 7 16.568 2.497 -4.802 1.00 1.00 H new ATOM 0 HG21 VAL A 7 17.758 4.300 -2.632 1.00 1.00 H new ATOM 0 HG22 VAL A 7 17.375 2.584 -2.358 1.00 1.00 H new ATOM 0 HG23 VAL A 7 19.013 3.194 -2.024 1.00 1.00 H new ATOM 106 N PRO A 8 21.484 2.027 -3.601 1.00 1.00 N ATOM 107 CA PRO A 8 22.575 2.111 -2.636 1.00 1.00 C ATOM 108 C PRO A 8 22.080 2.467 -1.229 1.00 1.00 C ATOM 109 O PRO A 8 21.985 1.600 -0.363 1.00 1.00 O ATOM 110 CB PRO A 8 23.561 3.135 -3.214 1.00 1.00 C ATOM 111 CG PRO A 8 23.347 3.002 -4.715 1.00 1.00 C ATOM 112 CD PRO A 8 21.840 2.770 -4.804 1.00 1.00 C ATOM 0 HA PRO A 8 23.065 1.147 -2.498 1.00 1.00 H new ATOM 0 HB2 PRO A 8 23.347 4.145 -2.863 1.00 1.00 H new ATOM 0 HB3 PRO A 8 24.589 2.910 -2.931 1.00 1.00 H new ATOM 0 HG2 PRO A 8 23.654 3.900 -5.252 1.00 1.00 H new ATOM 0 HG3 PRO A 8 23.913 2.171 -5.135 1.00 1.00 H new ATOM 0 HD2 PRO A 8 21.300 3.716 -4.854 1.00 1.00 H new ATOM 0 HD3 PRO A 8 21.583 2.208 -5.702 1.00 1.00 H new ATOM 120 N ASP A 9 21.743 3.734 -0.994 1.00 1.00 N ATOM 121 CA ASP A 9 21.375 4.235 0.322 1.00 1.00 C ATOM 122 C ASP A 9 19.883 4.492 0.327 1.00 1.00 C ATOM 123 O ASP A 9 19.430 5.588 -0.023 1.00 1.00 O ATOM 124 CB ASP A 9 22.181 5.482 0.688 1.00 1.00 C ATOM 125 CG ASP A 9 21.910 5.963 2.117 1.00 1.00 C ATOM 126 OD1 ASP A 9 20.911 5.584 2.767 1.00 1.00 O ATOM 127 OD2 ASP A 9 22.735 6.758 2.623 1.00 1.00 O ATOM 0 H ASP A 9 21.719 4.447 -1.723 1.00 1.00 H new ATOM 0 HA ASP A 9 21.612 3.495 1.086 1.00 1.00 H new ATOM 0 HB2 ASP A 9 23.244 5.268 0.576 1.00 1.00 H new ATOM 0 HB3 ASP A 9 21.942 6.283 -0.012 1.00 1.00 H new ATOM 132 N GLN A 10 19.125 3.448 0.667 1.00 1.00 N ATOM 133 CA GLN A 10 17.669 3.511 0.756 1.00 1.00 C ATOM 134 C GLN A 10 17.208 4.639 1.680 1.00 1.00 C ATOM 135 O GLN A 10 16.230 5.315 1.371 1.00 1.00 O ATOM 136 CB GLN A 10 17.066 2.185 1.238 1.00 1.00 C ATOM 137 CG GLN A 10 17.160 1.016 0.245 1.00 1.00 C ATOM 138 CD GLN A 10 16.154 -0.077 0.605 1.00 1.00 C ATOM 139 OE1 GLN A 10 14.950 0.141 0.543 1.00 1.00 O ATOM 140 NE2 GLN A 10 16.592 -1.256 1.011 1.00 1.00 N ATOM 0 H GLN A 10 19.509 2.530 0.889 1.00 1.00 H new ATOM 0 HA GLN A 10 17.312 3.711 -0.254 1.00 1.00 H new ATOM 0 HB2 GLN A 10 17.564 1.894 2.163 1.00 1.00 H new ATOM 0 HB3 GLN A 10 16.016 2.350 1.480 1.00 1.00 H new ATOM 0 HG2 GLN A 10 16.969 1.375 -0.766 1.00 1.00 H new ATOM 0 HG3 GLN A 10 18.170 0.605 0.253 1.00 1.00 H new ATOM 0 HE21 GLN A 10 17.594 -1.438 1.063 1.00 1.00 H new ATOM 0 HE22 GLN A 10 15.928 -1.984 1.273 1.00 1.00 H new ATOM 149 N ARG A 11 17.882 4.870 2.806 1.00 1.00 N ATOM 150 CA ARG A 11 17.446 5.892 3.754 1.00 1.00 C ATOM 151 C ARG A 11 17.684 7.297 3.227 1.00 1.00 C ATOM 152 O ARG A 11 16.800 8.141 3.352 1.00 1.00 O ATOM 153 CB ARG A 11 18.130 5.694 5.109 1.00 1.00 C ATOM 154 CG ARG A 11 17.206 6.019 6.291 1.00 1.00 C ATOM 155 CD ARG A 11 16.001 5.065 6.334 1.00 1.00 C ATOM 156 NE ARG A 11 15.393 4.998 7.667 1.00 1.00 N ATOM 157 CZ ARG A 11 15.849 4.311 8.722 1.00 1.00 C ATOM 158 NH1 ARG A 11 16.969 3.601 8.665 1.00 1.00 N ATOM 159 NH2 ARG A 11 15.167 4.338 9.853 1.00 1.00 N ATOM 0 H ARG A 11 18.725 4.367 3.082 1.00 1.00 H new ATOM 0 HA ARG A 11 16.370 5.778 3.886 1.00 1.00 H new ATOM 0 HB2 ARG A 11 18.471 4.662 5.192 1.00 1.00 H new ATOM 0 HB3 ARG A 11 19.016 6.327 5.160 1.00 1.00 H new ATOM 0 HG2 ARG A 11 17.765 5.945 7.224 1.00 1.00 H new ATOM 0 HG3 ARG A 11 16.856 7.048 6.210 1.00 1.00 H new ATOM 0 HD2 ARG A 11 15.254 5.394 5.612 1.00 1.00 H new ATOM 0 HD3 ARG A 11 16.319 4.067 6.031 1.00 1.00 H new ATOM 0 HE ARG A 11 14.534 5.530 7.805 1.00 1.00 H new ATOM 0 HH11 ARG A 11 17.509 3.568 7.800 1.00 1.00 H new ATOM 0 HH12 ARG A 11 17.290 3.088 9.486 1.00 1.00 H new ATOM 0 HH21 ARG A 11 14.304 4.878 9.915 1.00 1.00 H new ATOM 0 HH22 ARG A 11 15.504 3.819 10.664 1.00 1.00 H new ATOM 173 N SER A 12 18.829 7.575 2.610 1.00 1.00 N ATOM 174 CA SER A 12 19.009 8.849 1.924 1.00 1.00 C ATOM 175 C SER A 12 18.028 8.932 0.747 1.00 1.00 C ATOM 176 O SER A 12 17.576 10.018 0.389 1.00 1.00 O ATOM 177 CB SER A 12 20.471 8.978 1.485 1.00 1.00 C ATOM 178 OG SER A 12 20.823 10.293 1.085 1.00 1.00 O ATOM 0 H SER A 12 19.632 6.948 2.571 1.00 1.00 H new ATOM 0 HA SER A 12 18.791 9.686 2.588 1.00 1.00 H new ATOM 0 HB2 SER A 12 21.118 8.670 2.306 1.00 1.00 H new ATOM 0 HB3 SER A 12 20.657 8.292 0.658 1.00 1.00 H new ATOM 0 HG SER A 12 21.766 10.312 0.818 1.00 1.00 H new ATOM 184 N LYS A 13 17.596 7.807 0.170 1.00 1.00 N ATOM 185 CA LYS A 13 16.509 7.824 -0.794 1.00 1.00 C ATOM 186 C LYS A 13 15.215 8.264 -0.130 1.00 1.00 C ATOM 187 O LYS A 13 14.589 9.138 -0.706 1.00 1.00 O ATOM 188 CB LYS A 13 16.378 6.488 -1.515 1.00 1.00 C ATOM 189 CG LYS A 13 16.377 6.542 -3.052 1.00 1.00 C ATOM 190 CD LYS A 13 17.651 7.018 -3.761 1.00 1.00 C ATOM 191 CE LYS A 13 17.752 8.546 -3.841 1.00 1.00 C ATOM 192 NZ LYS A 13 18.788 8.974 -4.799 1.00 1.00 N ATOM 0 H LYS A 13 17.984 6.882 0.357 1.00 1.00 H new ATOM 0 HA LYS A 13 16.742 8.559 -1.564 1.00 1.00 H new ATOM 0 HB2 LYS A 13 17.198 5.845 -1.196 1.00 1.00 H new ATOM 0 HB3 LYS A 13 15.453 6.012 -1.188 1.00 1.00 H new ATOM 0 HG2 LYS A 13 16.145 5.543 -3.420 1.00 1.00 H new ATOM 0 HG3 LYS A 13 15.560 7.194 -3.362 1.00 1.00 H new ATOM 0 HD2 LYS A 13 18.522 6.628 -3.234 1.00 1.00 H new ATOM 0 HD3 LYS A 13 17.677 6.604 -4.769 1.00 1.00 H new ATOM 0 HE2 LYS A 13 16.788 8.959 -4.138 1.00 1.00 H new ATOM 0 HE3 LYS A 13 17.981 8.948 -2.854 1.00 1.00 H new ATOM 0 HZ1 LYS A 13 18.828 10.013 -4.826 1.00 1.00 H new ATOM 0 HZ2 LYS A 13 19.712 8.600 -4.501 1.00 1.00 H new ATOM 0 HZ3 LYS A 13 18.556 8.611 -5.746 1.00 1.00 H new ATOM 206 N PHE A 14 14.862 7.766 1.062 1.00 1.00 N ATOM 207 CA PHE A 14 13.692 8.133 1.885 1.00 1.00 C ATOM 208 C PHE A 14 13.687 9.608 2.351 1.00 1.00 C ATOM 209 O PHE A 14 12.719 10.093 2.936 1.00 1.00 O ATOM 210 CB PHE A 14 13.625 7.197 3.111 1.00 1.00 C ATOM 211 CG PHE A 14 12.440 7.415 4.036 1.00 1.00 C ATOM 212 CD1 PHE A 14 11.162 7.562 3.478 1.00 1.00 C ATOM 213 CD2 PHE A 14 12.603 7.498 5.434 1.00 1.00 C ATOM 214 CE1 PHE A 14 10.029 7.687 4.308 1.00 1.00 C ATOM 215 CE2 PHE A 14 11.478 7.683 6.260 1.00 1.00 C ATOM 216 CZ PHE A 14 10.191 7.755 5.701 1.00 1.00 C ATOM 0 H PHE A 14 15.424 7.044 1.513 1.00 1.00 H new ATOM 0 HA PHE A 14 12.813 8.017 1.251 1.00 1.00 H new ATOM 0 HB2 PHE A 14 13.603 6.166 2.758 1.00 1.00 H new ATOM 0 HB3 PHE A 14 14.542 7.317 3.689 1.00 1.00 H new ATOM 0 HD1 PHE A 14 11.045 7.580 2.405 1.00 1.00 H new ATOM 0 HD2 PHE A 14 13.588 7.420 5.870 1.00 1.00 H new ATOM 0 HE1 PHE A 14 9.041 7.730 3.874 1.00 1.00 H new ATOM 0 HE2 PHE A 14 11.605 7.770 7.329 1.00 1.00 H new ATOM 0 HZ PHE A 14 9.328 7.862 6.342 1.00 1.00 H new ATOM 226 N GLU A 15 14.748 10.345 2.049 1.00 1.00 N ATOM 227 CA GLU A 15 14.826 11.805 2.185 1.00 1.00 C ATOM 228 C GLU A 15 14.995 12.536 0.840 1.00 1.00 C ATOM 229 O GLU A 15 14.765 13.741 0.781 1.00 1.00 O ATOM 230 CB GLU A 15 15.867 12.202 3.252 1.00 1.00 C ATOM 231 CG GLU A 15 17.307 12.374 2.764 1.00 1.00 C ATOM 232 CD GLU A 15 18.264 12.661 3.919 1.00 1.00 C ATOM 233 OE1 GLU A 15 18.695 11.696 4.598 1.00 1.00 O ATOM 234 OE2 GLU A 15 18.668 13.838 4.096 1.00 1.00 O ATOM 0 H GLU A 15 15.610 9.935 1.690 1.00 1.00 H new ATOM 0 HA GLU A 15 13.858 12.152 2.548 1.00 1.00 H new ATOM 0 HB2 GLU A 15 15.547 13.138 3.710 1.00 1.00 H new ATOM 0 HB3 GLU A 15 15.860 11.444 4.036 1.00 1.00 H new ATOM 0 HG2 GLU A 15 17.625 11.471 2.244 1.00 1.00 H new ATOM 0 HG3 GLU A 15 17.352 13.190 2.043 1.00 1.00 H new ATOM 241 N ASN A 16 15.331 11.828 -0.246 1.00 1.00 N ATOM 242 CA ASN A 16 15.398 12.334 -1.611 1.00 1.00 C ATOM 243 C ASN A 16 14.039 12.285 -2.304 1.00 1.00 C ATOM 244 O ASN A 16 13.533 13.346 -2.656 1.00 1.00 O ATOM 245 CB ASN A 16 16.374 11.508 -2.460 1.00 1.00 C ATOM 246 CG ASN A 16 17.764 12.098 -2.511 1.00 1.00 C ATOM 247 OD1 ASN A 16 18.105 12.789 -3.466 1.00 1.00 O ATOM 248 ND2 ASN A 16 18.598 11.796 -1.541 1.00 1.00 N ATOM 0 H ASN A 16 15.574 10.839 -0.187 1.00 1.00 H new ATOM 0 HA ASN A 16 15.736 13.367 -1.532 1.00 1.00 H new ATOM 0 HB2 ASN A 16 16.430 10.497 -2.057 1.00 1.00 H new ATOM 0 HB3 ASN A 16 15.984 11.426 -3.474 1.00 1.00 H new ATOM 0 HD21 ASN A 16 19.558 12.138 -1.569 1.00 1.00 H new ATOM 0 HD22 ASN A 16 18.285 11.219 -0.760 1.00 1.00 H new ATOM 255 N GLU A 17 13.506 11.087 -2.596 1.00 1.00 N ATOM 256 CA GLU A 17 12.483 10.891 -3.614 1.00 1.00 C ATOM 257 C GLU A 17 11.259 11.804 -3.474 1.00 1.00 C ATOM 258 O GLU A 17 10.451 11.673 -2.558 1.00 1.00 O ATOM 259 CB GLU A 17 12.075 9.413 -3.693 1.00 1.00 C ATOM 260 CG GLU A 17 13.222 8.444 -3.995 1.00 1.00 C ATOM 261 CD GLU A 17 13.870 8.628 -5.370 1.00 1.00 C ATOM 262 OE1 GLU A 17 13.392 9.449 -6.180 1.00 1.00 O ATOM 263 OE2 GLU A 17 14.839 7.895 -5.675 1.00 1.00 O ATOM 0 H GLU A 17 13.781 10.226 -2.123 1.00 1.00 H new ATOM 0 HA GLU A 17 12.944 11.188 -4.556 1.00 1.00 H new ATOM 0 HB2 GLU A 17 11.616 9.127 -2.747 1.00 1.00 H new ATOM 0 HB3 GLU A 17 11.312 9.302 -4.464 1.00 1.00 H new ATOM 0 HG2 GLU A 17 13.989 8.560 -3.229 1.00 1.00 H new ATOM 0 HG3 GLU A 17 12.847 7.423 -3.919 1.00 1.00 H new ATOM 270 N GLU A 18 11.078 12.695 -4.448 1.00 1.00 N ATOM 271 CA GLU A 18 10.008 13.688 -4.518 1.00 1.00 C ATOM 272 C GLU A 18 8.614 13.041 -4.453 1.00 1.00 C ATOM 273 O GLU A 18 7.622 13.693 -4.118 1.00 1.00 O ATOM 274 CB GLU A 18 10.185 14.432 -5.851 1.00 1.00 C ATOM 275 CG GLU A 18 9.604 15.843 -5.876 1.00 1.00 C ATOM 276 CD GLU A 18 9.663 16.376 -7.304 1.00 1.00 C ATOM 277 OE1 GLU A 18 10.764 16.689 -7.807 1.00 1.00 O ATOM 278 OE2 GLU A 18 8.611 16.438 -7.981 1.00 1.00 O ATOM 0 H GLU A 18 11.706 12.746 -5.250 1.00 1.00 H new ATOM 0 HA GLU A 18 10.073 14.364 -3.665 1.00 1.00 H new ATOM 0 HB2 GLU A 18 11.249 14.488 -6.082 1.00 1.00 H new ATOM 0 HB3 GLU A 18 9.717 13.847 -6.643 1.00 1.00 H new ATOM 0 HG2 GLU A 18 8.574 15.833 -5.520 1.00 1.00 H new ATOM 0 HG3 GLU A 18 10.166 16.494 -5.207 1.00 1.00 H new ATOM 285 N PHE A 19 8.539 11.743 -4.756 1.00 1.00 N ATOM 286 CA PHE A 19 7.341 10.958 -4.815 1.00 1.00 C ATOM 287 C PHE A 19 6.717 10.929 -3.424 1.00 1.00 C ATOM 288 O PHE A 19 5.516 11.177 -3.303 1.00 1.00 O ATOM 289 CB PHE A 19 7.705 9.563 -5.360 1.00 1.00 C ATOM 290 CG PHE A 19 6.513 8.705 -5.733 1.00 1.00 C ATOM 291 CD1 PHE A 19 5.627 8.292 -4.727 1.00 1.00 C ATOM 292 CD2 PHE A 19 6.280 8.316 -7.067 1.00 1.00 C ATOM 293 CE1 PHE A 19 4.471 7.566 -5.055 1.00 1.00 C ATOM 294 CE2 PHE A 19 5.145 7.548 -7.388 1.00 1.00 C ATOM 295 CZ PHE A 19 4.224 7.201 -6.384 1.00 1.00 C ATOM 0 H PHE A 19 9.371 11.196 -4.977 1.00 1.00 H new ATOM 0 HA PHE A 19 6.596 11.381 -5.489 1.00 1.00 H new ATOM 0 HB2 PHE A 19 8.339 9.684 -6.238 1.00 1.00 H new ATOM 0 HB3 PHE A 19 8.296 9.036 -4.610 1.00 1.00 H new ATOM 0 HD1 PHE A 19 5.835 8.534 -3.695 1.00 1.00 H new ATOM 0 HD2 PHE A 19 6.972 8.607 -7.843 1.00 1.00 H new ATOM 0 HE1 PHE A 19 3.771 7.289 -4.281 1.00 1.00 H new ATOM 0 HE2 PHE A 19 4.982 7.225 -8.406 1.00 1.00 H new ATOM 0 HZ PHE A 19 3.328 6.654 -6.637 1.00 1.00 H new ATOM 305 N PHE A 20 7.469 10.616 -2.355 1.00 1.00 N ATOM 306 CA PHE A 20 6.846 10.356 -1.099 1.00 1.00 C ATOM 307 C PHE A 20 6.358 11.660 -0.488 1.00 1.00 C ATOM 308 O PHE A 20 5.401 11.631 0.273 1.00 1.00 O ATOM 309 CB PHE A 20 7.838 9.671 -0.163 1.00 1.00 C ATOM 310 CG PHE A 20 9.289 10.039 -0.148 1.00 1.00 C ATOM 311 CD1 PHE A 20 9.673 11.289 0.375 1.00 1.00 C ATOM 312 CD2 PHE A 20 10.261 9.076 -0.467 1.00 1.00 C ATOM 313 CE1 PHE A 20 11.030 11.623 0.464 1.00 1.00 C ATOM 314 CE2 PHE A 20 11.602 9.408 -0.369 1.00 1.00 C ATOM 315 CZ PHE A 20 11.979 10.677 0.066 1.00 1.00 C ATOM 0 H PHE A 20 8.486 10.544 -2.359 1.00 1.00 H new ATOM 0 HA PHE A 20 5.991 9.696 -1.249 1.00 1.00 H new ATOM 0 HB2 PHE A 20 7.466 9.814 0.851 1.00 1.00 H new ATOM 0 HB3 PHE A 20 7.785 8.603 -0.374 1.00 1.00 H new ATOM 0 HD1 PHE A 20 8.921 11.990 0.707 1.00 1.00 H new ATOM 0 HD2 PHE A 20 9.966 8.087 -0.785 1.00 1.00 H new ATOM 0 HE1 PHE A 20 11.337 12.591 0.832 1.00 1.00 H new ATOM 0 HE2 PHE A 20 12.357 8.682 -0.630 1.00 1.00 H new ATOM 0 HZ PHE A 20 13.027 10.935 0.096 1.00 1.00 H new ATOM 325 N ARG A 21 6.952 12.810 -0.822 1.00 1.00 N ATOM 326 CA ARG A 21 6.534 14.090 -0.261 1.00 1.00 C ATOM 327 C ARG A 21 5.126 14.465 -0.712 1.00 1.00 C ATOM 328 O ARG A 21 4.381 15.078 0.049 1.00 1.00 O ATOM 329 CB ARG A 21 7.546 15.173 -0.655 1.00 1.00 C ATOM 330 CG ARG A 21 8.954 14.962 -0.077 1.00 1.00 C ATOM 331 CD ARG A 21 8.961 14.898 1.464 1.00 1.00 C ATOM 332 NE ARG A 21 10.323 14.870 2.020 1.00 1.00 N ATOM 333 CZ ARG A 21 11.199 15.883 2.004 1.00 1.00 C ATOM 334 NH1 ARG A 21 10.847 17.080 1.542 1.00 1.00 N ATOM 335 NH2 ARG A 21 12.425 15.691 2.473 1.00 1.00 N ATOM 0 H ARG A 21 7.727 12.876 -1.482 1.00 1.00 H new ATOM 0 HA ARG A 21 6.507 14.004 0.825 1.00 1.00 H new ATOM 0 HB2 ARG A 21 7.614 15.212 -1.742 1.00 1.00 H new ATOM 0 HB3 ARG A 21 7.171 16.142 -0.324 1.00 1.00 H new ATOM 0 HG2 ARG A 21 9.372 14.038 -0.477 1.00 1.00 H new ATOM 0 HG3 ARG A 21 9.603 15.774 -0.406 1.00 1.00 H new ATOM 0 HD2 ARG A 21 8.427 15.760 1.863 1.00 1.00 H new ATOM 0 HD3 ARG A 21 8.420 14.009 1.790 1.00 1.00 H new ATOM 0 HE ARG A 21 10.628 14.000 2.457 1.00 1.00 H new ATOM 0 HH11 ARG A 21 9.901 17.234 1.195 1.00 1.00 H new ATOM 0 HH12 ARG A 21 11.524 17.843 1.535 1.00 1.00 H new ATOM 0 HH21 ARG A 21 12.693 14.778 2.841 1.00 1.00 H new ATOM 0 HH22 ARG A 21 13.100 16.456 2.465 1.00 1.00 H new ATOM 349 N LYS A 22 4.733 14.063 -1.920 1.00 1.00 N ATOM 350 CA LYS A 22 3.399 14.253 -2.464 1.00 1.00 C ATOM 351 C LYS A 22 2.371 13.435 -1.687 1.00 1.00 C ATOM 352 O LYS A 22 1.221 13.843 -1.551 1.00 1.00 O ATOM 353 CB LYS A 22 3.457 13.834 -3.935 1.00 1.00 C ATOM 354 CG LYS A 22 4.312 14.858 -4.697 1.00 1.00 C ATOM 355 CD LYS A 22 4.695 14.398 -6.101 1.00 1.00 C ATOM 356 CE LYS A 22 5.794 15.348 -6.577 1.00 1.00 C ATOM 357 NZ LYS A 22 6.284 15.012 -7.919 1.00 1.00 N ATOM 0 H LYS A 22 5.359 13.580 -2.564 1.00 1.00 H new ATOM 0 HA LYS A 22 3.086 15.294 -2.378 1.00 1.00 H new ATOM 0 HB2 LYS A 22 3.887 12.837 -4.029 1.00 1.00 H new ATOM 0 HB3 LYS A 22 2.453 13.790 -4.357 1.00 1.00 H new ATOM 0 HG2 LYS A 22 3.765 15.798 -4.767 1.00 1.00 H new ATOM 0 HG3 LYS A 22 5.219 15.059 -4.128 1.00 1.00 H new ATOM 0 HD2 LYS A 22 5.050 13.367 -6.090 1.00 1.00 H new ATOM 0 HD3 LYS A 22 3.835 14.432 -6.770 1.00 1.00 H new ATOM 0 HE2 LYS A 22 5.412 16.369 -6.578 1.00 1.00 H new ATOM 0 HE3 LYS A 22 6.625 15.319 -5.872 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 7.236 15.410 -8.051 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 6.323 13.978 -8.026 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 5.641 15.409 -8.633 1.00 1.00 H new ATOM 371 N LEU A 23 2.761 12.240 -1.244 1.00 1.00 N ATOM 372 CA LEU A 23 1.940 11.375 -0.407 1.00 1.00 C ATOM 373 C LEU A 23 1.923 11.878 1.036 1.00 1.00 C ATOM 374 O LEU A 23 0.908 11.804 1.723 1.00 1.00 O ATOM 375 CB LEU A 23 2.496 9.952 -0.462 1.00 1.00 C ATOM 376 CG LEU A 23 2.728 9.371 -1.876 1.00 1.00 C ATOM 377 CD1 LEU A 23 2.654 7.848 -1.810 1.00 1.00 C ATOM 378 CD2 LEU A 23 1.804 9.927 -2.977 1.00 1.00 C ATOM 0 H LEU A 23 3.674 11.841 -1.463 1.00 1.00 H new ATOM 0 HA LEU A 23 0.916 11.384 -0.780 1.00 1.00 H new ATOM 0 HB2 LEU A 23 3.443 9.932 0.078 1.00 1.00 H new ATOM 0 HB3 LEU A 23 1.810 9.294 0.072 1.00 1.00 H new ATOM 0 HG LEU A 23 3.723 9.697 -2.179 1.00 1.00 H new ATOM 0 HD11 LEU A 23 2.817 7.432 -2.804 1.00 1.00 H new ATOM 0 HD12 LEU A 23 3.421 7.476 -1.131 1.00 1.00 H new ATOM 0 HD13 LEU A 23 1.671 7.547 -1.447 1.00 1.00 H new ATOM 0 HD21 LEU A 23 2.048 9.456 -3.929 1.00 1.00 H new ATOM 0 HD22 LEU A 23 0.766 9.714 -2.722 1.00 1.00 H new ATOM 0 HD23 LEU A 23 1.944 11.005 -3.059 1.00 1.00 H new ATOM 390 N SER A 24 3.059 12.444 1.436 1.00 1.00 N ATOM 391 CA SER A 24 3.373 13.045 2.707 1.00 1.00 C ATOM 392 C SER A 24 3.163 12.094 3.891 1.00 1.00 C ATOM 393 O SER A 24 3.124 10.862 3.762 1.00 1.00 O ATOM 394 CB SER A 24 2.559 14.343 2.795 1.00 1.00 C ATOM 395 OG SER A 24 3.207 15.328 3.568 1.00 1.00 O ATOM 0 H SER A 24 3.858 12.492 0.804 1.00 1.00 H new ATOM 0 HA SER A 24 4.437 13.275 2.770 1.00 1.00 H new ATOM 0 HB2 SER A 24 2.384 14.729 1.791 1.00 1.00 H new ATOM 0 HB3 SER A 24 1.582 14.128 3.228 1.00 1.00 H new ATOM 0 HG SER A 24 2.655 16.137 3.596 1.00 1.00 H new ATOM 401 N ARG A 25 3.148 12.686 5.084 1.00 1.00 N ATOM 402 CA ARG A 25 2.563 12.087 6.277 1.00 1.00 C ATOM 403 C ARG A 25 1.052 12.307 6.218 1.00 1.00 C ATOM 404 O ARG A 25 0.581 13.022 5.335 1.00 1.00 O ATOM 405 CB ARG A 25 3.248 12.657 7.532 1.00 1.00 C ATOM 406 CG ARG A 25 4.654 12.043 7.614 1.00 1.00 C ATOM 407 CD ARG A 25 5.375 12.334 8.931 1.00 1.00 C ATOM 408 NE ARG A 25 6.622 11.554 9.011 1.00 1.00 N ATOM 409 CZ ARG A 25 7.781 11.859 8.413 1.00 1.00 C ATOM 410 NH1 ARG A 25 7.927 13.035 7.811 1.00 1.00 N ATOM 411 NH2 ARG A 25 8.795 10.997 8.404 1.00 1.00 N ATOM 0 H ARG A 25 3.549 13.609 5.249 1.00 1.00 H new ATOM 0 HA ARG A 25 2.729 11.011 6.326 1.00 1.00 H new ATOM 0 HB2 ARG A 25 3.308 13.744 7.475 1.00 1.00 H new ATOM 0 HB3 ARG A 25 2.672 12.416 8.425 1.00 1.00 H new ATOM 0 HG2 ARG A 25 4.578 10.964 7.482 1.00 1.00 H new ATOM 0 HG3 ARG A 25 5.256 12.423 6.789 1.00 1.00 H new ATOM 0 HD2 ARG A 25 5.598 13.398 9.005 1.00 1.00 H new ATOM 0 HD3 ARG A 25 4.727 12.085 9.771 1.00 1.00 H new ATOM 0 HE ARG A 25 6.601 10.703 9.574 1.00 1.00 H new ATOM 0 HH11 ARG A 25 7.157 13.704 7.805 1.00 1.00 H new ATOM 0 HH12 ARG A 25 8.809 13.269 7.355 1.00 1.00 H new ATOM 0 HH21 ARG A 25 8.696 10.088 8.857 1.00 1.00 H new ATOM 0 HH22 ARG A 25 9.671 11.245 7.944 1.00 1.00 H new ATOM 425 N GLU A 26 0.310 11.724 7.154 1.00 1.00 N ATOM 426 CA GLU A 26 -1.121 11.416 7.086 1.00 1.00 C ATOM 427 C GLU A 26 -1.964 12.421 6.286 1.00 1.00 C ATOM 428 O GLU A 26 -2.266 13.532 6.727 1.00 1.00 O ATOM 429 CB GLU A 26 -1.645 11.132 8.502 1.00 1.00 C ATOM 430 CG GLU A 26 -1.413 12.268 9.517 1.00 1.00 C ATOM 431 CD GLU A 26 -1.578 11.819 10.968 1.00 1.00 C ATOM 432 OE1 GLU A 26 -2.217 10.776 11.248 1.00 1.00 O ATOM 433 OE2 GLU A 26 -1.155 12.578 11.872 1.00 1.00 O ATOM 0 H GLU A 26 0.717 11.433 8.043 1.00 1.00 H new ATOM 0 HA GLU A 26 -1.237 10.511 6.490 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -2.714 10.928 8.444 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -1.167 10.226 8.876 1.00 1.00 H new ATOM 0 HG2 GLU A 26 -0.409 12.671 9.380 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -2.112 13.079 9.312 1.00 1.00 H new ATOM 440 N CYS A 27 -2.333 12.001 5.072 1.00 1.00 N ATOM 441 CA CYS A 27 -3.139 12.724 4.106 1.00 1.00 C ATOM 442 C CYS A 27 -4.359 11.906 3.711 1.00 1.00 C ATOM 443 O CYS A 27 -4.500 10.741 4.062 1.00 1.00 O ATOM 444 CB CYS A 27 -2.324 13.016 2.843 1.00 1.00 C ATOM 445 SG CYS A 27 -1.135 14.355 3.109 1.00 1.00 S ATOM 0 H CYS A 27 -2.053 11.084 4.723 1.00 1.00 H new ATOM 0 HA CYS A 27 -3.455 13.659 4.569 1.00 1.00 H new ATOM 0 HB2 CYS A 27 -1.794 12.115 2.535 1.00 1.00 H new ATOM 0 HB3 CYS A 27 -2.998 13.284 2.029 1.00 1.00 H new ATOM 0 HG CYS A 27 -0.303 14.016 4.049 1.00 1.00 H new ATOM 451 N GLU A 28 -5.243 12.529 2.948 1.00 1.00 N ATOM 452 CA GLU A 28 -6.422 11.868 2.421 1.00 1.00 C ATOM 453 C GLU A 28 -6.011 11.017 1.212 1.00 1.00 C ATOM 454 O GLU A 28 -5.128 11.406 0.432 1.00 1.00 O ATOM 455 CB GLU A 28 -7.470 12.948 2.122 1.00 1.00 C ATOM 456 CG GLU A 28 -8.846 12.398 1.724 1.00 1.00 C ATOM 457 CD GLU A 28 -9.947 13.415 2.014 1.00 1.00 C ATOM 458 OE1 GLU A 28 -9.907 14.550 1.486 1.00 1.00 O ATOM 459 OE2 GLU A 28 -10.822 13.132 2.862 1.00 1.00 O ATOM 0 H GLU A 28 -5.161 13.509 2.677 1.00 1.00 H new ATOM 0 HA GLU A 28 -6.877 11.176 3.130 1.00 1.00 H new ATOM 0 HB2 GLU A 28 -7.585 13.580 3.003 1.00 1.00 H new ATOM 0 HB3 GLU A 28 -7.100 13.585 1.319 1.00 1.00 H new ATOM 0 HG2 GLU A 28 -8.848 12.147 0.663 1.00 1.00 H new ATOM 0 HG3 GLU A 28 -9.045 11.476 2.270 1.00 1.00 H new ATOM 466 N ILE A 29 -6.654 9.858 1.061 1.00 1.00 N ATOM 467 CA ILE A 29 -6.409 8.868 0.017 1.00 1.00 C ATOM 468 C ILE A 29 -7.734 8.358 -0.533 1.00 1.00 C ATOM 469 O ILE A 29 -8.790 8.536 0.077 1.00 1.00 O ATOM 470 CB ILE A 29 -5.554 7.685 0.529 1.00 1.00 C ATOM 471 CG1 ILE A 29 -6.209 6.998 1.738 1.00 1.00 C ATOM 472 CG2 ILE A 29 -4.131 8.156 0.851 1.00 1.00 C ATOM 473 CD1 ILE A 29 -5.619 5.627 2.074 1.00 1.00 C ATOM 0 H ILE A 29 -7.398 9.572 1.698 1.00 1.00 H new ATOM 0 HA ILE A 29 -5.846 9.357 -0.778 1.00 1.00 H new ATOM 0 HB ILE A 29 -5.494 6.940 -0.264 1.00 1.00 H new ATOM 0 HG12 ILE A 29 -6.110 7.647 2.608 1.00 1.00 H new ATOM 0 HG13 ILE A 29 -7.276 6.885 1.544 1.00 1.00 H new ATOM 0 HG21 ILE A 29 -3.541 7.313 1.210 1.00 1.00 H new ATOM 0 HG22 ILE A 29 -3.670 8.564 -0.049 1.00 1.00 H new ATOM 0 HG23 ILE A 29 -4.168 8.927 1.621 1.00 1.00 H new ATOM 0 HD11 ILE A 29 -6.136 5.210 2.938 1.00 1.00 H new ATOM 0 HD12 ILE A 29 -5.742 4.959 1.221 1.00 1.00 H new ATOM 0 HD13 ILE A 29 -4.558 5.733 2.302 1.00 1.00 H new ATOM 485 N LYS A 30 -7.666 7.703 -1.689 1.00 1.00 N ATOM 486 CA LYS A 30 -8.846 7.188 -2.382 1.00 1.00 C ATOM 487 C LYS A 30 -8.482 5.988 -3.231 1.00 1.00 C ATOM 488 O LYS A 30 -7.525 6.082 -3.981 1.00 1.00 O ATOM 489 CB LYS A 30 -9.425 8.347 -3.200 1.00 1.00 C ATOM 490 CG LYS A 30 -10.770 8.057 -3.871 1.00 1.00 C ATOM 491 CD LYS A 30 -11.495 9.378 -4.185 1.00 1.00 C ATOM 492 CE LYS A 30 -10.672 10.205 -5.185 1.00 1.00 C ATOM 493 NZ LYS A 30 -11.273 11.511 -5.526 1.00 1.00 N ATOM 0 H LYS A 30 -6.789 7.513 -2.174 1.00 1.00 H new ATOM 0 HA LYS A 30 -9.601 6.831 -1.682 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -9.541 9.211 -2.546 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -8.704 8.624 -3.969 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -10.614 7.491 -4.789 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -11.387 7.440 -3.217 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -12.482 9.171 -4.598 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -11.646 9.947 -3.267 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -9.678 10.372 -4.771 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -10.543 9.626 -6.100 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -10.661 12.008 -6.204 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -12.210 11.361 -5.951 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -11.371 12.084 -4.663 1.00 1.00 H new ATOM 507 N TYR A 31 -9.171 4.853 -3.112 1.00 1.00 N ATOM 508 CA TYR A 31 -8.942 3.715 -4.002 1.00 1.00 C ATOM 509 C TYR A 31 -9.282 4.170 -5.433 1.00 1.00 C ATOM 510 O TYR A 31 -10.228 4.931 -5.622 1.00 1.00 O ATOM 511 CB TYR A 31 -9.722 2.488 -3.488 1.00 1.00 C ATOM 512 CG TYR A 31 -9.386 1.150 -4.147 1.00 1.00 C ATOM 513 CD1 TYR A 31 -9.569 0.952 -5.525 1.00 1.00 C ATOM 514 CD2 TYR A 31 -8.857 0.090 -3.388 1.00 1.00 C ATOM 515 CE1 TYR A 31 -9.173 -0.234 -6.158 1.00 1.00 C ATOM 516 CE2 TYR A 31 -8.481 -1.123 -4.002 1.00 1.00 C ATOM 517 CZ TYR A 31 -8.631 -1.283 -5.399 1.00 1.00 C ATOM 518 OH TYR A 31 -8.307 -2.436 -6.037 1.00 1.00 O ATOM 0 H TYR A 31 -9.892 4.697 -2.408 1.00 1.00 H new ATOM 0 HA TYR A 31 -7.902 3.388 -4.016 1.00 1.00 H new ATOM 0 HB2 TYR A 31 -9.547 2.395 -2.416 1.00 1.00 H new ATOM 0 HB3 TYR A 31 -10.787 2.678 -3.622 1.00 1.00 H new ATOM 0 HD1 TYR A 31 -10.027 1.734 -6.112 1.00 1.00 H new ATOM 0 HD2 TYR A 31 -8.737 0.207 -2.321 1.00 1.00 H new ATOM 0 HE1 TYR A 31 -9.285 -0.341 -7.227 1.00 1.00 H new ATOM 0 HE2 TYR A 31 -8.079 -1.929 -3.406 1.00 1.00 H new ATOM 0 HH TYR A 31 -7.626 -2.916 -5.520 1.00 1.00 H new ATOM 528 N THR A 32 -8.547 3.717 -6.453 1.00 1.00 N ATOM 529 CA THR A 32 -8.701 4.141 -7.836 1.00 1.00 C ATOM 530 C THR A 32 -8.389 2.921 -8.695 1.00 1.00 C ATOM 531 O THR A 32 -7.225 2.624 -8.945 1.00 1.00 O ATOM 532 CB THR A 32 -7.767 5.323 -8.152 1.00 1.00 C ATOM 533 OG1 THR A 32 -6.434 5.018 -7.790 1.00 1.00 O ATOM 534 CG2 THR A 32 -8.203 6.617 -7.459 1.00 1.00 C ATOM 0 H THR A 32 -7.808 3.025 -6.329 1.00 1.00 H new ATOM 0 HA THR A 32 -9.711 4.498 -8.036 1.00 1.00 H new ATOM 0 HB THR A 32 -7.827 5.486 -9.228 1.00 1.00 H new ATOM 0 HG1 THR A 32 -6.232 4.091 -8.037 1.00 1.00 H new ATOM 0 HG21 THR A 32 -7.510 7.418 -7.716 1.00 1.00 H new ATOM 0 HG22 THR A 32 -9.207 6.886 -7.788 1.00 1.00 H new ATOM 0 HG23 THR A 32 -8.203 6.469 -6.379 1.00 1.00 H new ATOM 542 N GLY A 33 -9.416 2.166 -9.065 1.00 1.00 N ATOM 543 CA GLY A 33 -9.286 0.993 -9.917 1.00 1.00 C ATOM 544 C GLY A 33 -10.674 0.476 -10.257 1.00 1.00 C ATOM 545 O GLY A 33 -11.471 1.227 -10.823 1.00 1.00 O ATOM 0 H GLY A 33 -10.376 2.355 -8.777 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -8.745 1.247 -10.828 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -8.710 0.220 -9.409 1.00 1.00 H new ATOM 549 N PHE A 34 -11.017 -0.763 -9.877 1.00 1.00 N ATOM 550 CA PHE A 34 -12.363 -1.272 -10.148 1.00 1.00 C ATOM 551 C PHE A 34 -13.422 -0.406 -9.453 1.00 1.00 C ATOM 552 O PHE A 34 -14.518 -0.256 -9.985 1.00 1.00 O ATOM 553 CB PHE A 34 -12.536 -2.765 -9.800 1.00 1.00 C ATOM 554 CG PHE A 34 -13.096 -3.028 -8.415 1.00 1.00 C ATOM 555 CD1 PHE A 34 -14.474 -2.851 -8.175 1.00 1.00 C ATOM 556 CD2 PHE A 34 -12.237 -3.334 -7.348 1.00 1.00 C ATOM 557 CE1 PHE A 34 -14.965 -2.838 -6.862 1.00 1.00 C ATOM 558 CE2 PHE A 34 -12.743 -3.353 -6.039 1.00 1.00 C ATOM 559 CZ PHE A 34 -14.090 -3.057 -5.789 1.00 1.00 C ATOM 0 H PHE A 34 -10.398 -1.414 -9.394 1.00 1.00 H new ATOM 0 HA PHE A 34 -12.509 -1.202 -11.226 1.00 1.00 H new ATOM 0 HB2 PHE A 34 -13.195 -3.223 -10.537 1.00 1.00 H new ATOM 0 HB3 PHE A 34 -11.569 -3.260 -9.887 1.00 1.00 H new ATOM 0 HD1 PHE A 34 -15.153 -2.725 -9.005 1.00 1.00 H new ATOM 0 HD2 PHE A 34 -11.196 -3.553 -7.533 1.00 1.00 H new ATOM 0 HE1 PHE A 34 -16.014 -2.660 -6.678 1.00 1.00 H new ATOM 0 HE2 PHE A 34 -12.088 -3.598 -5.216 1.00 1.00 H new ATOM 0 HZ PHE A 34 -14.452 -2.998 -4.773 1.00 1.00 H new ATOM 569 N ARG A 35 -13.124 0.177 -8.277 1.00 1.00 N ATOM 570 CA ARG A 35 -14.101 0.995 -7.538 1.00 1.00 C ATOM 571 C ARG A 35 -14.613 2.208 -8.309 1.00 1.00 C ATOM 572 O ARG A 35 -15.524 2.878 -7.824 1.00 1.00 O ATOM 573 CB ARG A 35 -13.580 1.434 -6.161 1.00 1.00 C ATOM 574 CG ARG A 35 -12.572 2.597 -6.167 1.00 1.00 C ATOM 575 CD ARG A 35 -13.152 4.025 -6.109 1.00 1.00 C ATOM 576 NE ARG A 35 -12.857 4.789 -7.332 1.00 1.00 N ATOM 577 CZ ARG A 35 -12.991 6.103 -7.540 1.00 1.00 C ATOM 578 NH1 ARG A 35 -13.510 6.917 -6.628 1.00 1.00 N ATOM 579 NH2 ARG A 35 -12.596 6.579 -8.712 1.00 1.00 N ATOM 0 H ARG A 35 -12.216 0.096 -7.820 1.00 1.00 H new ATOM 0 HA ARG A 35 -14.950 0.326 -7.397 1.00 1.00 H new ATOM 0 HB2 ARG A 35 -14.433 1.720 -5.545 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -13.113 0.575 -5.679 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -11.901 2.469 -5.317 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -11.964 2.514 -7.068 1.00 1.00 H new ATOM 0 HD2 ARG A 35 -14.231 3.973 -5.966 1.00 1.00 H new ATOM 0 HD3 ARG A 35 -12.741 4.549 -5.246 1.00 1.00 H new ATOM 0 HE ARG A 35 -12.506 4.247 -8.121 1.00 1.00 H new ATOM 0 HH11 ARG A 35 -13.823 6.545 -5.731 1.00 1.00 H new ATOM 0 HH12 ARG A 35 -13.596 7.914 -6.824 1.00 1.00 H new ATOM 0 HH21 ARG A 35 -12.208 5.949 -9.414 1.00 1.00 H new ATOM 0 HH22 ARG A 35 -12.680 7.576 -8.912 1.00 1.00 H new ATOM 593 N ASP A 36 -14.038 2.514 -9.465 1.00 1.00 N ATOM 594 CA ASP A 36 -14.513 3.557 -10.360 1.00 1.00 C ATOM 595 C ASP A 36 -15.893 3.172 -10.932 1.00 1.00 C ATOM 596 O ASP A 36 -16.650 4.045 -11.357 1.00 1.00 O ATOM 597 CB ASP A 36 -13.474 3.794 -11.474 1.00 1.00 C ATOM 598 CG ASP A 36 -12.073 4.234 -11.010 1.00 1.00 C ATOM 599 OD1 ASP A 36 -11.756 4.196 -9.797 1.00 1.00 O ATOM 600 OD2 ASP A 36 -11.259 4.605 -11.882 1.00 1.00 O ATOM 0 H ASP A 36 -13.209 2.032 -9.813 1.00 1.00 H new ATOM 0 HA ASP A 36 -14.635 4.491 -9.811 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -13.372 2.874 -12.049 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -13.865 4.552 -12.152 1.00 1.00 H new ATOM 605 N ARG A 37 -16.274 1.881 -10.908 1.00 1.00 N ATOM 606 CA ARG A 37 -17.649 1.429 -11.158 1.00 1.00 C ATOM 607 C ARG A 37 -18.615 2.094 -10.168 1.00 1.00 C ATOM 608 O ARG A 37 -18.203 2.419 -9.051 1.00 1.00 O ATOM 609 CB ARG A 37 -17.755 -0.102 -10.983 1.00 1.00 C ATOM 610 CG ARG A 37 -17.562 -0.957 -12.243 1.00 1.00 C ATOM 611 CD ARG A 37 -16.148 -0.991 -12.835 1.00 1.00 C ATOM 612 NE ARG A 37 -15.894 0.128 -13.758 1.00 1.00 N ATOM 613 CZ ARG A 37 -15.427 0.022 -15.007 1.00 1.00 C ATOM 614 NH1 ARG A 37 -14.975 -1.131 -15.481 1.00 1.00 N ATOM 615 NH2 ARG A 37 -15.409 1.082 -15.798 1.00 1.00 N ATOM 0 H ARG A 37 -15.627 1.117 -10.712 1.00 1.00 H new ATOM 0 HA ARG A 37 -17.911 1.704 -12.180 1.00 1.00 H new ATOM 0 HB2 ARG A 37 -17.015 -0.412 -10.245 1.00 1.00 H new ATOM 0 HB3 ARG A 37 -18.736 -0.329 -10.565 1.00 1.00 H new ATOM 0 HG2 ARG A 37 -17.860 -1.980 -12.011 1.00 1.00 H new ATOM 0 HG3 ARG A 37 -18.245 -0.593 -13.011 1.00 1.00 H new ATOM 0 HD2 ARG A 37 -15.418 -0.962 -12.026 1.00 1.00 H new ATOM 0 HD3 ARG A 37 -16.002 -1.933 -13.363 1.00 1.00 H new ATOM 0 HE ARG A 37 -16.092 1.068 -13.414 1.00 1.00 H new ATOM 0 HH11 ARG A 37 -14.979 -1.962 -14.890 1.00 1.00 H new ATOM 0 HH12 ARG A 37 -14.624 -1.187 -16.437 1.00 1.00 H new ATOM 0 HH21 ARG A 37 -15.751 1.980 -15.455 1.00 1.00 H new ATOM 0 HH22 ARG A 37 -15.053 1.002 -16.750 1.00 1.00 H new ATOM 629 N PRO A 38 -19.914 2.200 -10.489 1.00 1.00 N ATOM 630 CA PRO A 38 -20.904 2.673 -9.533 1.00 1.00 C ATOM 631 C PRO A 38 -20.962 1.770 -8.295 1.00 1.00 C ATOM 632 O PRO A 38 -20.647 0.572 -8.344 1.00 1.00 O ATOM 633 CB PRO A 38 -22.231 2.740 -10.291 1.00 1.00 C ATOM 634 CG PRO A 38 -22.027 1.831 -11.500 1.00 1.00 C ATOM 635 CD PRO A 38 -20.527 1.887 -11.767 1.00 1.00 C ATOM 0 HA PRO A 38 -20.649 3.658 -9.142 1.00 1.00 H new ATOM 0 HB2 PRO A 38 -23.060 2.397 -9.672 1.00 1.00 H new ATOM 0 HB3 PRO A 38 -22.463 3.760 -10.596 1.00 1.00 H new ATOM 0 HG2 PRO A 38 -22.356 0.813 -11.292 1.00 1.00 H new ATOM 0 HG3 PRO A 38 -22.597 2.180 -12.361 1.00 1.00 H new ATOM 0 HD2 PRO A 38 -20.162 0.936 -12.154 1.00 1.00 H new ATOM 0 HD3 PRO A 38 -20.290 2.646 -12.512 1.00 1.00 H new ATOM 643 N HIS A 39 -21.330 2.373 -7.165 1.00 1.00 N ATOM 644 CA HIS A 39 -21.447 1.694 -5.889 1.00 1.00 C ATOM 645 C HIS A 39 -22.722 0.867 -5.852 1.00 1.00 C ATOM 646 O HIS A 39 -23.758 1.251 -6.401 1.00 1.00 O ATOM 647 CB HIS A 39 -21.364 2.676 -4.714 1.00 1.00 C ATOM 648 CG HIS A 39 -20.033 2.547 -4.024 1.00 1.00 C ATOM 649 ND1 HIS A 39 -18.803 2.838 -4.570 1.00 1.00 N ATOM 650 CD2 HIS A 39 -19.821 1.874 -2.853 1.00 1.00 C ATOM 651 CE1 HIS A 39 -17.869 2.324 -3.754 1.00 1.00 C ATOM 652 NE2 HIS A 39 -18.440 1.739 -2.685 1.00 1.00 N ATOM 0 H HIS A 39 -21.558 3.366 -7.117 1.00 1.00 H new ATOM 0 HA HIS A 39 -20.601 1.015 -5.782 1.00 1.00 H new ATOM 0 HB2 HIS A 39 -21.499 3.696 -5.073 1.00 1.00 H new ATOM 0 HB3 HIS A 39 -22.169 2.478 -4.007 1.00 1.00 H new ATOM 0 HD1 HIS A 39 -18.633 3.350 -5.436 1.00 1.00 H new ATOM 0 HD2 HIS A 39 -20.583 1.512 -2.179 1.00 1.00 H new ATOM 0 HE1 HIS A 39 -16.805 2.373 -3.931 1.00 1.00 H new ATOM 660 N GLU A 40 -22.634 -0.276 -5.179 1.00 1.00 N ATOM 661 CA GLU A 40 -23.681 -1.283 -5.117 1.00 1.00 C ATOM 662 C GLU A 40 -23.299 -2.314 -4.056 1.00 1.00 C ATOM 663 O GLU A 40 -23.896 -2.370 -2.985 1.00 1.00 O ATOM 664 CB GLU A 40 -23.833 -1.922 -6.505 1.00 1.00 C ATOM 665 CG GLU A 40 -25.102 -2.767 -6.594 1.00 1.00 C ATOM 666 CD GLU A 40 -25.408 -3.104 -8.047 1.00 1.00 C ATOM 667 OE1 GLU A 40 -25.586 -2.175 -8.868 1.00 1.00 O ATOM 668 OE2 GLU A 40 -25.464 -4.304 -8.398 1.00 1.00 O ATOM 0 H GLU A 40 -21.804 -0.533 -4.645 1.00 1.00 H new ATOM 0 HA GLU A 40 -24.640 -0.845 -4.840 1.00 1.00 H new ATOM 0 HB2 GLU A 40 -23.860 -1.142 -7.265 1.00 1.00 H new ATOM 0 HB3 GLU A 40 -22.964 -2.545 -6.718 1.00 1.00 H new ATOM 0 HG2 GLU A 40 -24.978 -3.684 -6.019 1.00 1.00 H new ATOM 0 HG3 GLU A 40 -25.940 -2.226 -6.154 1.00 1.00 H new ATOM 675 N GLU A 41 -22.240 -3.078 -4.296 1.00 1.00 N ATOM 676 CA GLU A 41 -21.672 -4.067 -3.393 1.00 1.00 C ATOM 677 C GLU A 41 -20.188 -4.087 -3.746 1.00 1.00 C ATOM 678 O GLU A 41 -19.658 -4.986 -4.401 1.00 1.00 O ATOM 679 CB GLU A 41 -22.436 -5.401 -3.519 1.00 1.00 C ATOM 680 CG GLU A 41 -21.744 -6.688 -3.033 1.00 1.00 C ATOM 681 CD GLU A 41 -21.046 -6.653 -1.669 1.00 1.00 C ATOM 682 OE1 GLU A 41 -20.716 -5.577 -1.113 1.00 1.00 O ATOM 683 OE2 GLU A 41 -20.717 -7.754 -1.173 1.00 1.00 O ATOM 0 H GLU A 41 -21.727 -3.019 -5.176 1.00 1.00 H new ATOM 0 HA GLU A 41 -21.771 -3.842 -2.331 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -23.373 -5.300 -2.971 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -22.694 -5.538 -4.569 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -22.492 -7.481 -3.006 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -21.004 -6.973 -3.781 1.00 1.00 H new ATOM 690 N ARG A 42 -19.531 -2.969 -3.437 1.00 1.00 N ATOM 691 CA ARG A 42 -18.169 -2.693 -3.888 1.00 1.00 C ATOM 692 C ARG A 42 -17.211 -2.585 -2.711 1.00 1.00 C ATOM 693 O ARG A 42 -16.040 -2.870 -2.890 1.00 1.00 O ATOM 694 CB ARG A 42 -18.115 -1.441 -4.779 1.00 1.00 C ATOM 695 CG ARG A 42 -19.187 -1.386 -5.889 1.00 1.00 C ATOM 696 CD ARG A 42 -19.082 -2.487 -6.946 1.00 1.00 C ATOM 697 NE ARG A 42 -20.086 -2.306 -8.010 1.00 1.00 N ATOM 698 CZ ARG A 42 -20.514 -3.256 -8.855 1.00 1.00 C ATOM 699 NH1 ARG A 42 -20.067 -4.507 -8.770 1.00 1.00 N ATOM 700 NH2 ARG A 42 -21.395 -2.960 -9.799 1.00 1.00 N ATOM 0 H ARG A 42 -19.932 -2.226 -2.864 1.00 1.00 H new ATOM 0 HA ARG A 42 -17.845 -3.537 -4.497 1.00 1.00 H new ATOM 0 HB2 ARG A 42 -18.221 -0.559 -4.148 1.00 1.00 H new ATOM 0 HB3 ARG A 42 -17.130 -1.385 -5.242 1.00 1.00 H new ATOM 0 HG2 ARG A 42 -20.172 -1.442 -5.425 1.00 1.00 H new ATOM 0 HG3 ARG A 42 -19.123 -0.418 -6.387 1.00 1.00 H new ATOM 0 HD2 ARG A 42 -18.083 -2.482 -7.381 1.00 1.00 H new ATOM 0 HD3 ARG A 42 -19.220 -3.460 -6.475 1.00 1.00 H new ATOM 0 HE ARG A 42 -20.491 -1.376 -8.113 1.00 1.00 H new ATOM 0 HH11 ARG A 42 -19.387 -4.758 -8.053 1.00 1.00 H new ATOM 0 HH12 ARG A 42 -20.405 -5.215 -9.422 1.00 1.00 H new ATOM 0 HH21 ARG A 42 -21.750 -2.008 -9.885 1.00 1.00 H new ATOM 0 HH22 ARG A 42 -21.718 -3.685 -10.440 1.00 1.00 H new ATOM 714 N GLN A 43 -17.675 -2.271 -1.503 1.00 1.00 N ATOM 715 CA GLN A 43 -16.842 -2.228 -0.301 1.00 1.00 C ATOM 716 C GLN A 43 -16.298 -3.613 0.070 1.00 1.00 C ATOM 717 O GLN A 43 -15.122 -3.798 0.370 1.00 1.00 O ATOM 718 CB GLN A 43 -17.703 -1.683 0.832 1.00 1.00 C ATOM 719 CG GLN A 43 -17.860 -0.154 0.742 1.00 1.00 C ATOM 720 CD GLN A 43 -19.164 0.281 1.391 1.00 1.00 C ATOM 721 OE1 GLN A 43 -19.542 -0.234 2.433 1.00 1.00 O ATOM 722 NE2 GLN A 43 -19.921 1.157 0.757 1.00 1.00 N ATOM 0 H GLN A 43 -18.652 -2.036 -1.328 1.00 1.00 H new ATOM 0 HA GLN A 43 -15.977 -1.590 -0.483 1.00 1.00 H new ATOM 0 HB2 GLN A 43 -18.686 -2.152 0.800 1.00 1.00 H new ATOM 0 HB3 GLN A 43 -17.254 -1.947 1.790 1.00 1.00 H new ATOM 0 HG2 GLN A 43 -17.020 0.334 1.235 1.00 1.00 H new ATOM 0 HG3 GLN A 43 -17.843 0.159 -0.302 1.00 1.00 H new ATOM 0 HE21 GLN A 43 -19.594 1.580 -0.112 1.00 1.00 H new ATOM 0 HE22 GLN A 43 -20.833 1.411 1.136 1.00 1.00 H new ATOM 731 N THR A 44 -17.154 -4.616 0.021 1.00 1.00 N ATOM 732 CA THR A 44 -16.772 -6.006 0.220 1.00 1.00 C ATOM 733 C THR A 44 -15.820 -6.441 -0.896 1.00 1.00 C ATOM 734 O THR A 44 -14.740 -6.969 -0.618 1.00 1.00 O ATOM 735 CB THR A 44 -18.063 -6.834 0.221 1.00 1.00 C ATOM 736 OG1 THR A 44 -19.129 -6.156 0.867 1.00 1.00 O ATOM 737 CG2 THR A 44 -17.858 -8.205 0.845 1.00 1.00 C ATOM 0 H THR A 44 -18.150 -4.489 -0.161 1.00 1.00 H new ATOM 0 HA THR A 44 -16.246 -6.149 1.164 1.00 1.00 H new ATOM 0 HB THR A 44 -18.335 -6.974 -0.825 1.00 1.00 H new ATOM 0 HG1 THR A 44 -19.649 -5.656 0.203 1.00 1.00 H new ATOM 0 HG21 THR A 44 -18.797 -8.758 0.825 1.00 1.00 H new ATOM 0 HG22 THR A 44 -17.103 -8.752 0.281 1.00 1.00 H new ATOM 0 HG23 THR A 44 -17.527 -8.089 1.877 1.00 1.00 H new ATOM 745 N ARG A 45 -16.151 -6.156 -2.165 1.00 1.00 N ATOM 746 CA ARG A 45 -15.250 -6.431 -3.273 1.00 1.00 C ATOM 747 C ARG A 45 -13.921 -5.734 -3.060 1.00 1.00 C ATOM 748 O ARG A 45 -12.900 -6.294 -3.419 1.00 1.00 O ATOM 749 CB ARG A 45 -15.877 -5.957 -4.585 1.00 1.00 C ATOM 750 CG ARG A 45 -14.969 -6.206 -5.801 1.00 1.00 C ATOM 751 CD ARG A 45 -15.019 -7.627 -6.355 1.00 1.00 C ATOM 752 NE ARG A 45 -16.329 -7.937 -6.955 1.00 1.00 N ATOM 753 CZ ARG A 45 -16.548 -8.920 -7.839 1.00 1.00 C ATOM 754 NH1 ARG A 45 -15.582 -9.781 -8.132 1.00 1.00 N ATOM 755 NH2 ARG A 45 -17.723 -9.023 -8.443 1.00 1.00 N ATOM 0 H ARG A 45 -17.039 -5.735 -2.440 1.00 1.00 H new ATOM 0 HA ARG A 45 -15.079 -7.506 -3.323 1.00 1.00 H new ATOM 0 HB2 ARG A 45 -16.827 -6.470 -4.735 1.00 1.00 H new ATOM 0 HB3 ARG A 45 -16.098 -4.892 -4.514 1.00 1.00 H new ATOM 0 HG2 ARG A 45 -15.248 -5.512 -6.594 1.00 1.00 H new ATOM 0 HG3 ARG A 45 -13.941 -5.975 -5.523 1.00 1.00 H new ATOM 0 HD2 ARG A 45 -14.238 -7.752 -7.105 1.00 1.00 H new ATOM 0 HD3 ARG A 45 -14.809 -8.336 -5.554 1.00 1.00 H new ATOM 0 HE ARG A 45 -17.125 -7.363 -6.678 1.00 1.00 H new ATOM 0 HH11 ARG A 45 -14.670 -9.696 -7.684 1.00 1.00 H new ATOM 0 HH12 ARG A 45 -15.752 -10.528 -8.805 1.00 1.00 H new ATOM 0 HH21 ARG A 45 -18.464 -8.353 -8.235 1.00 1.00 H new ATOM 0 HH22 ARG A 45 -17.887 -9.772 -9.115 1.00 1.00 H new ATOM 769 N PHE A 46 -13.915 -4.543 -2.484 1.00 1.00 N ATOM 770 CA PHE A 46 -12.719 -3.778 -2.222 1.00 1.00 C ATOM 771 C PHE A 46 -11.759 -4.606 -1.382 1.00 1.00 C ATOM 772 O PHE A 46 -10.602 -4.749 -1.772 1.00 1.00 O ATOM 773 CB PHE A 46 -13.102 -2.428 -1.614 1.00 1.00 C ATOM 774 CG PHE A 46 -12.153 -1.916 -0.570 1.00 1.00 C ATOM 775 CD1 PHE A 46 -10.872 -1.531 -0.996 1.00 1.00 C ATOM 776 CD2 PHE A 46 -12.538 -1.781 0.783 1.00 1.00 C ATOM 777 CE1 PHE A 46 -9.964 -0.996 -0.082 1.00 1.00 C ATOM 778 CE2 PHE A 46 -11.665 -1.132 1.658 1.00 1.00 C ATOM 779 CZ PHE A 46 -10.368 -0.785 1.237 1.00 1.00 C ATOM 0 H PHE A 46 -14.768 -4.074 -2.180 1.00 1.00 H new ATOM 0 HA PHE A 46 -12.183 -3.548 -3.143 1.00 1.00 H new ATOM 0 HB2 PHE A 46 -13.171 -1.691 -2.414 1.00 1.00 H new ATOM 0 HB3 PHE A 46 -14.095 -2.513 -1.172 1.00 1.00 H new ATOM 0 HD1 PHE A 46 -10.589 -1.649 -2.032 1.00 1.00 H new ATOM 0 HD2 PHE A 46 -13.483 -2.170 1.131 1.00 1.00 H new ATOM 0 HE1 PHE A 46 -8.960 -0.748 -0.392 1.00 1.00 H new ATOM 0 HE2 PHE A 46 -11.986 -0.895 2.662 1.00 1.00 H new ATOM 0 HZ PHE A 46 -9.677 -0.350 1.943 1.00 1.00 H new ATOM 789 N GLN A 47 -12.238 -5.224 -0.299 1.00 1.00 N ATOM 790 CA GLN A 47 -11.411 -6.158 0.461 1.00 1.00 C ATOM 791 C GLN A 47 -10.999 -7.353 -0.400 1.00 1.00 C ATOM 792 O GLN A 47 -9.854 -7.776 -0.312 1.00 1.00 O ATOM 793 CB GLN A 47 -12.138 -6.612 1.731 1.00 1.00 C ATOM 794 CG GLN A 47 -12.133 -5.505 2.804 1.00 1.00 C ATOM 795 CD GLN A 47 -13.548 -5.029 3.082 1.00 1.00 C ATOM 796 OE1 GLN A 47 -14.497 -5.806 3.177 1.00 1.00 O ATOM 797 NE2 GLN A 47 -13.711 -3.738 3.301 1.00 1.00 N ATOM 0 H GLN A 47 -13.182 -5.096 0.066 1.00 1.00 H new ATOM 0 HA GLN A 47 -10.500 -5.640 0.761 1.00 1.00 H new ATOM 0 HB2 GLN A 47 -13.166 -6.881 1.488 1.00 1.00 H new ATOM 0 HB3 GLN A 47 -11.659 -7.507 2.127 1.00 1.00 H new ATOM 0 HG2 GLN A 47 -11.683 -5.882 3.722 1.00 1.00 H new ATOM 0 HG3 GLN A 47 -11.520 -4.668 2.469 1.00 1.00 H new ATOM 0 HE21 GLN A 47 -12.917 -3.103 3.219 1.00 1.00 H new ATOM 0 HE22 GLN A 47 -14.631 -3.375 3.552 1.00 1.00 H new ATOM 806 N ASN A 48 -11.881 -7.880 -1.255 1.00 1.00 N ATOM 807 CA ASN A 48 -11.544 -9.026 -2.103 1.00 1.00 C ATOM 808 C ASN A 48 -10.468 -8.684 -3.147 1.00 1.00 C ATOM 809 O ASN A 48 -9.572 -9.494 -3.358 1.00 1.00 O ATOM 810 CB ASN A 48 -12.792 -9.624 -2.781 1.00 1.00 C ATOM 811 CG ASN A 48 -13.739 -10.369 -1.839 1.00 1.00 C ATOM 812 OD1 ASN A 48 -13.936 -11.570 -1.971 1.00 1.00 O ATOM 813 ND2 ASN A 48 -14.387 -9.724 -0.887 1.00 1.00 N ATOM 0 H ASN A 48 -12.832 -7.532 -1.378 1.00 1.00 H new ATOM 0 HA ASN A 48 -11.126 -9.783 -1.440 1.00 1.00 H new ATOM 0 HB2 ASN A 48 -13.344 -8.820 -3.267 1.00 1.00 H new ATOM 0 HB3 ASN A 48 -12.469 -10.309 -3.565 1.00 1.00 H new ATOM 0 HD21 ASN A 48 -15.035 -10.227 -0.281 1.00 1.00 H new ATOM 0 HD22 ASN A 48 -14.239 -8.723 -0.758 1.00 1.00 H new ATOM 820 N ALA A 49 -10.493 -7.501 -3.767 1.00 1.00 N ATOM 821 CA ALA A 49 -9.469 -7.012 -4.692 1.00 1.00 C ATOM 822 C ALA A 49 -8.185 -6.690 -3.931 1.00 1.00 C ATOM 823 O ALA A 49 -7.089 -6.937 -4.429 1.00 1.00 O ATOM 824 CB ALA A 49 -9.987 -5.757 -5.421 1.00 1.00 C ATOM 0 H ALA A 49 -11.254 -6.835 -3.633 1.00 1.00 H new ATOM 0 HA ALA A 49 -9.251 -7.786 -5.428 1.00 1.00 H new ATOM 0 HB1 ALA A 49 -9.223 -5.395 -6.109 1.00 1.00 H new ATOM 0 HB2 ALA A 49 -10.889 -6.007 -5.979 1.00 1.00 H new ATOM 0 HB3 ALA A 49 -10.216 -4.981 -4.691 1.00 1.00 H new ATOM 830 N CYS A 50 -8.311 -6.177 -2.709 1.00 1.00 N ATOM 831 CA CYS A 50 -7.187 -6.071 -1.775 1.00 1.00 C ATOM 832 C CYS A 50 -6.651 -7.434 -1.311 1.00 1.00 C ATOM 833 O CYS A 50 -5.544 -7.492 -0.782 1.00 1.00 O ATOM 834 CB CYS A 50 -7.569 -5.181 -0.577 1.00 1.00 C ATOM 835 SG CYS A 50 -7.813 -3.474 -1.127 1.00 1.00 S ATOM 0 H CYS A 50 -9.192 -5.823 -2.337 1.00 1.00 H new ATOM 0 HA CYS A 50 -6.367 -5.601 -2.319 1.00 1.00 H new ATOM 0 HB2 CYS A 50 -8.481 -5.556 -0.111 1.00 1.00 H new ATOM 0 HB3 CYS A 50 -6.785 -5.219 0.180 1.00 1.00 H new ATOM 0 HG CYS A 50 -8.838 -2.962 -0.512 1.00 1.00 H new ATOM 841 N ARG A 51 -7.376 -8.536 -1.516 1.00 1.00 N ATOM 842 CA ARG A 51 -6.977 -9.889 -1.140 1.00 1.00 C ATOM 843 C ARG A 51 -6.430 -10.624 -2.355 1.00 1.00 C ATOM 844 O ARG A 51 -5.617 -11.533 -2.223 1.00 1.00 O ATOM 845 CB ARG A 51 -8.196 -10.616 -0.547 1.00 1.00 C ATOM 846 CG ARG A 51 -7.794 -11.959 0.054 1.00 1.00 C ATOM 847 CD ARG A 51 -8.968 -12.735 0.649 1.00 1.00 C ATOM 848 NE ARG A 51 -9.880 -13.197 -0.411 1.00 1.00 N ATOM 849 CZ ARG A 51 -11.149 -12.825 -0.587 1.00 1.00 C ATOM 850 NH1 ARG A 51 -11.698 -11.893 0.178 1.00 1.00 N ATOM 851 NH2 ARG A 51 -11.878 -13.366 -1.553 1.00 1.00 N ATOM 0 H ARG A 51 -8.291 -8.506 -1.966 1.00 1.00 H new ATOM 0 HA ARG A 51 -6.187 -9.857 -0.390 1.00 1.00 H new ATOM 0 HB2 ARG A 51 -8.657 -9.994 0.220 1.00 1.00 H new ATOM 0 HB3 ARG A 51 -8.945 -10.771 -1.324 1.00 1.00 H new ATOM 0 HG2 ARG A 51 -7.321 -12.566 -0.717 1.00 1.00 H new ATOM 0 HG3 ARG A 51 -7.048 -11.792 0.831 1.00 1.00 H new ATOM 0 HD2 ARG A 51 -8.596 -13.590 1.213 1.00 1.00 H new ATOM 0 HD3 ARG A 51 -9.510 -12.101 1.351 1.00 1.00 H new ATOM 0 HE ARG A 51 -9.503 -13.870 -1.079 1.00 1.00 H new ATOM 0 HH11 ARG A 51 -11.149 -11.449 0.914 1.00 1.00 H new ATOM 0 HH12 ARG A 51 -12.670 -11.620 0.031 1.00 1.00 H new ATOM 0 HH21 ARG A 51 -11.469 -14.071 -2.167 1.00 1.00 H new ATOM 0 HH22 ARG A 51 -12.848 -13.078 -1.683 1.00 1.00 H new ATOM 865 N ASP A 52 -6.855 -10.223 -3.549 1.00 1.00 N ATOM 866 CA ASP A 52 -6.433 -10.816 -4.808 1.00 1.00 C ATOM 867 C ASP A 52 -4.924 -10.739 -4.933 1.00 1.00 C ATOM 868 O ASP A 52 -4.282 -11.676 -5.419 1.00 1.00 O ATOM 869 CB ASP A 52 -7.128 -10.132 -5.988 1.00 1.00 C ATOM 870 CG ASP A 52 -7.504 -11.179 -7.032 1.00 1.00 C ATOM 871 OD1 ASP A 52 -6.634 -11.759 -7.716 1.00 1.00 O ATOM 872 OD2 ASP A 52 -8.714 -11.496 -7.090 1.00 1.00 O ATOM 0 H ASP A 52 -7.519 -9.458 -3.668 1.00 1.00 H new ATOM 0 HA ASP A 52 -6.724 -11.866 -4.822 1.00 1.00 H new ATOM 0 HB2 ASP A 52 -8.020 -9.608 -5.645 1.00 1.00 H new ATOM 0 HB3 ASP A 52 -6.469 -9.384 -6.428 1.00 1.00 H new ATOM 877 N GLY A 53 -4.339 -9.674 -4.387 1.00 1.00 N ATOM 878 CA GLY A 53 -2.901 -9.524 -4.335 1.00 1.00 C ATOM 879 C GLY A 53 -2.641 -8.050 -4.347 1.00 1.00 C ATOM 880 O GLY A 53 -3.200 -7.368 -3.490 1.00 1.00 O ATOM 0 H GLY A 53 -4.854 -8.898 -3.972 1.00 1.00 H new ATOM 0 HA2 GLY A 53 -2.493 -9.985 -3.436 1.00 1.00 H new ATOM 0 HA3 GLY A 53 -2.427 -10.011 -5.187 1.00 1.00 H new ATOM 884 N ARG A 54 -1.839 -7.562 -5.294 1.00 1.00 N ATOM 885 CA ARG A 54 -1.681 -6.132 -5.519 1.00 1.00 C ATOM 886 C ARG A 54 -3.041 -5.478 -5.752 1.00 1.00 C ATOM 887 O ARG A 54 -4.019 -6.135 -6.116 1.00 1.00 O ATOM 888 CB ARG A 54 -0.655 -5.868 -6.638 1.00 1.00 C ATOM 889 CG ARG A 54 -0.952 -6.422 -8.043 1.00 1.00 C ATOM 890 CD ARG A 54 -2.133 -5.767 -8.774 1.00 1.00 C ATOM 891 NE ARG A 54 -2.159 -4.296 -8.650 1.00 1.00 N ATOM 892 CZ ARG A 54 -1.725 -3.422 -9.567 1.00 1.00 C ATOM 893 NH1 ARG A 54 -0.989 -3.816 -10.599 1.00 1.00 N ATOM 894 NH2 ARG A 54 -2.017 -2.138 -9.431 1.00 1.00 N ATOM 0 H ARG A 54 -1.286 -8.146 -5.921 1.00 1.00 H new ATOM 0 HA ARG A 54 -1.270 -5.661 -4.626 1.00 1.00 H new ATOM 0 HB2 ARG A 54 -0.528 -4.789 -6.726 1.00 1.00 H new ATOM 0 HB3 ARG A 54 0.303 -6.276 -6.315 1.00 1.00 H new ATOM 0 HG2 ARG A 54 -0.058 -6.307 -8.656 1.00 1.00 H new ATOM 0 HG3 ARG A 54 -1.146 -7.491 -7.960 1.00 1.00 H new ATOM 0 HD2 ARG A 54 -2.090 -6.034 -9.830 1.00 1.00 H new ATOM 0 HD3 ARG A 54 -3.065 -6.174 -8.380 1.00 1.00 H new ATOM 0 HE ARG A 54 -2.543 -3.910 -7.787 1.00 1.00 H new ATOM 0 HH11 ARG A 54 -0.744 -4.801 -10.704 1.00 1.00 H new ATOM 0 HH12 ARG A 54 -0.668 -3.134 -11.287 1.00 1.00 H new ATOM 0 HH21 ARG A 54 -2.568 -1.822 -8.633 1.00 1.00 H new ATOM 0 HH22 ARG A 54 -1.691 -1.465 -10.124 1.00 1.00 H new ATOM 908 N SER A 55 -3.091 -4.161 -5.591 1.00 1.00 N ATOM 909 CA SER A 55 -4.327 -3.417 -5.844 1.00 1.00 C ATOM 910 C SER A 55 -3.961 -2.035 -6.381 1.00 1.00 C ATOM 911 O SER A 55 -2.827 -1.818 -6.804 1.00 1.00 O ATOM 912 CB SER A 55 -5.192 -3.365 -4.571 1.00 1.00 C ATOM 913 OG SER A 55 -6.474 -3.907 -4.813 1.00 1.00 O ATOM 0 H SER A 55 -2.302 -3.588 -5.290 1.00 1.00 H new ATOM 0 HA SER A 55 -4.934 -3.918 -6.598 1.00 1.00 H new ATOM 0 HB2 SER A 55 -4.703 -3.920 -3.771 1.00 1.00 H new ATOM 0 HB3 SER A 55 -5.286 -2.333 -4.232 1.00 1.00 H new ATOM 0 HG SER A 55 -6.428 -4.885 -4.777 1.00 1.00 H new ATOM 919 N GLU A 56 -4.914 -1.114 -6.443 1.00 1.00 N ATOM 920 CA GLU A 56 -4.716 0.186 -7.083 1.00 1.00 C ATOM 921 C GLU A 56 -5.405 1.278 -6.275 1.00 1.00 C ATOM 922 O GLU A 56 -6.626 1.280 -6.134 1.00 1.00 O ATOM 923 CB GLU A 56 -5.150 0.141 -8.555 1.00 1.00 C ATOM 924 CG GLU A 56 -4.476 1.286 -9.330 1.00 1.00 C ATOM 925 CD GLU A 56 -4.989 1.438 -10.764 1.00 1.00 C ATOM 926 OE1 GLU A 56 -5.447 0.449 -11.383 1.00 1.00 O ATOM 927 OE2 GLU A 56 -4.903 2.562 -11.318 1.00 1.00 O ATOM 0 H GLU A 56 -5.847 -1.244 -6.052 1.00 1.00 H new ATOM 0 HA GLU A 56 -3.654 0.432 -7.094 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -4.878 -0.818 -8.995 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -6.234 0.229 -8.627 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -4.637 2.221 -8.794 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -3.400 1.114 -9.354 1.00 1.00 H new ATOM 934 N ILE A 57 -4.620 2.165 -5.669 1.00 1.00 N ATOM 935 CA ILE A 57 -5.119 3.210 -4.777 1.00 1.00 C ATOM 936 C ILE A 57 -4.511 4.529 -5.263 1.00 1.00 C ATOM 937 O ILE A 57 -3.604 4.529 -6.080 1.00 1.00 O ATOM 938 CB ILE A 57 -4.867 2.808 -3.286 1.00 1.00 C ATOM 939 CG1 ILE A 57 -5.513 1.423 -3.000 1.00 1.00 C ATOM 940 CG2 ILE A 57 -5.397 3.857 -2.288 1.00 1.00 C ATOM 941 CD1 ILE A 57 -5.628 0.966 -1.535 1.00 1.00 C ATOM 0 H ILE A 57 -3.607 2.179 -5.785 1.00 1.00 H new ATOM 0 HA ILE A 57 -6.200 3.343 -4.807 1.00 1.00 H new ATOM 0 HB ILE A 57 -3.788 2.754 -3.143 1.00 1.00 H new ATOM 0 HG12 ILE A 57 -6.516 1.428 -3.427 1.00 1.00 H new ATOM 0 HG13 ILE A 57 -4.940 0.670 -3.540 1.00 1.00 H new ATOM 0 HG21 ILE A 57 -5.195 3.525 -1.270 1.00 1.00 H new ATOM 0 HG22 ILE A 57 -4.900 4.811 -2.464 1.00 1.00 H new ATOM 0 HG23 ILE A 57 -6.472 3.978 -2.423 1.00 1.00 H new ATOM 0 HD11 ILE A 57 -6.098 -0.017 -1.496 1.00 1.00 H new ATOM 0 HD12 ILE A 57 -4.634 0.910 -1.092 1.00 1.00 H new ATOM 0 HD13 ILE A 57 -6.234 1.680 -0.978 1.00 1.00 H new ATOM 953 N ALA A 58 -5.009 5.672 -4.823 1.00 1.00 N ATOM 954 CA ALA A 58 -4.420 6.969 -5.065 1.00 1.00 C ATOM 955 C ALA A 58 -4.371 7.749 -3.766 1.00 1.00 C ATOM 956 O ALA A 58 -5.062 7.431 -2.797 1.00 1.00 O ATOM 957 CB ALA A 58 -5.225 7.753 -6.107 1.00 1.00 C ATOM 0 H ALA A 58 -5.864 5.719 -4.269 1.00 1.00 H new ATOM 0 HA ALA A 58 -3.411 6.825 -5.451 1.00 1.00 H new ATOM 0 HB1 ALA A 58 -4.760 8.725 -6.270 1.00 1.00 H new ATOM 0 HB2 ALA A 58 -5.244 7.198 -7.045 1.00 1.00 H new ATOM 0 HB3 ALA A 58 -6.245 7.894 -5.748 1.00 1.00 H new ATOM 963 N PHE A 59 -3.598 8.828 -3.771 1.00 1.00 N ATOM 964 CA PHE A 59 -3.785 9.890 -2.802 1.00 1.00 C ATOM 965 C PHE A 59 -4.887 10.819 -3.282 1.00 1.00 C ATOM 966 O PHE A 59 -5.360 10.717 -4.416 1.00 1.00 O ATOM 967 CB PHE A 59 -2.438 10.598 -2.520 1.00 1.00 C ATOM 968 CG PHE A 59 -1.648 9.800 -1.527 1.00 1.00 C ATOM 969 CD1 PHE A 59 -1.023 8.624 -1.964 1.00 1.00 C ATOM 970 CD2 PHE A 59 -1.630 10.167 -0.170 1.00 1.00 C ATOM 971 CE1 PHE A 59 -0.444 7.765 -1.009 1.00 1.00 C ATOM 972 CE2 PHE A 59 -1.036 9.314 0.769 1.00 1.00 C ATOM 973 CZ PHE A 59 -0.476 8.093 0.357 1.00 1.00 C ATOM 0 H PHE A 59 -2.840 8.987 -4.434 1.00 1.00 H new ATOM 0 HA PHE A 59 -4.112 9.488 -1.843 1.00 1.00 H new ATOM 0 HB2 PHE A 59 -1.873 10.708 -3.445 1.00 1.00 H new ATOM 0 HB3 PHE A 59 -2.617 11.602 -2.135 1.00 1.00 H new ATOM 0 HD1 PHE A 59 -0.986 8.380 -3.015 1.00 1.00 H new ATOM 0 HD2 PHE A 59 -2.071 11.101 0.146 1.00 1.00 H new ATOM 0 HE1 PHE A 59 0.028 6.848 -1.329 1.00 1.00 H new ATOM 0 HE2 PHE A 59 -1.008 9.595 1.811 1.00 1.00 H new ATOM 0 HZ PHE A 59 -0.071 7.409 1.088 1.00 1.00 H new ATOM 983 N VAL A 60 -5.280 11.738 -2.410 1.00 1.00 N ATOM 984 CA VAL A 60 -6.187 12.835 -2.715 1.00 1.00 C ATOM 985 C VAL A 60 -5.435 14.162 -2.616 1.00 1.00 C ATOM 986 O VAL A 60 -5.664 15.039 -3.444 1.00 1.00 O ATOM 987 CB VAL A 60 -7.411 12.734 -1.785 1.00 1.00 C ATOM 988 CG1 VAL A 60 -8.250 14.007 -1.747 1.00 1.00 C ATOM 989 CG2 VAL A 60 -8.294 11.559 -2.220 1.00 1.00 C ATOM 0 H VAL A 60 -4.966 11.740 -1.440 1.00 1.00 H new ATOM 0 HA VAL A 60 -6.560 12.778 -3.737 1.00 1.00 H new ATOM 0 HB VAL A 60 -7.024 12.578 -0.778 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.095 13.866 -1.073 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.638 14.836 -1.392 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -8.618 14.230 -2.748 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -9.159 11.490 -1.560 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -8.631 11.717 -3.245 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -7.721 10.633 -2.165 1.00 1.00 H new ATOM 999 N ALA A 61 -4.489 14.281 -1.673 1.00 1.00 N ATOM 1000 CA ALA A 61 -3.736 15.493 -1.400 1.00 1.00 C ATOM 1001 C ALA A 61 -3.076 15.992 -2.681 1.00 1.00 C ATOM 1002 O ALA A 61 -3.459 17.038 -3.193 1.00 1.00 O ATOM 1003 CB ALA A 61 -2.725 15.240 -0.276 1.00 1.00 C ATOM 0 H ALA A 61 -4.226 13.506 -1.065 1.00 1.00 H new ATOM 0 HA ALA A 61 -4.408 16.279 -1.055 1.00 1.00 H new ATOM 0 HB1 ALA A 61 -2.165 16.154 -0.078 1.00 1.00 H new ATOM 0 HB2 ALA A 61 -3.254 14.935 0.627 1.00 1.00 H new ATOM 0 HB3 ALA A 61 -2.036 14.450 -0.577 1.00 1.00 H new ATOM 1009 N THR A 62 -2.146 15.206 -3.222 1.00 1.00 N ATOM 1010 CA THR A 62 -1.556 15.428 -4.535 1.00 1.00 C ATOM 1011 C THR A 62 -2.249 14.556 -5.604 1.00 1.00 C ATOM 1012 O THR A 62 -2.050 14.764 -6.800 1.00 1.00 O ATOM 1013 CB THR A 62 -0.044 15.188 -4.406 1.00 1.00 C ATOM 1014 OG1 THR A 62 0.585 16.197 -3.633 1.00 1.00 O ATOM 1015 CG2 THR A 62 0.681 15.208 -5.745 1.00 1.00 C ATOM 0 H THR A 62 -1.777 14.382 -2.748 1.00 1.00 H new ATOM 0 HA THR A 62 -1.708 16.451 -4.878 1.00 1.00 H new ATOM 0 HB THR A 62 0.028 14.205 -3.940 1.00 1.00 H new ATOM 0 HG1 THR A 62 0.931 15.806 -2.804 1.00 1.00 H new ATOM 0 HG21 THR A 62 1.745 15.033 -5.585 1.00 1.00 H new ATOM 0 HG22 THR A 62 0.277 14.427 -6.389 1.00 1.00 H new ATOM 0 HG23 THR A 62 0.541 16.179 -6.220 1.00 1.00 H new ATOM 1023 N GLY A 63 -3.099 13.600 -5.209 1.00 1.00 N ATOM 1024 CA GLY A 63 -3.929 12.865 -6.164 1.00 1.00 C ATOM 1025 C GLY A 63 -3.218 11.660 -6.791 1.00 1.00 C ATOM 1026 O GLY A 63 -3.567 11.260 -7.903 1.00 1.00 O ATOM 0 H GLY A 63 -3.228 13.320 -4.237 1.00 1.00 H new ATOM 0 HA2 GLY A 63 -4.832 12.522 -5.660 1.00 1.00 H new ATOM 0 HA3 GLY A 63 -4.245 13.543 -6.957 1.00 1.00 H new ATOM 1030 N THR A 64 -2.209 11.096 -6.124 1.00 1.00 N ATOM 1031 CA THR A 64 -1.171 10.278 -6.705 1.00 1.00 C ATOM 1032 C THR A 64 -1.654 8.841 -6.827 1.00 1.00 C ATOM 1033 O THR A 64 -1.582 8.089 -5.856 1.00 1.00 O ATOM 1034 CB THR A 64 0.070 10.383 -5.803 1.00 1.00 C ATOM 1035 OG1 THR A 64 0.289 11.724 -5.397 1.00 1.00 O ATOM 1036 CG2 THR A 64 1.317 9.834 -6.492 1.00 1.00 C ATOM 0 H THR A 64 -2.099 11.210 -5.116 1.00 1.00 H new ATOM 0 HA THR A 64 -0.918 10.620 -7.708 1.00 1.00 H new ATOM 0 HB THR A 64 -0.123 9.774 -4.920 1.00 1.00 H new ATOM 0 HG1 THR A 64 1.163 11.795 -4.959 1.00 1.00 H new ATOM 0 HG21 THR A 64 2.173 9.926 -5.823 1.00 1.00 H new ATOM 0 HG22 THR A 64 1.162 8.784 -6.742 1.00 1.00 H new ATOM 0 HG23 THR A 64 1.507 10.400 -7.404 1.00 1.00 H new ATOM 1044 N ASN A 65 -2.196 8.497 -7.990 1.00 1.00 N ATOM 1045 CA ASN A 65 -2.506 7.131 -8.401 1.00 1.00 C ATOM 1046 C ASN A 65 -1.270 6.235 -8.286 1.00 1.00 C ATOM 1047 O ASN A 65 -0.175 6.604 -8.711 1.00 1.00 O ATOM 1048 CB ASN A 65 -3.093 7.073 -9.812 1.00 1.00 C ATOM 1049 CG ASN A 65 -3.254 5.629 -10.256 1.00 1.00 C ATOM 1050 OD1 ASN A 65 -2.432 5.104 -10.996 1.00 1.00 O ATOM 1051 ND2 ASN A 65 -4.306 4.960 -9.838 1.00 1.00 N ATOM 0 H ASN A 65 -2.441 9.187 -8.700 1.00 1.00 H new ATOM 0 HA ASN A 65 -3.270 6.755 -7.721 1.00 1.00 H new ATOM 0 HB2 ASN A 65 -4.059 7.577 -9.832 1.00 1.00 H new ATOM 0 HB3 ASN A 65 -2.442 7.604 -10.506 1.00 1.00 H new ATOM 0 HD21 ASN A 65 -4.444 3.993 -10.130 1.00 1.00 H new ATOM 0 HD22 ASN A 65 -4.984 5.409 -9.222 1.00 1.00 H new ATOM 1058 N LEU A 66 -1.435 5.117 -7.589 1.00 1.00 N ATOM 1059 CA LEU A 66 -0.399 4.301 -7.005 1.00 1.00 C ATOM 1060 C LEU A 66 -0.858 2.842 -7.054 1.00 1.00 C ATOM 1061 O LEU A 66 -1.865 2.463 -6.455 1.00 1.00 O ATOM 1062 CB LEU A 66 -0.199 4.885 -5.608 1.00 1.00 C ATOM 1063 CG LEU A 66 0.927 4.250 -4.801 1.00 1.00 C ATOM 1064 CD1 LEU A 66 1.230 5.200 -3.650 1.00 1.00 C ATOM 1065 CD2 LEU A 66 0.508 2.884 -4.277 1.00 1.00 C ATOM 0 H LEU A 66 -2.365 4.738 -7.410 1.00 1.00 H new ATOM 0 HA LEU A 66 0.561 4.307 -7.522 1.00 1.00 H new ATOM 0 HB2 LEU A 66 -0.001 5.953 -5.702 1.00 1.00 H new ATOM 0 HB3 LEU A 66 -1.130 4.781 -5.050 1.00 1.00 H new ATOM 0 HG LEU A 66 1.811 4.095 -5.420 1.00 1.00 H new ATOM 0 HD11 LEU A 66 2.034 4.788 -3.040 1.00 1.00 H new ATOM 0 HD12 LEU A 66 1.536 6.168 -4.048 1.00 1.00 H new ATOM 0 HD13 LEU A 66 0.337 5.326 -3.037 1.00 1.00 H new ATOM 0 HD21 LEU A 66 1.326 2.448 -3.704 1.00 1.00 H new ATOM 0 HD22 LEU A 66 -0.367 2.993 -3.636 1.00 1.00 H new ATOM 0 HD23 LEU A 66 0.264 2.232 -5.116 1.00 1.00 H new ATOM 1077 N SER A 67 -0.119 1.986 -7.742 1.00 1.00 N ATOM 1078 CA SER A 67 -0.382 0.559 -7.709 1.00 1.00 C ATOM 1079 C SER A 67 0.179 0.025 -6.397 1.00 1.00 C ATOM 1080 O SER A 67 1.399 0.018 -6.201 1.00 1.00 O ATOM 1081 CB SER A 67 0.257 -0.108 -8.921 1.00 1.00 C ATOM 1082 OG SER A 67 -0.507 0.196 -10.078 1.00 1.00 O ATOM 0 H SER A 67 0.669 2.257 -8.331 1.00 1.00 H new ATOM 0 HA SER A 67 -1.450 0.344 -7.756 1.00 1.00 H new ATOM 0 HB2 SER A 67 1.282 0.242 -9.045 1.00 1.00 H new ATOM 0 HB3 SER A 67 0.304 -1.187 -8.775 1.00 1.00 H new ATOM 0 HG SER A 67 -0.099 -0.230 -10.861 1.00 1.00 H new ATOM 1088 N LEU A 68 -0.712 -0.312 -5.462 1.00 1.00 N ATOM 1089 CA LEU A 68 -0.343 -0.845 -4.162 1.00 1.00 C ATOM 1090 C LEU A 68 0.008 -2.309 -4.324 1.00 1.00 C ATOM 1091 O LEU A 68 -0.556 -2.981 -5.183 1.00 1.00 O ATOM 1092 CB LEU A 68 -1.500 -0.742 -3.160 1.00 1.00 C ATOM 1093 CG LEU A 68 -1.306 0.319 -2.070 1.00 1.00 C ATOM 1094 CD1 LEU A 68 -2.356 0.044 -1.000 1.00 1.00 C ATOM 1095 CD2 LEU A 68 0.085 0.322 -1.429 1.00 1.00 C ATOM 0 H LEU A 68 -1.719 -0.219 -5.594 1.00 1.00 H new ATOM 0 HA LEU A 68 0.500 -0.267 -3.783 1.00 1.00 H new ATOM 0 HB2 LEU A 68 -2.417 -0.521 -3.705 1.00 1.00 H new ATOM 0 HB3 LEU A 68 -1.639 -1.713 -2.684 1.00 1.00 H new ATOM 0 HG LEU A 68 -1.411 1.301 -2.532 1.00 1.00 H new ATOM 0 HD11 LEU A 68 -2.259 0.776 -0.198 1.00 1.00 H new ATOM 0 HD12 LEU A 68 -3.351 0.117 -1.439 1.00 1.00 H new ATOM 0 HD13 LEU A 68 -2.210 -0.958 -0.596 1.00 1.00 H new ATOM 0 HD21 LEU A 68 0.134 1.103 -0.670 1.00 1.00 H new ATOM 0 HD22 LEU A 68 0.274 -0.647 -0.966 1.00 1.00 H new ATOM 0 HD23 LEU A 68 0.838 0.512 -2.194 1.00 1.00 H new ATOM 1107 N GLN A 69 0.878 -2.830 -3.466 1.00 1.00 N ATOM 1108 CA GLN A 69 1.605 -4.040 -3.783 1.00 1.00 C ATOM 1109 C GLN A 69 1.597 -4.929 -2.537 1.00 1.00 C ATOM 1110 O GLN A 69 2.386 -4.726 -1.618 1.00 1.00 O ATOM 1111 CB GLN A 69 3.036 -3.657 -4.238 1.00 1.00 C ATOM 1112 CG GLN A 69 3.131 -2.442 -5.183 1.00 1.00 C ATOM 1113 CD GLN A 69 4.561 -2.029 -5.531 1.00 1.00 C ATOM 1114 OE1 GLN A 69 5.529 -2.729 -5.249 1.00 1.00 O ATOM 1115 NE2 GLN A 69 4.723 -0.871 -6.152 1.00 1.00 N ATOM 0 H GLN A 69 1.092 -2.431 -2.552 1.00 1.00 H new ATOM 0 HA GLN A 69 1.146 -4.596 -4.600 1.00 1.00 H new ATOM 0 HB2 GLN A 69 3.638 -3.454 -3.352 1.00 1.00 H new ATOM 0 HB3 GLN A 69 3.482 -4.518 -4.736 1.00 1.00 H new ATOM 0 HG2 GLN A 69 2.596 -2.670 -6.105 1.00 1.00 H new ATOM 0 HG3 GLN A 69 2.623 -1.596 -4.721 1.00 1.00 H new ATOM 0 HE21 GLN A 69 3.911 -0.297 -6.381 1.00 1.00 H new ATOM 0 HE22 GLN A 69 5.659 -0.552 -6.401 1.00 1.00 H new ATOM 1124 N PHE A 70 0.674 -5.888 -2.458 1.00 1.00 N ATOM 1125 CA PHE A 70 0.537 -6.734 -1.276 1.00 1.00 C ATOM 1126 C PHE A 70 1.420 -7.975 -1.464 1.00 1.00 C ATOM 1127 O PHE A 70 0.959 -9.104 -1.646 1.00 1.00 O ATOM 1128 CB PHE A 70 -0.943 -6.984 -0.968 1.00 1.00 C ATOM 1129 CG PHE A 70 -1.714 -5.703 -0.656 1.00 1.00 C ATOM 1130 CD1 PHE A 70 -1.791 -5.169 0.643 1.00 1.00 C ATOM 1131 CD2 PHE A 70 -2.332 -5.005 -1.701 1.00 1.00 C ATOM 1132 CE1 PHE A 70 -2.528 -3.993 0.883 1.00 1.00 C ATOM 1133 CE2 PHE A 70 -3.016 -3.800 -1.486 1.00 1.00 C ATOM 1134 CZ PHE A 70 -3.148 -3.307 -0.177 1.00 1.00 C ATOM 0 H PHE A 70 0.009 -6.097 -3.202 1.00 1.00 H new ATOM 0 HA PHE A 70 0.904 -6.249 -0.372 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -1.406 -7.482 -1.820 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -1.022 -7.664 -0.120 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -1.283 -5.662 1.459 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -2.280 -5.407 -2.702 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -2.618 -3.614 1.890 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -3.437 -3.256 -2.319 1.00 1.00 H new ATOM 0 HZ PHE A 70 -3.720 -2.411 0.013 1.00 1.00 H new ATOM 1144 N PHE A 71 2.721 -7.705 -1.423 1.00 1.00 N ATOM 1145 CA PHE A 71 3.894 -8.561 -1.465 1.00 1.00 C ATOM 1146 C PHE A 71 4.700 -8.429 -0.154 1.00 1.00 C ATOM 1147 O PHE A 71 5.586 -7.579 -0.008 1.00 1.00 O ATOM 1148 CB PHE A 71 4.601 -8.336 -2.812 1.00 1.00 C ATOM 1149 CG PHE A 71 5.684 -7.291 -2.816 1.00 1.00 C ATOM 1150 CD1 PHE A 71 5.310 -5.939 -2.876 1.00 1.00 C ATOM 1151 CD2 PHE A 71 7.034 -7.633 -2.730 1.00 1.00 C ATOM 1152 CE1 PHE A 71 6.279 -4.928 -2.849 1.00 1.00 C ATOM 1153 CE2 PHE A 71 8.011 -6.634 -2.796 1.00 1.00 C ATOM 1154 CZ PHE A 71 7.631 -5.285 -2.815 1.00 1.00 C ATOM 0 H PHE A 71 3.014 -6.731 -1.348 1.00 1.00 H new ATOM 0 HA PHE A 71 3.668 -9.627 -1.467 1.00 1.00 H new ATOM 0 HB2 PHE A 71 5.034 -9.282 -3.136 1.00 1.00 H new ATOM 0 HB3 PHE A 71 3.851 -8.058 -3.553 1.00 1.00 H new ATOM 0 HD1 PHE A 71 4.265 -5.676 -2.944 1.00 1.00 H new ATOM 0 HD2 PHE A 71 7.324 -8.667 -2.613 1.00 1.00 H new ATOM 0 HE1 PHE A 71 5.987 -3.888 -2.854 1.00 1.00 H new ATOM 0 HE2 PHE A 71 9.057 -6.902 -2.832 1.00 1.00 H new ATOM 0 HZ PHE A 71 8.388 -4.515 -2.803 1.00 1.00 H new ATOM 1164 N PRO A 72 4.325 -9.193 0.889 1.00 1.00 N ATOM 1165 CA PRO A 72 5.143 -9.306 2.086 1.00 1.00 C ATOM 1166 C PRO A 72 6.482 -9.952 1.722 1.00 1.00 C ATOM 1167 O PRO A 72 6.649 -10.462 0.612 1.00 1.00 O ATOM 1168 CB PRO A 72 4.349 -10.178 3.066 1.00 1.00 C ATOM 1169 CG PRO A 72 2.952 -10.308 2.461 1.00 1.00 C ATOM 1170 CD PRO A 72 3.173 -10.075 0.974 1.00 1.00 C ATOM 0 HA PRO A 72 5.361 -8.337 2.534 1.00 1.00 H new ATOM 0 HB2 PRO A 72 4.816 -11.155 3.188 1.00 1.00 H new ATOM 0 HB3 PRO A 72 4.307 -9.719 4.054 1.00 1.00 H new ATOM 0 HG2 PRO A 72 2.524 -11.292 2.652 1.00 1.00 H new ATOM 0 HG3 PRO A 72 2.265 -9.575 2.882 1.00 1.00 H new ATOM 0 HD2 PRO A 72 3.358 -11.014 0.452 1.00 1.00 H new ATOM 0 HD3 PRO A 72 2.296 -9.621 0.513 1.00 1.00 H new ATOM 1178 N ALA A 73 7.412 -10.015 2.676 1.00 1.00 N ATOM 1179 CA ALA A 73 8.561 -10.902 2.517 1.00 1.00 C ATOM 1180 C ALA A 73 8.085 -12.352 2.332 1.00 1.00 C ATOM 1181 O ALA A 73 8.680 -13.098 1.556 1.00 1.00 O ATOM 1182 CB ALA A 73 9.505 -10.759 3.708 1.00 1.00 C ATOM 0 H ALA A 73 7.394 -9.478 3.543 1.00 1.00 H new ATOM 0 HA ALA A 73 9.117 -10.620 1.623 1.00 1.00 H new ATOM 0 HB1 ALA A 73 10.358 -11.425 3.578 1.00 1.00 H new ATOM 0 HB2 ALA A 73 9.856 -9.729 3.773 1.00 1.00 H new ATOM 0 HB3 ALA A 73 8.976 -11.021 4.625 1.00 1.00 H new ATOM 1188 N SER A 74 6.984 -12.737 2.982 1.00 1.00 N ATOM 1189 CA SER A 74 6.213 -13.930 2.664 1.00 1.00 C ATOM 1190 C SER A 74 5.321 -13.640 1.442 1.00 1.00 C ATOM 1191 O SER A 74 4.182 -13.193 1.602 1.00 1.00 O ATOM 1192 CB SER A 74 5.380 -14.329 3.894 1.00 1.00 C ATOM 1193 OG SER A 74 6.181 -14.389 5.066 1.00 1.00 O ATOM 0 H SER A 74 6.598 -12.209 3.765 1.00 1.00 H new ATOM 0 HA SER A 74 6.870 -14.763 2.414 1.00 1.00 H new ATOM 0 HB2 SER A 74 4.574 -13.609 4.039 1.00 1.00 H new ATOM 0 HB3 SER A 74 4.914 -15.299 3.720 1.00 1.00 H new ATOM 0 HG SER A 74 5.623 -14.643 5.831 1.00 1.00 H new ATOM 1199 N TRP A 75 5.823 -13.814 0.213 1.00 1.00 N ATOM 1200 CA TRP A 75 5.048 -13.480 -0.977 1.00 1.00 C ATOM 1201 C TRP A 75 3.816 -14.377 -1.071 1.00 1.00 C ATOM 1202 O TRP A 75 3.888 -15.586 -0.839 1.00 1.00 O ATOM 1203 CB TRP A 75 5.880 -13.621 -2.247 1.00 1.00 C ATOM 1204 CG TRP A 75 6.905 -12.558 -2.485 1.00 1.00 C ATOM 1205 CD1 TRP A 75 7.933 -12.238 -1.672 1.00 1.00 C ATOM 1206 CD2 TRP A 75 6.984 -11.617 -3.589 1.00 1.00 C ATOM 1207 NE1 TRP A 75 8.680 -11.219 -2.222 1.00 1.00 N ATOM 1208 CE2 TRP A 75 8.165 -10.832 -3.443 1.00 1.00 C ATOM 1209 CE3 TRP A 75 6.150 -11.337 -4.688 1.00 1.00 C ATOM 1210 CZ2 TRP A 75 8.512 -9.845 -4.379 1.00 1.00 C ATOM 1211 CZ3 TRP A 75 6.483 -10.330 -5.615 1.00 1.00 C ATOM 1212 CH2 TRP A 75 7.671 -9.597 -5.473 1.00 1.00 C ATOM 0 H TRP A 75 6.755 -14.181 0.023 1.00 1.00 H new ATOM 0 HA TRP A 75 4.739 -12.439 -0.887 1.00 1.00 H new ATOM 0 HB2 TRP A 75 6.387 -14.586 -2.220 1.00 1.00 H new ATOM 0 HB3 TRP A 75 5.202 -13.641 -3.100 1.00 1.00 H new ATOM 0 HD1 TRP A 75 8.141 -12.713 -0.725 1.00 1.00 H new ATOM 0 HE1 TRP A 75 9.504 -10.806 -1.785 1.00 1.00 H new ATOM 0 HE3 TRP A 75 5.240 -11.903 -4.823 1.00 1.00 H new ATOM 0 HZ2 TRP A 75 9.424 -9.279 -4.257 1.00 1.00 H new ATOM 0 HZ3 TRP A 75 5.819 -10.121 -6.441 1.00 1.00 H new ATOM 0 HH2 TRP A 75 7.936 -8.846 -6.202 1.00 1.00 H new ATOM 1223 N GLN A 76 2.697 -13.759 -1.439 1.00 1.00 N ATOM 1224 CA GLN A 76 1.379 -14.374 -1.517 1.00 1.00 C ATOM 1225 C GLN A 76 1.279 -15.203 -2.807 1.00 1.00 C ATOM 1226 O GLN A 76 1.553 -16.403 -2.784 1.00 1.00 O ATOM 1227 CB GLN A 76 0.308 -13.302 -1.349 1.00 1.00 C ATOM 1228 CG GLN A 76 0.344 -12.744 0.086 1.00 1.00 C ATOM 1229 CD GLN A 76 -0.865 -11.862 0.314 1.00 1.00 C ATOM 1230 OE1 GLN A 76 -1.749 -12.177 1.107 1.00 1.00 O ATOM 1231 NE2 GLN A 76 -0.981 -10.794 -0.445 1.00 1.00 N ATOM 0 H GLN A 76 2.686 -12.774 -1.702 1.00 1.00 H new ATOM 0 HA GLN A 76 1.214 -15.080 -0.703 1.00 1.00 H new ATOM 0 HB2 GLN A 76 0.472 -12.497 -2.066 1.00 1.00 H new ATOM 0 HB3 GLN A 76 -0.675 -13.722 -1.560 1.00 1.00 H new ATOM 0 HG2 GLN A 76 0.352 -13.562 0.806 1.00 1.00 H new ATOM 0 HG3 GLN A 76 1.259 -12.173 0.243 1.00 1.00 H new ATOM 0 HE21 GLN A 76 -0.236 -10.549 -1.097 1.00 1.00 H new ATOM 0 HE22 GLN A 76 -1.816 -10.211 -0.381 1.00 1.00 H new ATOM 1240 N GLY A 77 0.934 -14.564 -3.931 1.00 1.00 N ATOM 1241 CA GLY A 77 0.956 -15.120 -5.272 1.00 1.00 C ATOM 1242 C GLY A 77 -0.264 -14.598 -6.011 1.00 1.00 C ATOM 1243 O GLY A 77 -0.193 -13.622 -6.764 1.00 1.00 O ATOM 0 H GLY A 77 0.617 -13.595 -3.919 1.00 1.00 H new ATOM 0 HA2 GLY A 77 1.870 -14.830 -5.791 1.00 1.00 H new ATOM 0 HA3 GLY A 77 0.943 -16.209 -5.234 1.00 1.00 H new ATOM 1247 N GLU A 78 -1.401 -15.203 -5.699 1.00 1.00 N ATOM 1248 CA GLU A 78 -2.763 -14.854 -6.093 1.00 1.00 C ATOM 1249 C GLU A 78 -3.634 -15.091 -4.853 1.00 1.00 C ATOM 1250 O GLU A 78 -3.201 -15.832 -3.970 1.00 1.00 O ATOM 1251 CB GLU A 78 -3.248 -15.760 -7.242 1.00 1.00 C ATOM 1252 CG GLU A 78 -4.419 -15.126 -8.012 1.00 1.00 C ATOM 1253 CD GLU A 78 -5.439 -16.158 -8.500 1.00 1.00 C ATOM 1254 OE1 GLU A 78 -5.106 -17.035 -9.328 1.00 1.00 O ATOM 1255 OE2 GLU A 78 -6.625 -16.052 -8.102 1.00 1.00 O ATOM 0 H GLU A 78 -1.395 -16.032 -5.105 1.00 1.00 H new ATOM 0 HA GLU A 78 -2.816 -13.823 -6.443 1.00 1.00 H new ATOM 0 HB2 GLU A 78 -2.423 -15.951 -7.928 1.00 1.00 H new ATOM 0 HB3 GLU A 78 -3.557 -16.724 -6.839 1.00 1.00 H new ATOM 0 HG2 GLU A 78 -4.921 -14.403 -7.369 1.00 1.00 H new ATOM 0 HG3 GLU A 78 -4.029 -14.575 -8.868 1.00 1.00 H new ATOM 1262 N GLN A 79 -4.813 -14.460 -4.773 1.00 1.00 N ATOM 1263 CA GLN A 79 -5.862 -14.646 -3.762 1.00 1.00 C ATOM 1264 C GLN A 79 -5.317 -14.976 -2.367 1.00 1.00 C ATOM 1265 O GLN A 79 -5.713 -15.941 -1.715 1.00 1.00 O ATOM 1266 CB GLN A 79 -6.947 -15.593 -4.290 1.00 1.00 C ATOM 1267 CG GLN A 79 -8.007 -14.776 -5.048 1.00 1.00 C ATOM 1268 CD GLN A 79 -8.806 -13.841 -4.132 1.00 1.00 C ATOM 1269 OE1 GLN A 79 -9.078 -14.156 -2.975 1.00 1.00 O ATOM 1270 NE2 GLN A 79 -9.201 -12.671 -4.598 1.00 1.00 N ATOM 0 H GLN A 79 -5.077 -13.756 -5.462 1.00 1.00 H new ATOM 0 HA GLN A 79 -6.354 -13.688 -3.595 1.00 1.00 H new ATOM 0 HB2 GLN A 79 -6.505 -16.339 -4.950 1.00 1.00 H new ATOM 0 HB3 GLN A 79 -7.409 -16.133 -3.463 1.00 1.00 H new ATOM 0 HG2 GLN A 79 -7.518 -14.186 -5.824 1.00 1.00 H new ATOM 0 HG3 GLN A 79 -8.693 -15.458 -5.551 1.00 1.00 H new ATOM 0 HE21 GLN A 79 -8.979 -12.403 -5.557 1.00 1.00 H new ATOM 0 HE22 GLN A 79 -9.728 -12.035 -3.999 1.00 1.00 H new ATOM 1279 N ARG A 80 -4.444 -14.077 -1.912 1.00 1.00 N ATOM 1280 CA ARG A 80 -3.707 -14.051 -0.658 1.00 1.00 C ATOM 1281 C ARG A 80 -3.018 -15.344 -0.254 1.00 1.00 C ATOM 1282 O ARG A 80 -3.002 -16.340 -0.967 1.00 1.00 O ATOM 1283 CB ARG A 80 -4.630 -13.574 0.474 1.00 1.00 C ATOM 1284 CG ARG A 80 -5.641 -14.593 1.052 1.00 1.00 C ATOM 1285 CD ARG A 80 -5.908 -14.409 2.557 1.00 1.00 C ATOM 1286 NE ARG A 80 -5.823 -13.005 2.995 1.00 1.00 N ATOM 1287 CZ ARG A 80 -6.237 -12.503 4.165 1.00 1.00 C ATOM 1288 NH1 ARG A 80 -6.770 -13.269 5.108 1.00 1.00 N ATOM 1289 NH2 ARG A 80 -6.083 -11.205 4.366 1.00 1.00 N ATOM 0 H ARG A 80 -4.214 -13.261 -2.480 1.00 1.00 H new ATOM 0 HA ARG A 80 -2.889 -13.353 -0.834 1.00 1.00 H new ATOM 0 HB2 ARG A 80 -4.003 -13.222 1.293 1.00 1.00 H new ATOM 0 HB3 ARG A 80 -5.191 -12.714 0.110 1.00 1.00 H new ATOM 0 HG2 ARG A 80 -6.583 -14.505 0.511 1.00 1.00 H new ATOM 0 HG3 ARG A 80 -5.267 -15.602 0.878 1.00 1.00 H new ATOM 0 HD2 ARG A 80 -6.899 -14.797 2.794 1.00 1.00 H new ATOM 0 HD3 ARG A 80 -5.190 -15.003 3.122 1.00 1.00 H new ATOM 0 HE ARG A 80 -5.405 -12.346 2.338 1.00 1.00 H new ATOM 0 HH11 ARG A 80 -6.874 -14.272 4.952 1.00 1.00 H new ATOM 0 HH12 ARG A 80 -7.076 -12.855 5.989 1.00 1.00 H new ATOM 0 HH21 ARG A 80 -5.661 -10.623 3.642 1.00 1.00 H new ATOM 0 HH22 ARG A 80 -6.386 -10.786 5.245 1.00 1.00 H new ATOM 1303 N GLN A 81 -2.420 -15.291 0.933 1.00 1.00 N ATOM 1304 CA GLN A 81 -2.125 -16.479 1.695 1.00 1.00 C ATOM 1305 C GLN A 81 -2.179 -16.095 3.166 1.00 1.00 C ATOM 1306 O GLN A 81 -3.108 -16.486 3.873 1.00 1.00 O ATOM 1307 CB GLN A 81 -0.812 -17.152 1.260 1.00 1.00 C ATOM 1308 CG GLN A 81 -0.747 -18.621 1.709 1.00 1.00 C ATOM 1309 CD GLN A 81 -1.722 -19.517 0.936 1.00 1.00 C ATOM 1310 OE1 GLN A 81 -2.940 -19.381 1.026 1.00 1.00 O ATOM 1311 NE2 GLN A 81 -1.227 -20.447 0.146 1.00 1.00 N ATOM 0 H GLN A 81 -2.131 -14.423 1.384 1.00 1.00 H new ATOM 0 HA GLN A 81 -2.869 -17.253 1.506 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -0.718 -17.099 0.175 1.00 1.00 H new ATOM 0 HB3 GLN A 81 0.033 -16.606 1.680 1.00 1.00 H new ATOM 0 HG2 GLN A 81 0.268 -18.994 1.574 1.00 1.00 H new ATOM 0 HG3 GLN A 81 -0.970 -18.682 2.774 1.00 1.00 H new ATOM 0 HE21 GLN A 81 -0.217 -20.565 0.067 1.00 1.00 H new ATOM 0 HE22 GLN A 81 -1.854 -21.050 -0.387 1.00 1.00 H new ATOM 1320 N THR A 82 -1.232 -15.269 3.601 1.00 1.00 N ATOM 1321 CA THR A 82 -1.013 -14.934 4.999 1.00 1.00 C ATOM 1322 C THR A 82 -0.389 -13.535 5.068 1.00 1.00 C ATOM 1323 O THR A 82 0.828 -13.408 5.176 1.00 1.00 O ATOM 1324 CB THR A 82 -0.117 -16.015 5.635 1.00 1.00 C ATOM 1325 OG1 THR A 82 -0.687 -17.296 5.434 1.00 1.00 O ATOM 1326 CG2 THR A 82 0.076 -15.816 7.139 1.00 1.00 C ATOM 0 H THR A 82 -0.579 -14.803 2.971 1.00 1.00 H new ATOM 0 HA THR A 82 -1.947 -14.912 5.561 1.00 1.00 H new ATOM 0 HB THR A 82 0.855 -15.932 5.149 1.00 1.00 H new ATOM 0 HG1 THR A 82 -0.111 -17.978 5.839 1.00 1.00 H new ATOM 0 HG21 THR A 82 0.715 -16.607 7.532 1.00 1.00 H new ATOM 0 HG22 THR A 82 0.543 -14.848 7.321 1.00 1.00 H new ATOM 0 HG23 THR A 82 -0.892 -15.851 7.638 1.00 1.00 H new ATOM 1334 N PRO A 83 -1.184 -12.467 4.926 1.00 1.00 N ATOM 1335 CA PRO A 83 -0.786 -11.113 5.290 1.00 1.00 C ATOM 1336 C PRO A 83 -1.096 -10.862 6.781 1.00 1.00 C ATOM 1337 O PRO A 83 -1.779 -11.679 7.408 1.00 1.00 O ATOM 1338 CB PRO A 83 -1.636 -10.246 4.366 1.00 1.00 C ATOM 1339 CG PRO A 83 -2.948 -11.014 4.322 1.00 1.00 C ATOM 1340 CD PRO A 83 -2.553 -12.480 4.442 1.00 1.00 C ATOM 0 HA PRO A 83 0.279 -10.908 5.176 1.00 1.00 H new ATOM 0 HB2 PRO A 83 -1.767 -9.238 4.760 1.00 1.00 H new ATOM 0 HB3 PRO A 83 -1.189 -10.146 3.377 1.00 1.00 H new ATOM 0 HG2 PRO A 83 -3.607 -10.715 5.137 1.00 1.00 H new ATOM 0 HG3 PRO A 83 -3.485 -10.825 3.392 1.00 1.00 H new ATOM 0 HD2 PRO A 83 -3.210 -13.010 5.132 1.00 1.00 H new ATOM 0 HD3 PRO A 83 -2.626 -12.987 3.480 1.00 1.00 H new ATOM 1348 N SER A 84 -0.655 -9.741 7.356 1.00 1.00 N ATOM 1349 CA SER A 84 -1.075 -9.330 8.691 1.00 1.00 C ATOM 1350 C SER A 84 -2.455 -8.663 8.638 1.00 1.00 C ATOM 1351 O SER A 84 -2.911 -8.267 7.566 1.00 1.00 O ATOM 1352 CB SER A 84 -0.076 -8.322 9.274 1.00 1.00 C ATOM 1353 OG SER A 84 1.238 -8.453 8.767 1.00 1.00 O ATOM 0 H SER A 84 -0.001 -9.098 6.910 1.00 1.00 H new ATOM 0 HA SER A 84 -1.118 -10.221 9.318 1.00 1.00 H new ATOM 0 HB2 SER A 84 -0.434 -7.313 9.070 1.00 1.00 H new ATOM 0 HB3 SER A 84 -0.049 -8.438 10.357 1.00 1.00 H new ATOM 0 HG SER A 84 1.817 -7.779 9.181 1.00 1.00 H new ATOM 1359 N ARG A 85 -3.037 -8.406 9.813 1.00 1.00 N ATOM 1360 CA ARG A 85 -4.237 -7.588 10.024 1.00 1.00 C ATOM 1361 C ARG A 85 -4.075 -6.236 9.348 1.00 1.00 C ATOM 1362 O ARG A 85 -4.924 -5.849 8.555 1.00 1.00 O ATOM 1363 CB ARG A 85 -4.454 -7.432 11.540 1.00 1.00 C ATOM 1364 CG ARG A 85 -5.586 -6.476 11.945 1.00 1.00 C ATOM 1365 CD ARG A 85 -5.366 -5.905 13.347 1.00 1.00 C ATOM 1366 NE ARG A 85 -6.248 -4.757 13.591 1.00 1.00 N ATOM 1367 CZ ARG A 85 -7.502 -4.772 14.048 1.00 1.00 C ATOM 1368 NH1 ARG A 85 -8.101 -5.922 14.344 1.00 1.00 N ATOM 1369 NH2 ARG A 85 -8.149 -3.623 14.187 1.00 1.00 N ATOM 0 H ARG A 85 -2.667 -8.781 10.686 1.00 1.00 H new ATOM 0 HA ARG A 85 -5.109 -8.070 9.583 1.00 1.00 H new ATOM 0 HB2 ARG A 85 -4.661 -8.415 11.964 1.00 1.00 H new ATOM 0 HB3 ARG A 85 -3.525 -7.080 11.989 1.00 1.00 H new ATOM 0 HG2 ARG A 85 -5.649 -5.660 11.225 1.00 1.00 H new ATOM 0 HG3 ARG A 85 -6.539 -7.005 11.912 1.00 1.00 H new ATOM 0 HD2 ARG A 85 -5.554 -6.678 14.092 1.00 1.00 H new ATOM 0 HD3 ARG A 85 -4.326 -5.600 13.460 1.00 1.00 H new ATOM 0 HE ARG A 85 -5.856 -3.838 13.387 1.00 1.00 H new ATOM 0 HH11 ARG A 85 -7.602 -6.803 14.222 1.00 1.00 H new ATOM 0 HH12 ARG A 85 -9.060 -5.923 14.693 1.00 1.00 H new ATOM 0 HH21 ARG A 85 -7.688 -2.746 13.946 1.00 1.00 H new ATOM 0 HH22 ARG A 85 -9.108 -3.616 14.535 1.00 1.00 H new ATOM 1383 N GLU A 86 -3.013 -5.498 9.680 1.00 1.00 N ATOM 1384 CA GLU A 86 -2.791 -4.162 9.130 1.00 1.00 C ATOM 1385 C GLU A 86 -2.664 -4.244 7.604 1.00 1.00 C ATOM 1386 O GLU A 86 -3.177 -3.396 6.879 1.00 1.00 O ATOM 1387 CB GLU A 86 -1.501 -3.581 9.730 1.00 1.00 C ATOM 1388 CG GLU A 86 -1.417 -2.048 9.643 1.00 1.00 C ATOM 1389 CD GLU A 86 -2.087 -1.332 10.821 1.00 1.00 C ATOM 1390 OE1 GLU A 86 -2.873 -1.964 11.566 1.00 1.00 O ATOM 1391 OE2 GLU A 86 -1.755 -0.149 11.054 1.00 1.00 O ATOM 0 H GLU A 86 -2.291 -5.807 10.331 1.00 1.00 H new ATOM 0 HA GLU A 86 -3.634 -3.517 9.380 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -1.429 -3.882 10.775 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -0.644 -4.013 9.214 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -0.369 -1.751 9.596 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -1.884 -1.718 8.715 1.00 1.00 H new ATOM 1398 N TYR A 87 -1.994 -5.299 7.138 1.00 1.00 N ATOM 1399 CA TYR A 87 -1.593 -5.553 5.770 1.00 1.00 C ATOM 1400 C TYR A 87 -2.824 -5.809 4.896 1.00 1.00 C ATOM 1401 O TYR A 87 -3.174 -4.942 4.093 1.00 1.00 O ATOM 1402 CB TYR A 87 -0.542 -6.675 5.813 1.00 1.00 C ATOM 1403 CG TYR A 87 0.403 -6.734 4.636 1.00 1.00 C ATOM 1404 CD1 TYR A 87 -0.047 -7.242 3.411 1.00 1.00 C ATOM 1405 CD2 TYR A 87 1.748 -6.340 4.781 1.00 1.00 C ATOM 1406 CE1 TYR A 87 0.805 -7.252 2.304 1.00 1.00 C ATOM 1407 CE2 TYR A 87 2.619 -6.362 3.673 1.00 1.00 C ATOM 1408 CZ TYR A 87 2.114 -6.752 2.417 1.00 1.00 C ATOM 1409 OH TYR A 87 2.876 -6.668 1.304 1.00 1.00 O ATOM 0 H TYR A 87 -1.699 -6.050 7.762 1.00 1.00 H new ATOM 0 HA TYR A 87 -1.120 -4.695 5.292 1.00 1.00 H new ATOM 0 HB2 TYR A 87 0.047 -6.561 6.723 1.00 1.00 H new ATOM 0 HB3 TYR A 87 -1.061 -7.631 5.887 1.00 1.00 H new ATOM 0 HD1 TYR A 87 -1.053 -7.626 3.322 1.00 1.00 H new ATOM 0 HD2 TYR A 87 2.113 -6.020 5.746 1.00 1.00 H new ATOM 0 HE1 TYR A 87 0.457 -7.645 1.360 1.00 1.00 H new ATOM 0 HE2 TYR A 87 3.657 -6.084 3.785 1.00 1.00 H new ATOM 0 HH TYR A 87 3.821 -6.612 1.558 1.00 1.00 H new ATOM 1419 N VAL A 88 -3.508 -6.949 5.066 1.00 1.00 N ATOM 1420 CA VAL A 88 -4.830 -7.171 4.471 1.00 1.00 C ATOM 1421 C VAL A 88 -5.722 -7.938 5.458 1.00 1.00 C ATOM 1422 O VAL A 88 -5.375 -9.028 5.908 1.00 1.00 O ATOM 1423 CB VAL A 88 -4.742 -7.909 3.117 1.00 1.00 C ATOM 1424 CG1 VAL A 88 -6.125 -8.114 2.473 1.00 1.00 C ATOM 1425 CG2 VAL A 88 -3.874 -7.209 2.066 1.00 1.00 C ATOM 0 H VAL A 88 -3.163 -7.736 5.615 1.00 1.00 H new ATOM 0 HA VAL A 88 -5.275 -6.197 4.268 1.00 1.00 H new ATOM 0 HB VAL A 88 -4.281 -8.859 3.387 1.00 1.00 H new ATOM 0 HG11 VAL A 88 -6.010 -8.637 1.524 1.00 1.00 H new ATOM 0 HG12 VAL A 88 -6.753 -8.705 3.140 1.00 1.00 H new ATOM 0 HG13 VAL A 88 -6.593 -7.145 2.299 1.00 1.00 H new ATOM 0 HG21 VAL A 88 -3.869 -7.797 1.148 1.00 1.00 H new ATOM 0 HG22 VAL A 88 -4.279 -6.218 1.860 1.00 1.00 H new ATOM 0 HG23 VAL A 88 -2.855 -7.113 2.441 1.00 1.00 H new ATOM 1435 N ASP A 89 -6.943 -7.439 5.632 1.00 1.00 N ATOM 1436 CA ASP A 89 -8.123 -8.019 6.268 1.00 1.00 C ATOM 1437 C ASP A 89 -8.017 -8.242 7.776 1.00 1.00 C ATOM 1438 O ASP A 89 -7.067 -8.831 8.287 1.00 1.00 O ATOM 1439 CB ASP A 89 -8.644 -9.262 5.547 1.00 1.00 C ATOM 1440 CG ASP A 89 -10.142 -9.468 5.766 1.00 1.00 C ATOM 1441 OD1 ASP A 89 -10.821 -8.652 6.437 1.00 1.00 O ATOM 1442 OD2 ASP A 89 -10.674 -10.395 5.115 1.00 1.00 O ATOM 0 H ASP A 89 -7.154 -6.502 5.288 1.00 1.00 H new ATOM 0 HA ASP A 89 -8.872 -7.235 6.157 1.00 1.00 H new ATOM 0 HB2 ASP A 89 -8.443 -9.172 4.479 1.00 1.00 H new ATOM 0 HB3 ASP A 89 -8.102 -10.139 5.901 1.00 1.00 H new ATOM 1447 N LEU A 90 -9.037 -7.738 8.468 1.00 1.00 N ATOM 1448 CA LEU A 90 -9.123 -7.426 9.882 1.00 1.00 C ATOM 1449 C LEU A 90 -10.564 -7.561 10.402 1.00 1.00 C ATOM 1450 O LEU A 90 -10.948 -6.876 11.350 1.00 1.00 O ATOM 1451 CB LEU A 90 -8.534 -6.023 10.131 1.00 1.00 C ATOM 1452 CG LEU A 90 -8.954 -4.821 9.257 1.00 1.00 C ATOM 1453 CD1 LEU A 90 -8.241 -4.813 7.906 1.00 1.00 C ATOM 1454 CD2 LEU A 90 -10.452 -4.688 8.977 1.00 1.00 C ATOM 0 H LEU A 90 -9.914 -7.517 7.995 1.00 1.00 H new ATOM 0 HA LEU A 90 -8.533 -8.148 10.447 1.00 1.00 H new ATOM 0 HB2 LEU A 90 -8.758 -5.761 11.165 1.00 1.00 H new ATOM 0 HB3 LEU A 90 -7.450 -6.112 10.053 1.00 1.00 H new ATOM 0 HG LEU A 90 -8.657 -3.974 9.876 1.00 1.00 H new ATOM 0 HD11 LEU A 90 -8.569 -3.950 7.327 1.00 1.00 H new ATOM 0 HD12 LEU A 90 -7.164 -4.757 8.063 1.00 1.00 H new ATOM 0 HD13 LEU A 90 -8.481 -5.727 7.362 1.00 1.00 H new ATOM 0 HD21 LEU A 90 -10.629 -3.810 8.355 1.00 1.00 H new ATOM 0 HD22 LEU A 90 -10.805 -5.578 8.457 1.00 1.00 H new ATOM 0 HD23 LEU A 90 -10.990 -4.580 9.919 1.00 1.00 H new ATOM 1466 N GLU A 91 -11.388 -8.406 9.772 1.00 1.00 N ATOM 1467 CA GLU A 91 -12.804 -8.701 10.062 1.00 1.00 C ATOM 1468 C GLU A 91 -13.793 -7.543 9.826 1.00 1.00 C ATOM 1469 O GLU A 91 -14.981 -7.812 9.623 1.00 1.00 O ATOM 1470 CB GLU A 91 -12.920 -9.295 11.484 1.00 1.00 C ATOM 1471 CG GLU A 91 -14.367 -9.578 11.900 1.00 1.00 C ATOM 1472 CD GLU A 91 -14.453 -10.605 13.019 1.00 1.00 C ATOM 1473 OE1 GLU A 91 -14.519 -11.815 12.693 1.00 1.00 O ATOM 1474 OE2 GLU A 91 -14.451 -10.220 14.210 1.00 1.00 O ATOM 0 H GLU A 91 -11.056 -8.951 8.976 1.00 1.00 H new ATOM 0 HA GLU A 91 -13.119 -9.437 9.322 1.00 1.00 H new ATOM 0 HB2 GLU A 91 -12.346 -10.221 11.533 1.00 1.00 H new ATOM 0 HB3 GLU A 91 -12.471 -8.604 12.198 1.00 1.00 H new ATOM 0 HG2 GLU A 91 -14.838 -8.650 12.224 1.00 1.00 H new ATOM 0 HG3 GLU A 91 -14.928 -9.936 11.037 1.00 1.00 H new ATOM 1481 N ARG A 92 -13.283 -6.312 9.748 1.00 1.00 N ATOM 1482 CA ARG A 92 -13.838 -4.989 9.417 1.00 1.00 C ATOM 1483 C ARG A 92 -13.619 -4.083 10.625 1.00 1.00 C ATOM 1484 O ARG A 92 -14.027 -4.429 11.731 1.00 1.00 O ATOM 1485 CB ARG A 92 -15.323 -4.942 8.983 1.00 1.00 C ATOM 1486 CG ARG A 92 -15.556 -3.874 7.909 1.00 1.00 C ATOM 1487 CD ARG A 92 -15.533 -4.425 6.469 1.00 1.00 C ATOM 1488 NE ARG A 92 -14.223 -4.945 6.038 1.00 1.00 N ATOM 1489 CZ ARG A 92 -13.793 -6.207 6.232 1.00 1.00 C ATOM 1490 NH1 ARG A 92 -14.635 -7.175 6.576 1.00 1.00 N ATOM 1491 NH2 ARG A 92 -12.500 -6.490 6.093 1.00 1.00 N ATOM 0 H ARG A 92 -12.290 -6.202 9.953 1.00 1.00 H new ATOM 0 HA ARG A 92 -13.306 -4.657 8.525 1.00 1.00 H new ATOM 0 HB2 ARG A 92 -15.623 -5.917 8.600 1.00 1.00 H new ATOM 0 HB3 ARG A 92 -15.951 -4.733 9.849 1.00 1.00 H new ATOM 0 HG2 ARG A 92 -16.518 -3.394 8.089 1.00 1.00 H new ATOM 0 HG3 ARG A 92 -14.792 -3.102 8.005 1.00 1.00 H new ATOM 0 HD2 ARG A 92 -16.272 -5.222 6.386 1.00 1.00 H new ATOM 0 HD3 ARG A 92 -15.839 -3.634 5.785 1.00 1.00 H new ATOM 0 HE ARG A 92 -13.595 -4.301 5.557 1.00 1.00 H new ATOM 0 HH11 ARG A 92 -15.627 -6.969 6.698 1.00 1.00 H new ATOM 0 HH12 ARG A 92 -14.290 -8.124 6.718 1.00 1.00 H new ATOM 0 HH21 ARG A 92 -11.841 -5.753 5.841 1.00 1.00 H new ATOM 0 HH22 ARG A 92 -12.168 -7.443 6.239 1.00 1.00 H new ATOM 1505 N GLU A 93 -12.953 -2.948 10.435 1.00 1.00 N ATOM 1506 CA GLU A 93 -12.824 -1.906 11.433 1.00 1.00 C ATOM 1507 C GLU A 93 -14.088 -1.032 11.384 1.00 1.00 C ATOM 1508 O GLU A 93 -15.090 -1.441 10.789 1.00 1.00 O ATOM 1509 CB GLU A 93 -11.486 -1.166 11.218 1.00 1.00 C ATOM 1510 CG GLU A 93 -10.594 -1.242 12.468 1.00 1.00 C ATOM 1511 CD GLU A 93 -11.072 -0.341 13.609 1.00 1.00 C ATOM 1512 OE1 GLU A 93 -11.632 0.743 13.330 1.00 1.00 O ATOM 1513 OE2 GLU A 93 -10.892 -0.731 14.785 1.00 1.00 O ATOM 0 H GLU A 93 -12.479 -2.728 9.559 1.00 1.00 H new ATOM 0 HA GLU A 93 -12.771 -2.294 12.450 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -10.961 -1.601 10.368 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -11.681 -0.122 10.972 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -10.560 -2.273 12.819 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -9.576 -0.963 12.197 1.00 1.00 H new ATOM 1520 N ALA A 94 -14.081 0.118 12.060 1.00 1.00 N ATOM 1521 CA ALA A 94 -15.248 0.939 12.386 1.00 1.00 C ATOM 1522 C ALA A 94 -15.838 1.640 11.161 1.00 1.00 C ATOM 1523 O ALA A 94 -15.638 2.838 10.939 1.00 1.00 O ATOM 1524 CB ALA A 94 -14.846 1.953 13.450 1.00 1.00 C ATOM 0 H ALA A 94 -13.214 0.523 12.414 1.00 1.00 H new ATOM 0 HA ALA A 94 -16.033 0.285 12.764 1.00 1.00 H new ATOM 0 HB1 ALA A 94 -15.705 2.573 13.704 1.00 1.00 H new ATOM 0 HB2 ALA A 94 -14.501 1.428 14.341 1.00 1.00 H new ATOM 0 HB3 ALA A 94 -14.044 2.584 13.067 1.00 1.00 H new ATOM 1530 N GLY A 95 -16.505 0.878 10.301 1.00 1.00 N ATOM 1531 CA GLY A 95 -16.975 1.360 9.017 1.00 1.00 C ATOM 1532 C GLY A 95 -15.832 1.821 8.114 1.00 1.00 C ATOM 1533 O GLY A 95 -16.085 2.525 7.141 1.00 1.00 O ATOM 0 H GLY A 95 -16.734 -0.099 10.482 1.00 1.00 H new ATOM 0 HA2 GLY A 95 -17.533 0.568 8.517 1.00 1.00 H new ATOM 0 HA3 GLY A 95 -17.667 2.187 9.174 1.00 1.00 H new ATOM 1537 N LYS A 96 -14.590 1.441 8.418 1.00 1.00 N ATOM 1538 CA LYS A 96 -13.386 1.568 7.616 1.00 1.00 C ATOM 1539 C LYS A 96 -12.678 0.220 7.602 1.00 1.00 C ATOM 1540 O LYS A 96 -12.949 -0.654 8.428 1.00 1.00 O ATOM 1541 CB LYS A 96 -12.496 2.732 8.122 1.00 1.00 C ATOM 1542 CG LYS A 96 -12.340 2.769 9.642 1.00 1.00 C ATOM 1543 CD LYS A 96 -11.162 3.553 10.238 1.00 1.00 C ATOM 1544 CE LYS A 96 -11.177 5.069 10.017 1.00 1.00 C ATOM 1545 NZ LYS A 96 -12.184 5.822 10.783 1.00 1.00 N ATOM 0 H LYS A 96 -14.390 0.997 9.314 1.00 1.00 H new ATOM 0 HA LYS A 96 -13.634 1.830 6.588 1.00 1.00 H new ATOM 0 HB2 LYS A 96 -11.509 2.648 7.666 1.00 1.00 H new ATOM 0 HB3 LYS A 96 -12.923 3.677 7.786 1.00 1.00 H new ATOM 0 HG2 LYS A 96 -13.258 3.182 10.060 1.00 1.00 H new ATOM 0 HG3 LYS A 96 -12.265 1.740 9.993 1.00 1.00 H new ATOM 0 HD2 LYS A 96 -11.132 3.364 11.311 1.00 1.00 H new ATOM 0 HD3 LYS A 96 -10.238 3.155 9.818 1.00 1.00 H new ATOM 0 HE2 LYS A 96 -10.191 5.462 10.265 1.00 1.00 H new ATOM 0 HE3 LYS A 96 -11.338 5.260 8.956 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 -12.106 6.834 10.558 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 -13.135 5.484 10.532 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 -12.024 5.680 11.801 1.00 1.00 H new ATOM 1559 N VAL A 97 -11.758 0.049 6.666 1.00 1.00 N ATOM 1560 CA VAL A 97 -10.768 -1.027 6.708 1.00 1.00 C ATOM 1561 C VAL A 97 -9.405 -0.352 6.821 1.00 1.00 C ATOM 1562 O VAL A 97 -9.251 0.781 6.371 1.00 1.00 O ATOM 1563 CB VAL A 97 -10.934 -1.960 5.484 1.00 1.00 C ATOM 1564 CG1 VAL A 97 -10.058 -1.611 4.289 1.00 1.00 C ATOM 1565 CG2 VAL A 97 -10.685 -3.436 5.765 1.00 1.00 C ATOM 0 H VAL A 97 -11.673 0.654 5.849 1.00 1.00 H new ATOM 0 HA VAL A 97 -10.894 -1.689 7.565 1.00 1.00 H new ATOM 0 HB VAL A 97 -11.984 -1.790 5.248 1.00 1.00 H new ATOM 0 HG11 VAL A 97 -10.244 -2.320 3.482 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -10.293 -0.603 3.948 1.00 1.00 H new ATOM 0 HG13 VAL A 97 -9.009 -1.661 4.580 1.00 1.00 H new ATOM 0 HG21 VAL A 97 -10.825 -4.009 4.849 1.00 1.00 H new ATOM 0 HG22 VAL A 97 -9.665 -3.571 6.125 1.00 1.00 H new ATOM 0 HG23 VAL A 97 -11.387 -3.786 6.522 1.00 1.00 H new ATOM 1575 N TYR A 98 -8.423 -1.033 7.397 1.00 1.00 N ATOM 1576 CA TYR A 98 -7.035 -0.612 7.387 1.00 1.00 C ATOM 1577 C TYR A 98 -6.346 -1.324 6.235 1.00 1.00 C ATOM 1578 O TYR A 98 -6.898 -2.288 5.707 1.00 1.00 O ATOM 1579 CB TYR A 98 -6.427 -0.920 8.757 1.00 1.00 C ATOM 1580 CG TYR A 98 -6.787 0.157 9.766 1.00 1.00 C ATOM 1581 CD1 TYR A 98 -8.109 0.244 10.242 1.00 1.00 C ATOM 1582 CD2 TYR A 98 -5.847 1.138 10.136 1.00 1.00 C ATOM 1583 CE1 TYR A 98 -8.509 1.319 11.049 1.00 1.00 C ATOM 1584 CE2 TYR A 98 -6.235 2.214 10.957 1.00 1.00 C ATOM 1585 CZ TYR A 98 -7.574 2.314 11.403 1.00 1.00 C ATOM 1586 OH TYR A 98 -7.986 3.370 12.152 1.00 1.00 O ATOM 0 H TYR A 98 -8.576 -1.911 7.893 1.00 1.00 H new ATOM 0 HA TYR A 98 -6.917 0.460 7.226 1.00 1.00 H new ATOM 0 HB2 TYR A 98 -6.785 -1.887 9.109 1.00 1.00 H new ATOM 0 HB3 TYR A 98 -5.343 -0.994 8.670 1.00 1.00 H new ATOM 0 HD1 TYR A 98 -8.822 -0.525 9.983 1.00 1.00 H new ATOM 0 HD2 TYR A 98 -4.827 1.065 9.789 1.00 1.00 H new ATOM 0 HE1 TYR A 98 -9.529 1.385 11.398 1.00 1.00 H new ATOM 0 HE2 TYR A 98 -5.512 2.962 11.246 1.00 1.00 H new ATOM 0 HH TYR A 98 -7.229 3.970 12.316 1.00 1.00 H new ATOM 1596 N LEU A 99 -5.199 -0.818 5.793 1.00 1.00 N ATOM 1597 CA LEU A 99 -4.407 -1.322 4.703 1.00 1.00 C ATOM 1598 C LEU A 99 -2.939 -0.979 4.965 1.00 1.00 C ATOM 1599 O LEU A 99 -2.619 0.011 5.631 1.00 1.00 O ATOM 1600 CB LEU A 99 -4.870 -0.601 3.438 1.00 1.00 C ATOM 1601 CG LEU A 99 -6.226 -1.006 2.838 1.00 1.00 C ATOM 1602 CD1 LEU A 99 -6.387 -0.242 1.524 1.00 1.00 C ATOM 1603 CD2 LEU A 99 -6.386 -2.502 2.552 1.00 1.00 C ATOM 0 H LEU A 99 -4.781 0.008 6.222 1.00 1.00 H new ATOM 0 HA LEU A 99 -4.516 -2.402 4.599 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -4.905 0.467 3.655 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -4.108 -0.746 2.672 1.00 1.00 H new ATOM 0 HG LEU A 99 -6.987 -0.764 3.580 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -7.341 -0.503 1.066 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -6.360 0.830 1.721 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -5.575 -0.507 0.847 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -7.374 -2.688 2.131 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -5.623 -2.820 1.842 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -6.275 -3.064 3.480 1.00 1.00 H new ATOM 1615 N LYS A 100 -2.038 -1.742 4.352 1.00 1.00 N ATOM 1616 CA LYS A 100 -0.585 -1.609 4.508 1.00 1.00 C ATOM 1617 C LYS A 100 0.036 -2.435 3.406 1.00 1.00 C ATOM 1618 O LYS A 100 -0.274 -3.616 3.271 1.00 1.00 O ATOM 1619 CB LYS A 100 -0.073 -2.117 5.881 1.00 1.00 C ATOM 1620 CG LYS A 100 1.160 -1.397 6.457 1.00 1.00 C ATOM 1621 CD LYS A 100 2.519 -1.516 5.732 1.00 1.00 C ATOM 1622 CE LYS A 100 3.127 -2.921 5.604 1.00 1.00 C ATOM 1623 NZ LYS A 100 4.593 -2.884 5.322 1.00 1.00 N ATOM 0 H LYS A 100 -2.302 -2.493 3.714 1.00 1.00 H new ATOM 0 HA LYS A 100 -0.313 -0.555 4.454 1.00 1.00 H new ATOM 0 HB2 LYS A 100 -0.886 -2.033 6.602 1.00 1.00 H new ATOM 0 HB3 LYS A 100 0.162 -3.177 5.788 1.00 1.00 H new ATOM 0 HG2 LYS A 100 0.917 -0.336 6.524 1.00 1.00 H new ATOM 0 HG3 LYS A 100 1.301 -1.756 7.476 1.00 1.00 H new ATOM 0 HD2 LYS A 100 2.404 -1.105 4.729 1.00 1.00 H new ATOM 0 HD3 LYS A 100 3.237 -0.884 6.255 1.00 1.00 H new ATOM 0 HE2 LYS A 100 2.951 -3.475 6.526 1.00 1.00 H new ATOM 0 HE3 LYS A 100 2.620 -3.462 4.805 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 4.956 -3.855 5.245 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 4.762 -2.379 4.429 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 5.083 -2.392 6.096 1.00 1.00 H new ATOM 1637 N ALA A 101 0.922 -1.839 2.631 1.00 1.00 N ATOM 1638 CA ALA A 101 1.698 -2.560 1.631 1.00 1.00 C ATOM 1639 C ALA A 101 3.053 -1.854 1.544 1.00 1.00 C ATOM 1640 O ALA A 101 3.071 -0.626 1.566 1.00 1.00 O ATOM 1641 CB ALA A 101 0.923 -2.578 0.301 1.00 1.00 C ATOM 0 H ALA A 101 1.127 -0.841 2.674 1.00 1.00 H new ATOM 0 HA ALA A 101 1.865 -3.605 1.890 1.00 1.00 H new ATOM 0 HB1 ALA A 101 1.501 -3.117 -0.450 1.00 1.00 H new ATOM 0 HB2 ALA A 101 -0.036 -3.075 0.446 1.00 1.00 H new ATOM 0 HB3 ALA A 101 0.755 -1.555 -0.036 1.00 1.00 H new ATOM 1647 N PRO A 102 4.195 -2.560 1.514 1.00 1.00 N ATOM 1648 CA PRO A 102 5.445 -1.938 1.115 1.00 1.00 C ATOM 1649 C PRO A 102 5.277 -1.387 -0.311 1.00 1.00 C ATOM 1650 O PRO A 102 4.466 -1.880 -1.105 1.00 1.00 O ATOM 1651 CB PRO A 102 6.510 -3.045 1.118 1.00 1.00 C ATOM 1652 CG PRO A 102 5.853 -4.223 1.833 1.00 1.00 C ATOM 1653 CD PRO A 102 4.362 -3.990 1.602 1.00 1.00 C ATOM 0 HA PRO A 102 5.729 -1.125 1.783 1.00 1.00 H new ATOM 0 HB2 PRO A 102 6.803 -3.313 0.103 1.00 1.00 H new ATOM 0 HB3 PRO A 102 7.413 -2.723 1.636 1.00 1.00 H new ATOM 0 HG2 PRO A 102 6.179 -5.177 1.419 1.00 1.00 H new ATOM 0 HG3 PRO A 102 6.098 -4.236 2.895 1.00 1.00 H new ATOM 0 HD2 PRO A 102 4.027 -4.479 0.687 1.00 1.00 H new ATOM 0 HD3 PRO A 102 3.771 -4.403 2.419 1.00 1.00 H new ATOM 1661 N MET A 103 6.102 -0.421 -0.668 1.00 1.00 N ATOM 1662 CA MET A 103 6.380 -0.038 -2.040 1.00 1.00 C ATOM 1663 C MET A 103 7.817 -0.384 -2.378 1.00 1.00 C ATOM 1664 O MET A 103 8.645 -0.538 -1.488 1.00 1.00 O ATOM 1665 CB MET A 103 6.271 1.479 -2.229 1.00 1.00 C ATOM 1666 CG MET A 103 5.076 2.218 -1.620 1.00 1.00 C ATOM 1667 SD MET A 103 3.714 2.546 -2.766 1.00 1.00 S ATOM 1668 CE MET A 103 3.298 0.878 -3.324 1.00 1.00 C ATOM 0 H MET A 103 6.615 0.139 0.013 1.00 1.00 H new ATOM 0 HA MET A 103 5.660 -0.561 -2.670 1.00 1.00 H new ATOM 0 HB2 MET A 103 7.177 1.927 -1.822 1.00 1.00 H new ATOM 0 HB3 MET A 103 6.270 1.678 -3.301 1.00 1.00 H new ATOM 0 HG2 MET A 103 4.694 1.633 -0.784 1.00 1.00 H new ATOM 0 HG3 MET A 103 5.424 3.167 -1.212 1.00 1.00 H new ATOM 0 HE1 MET A 103 2.428 0.920 -3.980 1.00 1.00 H new ATOM 0 HE2 MET A 103 4.143 0.455 -3.868 1.00 1.00 H new ATOM 0 HE3 MET A 103 3.072 0.252 -2.461 1.00 1.00 H new ATOM 1678 N ILE A 104 8.119 -0.368 -3.675 1.00 1.00 N ATOM 1679 CA ILE A 104 9.461 -0.227 -4.218 1.00 1.00 C ATOM 1680 C ILE A 104 9.318 0.777 -5.354 1.00 1.00 C ATOM 1681 O ILE A 104 9.362 0.433 -6.535 1.00 1.00 O ATOM 1682 CB ILE A 104 10.111 -1.578 -4.590 1.00 1.00 C ATOM 1683 CG1 ILE A 104 10.170 -2.443 -3.318 1.00 1.00 C ATOM 1684 CG2 ILE A 104 11.543 -1.374 -5.121 1.00 1.00 C ATOM 1685 CD1 ILE A 104 10.813 -3.815 -3.485 1.00 1.00 C ATOM 0 H ILE A 104 7.407 -0.456 -4.400 1.00 1.00 H new ATOM 0 HA ILE A 104 10.174 0.147 -3.483 1.00 1.00 H new ATOM 0 HB ILE A 104 9.521 -2.059 -5.370 1.00 1.00 H new ATOM 0 HG12 ILE A 104 10.719 -1.895 -2.552 1.00 1.00 H new ATOM 0 HG13 ILE A 104 9.155 -2.580 -2.946 1.00 1.00 H new ATOM 0 HG21 ILE A 104 11.978 -2.341 -5.376 1.00 1.00 H new ATOM 0 HG22 ILE A 104 11.515 -0.743 -6.010 1.00 1.00 H new ATOM 0 HG23 ILE A 104 12.150 -0.894 -4.354 1.00 1.00 H new ATOM 0 HD11 ILE A 104 10.803 -4.340 -2.530 1.00 1.00 H new ATOM 0 HD12 ILE A 104 10.254 -4.391 -4.222 1.00 1.00 H new ATOM 0 HD13 ILE A 104 11.843 -3.696 -3.823 1.00 1.00 H new ATOM 1697 N LEU A 105 9.084 2.041 -4.999 1.00 1.00 N ATOM 1698 CA LEU A 105 9.354 3.130 -5.927 1.00 1.00 C ATOM 1699 C LEU A 105 10.863 3.302 -5.866 1.00 1.00 C ATOM 1700 O LEU A 105 11.427 3.391 -4.779 1.00 1.00 O ATOM 1701 CB LEU A 105 8.643 4.444 -5.543 1.00 1.00 C ATOM 1702 CG LEU A 105 7.155 4.576 -5.935 1.00 1.00 C ATOM 1703 CD1 LEU A 105 6.896 4.423 -7.436 1.00 1.00 C ATOM 1704 CD2 LEU A 105 6.257 3.586 -5.196 1.00 1.00 C ATOM 0 H LEU A 105 8.715 2.329 -4.093 1.00 1.00 H new ATOM 0 HA LEU A 105 8.981 2.896 -6.924 1.00 1.00 H new ATOM 0 HB2 LEU A 105 8.721 4.568 -4.463 1.00 1.00 H new ATOM 0 HB3 LEU A 105 9.188 5.270 -5.999 1.00 1.00 H new ATOM 0 HG LEU A 105 6.903 5.594 -5.638 1.00 1.00 H new ATOM 0 HD11 LEU A 105 5.829 4.528 -7.634 1.00 1.00 H new ATOM 0 HD12 LEU A 105 7.443 5.193 -7.980 1.00 1.00 H new ATOM 0 HD13 LEU A 105 7.231 3.439 -7.765 1.00 1.00 H new ATOM 0 HD21 LEU A 105 5.223 3.726 -5.512 1.00 1.00 H new ATOM 0 HD22 LEU A 105 6.572 2.568 -5.425 1.00 1.00 H new ATOM 0 HD23 LEU A 105 6.334 3.756 -4.122 1.00 1.00 H new ATOM 1716 N ASN A 106 11.527 3.298 -7.016 1.00 1.00 N ATOM 1717 CA ASN A 106 12.926 3.660 -7.255 1.00 1.00 C ATOM 1718 C ASN A 106 13.922 2.643 -6.701 1.00 1.00 C ATOM 1719 O ASN A 106 15.099 2.733 -7.042 1.00 1.00 O ATOM 1720 CB ASN A 106 13.258 5.089 -6.766 1.00 1.00 C ATOM 1721 CG ASN A 106 12.570 6.179 -7.577 1.00 1.00 C ATOM 1722 OD1 ASN A 106 11.402 6.077 -7.935 1.00 1.00 O ATOM 1723 ND2 ASN A 106 13.277 7.228 -7.951 1.00 1.00 N ATOM 0 H ASN A 106 11.064 3.018 -7.881 1.00 1.00 H new ATOM 0 HA ASN A 106 13.040 3.646 -8.339 1.00 1.00 H new ATOM 0 HB2 ASN A 106 12.966 5.185 -5.720 1.00 1.00 H new ATOM 0 HB3 ASN A 106 14.337 5.239 -6.810 1.00 1.00 H new ATOM 0 HD21 ASN A 106 12.851 7.948 -8.535 1.00 1.00 H new ATOM 0 HD22 ASN A 106 14.249 7.319 -7.657 1.00 1.00 H new ATOM 1730 N GLY A 107 13.486 1.672 -5.899 1.00 1.00 N ATOM 1731 CA GLY A 107 14.365 0.827 -5.092 1.00 1.00 C ATOM 1732 C GLY A 107 14.350 1.223 -3.612 1.00 1.00 C ATOM 1733 O GLY A 107 15.284 0.860 -2.899 1.00 1.00 O ATOM 0 H GLY A 107 12.497 1.447 -5.790 1.00 1.00 H new ATOM 0 HA2 GLY A 107 14.057 -0.214 -5.191 1.00 1.00 H new ATOM 0 HA3 GLY A 107 15.383 0.896 -5.474 1.00 1.00 H new ATOM 1737 N VAL A 108 13.359 1.995 -3.153 1.00 1.00 N ATOM 1738 CA VAL A 108 13.133 2.306 -1.755 1.00 1.00 C ATOM 1739 C VAL A 108 11.992 1.433 -1.251 1.00 1.00 C ATOM 1740 O VAL A 108 10.873 1.564 -1.749 1.00 1.00 O ATOM 1741 CB VAL A 108 12.814 3.799 -1.499 1.00 1.00 C ATOM 1742 CG1 VAL A 108 13.241 4.172 -0.068 1.00 1.00 C ATOM 1743 CG2 VAL A 108 13.521 4.744 -2.472 1.00 1.00 C ATOM 0 H VAL A 108 12.675 2.430 -3.772 1.00 1.00 H new ATOM 0 HA VAL A 108 14.057 2.102 -1.214 1.00 1.00 H new ATOM 0 HB VAL A 108 11.740 3.917 -1.645 1.00 1.00 H new ATOM 0 HG11 VAL A 108 13.018 5.223 0.116 1.00 1.00 H new ATOM 0 HG12 VAL A 108 12.696 3.555 0.647 1.00 1.00 H new ATOM 0 HG13 VAL A 108 14.311 4.003 0.048 1.00 1.00 H new ATOM 0 HG21 VAL A 108 13.254 5.774 -2.237 1.00 1.00 H new ATOM 0 HG22 VAL A 108 14.600 4.619 -2.381 1.00 1.00 H new ATOM 0 HG23 VAL A 108 13.213 4.513 -3.492 1.00 1.00 H new ATOM 1753 N CYS A 109 12.262 0.593 -0.254 1.00 1.00 N ATOM 1754 CA CYS A 109 11.237 0.016 0.589 1.00 1.00 C ATOM 1755 C CYS A 109 10.778 1.146 1.497 1.00 1.00 C ATOM 1756 O CYS A 109 11.430 1.477 2.488 1.00 1.00 O ATOM 1757 CB CYS A 109 11.773 -1.170 1.390 1.00 1.00 C ATOM 1758 SG CYS A 109 12.311 -2.471 0.246 1.00 1.00 S ATOM 0 H CYS A 109 13.208 0.296 -0.013 1.00 1.00 H new ATOM 0 HA CYS A 109 10.411 -0.383 0.001 1.00 1.00 H new ATOM 0 HB2 CYS A 109 12.607 -0.853 2.017 1.00 1.00 H new ATOM 0 HB3 CYS A 109 11.000 -1.553 2.057 1.00 1.00 H new ATOM 0 HG CYS A 109 11.792 -3.607 0.606 1.00 1.00 H new ATOM 1764 N VAL A 110 9.712 1.807 1.074 1.00 1.00 N ATOM 1765 CA VAL A 110 8.884 2.598 1.964 1.00 1.00 C ATOM 1766 C VAL A 110 7.595 1.836 2.184 1.00 1.00 C ATOM 1767 O VAL A 110 7.112 1.109 1.321 1.00 1.00 O ATOM 1768 CB VAL A 110 8.621 4.022 1.426 1.00 1.00 C ATOM 1769 CG1 VAL A 110 9.898 4.871 1.481 1.00 1.00 C ATOM 1770 CG2 VAL A 110 8.003 4.013 0.028 1.00 1.00 C ATOM 0 H VAL A 110 9.398 1.809 0.103 1.00 1.00 H new ATOM 0 HA VAL A 110 9.406 2.745 2.909 1.00 1.00 H new ATOM 0 HB VAL A 110 7.882 4.484 2.081 1.00 1.00 H new ATOM 0 HG11 VAL A 110 9.688 5.869 1.097 1.00 1.00 H new ATOM 0 HG12 VAL A 110 10.242 4.944 2.513 1.00 1.00 H new ATOM 0 HG13 VAL A 110 10.672 4.404 0.872 1.00 1.00 H new ATOM 0 HG21 VAL A 110 7.838 5.038 -0.304 1.00 1.00 H new ATOM 0 HG22 VAL A 110 8.678 3.512 -0.665 1.00 1.00 H new ATOM 0 HG23 VAL A 110 7.051 3.483 0.054 1.00 1.00 H new ATOM 1780 N ILE A 111 6.994 2.091 3.325 1.00 1.00 N ATOM 1781 CA ILE A 111 5.684 1.616 3.675 1.00 1.00 C ATOM 1782 C ILE A 111 4.701 2.541 3.017 1.00 1.00 C ATOM 1783 O ILE A 111 4.872 3.753 3.089 1.00 1.00 O ATOM 1784 CB ILE A 111 5.483 1.721 5.205 1.00 1.00 C ATOM 1785 CG1 ILE A 111 6.275 0.598 5.856 1.00 1.00 C ATOM 1786 CG2 ILE A 111 4.005 1.688 5.609 1.00 1.00 C ATOM 1787 CD1 ILE A 111 6.273 0.489 7.368 1.00 1.00 C ATOM 0 H ILE A 111 7.424 2.656 4.057 1.00 1.00 H new ATOM 0 HA ILE A 111 5.554 0.580 3.361 1.00 1.00 H new ATOM 0 HB ILE A 111 5.849 2.687 5.552 1.00 1.00 H new ATOM 0 HG12 ILE A 111 5.902 -0.345 5.456 1.00 1.00 H new ATOM 0 HG13 ILE A 111 7.312 0.694 5.533 1.00 1.00 H new ATOM 0 HG21 ILE A 111 3.922 1.765 6.693 1.00 1.00 H new ATOM 0 HG22 ILE A 111 3.482 2.524 5.145 1.00 1.00 H new ATOM 0 HG23 ILE A 111 3.558 0.751 5.277 1.00 1.00 H new ATOM 0 HD11 ILE A 111 6.883 -0.361 7.672 1.00 1.00 H new ATOM 0 HD12 ILE A 111 6.683 1.402 7.799 1.00 1.00 H new ATOM 0 HD13 ILE A 111 5.252 0.348 7.721 1.00 1.00 H new ATOM 1799 N TRP A 112 3.628 1.974 2.497 1.00 1.00 N ATOM 1800 CA TRP A 112 2.407 2.692 2.258 1.00 1.00 C ATOM 1801 C TRP A 112 1.486 2.151 3.339 1.00 1.00 C ATOM 1802 O TRP A 112 1.339 0.929 3.468 1.00 1.00 O ATOM 1803 CB TRP A 112 1.873 2.388 0.857 1.00 1.00 C ATOM 1804 CG TRP A 112 0.610 3.096 0.474 1.00 1.00 C ATOM 1805 CD1 TRP A 112 0.530 4.104 -0.418 1.00 1.00 C ATOM 1806 CD2 TRP A 112 -0.758 2.861 0.933 1.00 1.00 C ATOM 1807 NE1 TRP A 112 -0.788 4.490 -0.564 1.00 1.00 N ATOM 1808 CE2 TRP A 112 -1.623 3.764 0.252 1.00 1.00 C ATOM 1809 CE3 TRP A 112 -1.368 1.969 1.839 1.00 1.00 C ATOM 1810 CZ2 TRP A 112 -3.010 3.780 0.459 1.00 1.00 C ATOM 1811 CZ3 TRP A 112 -2.742 2.026 2.111 1.00 1.00 C ATOM 1812 CH2 TRP A 112 -3.572 2.918 1.414 1.00 1.00 C ATOM 0 H TRP A 112 3.588 0.991 2.229 1.00 1.00 H new ATOM 0 HA TRP A 112 2.515 3.776 2.297 1.00 1.00 H new ATOM 0 HB2 TRP A 112 2.645 2.643 0.131 1.00 1.00 H new ATOM 0 HB3 TRP A 112 1.704 1.314 0.778 1.00 1.00 H new ATOM 0 HD1 TRP A 112 1.368 4.543 -0.939 1.00 1.00 H new ATOM 0 HE1 TRP A 112 -1.103 5.223 -1.199 1.00 1.00 H new ATOM 0 HE3 TRP A 112 -0.763 1.225 2.335 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 -3.639 4.448 -0.110 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 -3.166 1.378 2.864 1.00 1.00 H new ATOM 0 HH2 TRP A 112 -4.634 2.941 1.611 1.00 1.00 H new ATOM 1823 N LYS A 113 0.888 3.022 4.146 1.00 1.00 N ATOM 1824 CA LYS A 113 -0.142 2.618 5.094 1.00 1.00 C ATOM 1825 C LYS A 113 -1.375 3.506 4.968 1.00 1.00 C ATOM 1826 O LYS A 113 -1.296 4.615 4.437 1.00 1.00 O ATOM 1827 CB LYS A 113 0.449 2.617 6.508 1.00 1.00 C ATOM 1828 CG LYS A 113 0.777 4.017 7.075 1.00 1.00 C ATOM 1829 CD LYS A 113 0.369 4.186 8.543 1.00 1.00 C ATOM 1830 CE LYS A 113 1.239 3.362 9.498 1.00 1.00 C ATOM 1831 NZ LYS A 113 0.829 3.566 10.902 1.00 1.00 N ATOM 0 H LYS A 113 1.102 4.019 4.161 1.00 1.00 H new ATOM 0 HA LYS A 113 -0.477 1.605 4.871 1.00 1.00 H new ATOM 0 HB2 LYS A 113 -0.254 2.124 7.180 1.00 1.00 H new ATOM 0 HB3 LYS A 113 1.360 2.019 6.505 1.00 1.00 H new ATOM 0 HG2 LYS A 113 1.847 4.199 6.979 1.00 1.00 H new ATOM 0 HG3 LYS A 113 0.270 4.773 6.475 1.00 1.00 H new ATOM 0 HD2 LYS A 113 0.435 5.239 8.815 1.00 1.00 H new ATOM 0 HD3 LYS A 113 -0.674 3.891 8.662 1.00 1.00 H new ATOM 0 HE2 LYS A 113 1.162 2.305 9.244 1.00 1.00 H new ATOM 0 HE3 LYS A 113 2.285 3.644 9.377 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 1.435 2.996 11.527 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 0.925 4.572 11.149 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 -0.162 3.274 11.020 1.00 1.00 H new ATOM 1845 N GLY A 114 -2.497 3.066 5.527 1.00 1.00 N ATOM 1846 CA GLY A 114 -3.673 3.908 5.628 1.00 1.00 C ATOM 1847 C GLY A 114 -4.887 3.119 6.071 1.00 1.00 C ATOM 1848 O GLY A 114 -4.812 1.924 6.351 1.00 1.00 O ATOM 0 H GLY A 114 -2.612 2.130 5.916 1.00 1.00 H new ATOM 0 HA2 GLY A 114 -3.484 4.714 6.337 1.00 1.00 H new ATOM 0 HA3 GLY A 114 -3.873 4.372 4.662 1.00 1.00 H new ATOM 1852 N TRP A 115 -6.026 3.792 6.105 1.00 1.00 N ATOM 1853 CA TRP A 115 -7.333 3.209 6.254 1.00 1.00 C ATOM 1854 C TRP A 115 -8.228 3.790 5.171 1.00 1.00 C ATOM 1855 O TRP A 115 -8.165 4.975 4.849 1.00 1.00 O ATOM 1856 CB TRP A 115 -7.858 3.451 7.672 1.00 1.00 C ATOM 1857 CG TRP A 115 -8.061 4.877 8.090 1.00 1.00 C ATOM 1858 CD1 TRP A 115 -9.189 5.591 7.886 1.00 1.00 C ATOM 1859 CD2 TRP A 115 -7.138 5.788 8.760 1.00 1.00 C ATOM 1860 NE1 TRP A 115 -9.089 6.814 8.519 1.00 1.00 N ATOM 1861 CE2 TRP A 115 -7.851 6.977 9.100 1.00 1.00 C ATOM 1862 CE3 TRP A 115 -5.766 5.747 9.092 1.00 1.00 C ATOM 1863 CZ2 TRP A 115 -7.246 8.050 9.774 1.00 1.00 C ATOM 1864 CZ3 TRP A 115 -5.136 6.840 9.720 1.00 1.00 C ATOM 1865 CH2 TRP A 115 -5.879 7.977 10.082 1.00 1.00 C ATOM 0 H TRP A 115 -6.056 4.808 6.025 1.00 1.00 H new ATOM 0 HA TRP A 115 -7.306 2.127 6.128 1.00 1.00 H new ATOM 0 HB2 TRP A 115 -8.810 2.930 7.774 1.00 1.00 H new ATOM 0 HB3 TRP A 115 -7.164 2.988 8.374 1.00 1.00 H new ATOM 0 HD1 TRP A 115 -10.041 5.256 7.314 1.00 1.00 H new ATOM 0 HE1 TRP A 115 -9.836 7.508 8.552 1.00 1.00 H new ATOM 0 HE3 TRP A 115 -5.190 4.863 8.861 1.00 1.00 H new ATOM 0 HZ2 TRP A 115 -7.824 8.919 10.051 1.00 1.00 H new ATOM 0 HZ3 TRP A 115 -4.076 6.804 9.924 1.00 1.00 H new ATOM 0 HH2 TRP A 115 -5.397 8.795 10.597 1.00 1.00 H new ATOM 1876 N ILE A 116 -9.068 2.943 4.597 1.00 1.00 N ATOM 1877 CA ILE A 116 -10.018 3.295 3.562 1.00 1.00 C ATOM 1878 C ILE A 116 -11.391 2.958 4.138 1.00 1.00 C ATOM 1879 O ILE A 116 -11.726 1.802 4.411 1.00 1.00 O ATOM 1880 CB ILE A 116 -9.656 2.579 2.248 1.00 1.00 C ATOM 1881 CG1 ILE A 116 -8.474 3.224 1.491 1.00 1.00 C ATOM 1882 CG2 ILE A 116 -10.856 2.462 1.308 1.00 1.00 C ATOM 1883 CD1 ILE A 116 -8.764 4.562 0.795 1.00 1.00 C ATOM 0 H ILE A 116 -9.105 1.956 4.851 1.00 1.00 H new ATOM 0 HA ILE A 116 -10.009 4.351 3.291 1.00 1.00 H new ATOM 0 HB ILE A 116 -9.341 1.583 2.559 1.00 1.00 H new ATOM 0 HG12 ILE A 116 -7.657 3.375 2.196 1.00 1.00 H new ATOM 0 HG13 ILE A 116 -8.121 2.517 0.740 1.00 1.00 H new ATOM 0 HG21 ILE A 116 -10.554 1.950 0.394 1.00 1.00 H new ATOM 0 HG22 ILE A 116 -11.647 1.894 1.797 1.00 1.00 H new ATOM 0 HG23 ILE A 116 -11.224 3.458 1.062 1.00 1.00 H new ATOM 0 HD11 ILE A 116 -7.861 4.917 0.298 1.00 1.00 H new ATOM 0 HD12 ILE A 116 -9.554 4.424 0.057 1.00 1.00 H new ATOM 0 HD13 ILE A 116 -9.083 5.296 1.535 1.00 1.00 H new ATOM 1895 N ASP A 117 -12.141 4.011 4.414 1.00 1.00 N ATOM 1896 CA ASP A 117 -13.502 4.031 4.874 1.00 1.00 C ATOM 1897 C ASP A 117 -14.462 3.367 3.887 1.00 1.00 C ATOM 1898 O ASP A 117 -14.305 3.430 2.664 1.00 1.00 O ATOM 1899 CB ASP A 117 -13.866 5.495 5.126 1.00 1.00 C ATOM 1900 CG ASP A 117 -15.043 5.646 6.076 1.00 1.00 C ATOM 1901 OD1 ASP A 117 -14.811 5.676 7.308 1.00 1.00 O ATOM 1902 OD2 ASP A 117 -16.191 5.776 5.602 1.00 1.00 O ATOM 0 H ASP A 117 -11.770 4.955 4.309 1.00 1.00 H new ATOM 0 HA ASP A 117 -13.595 3.449 5.791 1.00 1.00 H new ATOM 0 HB2 ASP A 117 -13.001 6.015 5.538 1.00 1.00 H new ATOM 0 HB3 ASP A 117 -14.105 5.975 4.177 1.00 1.00 H new ATOM 1907 N LEU A 118 -15.482 2.707 4.420 1.00 1.00 N ATOM 1908 CA LEU A 118 -16.392 1.854 3.674 1.00 1.00 C ATOM 1909 C LEU A 118 -17.569 2.713 3.242 1.00 1.00 C ATOM 1910 O LEU A 118 -18.680 2.620 3.777 1.00 1.00 O ATOM 1911 CB LEU A 118 -16.840 0.655 4.516 1.00 1.00 C ATOM 1912 CG LEU A 118 -15.691 -0.109 5.178 1.00 1.00 C ATOM 1913 CD1 LEU A 118 -16.294 -1.028 6.228 1.00 1.00 C ATOM 1914 CD2 LEU A 118 -14.746 -0.834 4.211 1.00 1.00 C ATOM 0 H LEU A 118 -15.704 2.753 5.414 1.00 1.00 H new ATOM 0 HA LEU A 118 -15.896 1.438 2.797 1.00 1.00 H new ATOM 0 HB2 LEU A 118 -17.524 1.004 5.290 1.00 1.00 H new ATOM 0 HB3 LEU A 118 -17.400 -0.032 3.881 1.00 1.00 H new ATOM 0 HG LEU A 118 -15.024 0.616 5.645 1.00 1.00 H new ATOM 0 HD11 LEU A 118 -15.499 -1.589 6.720 1.00 1.00 H new ATOM 0 HD12 LEU A 118 -16.830 -0.433 6.968 1.00 1.00 H new ATOM 0 HD13 LEU A 118 -16.986 -1.722 5.750 1.00 1.00 H new ATOM 0 HD21 LEU A 118 -13.967 -1.344 4.778 1.00 1.00 H new ATOM 0 HD22 LEU A 118 -15.310 -1.564 3.630 1.00 1.00 H new ATOM 0 HD23 LEU A 118 -14.289 -0.109 3.537 1.00 1.00 H new ATOM 1926 N HIS A 119 -17.294 3.588 2.283 1.00 1.00 N ATOM 1927 CA HIS A 119 -18.280 4.504 1.752 1.00 1.00 C ATOM 1928 C HIS A 119 -18.206 4.470 0.228 1.00 1.00 C ATOM 1929 O HIS A 119 -18.956 3.710 -0.385 1.00 1.00 O ATOM 1930 CB HIS A 119 -18.162 5.868 2.453 1.00 1.00 C ATOM 1931 CG HIS A 119 -17.039 6.756 1.991 1.00 1.00 C ATOM 1932 ND1 HIS A 119 -17.236 7.850 1.180 1.00 1.00 N ATOM 1933 CD2 HIS A 119 -15.692 6.486 2.013 1.00 1.00 C ATOM 1934 CE1 HIS A 119 -16.053 8.189 0.656 1.00 1.00 C ATOM 1935 NE2 HIS A 119 -15.103 7.367 1.118 1.00 1.00 N ATOM 0 H HIS A 119 -16.373 3.678 1.853 1.00 1.00 H new ATOM 0 HA HIS A 119 -19.305 4.210 1.975 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -19.101 6.405 2.319 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -18.044 5.695 3.523 1.00 1.00 H new ATOM 0 HD1 HIS A 119 -18.126 8.319 1.009 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -15.191 5.737 2.609 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -15.889 9.003 -0.035 1.00 1.00 H new ATOM 1943 N ARG A 120 -17.278 5.209 -0.384 1.00 1.00 N ATOM 1944 CA ARG A 120 -16.860 5.069 -1.771 1.00 1.00 C ATOM 1945 C ARG A 120 -15.485 4.417 -1.857 1.00 1.00 C ATOM 1946 O ARG A 120 -15.050 4.144 -2.974 1.00 1.00 O ATOM 1947 CB ARG A 120 -16.797 6.438 -2.468 1.00 1.00 C ATOM 1948 CG ARG A 120 -18.061 7.299 -2.411 1.00 1.00 C ATOM 1949 CD ARG A 120 -19.305 6.640 -3.035 1.00 1.00 C ATOM 1950 NE ARG A 120 -20.058 5.822 -2.065 1.00 1.00 N ATOM 1951 CZ ARG A 120 -20.901 6.298 -1.139 1.00 1.00 C ATOM 1952 NH1 ARG A 120 -21.135 7.601 -1.024 1.00 1.00 N ATOM 1953 NH2 ARG A 120 -21.501 5.466 -0.303 1.00 1.00 N ATOM 0 H ARG A 120 -16.778 5.954 0.101 1.00 1.00 H new ATOM 0 HA ARG A 120 -17.598 4.440 -2.270 1.00 1.00 H new ATOM 0 HB2 ARG A 120 -15.978 7.007 -2.027 1.00 1.00 H new ATOM 0 HB3 ARG A 120 -16.544 6.275 -3.516 1.00 1.00 H new ATOM 0 HG2 ARG A 120 -18.276 7.540 -1.370 1.00 1.00 H new ATOM 0 HG3 ARG A 120 -17.868 8.242 -2.923 1.00 1.00 H new ATOM 0 HD2 ARG A 120 -19.959 7.414 -3.438 1.00 1.00 H new ATOM 0 HD3 ARG A 120 -18.999 6.014 -3.873 1.00 1.00 H new ATOM 0 HE ARG A 120 -19.926 4.811 -2.103 1.00 1.00 H new ATOM 0 HH11 ARG A 120 -20.669 8.260 -1.648 1.00 1.00 H new ATOM 0 HH12 ARG A 120 -21.781 7.942 -0.312 1.00 1.00 H new ATOM 0 HH21 ARG A 120 -21.321 4.464 -0.364 1.00 1.00 H new ATOM 0 HH22 ARG A 120 -22.143 5.827 0.403 1.00 1.00 H new ATOM 1967 N LEU A 121 -14.808 4.174 -0.727 1.00 1.00 N ATOM 1968 CA LEU A 121 -13.416 3.766 -0.622 1.00 1.00 C ATOM 1969 C LEU A 121 -12.503 4.977 -0.813 1.00 1.00 C ATOM 1970 O LEU A 121 -11.547 4.932 -1.586 1.00 1.00 O ATOM 1971 CB LEU A 121 -13.013 2.542 -1.479 1.00 1.00 C ATOM 1972 CG LEU A 121 -13.715 1.195 -1.210 1.00 1.00 C ATOM 1973 CD1 LEU A 121 -14.346 1.037 0.182 1.00 1.00 C ATOM 1974 CD2 LEU A 121 -14.769 0.872 -2.269 1.00 1.00 C ATOM 0 H LEU A 121 -15.251 4.265 0.188 1.00 1.00 H new ATOM 0 HA LEU A 121 -13.282 3.386 0.391 1.00 1.00 H new ATOM 0 HB2 LEU A 121 -13.179 2.800 -2.525 1.00 1.00 H new ATOM 0 HB3 LEU A 121 -11.941 2.388 -1.355 1.00 1.00 H new ATOM 0 HG LEU A 121 -12.892 0.482 -1.259 1.00 1.00 H new ATOM 0 HD11 LEU A 121 -14.811 0.054 0.261 1.00 1.00 H new ATOM 0 HD12 LEU A 121 -13.574 1.136 0.945 1.00 1.00 H new ATOM 0 HD13 LEU A 121 -15.102 1.809 0.329 1.00 1.00 H new ATOM 0 HD21 LEU A 121 -15.236 -0.085 -2.037 1.00 1.00 H new ATOM 0 HD22 LEU A 121 -15.528 1.654 -2.277 1.00 1.00 H new ATOM 0 HD23 LEU A 121 -14.295 0.817 -3.249 1.00 1.00 H new ATOM 1986 N ASP A 122 -12.784 6.045 -0.073 1.00 1.00 N ATOM 1987 CA ASP A 122 -11.841 7.111 0.241 1.00 1.00 C ATOM 1988 C ASP A 122 -11.456 6.893 1.707 1.00 1.00 C ATOM 1989 O ASP A 122 -12.022 6.033 2.388 1.00 1.00 O ATOM 1990 CB ASP A 122 -12.365 8.554 0.054 1.00 1.00 C ATOM 1991 CG ASP A 122 -13.271 8.908 -1.125 1.00 1.00 C ATOM 1992 OD1 ASP A 122 -13.552 8.100 -2.039 1.00 1.00 O ATOM 1993 OD2 ASP A 122 -13.725 10.077 -1.132 1.00 1.00 O ATOM 0 H ASP A 122 -13.705 6.196 0.338 1.00 1.00 H new ATOM 0 HA ASP A 122 -11.010 7.044 -0.461 1.00 1.00 H new ATOM 0 HB2 ASP A 122 -12.903 8.820 0.964 1.00 1.00 H new ATOM 0 HB3 ASP A 122 -11.494 9.207 -0.003 1.00 1.00 H new ATOM 1998 N GLY A 123 -10.500 7.651 2.231 1.00 1.00 N ATOM 1999 CA GLY A 123 -10.061 7.491 3.604 1.00 1.00 C ATOM 2000 C GLY A 123 -8.752 8.250 3.817 1.00 1.00 C ATOM 2001 O GLY A 123 -8.572 9.305 3.208 1.00 1.00 O ATOM 0 H GLY A 123 -10.014 8.386 1.718 1.00 1.00 H new ATOM 0 HA2 GLY A 123 -10.825 7.865 4.286 1.00 1.00 H new ATOM 0 HA3 GLY A 123 -9.921 6.434 3.831 1.00 1.00 H new ATOM 2005 N MET A 124 -7.866 7.792 4.697 1.00 1.00 N ATOM 2006 CA MET A 124 -6.654 8.513 5.102 1.00 1.00 C ATOM 2007 C MET A 124 -5.462 7.565 5.064 1.00 1.00 C ATOM 2008 O MET A 124 -5.583 6.411 5.452 1.00 1.00 O ATOM 2009 CB MET A 124 -6.814 9.026 6.531 1.00 1.00 C ATOM 2010 CG MET A 124 -7.686 10.271 6.701 1.00 1.00 C ATOM 2011 SD MET A 124 -7.024 11.816 6.017 1.00 1.00 S ATOM 2012 CE MET A 124 -5.431 11.930 6.882 1.00 1.00 C ATOM 0 H MET A 124 -7.969 6.890 5.161 1.00 1.00 H new ATOM 0 HA MET A 124 -6.495 9.348 4.420 1.00 1.00 H new ATOM 0 HB2 MET A 124 -7.236 8.225 7.139 1.00 1.00 H new ATOM 0 HB3 MET A 124 -5.824 9.242 6.932 1.00 1.00 H new ATOM 0 HG2 MET A 124 -8.653 10.078 6.236 1.00 1.00 H new ATOM 0 HG3 MET A 124 -7.868 10.418 7.766 1.00 1.00 H new ATOM 0 HE1 MET A 124 -4.981 12.904 6.689 1.00 1.00 H new ATOM 0 HE2 MET A 124 -5.590 11.810 7.954 1.00 1.00 H new ATOM 0 HE3 MET A 124 -4.765 11.145 6.524 1.00 1.00 H new ATOM 2022 N GLY A 125 -4.301 8.028 4.621 1.00 1.00 N ATOM 2023 CA GLY A 125 -3.092 7.233 4.546 1.00 1.00 C ATOM 2024 C GLY A 125 -1.905 8.106 4.194 1.00 1.00 C ATOM 2025 O GLY A 125 -2.017 9.327 4.086 1.00 1.00 O ATOM 0 H GLY A 125 -4.175 8.987 4.298 1.00 1.00 H new ATOM 0 HA2 GLY A 125 -2.916 6.737 5.500 1.00 1.00 H new ATOM 0 HA3 GLY A 125 -3.210 6.450 3.797 1.00 1.00 H new ATOM 2029 N CYS A 126 -0.744 7.481 4.074 1.00 1.00 N ATOM 2030 CA CYS A 126 0.550 8.135 3.968 1.00 1.00 C ATOM 2031 C CYS A 126 1.619 7.067 3.830 1.00 1.00 C ATOM 2032 O CYS A 126 1.321 5.871 3.756 1.00 1.00 O ATOM 2033 CB CYS A 126 0.809 9.016 5.201 1.00 1.00 C ATOM 2034 SG CYS A 126 0.309 8.194 6.744 1.00 1.00 S ATOM 0 H CYS A 126 -0.675 6.464 4.047 1.00 1.00 H new ATOM 0 HA CYS A 126 0.569 8.784 3.092 1.00 1.00 H new ATOM 0 HB2 CYS A 126 1.869 9.267 5.251 1.00 1.00 H new ATOM 0 HB3 CYS A 126 0.264 9.954 5.097 1.00 1.00 H new ATOM 0 HG CYS A 126 0.551 8.979 7.752 1.00 1.00 H new ATOM 2040 N LEU A 127 2.874 7.501 3.801 1.00 1.00 N ATOM 2041 CA LEU A 127 3.989 6.581 3.785 1.00 1.00 C ATOM 2042 C LEU A 127 4.636 6.492 5.159 1.00 1.00 C ATOM 2043 O LEU A 127 4.401 7.322 6.042 1.00 1.00 O ATOM 2044 CB LEU A 127 5.006 6.997 2.720 1.00 1.00 C ATOM 2045 CG LEU A 127 4.440 6.989 1.289 1.00 1.00 C ATOM 2046 CD1 LEU A 127 5.509 7.574 0.394 1.00 1.00 C ATOM 2047 CD2 LEU A 127 4.055 5.614 0.749 1.00 1.00 C ATOM 0 H LEU A 127 3.138 8.486 3.788 1.00 1.00 H new ATOM 0 HA LEU A 127 3.617 5.589 3.530 1.00 1.00 H new ATOM 0 HB2 LEU A 127 5.372 7.997 2.951 1.00 1.00 H new ATOM 0 HB3 LEU A 127 5.863 6.325 2.766 1.00 1.00 H new ATOM 0 HG LEU A 127 3.513 7.562 1.307 1.00 1.00 H new ATOM 0 HD11 LEU A 127 5.153 7.589 -0.636 1.00 1.00 H new ATOM 0 HD12 LEU A 127 5.736 8.591 0.715 1.00 1.00 H new ATOM 0 HD13 LEU A 127 6.410 6.964 0.457 1.00 1.00 H new ATOM 0 HD21 LEU A 127 3.668 5.717 -0.265 1.00 1.00 H new ATOM 0 HD22 LEU A 127 4.933 4.968 0.738 1.00 1.00 H new ATOM 0 HD23 LEU A 127 3.289 5.174 1.387 1.00 1.00 H new ATOM 2059 N GLU A 128 5.491 5.492 5.304 1.00 1.00 N ATOM 2060 CA GLU A 128 6.556 5.388 6.313 1.00 1.00 C ATOM 2061 C GLU A 128 7.777 4.723 5.648 1.00 1.00 C ATOM 2062 O GLU A 128 7.753 4.505 4.444 1.00 1.00 O ATOM 2063 CB GLU A 128 6.025 4.621 7.546 1.00 1.00 C ATOM 2064 CG GLU A 128 6.572 5.115 8.891 1.00 1.00 C ATOM 2065 CD GLU A 128 5.891 6.411 9.340 1.00 1.00 C ATOM 2066 OE1 GLU A 128 4.782 6.340 9.923 1.00 1.00 O ATOM 2067 OE2 GLU A 128 6.426 7.508 9.065 1.00 1.00 O ATOM 0 H GLU A 128 5.466 4.679 4.689 1.00 1.00 H new ATOM 0 HA GLU A 128 6.870 6.366 6.678 1.00 1.00 H new ATOM 0 HB2 GLU A 128 4.938 4.694 7.562 1.00 1.00 H new ATOM 0 HB3 GLU A 128 6.272 3.565 7.434 1.00 1.00 H new ATOM 0 HG2 GLU A 128 6.424 4.345 9.648 1.00 1.00 H new ATOM 0 HG3 GLU A 128 7.646 5.279 8.808 1.00 1.00 H new ATOM 2074 N PHE A 129 8.844 4.400 6.377 1.00 1.00 N ATOM 2075 CA PHE A 129 9.943 3.542 5.899 1.00 1.00 C ATOM 2076 C PHE A 129 9.880 2.218 6.644 1.00 1.00 C ATOM 2077 O PHE A 129 9.879 2.246 7.878 1.00 1.00 O ATOM 2078 CB PHE A 129 11.290 4.237 6.125 1.00 1.00 C ATOM 2079 CG PHE A 129 12.533 3.447 5.749 1.00 1.00 C ATOM 2080 CD1 PHE A 129 12.957 3.430 4.412 1.00 1.00 C ATOM 2081 CD2 PHE A 129 13.299 2.774 6.720 1.00 1.00 C ATOM 2082 CE1 PHE A 129 14.110 2.728 4.027 1.00 1.00 C ATOM 2083 CE2 PHE A 129 14.480 2.103 6.342 1.00 1.00 C ATOM 2084 CZ PHE A 129 14.877 2.062 4.995 1.00 1.00 C ATOM 0 H PHE A 129 8.978 4.729 7.333 1.00 1.00 H new ATOM 0 HA PHE A 129 9.841 3.359 4.829 1.00 1.00 H new ATOM 0 HB2 PHE A 129 11.293 5.168 5.558 1.00 1.00 H new ATOM 0 HB3 PHE A 129 11.363 4.506 7.179 1.00 1.00 H new ATOM 0 HD1 PHE A 129 12.387 3.966 3.667 1.00 1.00 H new ATOM 0 HD2 PHE A 129 12.982 2.772 7.753 1.00 1.00 H new ATOM 0 HE1 PHE A 129 14.406 2.701 2.989 1.00 1.00 H new ATOM 0 HE2 PHE A 129 15.084 1.617 7.094 1.00 1.00 H new ATOM 0 HZ PHE A 129 15.766 1.522 4.707 1.00 1.00 H new ATOM 2094 N ASP A 130 9.793 1.077 5.950 1.00 1.00 N ATOM 2095 CA ASP A 130 9.802 -0.205 6.609 1.00 1.00 C ATOM 2096 C ASP A 130 11.288 -0.542 6.723 1.00 1.00 C ATOM 2097 O ASP A 130 11.868 -1.084 5.782 1.00 1.00 O ATOM 2098 CB ASP A 130 9.106 -1.357 5.844 1.00 1.00 C ATOM 2099 CG ASP A 130 8.371 -1.208 4.507 1.00 1.00 C ATOM 2100 OD1 ASP A 130 8.847 -0.427 3.659 1.00 1.00 O ATOM 2101 OD2 ASP A 130 7.338 -1.913 4.339 1.00 1.00 O ATOM 0 H ASP A 130 9.716 1.030 4.934 1.00 1.00 H new ATOM 0 HA ASP A 130 9.250 -0.125 7.545 1.00 1.00 H new ATOM 0 HB2 ASP A 130 9.873 -2.114 5.681 1.00 1.00 H new ATOM 0 HB3 ASP A 130 8.381 -1.782 6.538 1.00 1.00 H new ATOM 2106 N GLU A 131 11.941 -0.234 7.846 1.00 1.00 N ATOM 2107 CA GLU A 131 13.339 -0.648 7.980 1.00 1.00 C ATOM 2108 C GLU A 131 13.479 -2.167 7.920 1.00 1.00 C ATOM 2109 O GLU A 131 14.445 -2.669 7.361 1.00 1.00 O ATOM 2110 CB GLU A 131 14.037 -0.078 9.219 1.00 1.00 C ATOM 2111 CG GLU A 131 13.355 -0.357 10.564 1.00 1.00 C ATOM 2112 CD GLU A 131 12.339 0.717 10.932 1.00 1.00 C ATOM 2113 OE1 GLU A 131 12.731 1.902 10.987 1.00 1.00 O ATOM 2114 OE2 GLU A 131 11.181 0.361 11.256 1.00 1.00 O ATOM 0 H GLU A 131 11.550 0.275 8.639 1.00 1.00 H new ATOM 0 HA GLU A 131 13.855 -0.217 7.122 1.00 1.00 H new ATOM 0 HB2 GLU A 131 15.050 -0.479 9.258 1.00 1.00 H new ATOM 0 HB3 GLU A 131 14.126 1.001 9.097 1.00 1.00 H new ATOM 0 HG2 GLU A 131 12.857 -1.326 10.522 1.00 1.00 H new ATOM 0 HG3 GLU A 131 14.112 -0.421 11.346 1.00 1.00 H new ATOM 2121 N GLU A 132 12.513 -2.909 8.452 1.00 1.00 N ATOM 2122 CA GLU A 132 12.560 -4.363 8.462 1.00 1.00 C ATOM 2123 C GLU A 132 12.436 -4.931 7.054 1.00 1.00 C ATOM 2124 O GLU A 132 13.243 -5.760 6.636 1.00 1.00 O ATOM 2125 CB GLU A 132 11.416 -4.865 9.347 1.00 1.00 C ATOM 2126 CG GLU A 132 11.472 -6.375 9.624 1.00 1.00 C ATOM 2127 CD GLU A 132 10.275 -7.179 9.101 1.00 1.00 C ATOM 2128 OE1 GLU A 132 9.172 -6.616 8.899 1.00 1.00 O ATOM 2129 OE2 GLU A 132 10.418 -8.412 8.958 1.00 1.00 O ATOM 0 H GLU A 132 11.678 -2.518 8.887 1.00 1.00 H new ATOM 0 HA GLU A 132 13.520 -4.696 8.856 1.00 1.00 H new ATOM 0 HB2 GLU A 132 11.439 -4.329 10.296 1.00 1.00 H new ATOM 0 HB3 GLU A 132 10.466 -4.626 8.869 1.00 1.00 H new ATOM 0 HG2 GLU A 132 12.382 -6.777 9.178 1.00 1.00 H new ATOM 0 HG3 GLU A 132 11.550 -6.528 10.700 1.00 1.00 H new ATOM 2136 N ARG A 133 11.431 -4.490 6.298 1.00 1.00 N ATOM 2137 CA ARG A 133 11.286 -4.934 4.926 1.00 1.00 C ATOM 2138 C ARG A 133 12.472 -4.458 4.101 1.00 1.00 C ATOM 2139 O ARG A 133 12.916 -5.233 3.263 1.00 1.00 O ATOM 2140 CB ARG A 133 9.996 -4.374 4.356 1.00 1.00 C ATOM 2141 CG ARG A 133 9.515 -5.017 3.070 1.00 1.00 C ATOM 2142 CD ARG A 133 8.830 -6.375 3.263 1.00 1.00 C ATOM 2143 NE ARG A 133 8.465 -6.937 1.954 1.00 1.00 N ATOM 2144 CZ ARG A 133 9.336 -7.473 1.089 1.00 1.00 C ATOM 2145 NH1 ARG A 133 10.604 -7.707 1.425 1.00 1.00 N ATOM 2146 NH2 ARG A 133 8.946 -7.761 -0.139 1.00 1.00 N ATOM 0 H ARG A 133 10.717 -3.834 6.614 1.00 1.00 H new ATOM 0 HA ARG A 133 11.253 -6.023 4.894 1.00 1.00 H new ATOM 0 HB2 ARG A 133 9.213 -4.476 5.107 1.00 1.00 H new ATOM 0 HB3 ARG A 133 10.131 -3.307 4.179 1.00 1.00 H new ATOM 0 HG2 ARG A 133 8.819 -4.339 2.576 1.00 1.00 H new ATOM 0 HG3 ARG A 133 10.366 -5.144 2.400 1.00 1.00 H new ATOM 0 HD2 ARG A 133 9.497 -7.058 3.789 1.00 1.00 H new ATOM 0 HD3 ARG A 133 7.940 -6.259 3.881 1.00 1.00 H new ATOM 0 HE ARG A 133 7.481 -6.917 1.686 1.00 1.00 H new ATOM 0 HH11 ARG A 133 10.934 -7.477 2.362 1.00 1.00 H new ATOM 0 HH12 ARG A 133 11.245 -8.116 0.745 1.00 1.00 H new ATOM 0 HH21 ARG A 133 7.985 -7.575 -0.426 1.00 1.00 H new ATOM 0 HH22 ARG A 133 9.606 -8.169 -0.801 1.00 1.00 H new ATOM 2160 N ALA A 134 12.995 -3.251 4.338 1.00 1.00 N ATOM 2161 CA ALA A 134 14.181 -2.757 3.663 1.00 1.00 C ATOM 2162 C ALA A 134 15.365 -3.663 3.969 1.00 1.00 C ATOM 2163 O ALA A 134 16.064 -4.010 3.024 1.00 1.00 O ATOM 2164 CB ALA A 134 14.486 -1.308 4.067 1.00 1.00 C ATOM 0 H ALA A 134 12.599 -2.592 5.008 1.00 1.00 H new ATOM 0 HA ALA A 134 13.997 -2.767 2.589 1.00 1.00 H new ATOM 0 HB1 ALA A 134 15.380 -0.965 3.545 1.00 1.00 H new ATOM 0 HB2 ALA A 134 13.643 -0.671 3.800 1.00 1.00 H new ATOM 0 HB3 ALA A 134 14.652 -1.258 5.143 1.00 1.00 H new ATOM 2170 N GLN A 135 15.577 -4.099 5.221 1.00 1.00 N ATOM 2171 CA GLN A 135 16.590 -5.097 5.520 1.00 1.00 C ATOM 2172 C GLN A 135 16.311 -6.403 4.779 1.00 1.00 C ATOM 2173 O GLN A 135 17.265 -7.079 4.383 1.00 1.00 O ATOM 2174 CB GLN A 135 16.636 -5.408 7.022 1.00 1.00 C ATOM 2175 CG GLN A 135 17.278 -4.322 7.888 1.00 1.00 C ATOM 2176 CD GLN A 135 17.524 -4.846 9.306 1.00 1.00 C ATOM 2177 OE1 GLN A 135 18.034 -5.950 9.494 1.00 1.00 O ATOM 2178 NE2 GLN A 135 17.159 -4.107 10.341 1.00 1.00 N ATOM 0 H GLN A 135 15.056 -3.771 6.034 1.00 1.00 H new ATOM 0 HA GLN A 135 17.544 -4.681 5.197 1.00 1.00 H new ATOM 0 HB2 GLN A 135 15.618 -5.578 7.374 1.00 1.00 H new ATOM 0 HB3 GLN A 135 17.183 -6.339 7.168 1.00 1.00 H new ATOM 0 HG2 GLN A 135 18.220 -4.003 7.443 1.00 1.00 H new ATOM 0 HG3 GLN A 135 16.630 -3.446 7.924 1.00 1.00 H new ATOM 0 HE21 GLN A 135 16.736 -3.191 10.190 1.00 1.00 H new ATOM 0 HE22 GLN A 135 17.301 -4.453 11.290 1.00 1.00 H new ATOM 2187 N GLN A 136 15.045 -6.814 4.629 1.00 1.00 N ATOM 2188 CA GLN A 136 14.784 -8.093 3.982 1.00 1.00 C ATOM 2189 C GLN A 136 15.055 -7.980 2.488 1.00 1.00 C ATOM 2190 O GLN A 136 15.687 -8.865 1.921 1.00 1.00 O ATOM 2191 CB GLN A 136 13.369 -8.592 4.300 1.00 1.00 C ATOM 2192 CG GLN A 136 13.303 -9.166 5.724 1.00 1.00 C ATOM 2193 CD GLN A 136 14.000 -10.526 5.822 1.00 1.00 C ATOM 2194 OE1 GLN A 136 13.392 -11.559 5.541 1.00 1.00 O ATOM 2195 NE2 GLN A 136 15.265 -10.590 6.201 1.00 1.00 N ATOM 0 H GLN A 136 14.219 -6.299 4.935 1.00 1.00 H new ATOM 0 HA GLN A 136 15.464 -8.847 4.379 1.00 1.00 H new ATOM 0 HB2 GLN A 136 12.658 -7.772 4.200 1.00 1.00 H new ATOM 0 HB3 GLN A 136 13.077 -9.357 3.580 1.00 1.00 H new ATOM 0 HG2 GLN A 136 13.769 -8.468 6.419 1.00 1.00 H new ATOM 0 HG3 GLN A 136 12.261 -9.269 6.026 1.00 1.00 H new ATOM 0 HE21 GLN A 136 15.771 -9.736 6.434 1.00 1.00 H new ATOM 0 HE22 GLN A 136 15.735 -11.494 6.260 1.00 1.00 H new ATOM 2204 N GLU A 137 14.634 -6.891 1.857 1.00 1.00 N ATOM 2205 CA GLU A 137 14.829 -6.669 0.442 1.00 1.00 C ATOM 2206 C GLU A 137 16.295 -6.373 0.132 1.00 1.00 C ATOM 2207 O GLU A 137 16.786 -6.773 -0.919 1.00 1.00 O ATOM 2208 CB GLU A 137 13.911 -5.523 -0.010 1.00 1.00 C ATOM 2209 CG GLU A 137 13.291 -5.848 -1.372 1.00 1.00 C ATOM 2210 CD GLU A 137 12.131 -6.847 -1.230 1.00 1.00 C ATOM 2211 OE1 GLU A 137 12.314 -7.973 -0.725 1.00 1.00 O ATOM 2212 OE2 GLU A 137 10.978 -6.497 -1.546 1.00 1.00 O ATOM 0 H GLU A 137 14.142 -6.131 2.326 1.00 1.00 H new ATOM 0 HA GLU A 137 14.568 -7.571 -0.111 1.00 1.00 H new ATOM 0 HB2 GLU A 137 13.124 -5.365 0.728 1.00 1.00 H new ATOM 0 HB3 GLU A 137 14.480 -4.595 -0.073 1.00 1.00 H new ATOM 0 HG2 GLU A 137 12.930 -4.931 -1.838 1.00 1.00 H new ATOM 0 HG3 GLU A 137 14.053 -6.263 -2.032 1.00 1.00 H new ATOM 2219 N ASP A 138 17.018 -5.745 1.064 1.00 1.00 N ATOM 2220 CA ASP A 138 18.456 -5.509 0.981 1.00 1.00 C ATOM 2221 C ASP A 138 19.191 -6.838 0.852 1.00 1.00 C ATOM 2222 O ASP A 138 20.199 -6.897 0.150 1.00 1.00 O ATOM 2223 CB ASP A 138 18.995 -4.803 2.241 1.00 1.00 C ATOM 2224 CG ASP A 138 19.009 -3.279 2.221 1.00 1.00 C ATOM 2225 OD1 ASP A 138 18.936 -2.658 1.137 1.00 1.00 O ATOM 2226 OD2 ASP A 138 19.218 -2.677 3.298 1.00 1.00 O ATOM 0 H ASP A 138 16.604 -5.377 1.921 1.00 1.00 H new ATOM 0 HA ASP A 138 18.625 -4.875 0.111 1.00 1.00 H new ATOM 0 HB2 ASP A 138 18.398 -5.126 3.093 1.00 1.00 H new ATOM 0 HB3 ASP A 138 20.013 -5.150 2.416 1.00 1.00 H new ATOM 2231 N ALA A 139 18.729 -7.874 1.564 1.00 1.00 N ATOM 2232 CA ALA A 139 19.214 -9.241 1.452 1.00 1.00 C ATOM 2233 C ALA A 139 18.688 -9.947 0.195 1.00 1.00 C ATOM 2234 O ALA A 139 19.445 -10.648 -0.479 1.00 1.00 O ATOM 2235 CB ALA A 139 18.849 -10.020 2.718 1.00 1.00 C ATOM 0 H ALA A 139 17.984 -7.773 2.253 1.00 1.00 H new ATOM 0 HA ALA A 139 20.299 -9.206 1.351 1.00 1.00 H new ATOM 0 HB1 ALA A 139 19.213 -11.044 2.633 1.00 1.00 H new ATOM 0 HB2 ALA A 139 19.308 -9.543 3.584 1.00 1.00 H new ATOM 0 HB3 ALA A 139 17.766 -10.029 2.840 1.00 1.00 H new ATOM 2241 N LEU A 140 17.396 -9.819 -0.126 1.00 1.00 N ATOM 2242 CA LEU A 140 16.774 -10.451 -1.288 1.00 1.00 C ATOM 2243 C LEU A 140 17.271 -9.876 -2.613 1.00 1.00 C ATOM 2244 O LEU A 140 17.124 -10.512 -3.654 1.00 1.00 O ATOM 2245 CB LEU A 140 15.238 -10.393 -1.218 1.00 1.00 C ATOM 2246 CG LEU A 140 14.594 -11.326 -0.173 1.00 1.00 C ATOM 2247 CD1 LEU A 140 13.076 -11.336 -0.367 1.00 1.00 C ATOM 2248 CD2 LEU A 140 15.133 -12.757 -0.258 1.00 1.00 C ATOM 0 H LEU A 140 16.744 -9.262 0.427 1.00 1.00 H new ATOM 0 HA LEU A 140 17.080 -11.497 -1.255 1.00 1.00 H new ATOM 0 HB2 LEU A 140 14.938 -9.368 -1.000 1.00 1.00 H new ATOM 0 HB3 LEU A 140 14.836 -10.641 -2.200 1.00 1.00 H new ATOM 0 HG LEU A 140 14.849 -10.941 0.814 1.00 1.00 H new ATOM 0 HD11 LEU A 140 12.619 -11.995 0.371 1.00 1.00 H new ATOM 0 HD12 LEU A 140 12.687 -10.326 -0.242 1.00 1.00 H new ATOM 0 HD13 LEU A 140 12.840 -11.694 -1.369 1.00 1.00 H new ATOM 0 HD21 LEU A 140 14.648 -13.374 0.498 1.00 1.00 H new ATOM 0 HD22 LEU A 140 14.926 -13.166 -1.247 1.00 1.00 H new ATOM 0 HD23 LEU A 140 16.209 -12.751 -0.086 1.00 1.00 H new ATOM 2260 N ALA A 141 17.951 -8.734 -2.567 1.00 1.00 N ATOM 2261 CA ALA A 141 18.796 -8.170 -3.612 1.00 1.00 C ATOM 2262 C ALA A 141 20.014 -9.052 -3.950 1.00 1.00 C ATOM 2263 O ALA A 141 20.864 -8.620 -4.728 1.00 1.00 O ATOM 2264 CB ALA A 141 19.267 -6.790 -3.149 1.00 1.00 C ATOM 0 H ALA A 141 17.923 -8.138 -1.740 1.00 1.00 H new ATOM 0 HA ALA A 141 18.205 -8.105 -4.525 1.00 1.00 H new ATOM 0 HB1 ALA A 141 19.902 -6.346 -3.916 1.00 1.00 H new ATOM 0 HB2 ALA A 141 18.402 -6.149 -2.979 1.00 1.00 H new ATOM 0 HB3 ALA A 141 19.832 -6.890 -2.223 1.00 1.00 H new ATOM 2270 N GLN A 142 20.109 -10.264 -3.396 1.00 1.00 N ATOM 2271 CA GLN A 142 21.286 -11.094 -3.209 1.00 1.00 C ATOM 2272 C GLN A 142 22.376 -10.298 -2.497 1.00 1.00 C ATOM 2273 O GLN A 142 23.356 -9.842 -3.086 1.00 1.00 O ATOM 2274 CB GLN A 142 21.722 -11.781 -4.502 1.00 1.00 C ATOM 2275 CG GLN A 142 20.933 -13.058 -4.822 1.00 1.00 C ATOM 2276 CD GLN A 142 19.429 -12.837 -4.919 1.00 1.00 C ATOM 2277 OE1 GLN A 142 18.953 -12.161 -5.830 1.00 1.00 O ATOM 2278 NE2 GLN A 142 18.671 -13.393 -3.991 1.00 1.00 N ATOM 0 H GLN A 142 19.276 -10.728 -3.034 1.00 1.00 H new ATOM 0 HA GLN A 142 21.041 -11.927 -2.550 1.00 1.00 H new ATOM 0 HB2 GLN A 142 21.612 -11.080 -5.330 1.00 1.00 H new ATOM 0 HB3 GLN A 142 22.781 -12.028 -4.432 1.00 1.00 H new ATOM 0 HG2 GLN A 142 21.293 -13.471 -5.764 1.00 1.00 H new ATOM 0 HG3 GLN A 142 21.134 -13.802 -4.051 1.00 1.00 H new ATOM 0 HE21 GLN A 142 19.098 -13.948 -3.249 1.00 1.00 H new ATOM 0 HE22 GLN A 142 17.659 -13.268 -4.016 1.00 1.00 H new ATOM 2287 N GLN A 143 22.175 -10.155 -1.195 1.00 1.00 N ATOM 2288 CA GLN A 143 23.190 -9.848 -0.214 1.00 1.00 C ATOM 2289 C GLN A 143 22.837 -10.740 0.969 1.00 1.00 C ATOM 2290 O GLN A 143 22.581 -10.227 2.075 1.00 1.00 O ATOM 2291 CB GLN A 143 23.172 -8.337 0.055 1.00 1.00 C ATOM 2292 CG GLN A 143 24.413 -7.841 0.805 1.00 1.00 C ATOM 2293 CD GLN A 143 24.433 -6.320 0.980 1.00 1.00 C ATOM 2294 OE1 GLN A 143 25.495 -5.699 0.981 1.00 1.00 O ATOM 2295 NE2 GLN A 143 23.285 -5.681 1.140 1.00 1.00 N ATOM 0 H GLN A 143 21.249 -10.257 -0.779 1.00 1.00 H new ATOM 0 HA GLN A 143 24.219 -10.051 -0.511 1.00 1.00 H new ATOM 0 HB2 GLN A 143 23.093 -7.807 -0.894 1.00 1.00 H new ATOM 0 HB3 GLN A 143 22.282 -8.088 0.634 1.00 1.00 H new ATOM 0 HG2 GLN A 143 24.453 -8.315 1.786 1.00 1.00 H new ATOM 0 HG3 GLN A 143 25.307 -8.152 0.264 1.00 1.00 H new ATOM 0 HE21 GLN A 143 22.407 -6.201 1.138 1.00 1.00 H new ATOM 0 HE22 GLN A 143 23.278 -4.669 1.265 1.00 1.00 H new