USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 930 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 59 MET CE :methyl -166:sc= -1.26 (180deg=-2.05) USER MOD Set 1.2: A 115 HIS : no HD1:sc= -7.51! K(o=-8.8!,f=-6.7) USER MOD Set 2.1: A 53 HIS : no HD1:sc= -2.21 K(o=-1.4,f=-9.9!) USER MOD Set 2.2: A 99 TYR OH : rot 119:sc= 0.837 USER MOD Set 3.1: A 33 LYS NZ :NH3+ 171:sc= 1.26 (180deg=1.2) USER MOD Set 3.2: A 38 SER OG : rot -144:sc= 1.21 USER MOD Set 4.1: A 6 THR OG1 : rot 158:sc= 1.42 USER MOD Set 4.2: A 35 GLN : amide:sc= 0.987 K(o=2.4,f=0.75) USER MOD Single : A 10 HIS : no HD1:sc= -0.277 K(o=-0.28,f=-1.1) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 180:sc=-0.00621 USER MOD Single : A 29 MET CE :methyl 176:sc= -0.408 (180deg=-0.475) USER MOD Single : A 40 LYS NZ :NH3+ 137:sc= 1.73 (180deg=0.219) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.049) USER MOD Single : A 55 THR OG1 : rot 75:sc= 0.985 USER MOD Single : A 57 LYS NZ :NH3+ -145:sc= -0.0134 (180deg=-2.23!) USER MOD Single : A 68 ASN : amide:sc= 0.162 K(o=0.16,f=-6.7!) USER MOD Single : A 71 ASN : amide:sc= -0.212 X(o=-0.21,f=-0.082) USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 91 ASN : amide:sc= 0.323 K(o=0.32,f=-0.57) USER MOD Single : A 93 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 95 THR OG1 : rot -107:sc= 1.07 USER MOD Single : A 97 THR OG1 : rot 128:sc= 1.21 USER MOD Single : A 100 CYS SG : rot 101:sc= 0.0673 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 76:sc= 0.318 USER MOD Single : A 104 MET CE :methyl 179:sc= -1.11 (180deg=-1.12) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 158:sc= 1.29 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 CYS SG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -164:sc= 2.49 (180deg=1.49) USER MOD ----------------------------------------------------------------- ATOM 38 N GLY A 4 -2.417 5.307 3.047 1.00 0.00 N ATOM 39 CA GLY A 4 -3.489 5.631 3.980 1.00 0.00 C ATOM 40 C GLY A 4 -3.162 6.878 4.786 1.00 0.00 C ATOM 41 O GLY A 4 -3.078 6.820 6.012 1.00 0.00 O ATOM 0 HA2 GLY A 4 -4.418 5.784 3.431 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.652 4.791 4.655 1.00 0.00 H new ATOM 45 N ASP A 5 -2.993 7.999 4.085 1.00 0.00 N ATOM 46 CA ASP A 5 -2.699 9.286 4.684 1.00 0.00 C ATOM 47 C ASP A 5 -2.936 10.388 3.650 1.00 0.00 C ATOM 48 O ASP A 5 -3.623 11.366 3.934 1.00 0.00 O ATOM 49 CB ASP A 5 -1.227 9.329 5.174 1.00 0.00 C ATOM 50 CG ASP A 5 -0.970 10.576 6.014 1.00 0.00 C ATOM 51 OD1 ASP A 5 -1.728 10.772 6.990 1.00 0.00 O ATOM 52 OD2 ASP A 5 -0.003 11.298 5.694 1.00 0.00 O ATOM 0 H ASP A 5 -3.059 8.031 3.068 1.00 0.00 H new ATOM 0 HA ASP A 5 -3.354 9.441 5.541 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.009 8.438 5.763 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.554 9.318 4.317 1.00 0.00 H new ATOM 57 N THR A 6 -2.359 10.197 2.455 1.00 0.00 N ATOM 58 CA THR A 6 -2.394 11.057 1.286 1.00 0.00 C ATOM 59 C THR A 6 -2.048 12.492 1.631 1.00 0.00 C ATOM 60 O THR A 6 -1.348 12.715 2.612 1.00 0.00 O ATOM 61 CB THR A 6 -3.639 10.846 0.438 1.00 0.00 C ATOM 62 OG1 THR A 6 -3.439 11.405 -0.843 1.00 0.00 O ATOM 63 CG2 THR A 6 -4.814 11.507 1.126 1.00 0.00 C ATOM 0 H THR A 6 -1.808 9.357 2.277 1.00 0.00 H new ATOM 0 HA THR A 6 -1.593 10.752 0.613 1.00 0.00 H new ATOM 0 HB THR A 6 -3.841 9.781 0.323 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.055 10.988 -1.482 1.00 0.00 H new ATOM 0 HG21 THR A 6 -5.714 11.363 0.528 1.00 0.00 H new ATOM 0 HG22 THR A 6 -4.957 11.061 2.110 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.618 12.574 1.236 1.00 0.00 H new ATOM 71 N PHE A 7 -2.468 13.437 0.777 1.00 0.00 N ATOM 72 CA PHE A 7 -2.064 14.826 0.856 1.00 0.00 C ATOM 73 C PHE A 7 -3.201 15.803 0.595 1.00 0.00 C ATOM 74 O PHE A 7 -4.299 15.382 0.228 1.00 0.00 O ATOM 75 CB PHE A 7 -0.851 14.929 -0.063 1.00 0.00 C ATOM 76 CG PHE A 7 0.079 13.704 0.189 1.00 0.00 C ATOM 77 CD1 PHE A 7 0.926 13.649 1.326 1.00 0.00 C ATOM 78 CD2 PHE A 7 0.045 12.560 -0.653 1.00 0.00 C ATOM 79 CE1 PHE A 7 1.749 12.537 1.571 1.00 0.00 C ATOM 80 CE2 PHE A 7 0.874 11.452 -0.405 1.00 0.00 C ATOM 81 CZ PHE A 7 1.736 11.443 0.698 1.00 0.00 C ATOM 0 H PHE A 7 -3.106 13.243 0.006 1.00 0.00 H new ATOM 0 HA PHE A 7 -1.783 15.129 1.865 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -1.169 14.953 -1.105 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -0.312 15.857 0.127 1.00 0.00 H new ATOM 0 HD1 PHE A 7 0.938 14.479 2.017 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -0.629 12.541 -1.497 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.395 12.526 2.437 1.00 0.00 H new ATOM 0 HE2 PHE A 7 0.846 10.602 -1.070 1.00 0.00 H new ATOM 0 HZ PHE A 7 2.386 10.599 0.874 1.00 0.00 H new ATOM 91 N ILE A 8 -2.943 17.096 0.846 1.00 0.00 N ATOM 92 CA ILE A 8 -3.953 18.141 0.775 1.00 0.00 C ATOM 93 C ILE A 8 -3.806 19.135 -0.366 1.00 0.00 C ATOM 94 O ILE A 8 -2.724 19.309 -0.922 1.00 0.00 O ATOM 95 CB ILE A 8 -4.087 18.792 2.169 1.00 0.00 C ATOM 96 CG1 ILE A 8 -4.700 17.693 3.053 1.00 0.00 C ATOM 97 CG2 ILE A 8 -4.910 20.091 2.207 1.00 0.00 C ATOM 98 CD1 ILE A 8 -5.209 18.236 4.370 1.00 0.00 C ATOM 0 H ILE A 8 -2.018 17.439 1.105 1.00 0.00 H new ATOM 0 HA ILE A 8 -4.895 17.663 0.506 1.00 0.00 H new ATOM 0 HB ILE A 8 -3.111 19.128 2.518 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.520 17.214 2.518 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -3.952 16.924 3.244 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -4.945 20.470 3.229 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -4.445 20.835 1.560 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -5.923 19.890 1.859 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -5.633 17.423 4.959 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -4.385 18.691 4.919 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.977 18.986 4.182 1.00 0.00 H new ATOM 110 N ARG A 9 -4.937 19.784 -0.684 1.00 0.00 N ATOM 111 CA ARG A 9 -5.047 20.802 -1.705 1.00 0.00 C ATOM 112 C ARG A 9 -4.924 22.128 -0.966 1.00 0.00 C ATOM 113 O ARG A 9 -3.962 22.863 -1.190 1.00 0.00 O ATOM 114 CB ARG A 9 -6.397 20.649 -2.461 1.00 0.00 C ATOM 115 CG ARG A 9 -6.393 21.328 -3.838 1.00 0.00 C ATOM 116 CD ARG A 9 -6.271 22.853 -3.749 1.00 0.00 C ATOM 117 NE ARG A 9 -6.570 23.491 -5.037 1.00 0.00 N ATOM 118 CZ ARG A 9 -6.680 24.817 -5.226 1.00 0.00 C ATOM 119 NH1 ARG A 9 -6.493 25.667 -4.207 1.00 0.00 N ATOM 120 NH2 ARG A 9 -6.979 25.290 -6.442 1.00 0.00 N ATOM 0 H ARG A 9 -5.822 19.598 -0.213 1.00 0.00 H new ATOM 0 HA ARG A 9 -4.275 20.728 -2.471 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.620 19.589 -2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.197 21.074 -1.855 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -5.565 20.936 -4.429 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.311 21.072 -4.367 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -6.954 23.230 -2.987 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -5.262 23.121 -3.434 1.00 0.00 H new ATOM 0 HE ARG A 9 -6.704 22.885 -5.846 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -6.265 25.309 -3.279 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -6.578 26.672 -4.359 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -7.122 24.645 -7.219 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -7.064 26.295 -6.591 1.00 0.00 H new ATOM 134 N HIS A 10 -5.889 22.427 -0.084 1.00 0.00 N ATOM 135 CA HIS A 10 -5.896 23.669 0.680 1.00 0.00 C ATOM 136 C HIS A 10 -6.997 23.775 1.745 1.00 0.00 C ATOM 137 O HIS A 10 -7.849 22.890 1.865 1.00 0.00 O ATOM 138 CB HIS A 10 -6.038 24.843 -0.317 1.00 0.00 C ATOM 139 CG HIS A 10 -7.464 25.262 -0.598 1.00 0.00 C ATOM 140 ND1 HIS A 10 -8.468 24.355 -0.901 1.00 0.00 N ATOM 141 CD2 HIS A 10 -8.078 26.491 -0.615 1.00 0.00 C ATOM 142 CE1 HIS A 10 -9.602 25.055 -1.081 1.00 0.00 C ATOM 143 NE2 HIS A 10 -9.428 26.366 -0.921 1.00 0.00 N ATOM 0 H HIS A 10 -6.680 21.814 0.114 1.00 0.00 H new ATOM 0 HA HIS A 10 -4.958 23.697 1.234 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -5.491 25.702 0.073 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -5.563 24.563 -1.258 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -7.579 27.428 -0.417 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -10.551 24.603 -1.329 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -10.124 27.107 -1.004 1.00 0.00 H new ATOM 151 N ILE A 11 -6.965 24.904 2.480 1.00 0.00 N ATOM 152 CA ILE A 11 -7.915 25.282 3.515 1.00 0.00 C ATOM 153 C ILE A 11 -8.809 26.416 3.003 1.00 0.00 C ATOM 154 O ILE A 11 -8.342 27.268 2.250 1.00 0.00 O ATOM 155 CB ILE A 11 -7.234 25.728 4.829 1.00 0.00 C ATOM 156 CG1 ILE A 11 -5.895 25.017 5.083 1.00 0.00 C ATOM 157 CG2 ILE A 11 -8.225 25.495 5.985 1.00 0.00 C ATOM 158 CD1 ILE A 11 -5.128 25.539 6.304 1.00 0.00 C ATOM 0 H ILE A 11 -6.234 25.604 2.352 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.504 24.393 3.741 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.984 26.786 4.752 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.081 23.951 5.214 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.266 25.125 4.199 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.767 25.803 6.925 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.128 26.080 5.813 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.482 24.437 6.036 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.196 24.985 6.412 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.907 26.598 6.170 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.735 25.406 7.199 1.00 0.00 H new ATOM 170 N ALA A 12 -10.073 26.452 3.437 1.00 0.00 N ATOM 171 CA ALA A 12 -11.046 27.477 3.125 1.00 0.00 C ATOM 172 C ALA A 12 -11.808 27.579 4.437 1.00 0.00 C ATOM 173 O ALA A 12 -12.349 26.576 4.888 1.00 0.00 O ATOM 174 CB ALA A 12 -11.981 27.050 2.000 1.00 0.00 C ATOM 0 H ALA A 12 -10.453 25.726 4.045 1.00 0.00 H new ATOM 0 HA ALA A 12 -10.598 28.409 2.781 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.695 27.848 1.798 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -11.399 26.847 1.101 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -12.518 26.149 2.296 1.00 0.00 H new ATOM 180 N LEU A 13 -11.841 28.741 5.084 1.00 0.00 N ATOM 181 CA LEU A 13 -12.521 28.863 6.365 1.00 0.00 C ATOM 182 C LEU A 13 -13.957 29.245 6.052 1.00 0.00 C ATOM 183 O LEU A 13 -14.187 30.038 5.140 1.00 0.00 O ATOM 184 CB LEU A 13 -11.783 29.876 7.249 1.00 0.00 C ATOM 185 CG LEU A 13 -11.836 29.765 8.800 1.00 0.00 C ATOM 186 CD1 LEU A 13 -10.896 30.828 9.355 1.00 0.00 C ATOM 187 CD2 LEU A 13 -13.126 29.961 9.571 1.00 0.00 C ATOM 0 H LEU A 13 -11.409 29.601 4.745 1.00 0.00 H new ATOM 0 HA LEU A 13 -12.524 27.935 6.936 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.732 29.847 6.961 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -12.158 30.865 6.985 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.601 28.711 8.945 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -10.902 30.786 10.444 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.885 30.646 8.990 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -11.228 31.814 9.028 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -12.935 29.839 10.637 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.513 30.963 9.384 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -13.859 29.222 9.247 1.00 0.00 H new ATOM 199 N LEU A 14 -14.917 28.679 6.785 1.00 0.00 N ATOM 200 CA LEU A 14 -16.321 28.988 6.544 1.00 0.00 C ATOM 201 C LEU A 14 -16.642 30.169 7.418 1.00 0.00 C ATOM 202 O LEU A 14 -17.114 31.195 6.931 1.00 0.00 O ATOM 203 CB LEU A 14 -17.251 27.793 6.861 1.00 0.00 C ATOM 204 CG LEU A 14 -18.335 27.656 5.774 1.00 0.00 C ATOM 205 CD1 LEU A 14 -17.754 27.210 4.416 1.00 0.00 C ATOM 206 CD2 LEU A 14 -19.411 26.677 6.254 1.00 0.00 C ATOM 0 H LEU A 14 -14.749 28.014 7.540 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.486 29.209 5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.667 26.874 6.920 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -17.719 27.936 7.835 1.00 0.00 H new ATOM 0 HG LEU A 14 -18.777 28.639 5.612 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -18.559 27.129 3.685 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -17.025 27.944 4.073 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -17.267 26.241 4.529 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -20.180 26.577 5.488 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -18.959 25.703 6.443 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -19.861 27.053 7.173 1.00 0.00 H new ATOM 218 N GLY A 15 -16.350 30.019 8.709 1.00 0.00 N ATOM 219 CA GLY A 15 -16.585 31.157 9.587 1.00 0.00 C ATOM 220 C GLY A 15 -16.806 30.836 11.050 1.00 0.00 C ATOM 221 O GLY A 15 -15.876 30.440 11.742 1.00 0.00 O ATOM 0 H GLY A 15 -15.975 29.178 9.147 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -15.733 31.832 9.509 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -17.456 31.700 9.220 1.00 0.00 H new ATOM 225 N PHE A 16 -18.039 31.045 11.517 1.00 0.00 N ATOM 226 CA PHE A 16 -18.400 30.902 12.916 1.00 0.00 C ATOM 227 C PHE A 16 -18.829 29.473 13.233 1.00 0.00 C ATOM 228 O PHE A 16 -18.808 28.616 12.356 1.00 0.00 O ATOM 229 CB PHE A 16 -19.526 31.907 13.222 1.00 0.00 C ATOM 230 CG PHE A 16 -19.177 33.356 12.790 1.00 0.00 C ATOM 231 CD1 PHE A 16 -18.211 34.116 13.498 1.00 0.00 C ATOM 232 CD2 PHE A 16 -19.794 33.966 11.668 1.00 0.00 C ATOM 233 CE1 PHE A 16 -17.884 35.425 13.106 1.00 0.00 C ATOM 234 CE2 PHE A 16 -19.464 35.278 11.281 1.00 0.00 C ATOM 235 CZ PHE A 16 -18.510 36.009 11.998 1.00 0.00 C ATOM 0 H PHE A 16 -18.819 31.321 10.921 1.00 0.00 H new ATOM 0 HA PHE A 16 -17.536 31.112 13.546 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.436 31.591 12.713 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -19.738 31.893 14.291 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -17.718 33.680 14.354 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -20.529 33.414 11.101 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -17.146 35.984 13.662 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -19.950 35.724 10.426 1.00 0.00 H new ATOM 0 HZ PHE A 16 -18.259 37.016 11.699 1.00 0.00 H new ATOM 245 N GLU A 17 -19.199 29.233 14.494 1.00 0.00 N ATOM 246 CA GLU A 17 -19.656 27.965 15.049 1.00 0.00 C ATOM 247 C GLU A 17 -20.139 28.240 16.485 1.00 0.00 C ATOM 248 O GLU A 17 -19.900 29.328 17.010 1.00 0.00 O ATOM 249 CB GLU A 17 -18.532 26.924 14.992 1.00 0.00 C ATOM 250 CG GLU A 17 -18.989 25.538 14.529 1.00 0.00 C ATOM 251 CD GLU A 17 -19.767 24.805 15.611 1.00 0.00 C ATOM 252 OE1 GLU A 17 -19.112 24.147 16.446 1.00 0.00 O ATOM 253 OE2 GLU A 17 -21.008 24.947 15.614 1.00 0.00 O ATOM 0 H GLU A 17 -19.185 29.971 15.197 1.00 0.00 H new ATOM 0 HA GLU A 17 -20.481 27.549 14.470 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -17.753 27.282 14.319 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -18.082 26.835 15.981 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -19.612 25.640 13.640 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -18.120 24.946 14.243 1.00 0.00 H new ATOM 260 N LYS A 18 -20.840 27.281 17.106 1.00 0.00 N ATOM 261 CA LYS A 18 -21.437 27.365 18.424 1.00 0.00 C ATOM 262 C LYS A 18 -21.222 26.105 19.293 1.00 0.00 C ATOM 263 O LYS A 18 -21.998 25.157 19.204 1.00 0.00 O ATOM 264 CB LYS A 18 -22.944 27.652 18.284 1.00 0.00 C ATOM 265 CG LYS A 18 -23.344 28.678 17.210 1.00 0.00 C ATOM 266 CD LYS A 18 -23.663 27.996 15.869 1.00 0.00 C ATOM 267 CE LYS A 18 -23.884 29.011 14.742 1.00 0.00 C ATOM 268 NZ LYS A 18 -25.070 29.856 14.977 1.00 0.00 N ATOM 0 H LYS A 18 -21.009 26.377 16.666 1.00 0.00 H new ATOM 0 HA LYS A 18 -20.931 28.179 18.943 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -23.453 26.713 18.067 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -23.317 28.001 19.247 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -24.214 29.241 17.549 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -22.535 29.395 17.071 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -22.845 27.328 15.599 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -24.555 27.379 15.980 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -23.002 29.644 14.648 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -23.999 28.482 13.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -25.180 30.527 14.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -25.917 29.256 15.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -24.951 30.382 15.866 1.00 0.00 H new ATOM 282 N ARG A 19 -20.206 26.100 20.168 1.00 0.00 N ATOM 283 CA ARG A 19 -19.918 25.043 21.126 1.00 0.00 C ATOM 284 C ARG A 19 -20.146 25.688 22.491 1.00 0.00 C ATOM 285 O ARG A 19 -19.327 26.478 22.956 1.00 0.00 O ATOM 286 CB ARG A 19 -18.488 24.496 20.962 1.00 0.00 C ATOM 287 CG ARG A 19 -18.494 22.992 20.663 1.00 0.00 C ATOM 288 CD ARG A 19 -18.900 22.713 19.214 1.00 0.00 C ATOM 289 NE ARG A 19 -18.995 21.270 18.953 1.00 0.00 N ATOM 290 CZ ARG A 19 -19.425 20.736 17.798 1.00 0.00 C ATOM 291 NH1 ARG A 19 -19.723 21.520 16.757 1.00 0.00 N ATOM 292 NH2 ARG A 19 -19.571 19.409 17.687 1.00 0.00 N ATOM 0 H ARG A 19 -19.539 26.869 20.223 1.00 0.00 H new ATOM 0 HA ARG A 19 -20.557 24.171 20.984 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -17.984 25.027 20.154 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -17.918 24.685 21.872 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -17.503 22.578 20.851 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -19.184 22.488 21.339 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -19.860 23.186 19.006 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.171 23.160 18.538 1.00 0.00 H new ATOM 0 HE ARG A 19 -18.716 20.632 19.698 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -19.624 22.532 16.836 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -20.049 21.106 15.884 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -19.356 18.804 18.480 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -19.898 19.003 16.810 1.00 0.00 H new ATOM 401 N TYR A 26 -17.661 30.276 21.797 1.00 0.00 N ATOM 402 CA TYR A 26 -17.929 29.959 20.394 1.00 0.00 C ATOM 403 C TYR A 26 -16.615 29.557 19.718 1.00 0.00 C ATOM 404 O TYR A 26 -15.539 29.962 20.162 1.00 0.00 O ATOM 405 CB TYR A 26 -18.659 31.083 19.633 1.00 0.00 C ATOM 406 CG TYR A 26 -20.214 31.048 19.713 1.00 0.00 C ATOM 407 CD1 TYR A 26 -20.896 30.368 20.758 1.00 0.00 C ATOM 408 CD2 TYR A 26 -21.013 31.692 18.732 1.00 0.00 C ATOM 409 CE1 TYR A 26 -22.299 30.341 20.821 1.00 0.00 C ATOM 410 CE2 TYR A 26 -22.418 31.664 18.802 1.00 0.00 C ATOM 411 CZ TYR A 26 -23.062 30.989 19.846 1.00 0.00 C ATOM 412 OH TYR A 26 -24.424 30.957 19.914 1.00 0.00 O ATOM 0 HA TYR A 26 -18.625 29.121 20.365 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -18.314 32.042 20.019 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -18.366 31.038 18.584 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.323 29.861 21.520 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.533 32.213 17.917 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -22.791 29.817 21.627 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -23.003 32.166 18.046 1.00 0.00 H new ATOM 0 HH TYR A 26 -24.801 31.457 19.160 1.00 0.00 H new ATOM 422 N VAL A 27 -16.712 28.747 18.659 1.00 0.00 N ATOM 423 CA VAL A 27 -15.578 28.219 17.903 1.00 0.00 C ATOM 424 C VAL A 27 -15.789 28.567 16.427 1.00 0.00 C ATOM 425 O VAL A 27 -16.826 29.151 16.111 1.00 0.00 O ATOM 426 CB VAL A 27 -15.406 26.721 18.242 1.00 0.00 C ATOM 427 CG1 VAL A 27 -15.309 26.513 19.761 1.00 0.00 C ATOM 428 CG2 VAL A 27 -16.481 25.785 17.691 1.00 0.00 C ATOM 0 H VAL A 27 -17.611 28.432 18.295 1.00 0.00 H new ATOM 0 HA VAL A 27 -14.624 28.672 18.173 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.479 26.448 17.738 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -15.188 25.451 19.976 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.451 27.062 20.149 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -16.219 26.878 20.237 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -16.259 24.760 17.990 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -17.454 26.076 18.086 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -16.497 25.850 16.603 1.00 0.00 H new ATOM 438 N TYR A 28 -14.837 28.260 15.529 1.00 0.00 N ATOM 439 CA TYR A 28 -14.930 28.569 14.121 1.00 0.00 C ATOM 440 C TYR A 28 -15.059 27.330 13.237 1.00 0.00 C ATOM 441 O TYR A 28 -14.312 26.364 13.405 1.00 0.00 O ATOM 442 CB TYR A 28 -13.799 29.490 13.637 1.00 0.00 C ATOM 443 CG TYR A 28 -12.598 29.751 14.512 1.00 0.00 C ATOM 444 CD1 TYR A 28 -11.734 28.707 14.850 1.00 0.00 C ATOM 445 CD2 TYR A 28 -12.328 31.054 14.968 1.00 0.00 C ATOM 446 CE1 TYR A 28 -10.636 28.962 15.671 1.00 0.00 C ATOM 447 CE2 TYR A 28 -11.221 31.313 15.791 1.00 0.00 C ATOM 448 CZ TYR A 28 -10.375 30.255 16.157 1.00 0.00 C ATOM 449 OH TYR A 28 -9.290 30.487 16.948 1.00 0.00 O ATOM 0 H TYR A 28 -13.972 27.782 15.782 1.00 0.00 H new ATOM 0 HA TYR A 28 -15.862 29.124 14.015 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -13.430 29.080 12.697 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -14.247 30.457 13.408 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -11.915 27.709 14.478 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -12.981 31.865 14.681 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -9.974 28.151 15.938 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -11.022 32.316 16.139 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.261 31.435 17.193 1.00 0.00 H new ATOM 459 N MET A 29 -16.007 27.380 12.288 1.00 0.00 N ATOM 460 CA MET A 29 -16.249 26.280 11.357 1.00 0.00 C ATOM 461 C MET A 29 -15.251 26.303 10.183 1.00 0.00 C ATOM 462 O MET A 29 -15.241 27.282 9.432 1.00 0.00 O ATOM 463 CB MET A 29 -17.700 26.373 10.873 1.00 0.00 C ATOM 464 CG MET A 29 -18.158 25.219 9.996 1.00 0.00 C ATOM 465 SD MET A 29 -18.083 23.621 10.836 1.00 0.00 S ATOM 466 CE MET A 29 -17.182 22.780 9.540 1.00 0.00 C ATOM 0 H MET A 29 -16.622 28.182 12.149 1.00 0.00 H new ATOM 0 HA MET A 29 -16.095 25.327 11.864 1.00 0.00 H new ATOM 0 HB2 MET A 29 -18.355 26.431 11.743 1.00 0.00 H new ATOM 0 HB3 MET A 29 -17.824 27.303 10.318 1.00 0.00 H new ATOM 0 HG2 MET A 29 -19.181 25.403 9.668 1.00 0.00 H new ATOM 0 HG3 MET A 29 -17.538 25.182 9.100 1.00 0.00 H new ATOM 0 HE1 MET A 29 -16.946 21.765 9.861 1.00 0.00 H new ATOM 0 HE2 MET A 29 -17.792 22.743 8.638 1.00 0.00 H new ATOM 0 HE3 MET A 29 -16.258 23.319 9.331 1.00 0.00 H new ATOM 476 N PHE A 30 -14.417 25.255 10.013 1.00 0.00 N ATOM 477 CA PHE A 30 -13.400 25.162 8.973 1.00 0.00 C ATOM 478 C PHE A 30 -13.700 24.170 7.847 1.00 0.00 C ATOM 479 O PHE A 30 -14.130 23.051 8.128 1.00 0.00 O ATOM 480 CB PHE A 30 -12.037 24.771 9.586 1.00 0.00 C ATOM 481 CG PHE A 30 -11.170 25.972 10.061 1.00 0.00 C ATOM 482 CD1 PHE A 30 -11.604 26.956 11.001 1.00 0.00 C ATOM 483 CD2 PHE A 30 -9.863 26.131 9.533 1.00 0.00 C ATOM 484 CE1 PHE A 30 -10.754 28.006 11.367 1.00 0.00 C ATOM 485 CE2 PHE A 30 -9.025 27.182 9.900 1.00 0.00 C ATOM 486 CZ PHE A 30 -9.469 28.121 10.818 1.00 0.00 C ATOM 0 H PHE A 30 -14.443 24.434 10.618 1.00 0.00 H new ATOM 0 HA PHE A 30 -13.386 26.157 8.528 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.212 24.109 10.434 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -11.472 24.202 8.848 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -12.592 26.890 11.431 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.503 25.407 8.817 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -11.093 28.739 12.084 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -8.037 27.264 9.472 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.827 28.939 11.110 1.00 0.00 H new ATOM 496 N LEU A 31 -13.425 24.549 6.581 1.00 0.00 N ATOM 497 CA LEU A 31 -13.597 23.682 5.438 1.00 0.00 C ATOM 498 C LEU A 31 -12.246 23.220 4.891 1.00 0.00 C ATOM 499 O LEU A 31 -11.464 24.050 4.427 1.00 0.00 O ATOM 500 CB LEU A 31 -14.452 24.379 4.366 1.00 0.00 C ATOM 501 CG LEU A 31 -15.917 23.937 4.385 1.00 0.00 C ATOM 502 CD1 LEU A 31 -16.035 22.511 3.867 1.00 0.00 C ATOM 503 CD2 LEU A 31 -16.565 24.098 5.769 1.00 0.00 C ATOM 0 H LEU A 31 -13.075 25.477 6.341 1.00 0.00 H new ATOM 0 HA LEU A 31 -14.131 22.785 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -14.402 25.458 4.515 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -14.029 24.173 3.383 1.00 0.00 H new ATOM 0 HG LEU A 31 -16.473 24.597 3.720 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -17.081 22.203 3.883 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -15.659 22.463 2.845 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -15.451 21.844 4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -17.603 23.770 5.725 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -16.024 23.493 6.497 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -16.528 25.145 6.068 1.00 0.00 H new ATOM 515 N VAL A 32 -11.965 21.905 4.923 1.00 0.00 N ATOM 516 CA VAL A 32 -10.727 21.376 4.375 1.00 0.00 C ATOM 517 C VAL A 32 -11.045 20.730 3.033 1.00 0.00 C ATOM 518 O VAL A 32 -12.028 19.991 2.939 1.00 0.00 O ATOM 519 CB VAL A 32 -9.958 20.480 5.351 1.00 0.00 C ATOM 520 CG1 VAL A 32 -10.850 19.601 6.220 1.00 0.00 C ATOM 521 CG2 VAL A 32 -8.899 19.634 4.634 1.00 0.00 C ATOM 0 H VAL A 32 -12.584 21.200 5.324 1.00 0.00 H new ATOM 0 HA VAL A 32 -10.022 22.190 4.207 1.00 0.00 H new ATOM 0 HB VAL A 32 -9.455 21.169 6.029 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -10.231 18.997 6.883 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -11.512 20.230 6.815 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.446 18.946 5.584 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -8.376 19.013 5.361 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -9.383 18.997 3.893 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -8.185 20.290 4.137 1.00 0.00 H new ATOM 531 N LYS A 33 -10.224 21.004 2.004 1.00 0.00 N ATOM 532 CA LYS A 33 -10.436 20.422 0.693 1.00 0.00 C ATOM 533 C LYS A 33 -9.309 19.462 0.369 1.00 0.00 C ATOM 534 O LYS A 33 -8.172 19.902 0.186 1.00 0.00 O ATOM 535 CB LYS A 33 -10.723 21.435 -0.420 1.00 0.00 C ATOM 536 CG LYS A 33 -11.151 20.656 -1.681 1.00 0.00 C ATOM 537 CD LYS A 33 -11.975 21.505 -2.657 1.00 0.00 C ATOM 538 CE LYS A 33 -12.368 20.710 -3.914 1.00 0.00 C ATOM 539 NZ LYS A 33 -13.249 19.559 -3.624 1.00 0.00 N ATOM 0 H LYS A 33 -9.416 21.623 2.067 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.365 19.854 0.741 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.510 22.124 -0.113 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.837 22.035 -0.626 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -10.262 20.285 -2.191 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -11.735 19.785 -1.383 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -12.875 21.863 -2.157 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -11.401 22.385 -2.948 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -12.871 21.376 -4.615 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.464 20.352 -4.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -13.601 19.157 -4.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.713 18.834 -3.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -14.054 19.875 -3.046 1.00 0.00 H new ATOM 553 N TRP A 34 -9.627 18.160 0.292 1.00 0.00 N ATOM 554 CA TRP A 34 -8.617 17.180 -0.036 1.00 0.00 C ATOM 555 C TRP A 34 -8.616 16.968 -1.548 1.00 0.00 C ATOM 556 O TRP A 34 -9.606 17.281 -2.207 1.00 0.00 O ATOM 557 CB TRP A 34 -8.859 15.867 0.707 1.00 0.00 C ATOM 558 CG TRP A 34 -8.725 15.856 2.196 1.00 0.00 C ATOM 559 CD1 TRP A 34 -9.619 16.353 3.078 1.00 0.00 C ATOM 560 CD2 TRP A 34 -7.635 15.311 2.996 1.00 0.00 C ATOM 561 NE1 TRP A 34 -9.167 16.150 4.368 1.00 0.00 N ATOM 562 CE2 TRP A 34 -7.943 15.508 4.375 1.00 0.00 C ATOM 563 CE3 TRP A 34 -6.414 14.666 2.694 1.00 0.00 C ATOM 564 CZ2 TRP A 34 -7.085 15.079 5.403 1.00 0.00 C ATOM 565 CZ3 TRP A 34 -5.547 14.242 3.714 1.00 0.00 C ATOM 566 CH2 TRP A 34 -5.880 14.443 5.063 1.00 0.00 C ATOM 0 H TRP A 34 -10.560 17.781 0.451 1.00 0.00 H new ATOM 0 HA TRP A 34 -7.640 17.545 0.280 1.00 0.00 H new ATOM 0 HB2 TRP A 34 -9.866 15.528 0.462 1.00 0.00 H new ATOM 0 HB3 TRP A 34 -8.167 15.127 0.306 1.00 0.00 H new ATOM 0 HD1 TRP A 34 -10.548 16.837 2.815 1.00 0.00 H new ATOM 0 HE1 TRP A 34 -9.672 16.437 5.207 1.00 0.00 H new ATOM 0 HE3 TRP A 34 -6.144 14.497 1.662 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 -7.349 15.236 6.438 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -4.616 13.757 3.459 1.00 0.00 H new ATOM 0 HH2 TRP A 34 -5.209 14.108 5.840 1.00 0.00 H new ATOM 577 N GLN A 35 -7.519 16.428 -2.099 1.00 0.00 N ATOM 578 CA GLN A 35 -7.404 16.144 -3.528 1.00 0.00 C ATOM 579 C GLN A 35 -7.914 14.728 -3.837 1.00 0.00 C ATOM 580 O GLN A 35 -8.073 14.389 -5.008 1.00 0.00 O ATOM 581 CB GLN A 35 -5.941 16.421 -4.027 1.00 0.00 C ATOM 582 CG GLN A 35 -4.828 15.826 -3.152 1.00 0.00 C ATOM 583 CD GLN A 35 -4.865 14.304 -3.133 1.00 0.00 C ATOM 584 OE1 GLN A 35 -4.705 13.673 -4.173 1.00 0.00 O ATOM 585 NE2 GLN A 35 -5.083 13.709 -1.964 1.00 0.00 N ATOM 0 H GLN A 35 -6.689 16.178 -1.562 1.00 0.00 H new ATOM 0 HA GLN A 35 -8.045 16.822 -4.092 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -5.838 16.025 -5.037 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -5.794 17.499 -4.091 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -3.859 16.160 -3.523 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.927 16.203 -2.134 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -5.211 14.270 -1.122 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.122 12.691 -1.909 1.00 0.00 H new ATOM 594 N ASP A 36 -8.195 13.924 -2.797 1.00 0.00 N ATOM 595 CA ASP A 36 -8.721 12.572 -2.866 1.00 0.00 C ATOM 596 C ASP A 36 -10.087 12.514 -2.187 1.00 0.00 C ATOM 597 O ASP A 36 -11.094 12.218 -2.825 1.00 0.00 O ATOM 598 CB ASP A 36 -7.758 11.589 -2.153 1.00 0.00 C ATOM 599 CG ASP A 36 -6.634 11.079 -3.041 1.00 0.00 C ATOM 600 OD1 ASP A 36 -6.926 10.725 -4.203 1.00 0.00 O ATOM 601 OD2 ASP A 36 -5.501 11.020 -2.516 1.00 0.00 O ATOM 0 H ASP A 36 -8.048 14.229 -1.835 1.00 0.00 H new ATOM 0 HA ASP A 36 -8.819 12.287 -3.914 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.325 12.085 -1.284 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -8.330 10.739 -1.783 1.00 0.00 H new ATOM 606 N LEU A 37 -10.120 12.798 -0.881 1.00 0.00 N ATOM 607 CA LEU A 37 -11.340 12.775 -0.084 1.00 0.00 C ATOM 608 C LEU A 37 -12.297 13.920 -0.452 1.00 0.00 C ATOM 609 O LEU A 37 -13.429 13.941 0.033 1.00 0.00 O ATOM 610 CB LEU A 37 -11.023 12.810 1.410 1.00 0.00 C ATOM 611 CG LEU A 37 -10.307 11.566 2.010 1.00 0.00 C ATOM 612 CD1 LEU A 37 -8.865 11.435 1.515 1.00 0.00 C ATOM 613 CD2 LEU A 37 -10.325 11.682 3.525 1.00 0.00 C ATOM 0 H LEU A 37 -9.289 13.052 -0.347 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.845 11.837 -0.313 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.402 13.684 1.604 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.958 12.957 1.951 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.839 10.672 1.684 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.406 10.552 1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.860 11.337 0.429 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.300 12.322 1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -9.826 10.817 3.962 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.805 12.591 3.826 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -11.357 11.721 3.875 1.00 0.00 H new ATOM 625 N SER A 38 -11.848 14.871 -1.284 1.00 0.00 N ATOM 626 CA SER A 38 -12.638 16.030 -1.699 1.00 0.00 C ATOM 627 C SER A 38 -13.011 16.865 -0.472 1.00 0.00 C ATOM 628 O SER A 38 -12.264 16.902 0.507 1.00 0.00 O ATOM 629 CB SER A 38 -13.866 15.585 -2.536 1.00 0.00 C ATOM 630 OG SER A 38 -14.230 16.678 -3.357 1.00 0.00 O ATOM 0 H SER A 38 -10.913 14.853 -1.691 1.00 0.00 H new ATOM 0 HA SER A 38 -12.045 16.669 -2.353 1.00 0.00 H new ATOM 0 HB2 SER A 38 -13.623 14.712 -3.142 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.693 15.300 -1.885 1.00 0.00 H new ATOM 0 HG SER A 38 -15.205 16.706 -3.452 1.00 0.00 H new ATOM 636 N GLU A 39 -14.160 17.545 -0.535 1.00 0.00 N ATOM 637 CA GLU A 39 -14.650 18.398 0.535 1.00 0.00 C ATOM 638 C GLU A 39 -14.844 17.581 1.814 1.00 0.00 C ATOM 639 O GLU A 39 -15.461 16.521 1.767 1.00 0.00 O ATOM 640 CB GLU A 39 -15.980 19.142 0.163 1.00 0.00 C ATOM 641 CG GLU A 39 -16.855 18.435 -0.888 1.00 0.00 C ATOM 642 CD GLU A 39 -16.386 18.636 -2.326 1.00 0.00 C ATOM 643 OE1 GLU A 39 -15.708 19.657 -2.582 1.00 0.00 O ATOM 644 OE2 GLU A 39 -16.657 17.729 -3.140 1.00 0.00 O ATOM 0 H GLU A 39 -14.779 17.513 -1.345 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.893 19.165 0.698 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -16.568 19.277 1.071 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -15.730 20.137 -0.206 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -16.875 17.367 -0.670 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -17.879 18.798 -0.797 1.00 0.00 H new ATOM 651 N LYS A 40 -14.329 18.065 2.951 1.00 0.00 N ATOM 652 CA LYS A 40 -14.428 17.439 4.260 1.00 0.00 C ATOM 653 C LYS A 40 -14.535 18.612 5.237 1.00 0.00 C ATOM 654 O LYS A 40 -13.924 19.656 4.997 1.00 0.00 O ATOM 655 CB LYS A 40 -13.191 16.581 4.560 1.00 0.00 C ATOM 656 CG LYS A 40 -13.034 15.296 3.726 1.00 0.00 C ATOM 657 CD LYS A 40 -13.862 14.090 4.212 1.00 0.00 C ATOM 658 CE LYS A 40 -15.269 13.921 3.617 1.00 0.00 C ATOM 659 NZ LYS A 40 -15.267 13.871 2.143 1.00 0.00 N ATOM 0 H LYS A 40 -13.810 18.943 2.977 1.00 0.00 H new ATOM 0 HA LYS A 40 -15.280 16.763 4.330 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -12.304 17.196 4.411 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -13.214 16.304 5.614 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.312 15.515 2.695 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -11.981 15.014 3.719 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -13.295 13.183 4.002 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -13.959 14.161 5.295 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -15.715 13.005 4.006 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -15.899 14.747 3.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -15.909 13.119 1.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -15.586 14.785 1.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.304 13.673 1.804 1.00 0.00 H new ATOM 673 N VAL A 41 -15.322 18.481 6.312 1.00 0.00 N ATOM 674 CA VAL A 41 -15.551 19.565 7.245 1.00 0.00 C ATOM 675 C VAL A 41 -14.932 19.284 8.610 1.00 0.00 C ATOM 676 O VAL A 41 -14.897 18.125 9.018 1.00 0.00 O ATOM 677 CB VAL A 41 -17.053 19.867 7.285 1.00 0.00 C ATOM 678 CG1 VAL A 41 -17.691 19.681 5.895 1.00 0.00 C ATOM 679 CG2 VAL A 41 -17.790 19.064 8.359 1.00 0.00 C ATOM 0 H VAL A 41 -15.812 17.618 6.550 1.00 0.00 H new ATOM 0 HA VAL A 41 -15.041 20.467 6.905 1.00 0.00 H new ATOM 0 HB VAL A 41 -17.158 20.915 7.567 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -18.757 19.902 5.951 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -17.218 20.358 5.184 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -17.550 18.652 5.565 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -18.850 19.319 8.341 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -17.670 17.998 8.163 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -17.376 19.302 9.339 1.00 0.00 H new ATOM 689 N VAL A 42 -14.449 20.321 9.316 1.00 0.00 N ATOM 690 CA VAL A 42 -13.857 20.159 10.637 1.00 0.00 C ATOM 691 C VAL A 42 -14.095 21.428 11.446 1.00 0.00 C ATOM 692 O VAL A 42 -14.419 22.478 10.894 1.00 0.00 O ATOM 693 CB VAL A 42 -12.345 19.821 10.573 1.00 0.00 C ATOM 694 CG1 VAL A 42 -12.004 18.685 9.605 1.00 0.00 C ATOM 695 CG2 VAL A 42 -11.471 21.030 10.207 1.00 0.00 C ATOM 0 H VAL A 42 -14.462 21.285 8.982 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.339 19.311 11.124 1.00 0.00 H new ATOM 0 HB VAL A 42 -12.120 19.499 11.590 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.929 18.508 9.616 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.525 17.778 9.911 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.316 18.960 8.597 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.424 20.727 10.179 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.766 21.409 9.228 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.602 21.813 10.954 1.00 0.00 H new ATOM 705 N TYR A 43 -13.943 21.326 12.765 1.00 0.00 N ATOM 706 CA TYR A 43 -14.169 22.394 13.699 1.00 0.00 C ATOM 707 C TYR A 43 -12.823 22.849 14.228 1.00 0.00 C ATOM 708 O TYR A 43 -11.886 22.052 14.289 1.00 0.00 O ATOM 709 CB TYR A 43 -15.091 21.874 14.800 1.00 0.00 C ATOM 710 CG TYR A 43 -16.353 21.184 14.185 1.00 0.00 C ATOM 711 CD1 TYR A 43 -16.284 19.925 13.528 1.00 0.00 C ATOM 712 CD2 TYR A 43 -17.627 21.797 14.219 1.00 0.00 C ATOM 713 CE1 TYR A 43 -17.407 19.323 12.947 1.00 0.00 C ATOM 714 CE2 TYR A 43 -18.751 21.194 13.639 1.00 0.00 C ATOM 715 CZ TYR A 43 -18.651 19.954 12.999 1.00 0.00 C ATOM 716 OH TYR A 43 -19.746 19.373 12.432 1.00 0.00 O ATOM 0 H TYR A 43 -13.648 20.460 13.215 1.00 0.00 H new ATOM 0 HA TYR A 43 -14.654 23.255 13.238 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -14.552 21.164 15.427 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -15.398 22.699 15.443 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.333 19.416 13.475 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -17.736 22.755 14.705 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -17.310 18.366 12.456 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -19.707 21.693 13.687 1.00 0.00 H new ATOM 0 HH TYR A 43 -20.527 19.950 12.563 1.00 0.00 H new ATOM 726 N ARG A 44 -12.720 24.127 14.593 1.00 0.00 N ATOM 727 CA ARG A 44 -11.477 24.676 15.098 1.00 0.00 C ATOM 728 C ARG A 44 -11.847 25.659 16.202 1.00 0.00 C ATOM 729 O ARG A 44 -12.937 26.222 16.166 1.00 0.00 O ATOM 730 CB ARG A 44 -10.753 25.384 13.953 1.00 0.00 C ATOM 731 CG ARG A 44 -10.009 24.466 12.982 1.00 0.00 C ATOM 732 CD ARG A 44 -8.729 23.880 13.589 1.00 0.00 C ATOM 733 NE ARG A 44 -7.686 23.709 12.566 1.00 0.00 N ATOM 734 CZ ARG A 44 -6.985 24.714 12.009 1.00 0.00 C ATOM 735 NH1 ARG A 44 -7.241 25.986 12.340 1.00 0.00 N ATOM 736 NH2 ARG A 44 -6.021 24.448 11.121 1.00 0.00 N ATOM 0 H ARG A 44 -13.488 24.797 14.545 1.00 0.00 H new ATOM 0 HA ARG A 44 -10.815 23.905 15.492 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -11.482 25.967 13.390 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -10.040 26.090 14.378 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -10.668 23.653 12.679 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -9.757 25.025 12.081 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -8.364 24.537 14.378 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -8.950 22.918 14.052 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.479 22.760 12.256 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.972 26.199 13.019 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.705 26.742 11.913 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.816 23.482 10.865 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.491 25.211 10.700 1.00 0.00 H new ATOM 750 N ARG A 45 -10.955 25.875 17.171 1.00 0.00 N ATOM 751 CA ARG A 45 -11.143 26.773 18.298 1.00 0.00 C ATOM 752 C ARG A 45 -9.779 27.320 18.726 1.00 0.00 C ATOM 753 O ARG A 45 -8.747 26.728 18.415 1.00 0.00 O ATOM 754 CB ARG A 45 -11.869 26.053 19.446 1.00 0.00 C ATOM 755 CG ARG A 45 -11.110 24.849 20.012 1.00 0.00 C ATOM 756 CD ARG A 45 -11.866 24.222 21.189 1.00 0.00 C ATOM 757 NE ARG A 45 -13.049 23.462 20.751 1.00 0.00 N ATOM 758 CZ ARG A 45 -13.980 22.959 21.581 1.00 0.00 C ATOM 759 NH1 ARG A 45 -13.967 23.261 22.887 1.00 0.00 N ATOM 760 NH2 ARG A 45 -14.926 22.141 21.108 1.00 0.00 N ATOM 0 H ARG A 45 -10.048 25.408 17.187 1.00 0.00 H new ATOM 0 HA ARG A 45 -11.775 27.613 18.009 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -12.049 26.766 20.251 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -12.844 25.719 19.092 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -10.968 24.104 19.229 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -10.118 25.161 20.338 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -11.195 23.561 21.738 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -12.176 25.007 21.879 1.00 0.00 H new ATOM 0 HE ARG A 45 -13.170 23.307 19.750 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -13.246 23.878 23.261 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -14.678 22.874 23.507 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -14.942 21.898 20.117 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -15.632 21.760 21.738 1.00 0.00 H new ATOM 774 N PHE A 46 -9.768 28.451 19.435 1.00 0.00 N ATOM 775 CA PHE A 46 -8.562 29.121 19.895 1.00 0.00 C ATOM 776 C PHE A 46 -7.554 28.175 20.547 1.00 0.00 C ATOM 777 O PHE A 46 -6.435 28.034 20.060 1.00 0.00 O ATOM 778 CB PHE A 46 -8.936 30.314 20.787 1.00 0.00 C ATOM 779 CG PHE A 46 -9.843 30.021 21.970 1.00 0.00 C ATOM 780 CD1 PHE A 46 -11.236 29.937 21.787 1.00 0.00 C ATOM 781 CD2 PHE A 46 -9.298 29.834 23.255 1.00 0.00 C ATOM 782 CE1 PHE A 46 -12.078 29.666 22.878 1.00 0.00 C ATOM 783 CE2 PHE A 46 -10.142 29.563 24.346 1.00 0.00 C ATOM 784 CZ PHE A 46 -11.532 29.478 24.158 1.00 0.00 C ATOM 0 H PHE A 46 -10.623 28.934 19.709 1.00 0.00 H new ATOM 0 HA PHE A 46 -8.038 29.505 19.019 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -8.015 30.758 21.165 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -9.420 31.066 20.164 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -11.659 30.081 20.804 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -8.230 29.899 23.402 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.146 29.602 22.732 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -9.721 29.420 25.330 1.00 0.00 H new ATOM 0 HZ PHE A 46 -12.179 29.268 24.997 1.00 0.00 H new ATOM 794 N THR A 47 -7.953 27.521 21.640 1.00 0.00 N ATOM 795 CA THR A 47 -7.107 26.588 22.380 1.00 0.00 C ATOM 796 C THR A 47 -6.559 25.443 21.520 1.00 0.00 C ATOM 797 O THR A 47 -5.534 24.866 21.873 1.00 0.00 O ATOM 798 CB THR A 47 -7.838 26.082 23.634 1.00 0.00 C ATOM 799 OG1 THR A 47 -6.961 25.307 24.426 1.00 0.00 O ATOM 800 CG2 THR A 47 -9.090 25.264 23.304 1.00 0.00 C ATOM 0 H THR A 47 -8.885 27.627 22.040 1.00 0.00 H new ATOM 0 HA THR A 47 -6.224 27.142 22.699 1.00 0.00 H new ATOM 0 HB THR A 47 -8.164 26.964 24.185 1.00 0.00 H new ATOM 0 HG1 THR A 47 -7.434 24.990 25.223 1.00 0.00 H new ATOM 0 HG21 THR A 47 -9.563 24.934 24.229 1.00 0.00 H new ATOM 0 HG22 THR A 47 -9.789 25.880 22.739 1.00 0.00 H new ATOM 0 HG23 THR A 47 -8.810 24.394 22.709 1.00 0.00 H new ATOM 808 N GLU A 48 -7.214 25.115 20.403 1.00 0.00 N ATOM 809 CA GLU A 48 -6.793 24.069 19.493 1.00 0.00 C ATOM 810 C GLU A 48 -5.729 24.631 18.563 1.00 0.00 C ATOM 811 O GLU A 48 -4.705 23.983 18.357 1.00 0.00 O ATOM 812 CB GLU A 48 -7.989 23.526 18.715 1.00 0.00 C ATOM 813 CG GLU A 48 -8.715 22.427 19.491 1.00 0.00 C ATOM 814 CD GLU A 48 -7.895 21.145 19.579 1.00 0.00 C ATOM 815 OE1 GLU A 48 -7.306 20.778 18.538 1.00 0.00 O ATOM 816 OE2 GLU A 48 -7.869 20.562 20.682 1.00 0.00 O ATOM 0 H GLU A 48 -8.070 25.585 20.108 1.00 0.00 H new ATOM 0 HA GLU A 48 -6.369 23.235 20.052 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -8.683 24.339 18.500 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.651 23.133 17.756 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.939 22.782 20.497 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.669 22.214 19.008 1.00 0.00 H new ATOM 823 N ILE A 49 -5.941 25.841 18.020 1.00 0.00 N ATOM 824 CA ILE A 49 -4.909 26.454 17.186 1.00 0.00 C ATOM 825 C ILE A 49 -3.652 26.586 18.048 1.00 0.00 C ATOM 826 O ILE A 49 -2.547 26.309 17.588 1.00 0.00 O ATOM 827 CB ILE A 49 -5.338 27.809 16.576 1.00 0.00 C ATOM 828 CG1 ILE A 49 -6.205 27.616 15.317 1.00 0.00 C ATOM 829 CG2 ILE A 49 -4.100 28.635 16.190 1.00 0.00 C ATOM 830 CD1 ILE A 49 -7.669 27.336 15.646 1.00 0.00 C ATOM 0 H ILE A 49 -6.789 26.394 18.140 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.720 25.819 16.321 1.00 0.00 H new ATOM 0 HB ILE A 49 -5.923 28.331 17.334 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -6.141 28.510 14.697 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.805 26.790 14.729 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.416 29.586 15.762 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.495 28.820 17.077 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.510 28.085 15.457 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -8.232 27.209 14.721 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.740 26.426 16.242 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.082 28.173 16.210 1.00 0.00 H new ATOM 842 N TYR A 50 -3.825 26.997 19.308 1.00 0.00 N ATOM 843 CA TYR A 50 -2.733 27.153 20.247 1.00 0.00 C ATOM 844 C TYR A 50 -2.072 25.822 20.526 1.00 0.00 C ATOM 845 O TYR A 50 -0.866 25.729 20.366 1.00 0.00 O ATOM 846 CB TYR A 50 -3.224 27.808 21.545 1.00 0.00 C ATOM 847 CG TYR A 50 -3.981 29.144 21.346 1.00 0.00 C ATOM 848 CD1 TYR A 50 -3.846 29.908 20.156 1.00 0.00 C ATOM 849 CD2 TYR A 50 -4.846 29.639 22.349 1.00 0.00 C ATOM 850 CE1 TYR A 50 -4.538 31.117 19.989 1.00 0.00 C ATOM 851 CE2 TYR A 50 -5.536 30.853 22.180 1.00 0.00 C ATOM 852 CZ TYR A 50 -5.381 31.594 20.999 1.00 0.00 C ATOM 853 OH TYR A 50 -6.050 32.769 20.824 1.00 0.00 O ATOM 0 H TYR A 50 -4.738 27.230 19.699 1.00 0.00 H new ATOM 0 HA TYR A 50 -1.987 27.810 19.799 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -3.879 27.108 22.065 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -2.367 27.985 22.194 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -3.200 29.552 19.367 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -4.979 29.075 23.261 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -4.419 31.682 19.076 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.187 31.216 22.962 1.00 0.00 H new ATOM 0 HH TYR A 50 -6.593 32.957 21.618 1.00 0.00 H new ATOM 863 N GLU A 51 -2.828 24.807 20.938 1.00 0.00 N ATOM 864 CA GLU A 51 -2.238 23.503 21.231 1.00 0.00 C ATOM 865 C GLU A 51 -1.454 22.984 20.019 1.00 0.00 C ATOM 866 O GLU A 51 -0.332 22.503 20.162 1.00 0.00 O ATOM 867 CB GLU A 51 -3.281 22.501 21.747 1.00 0.00 C ATOM 868 CG GLU A 51 -2.622 21.238 22.322 1.00 0.00 C ATOM 869 CD GLU A 51 -1.747 21.556 23.533 1.00 0.00 C ATOM 870 OE1 GLU A 51 -2.333 21.790 24.611 1.00 0.00 O ATOM 871 OE2 GLU A 51 -0.510 21.593 23.350 1.00 0.00 O ATOM 0 H GLU A 51 -3.837 24.860 21.075 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.525 23.625 22.047 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.891 22.975 22.516 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -3.952 22.223 20.934 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.394 20.524 22.609 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -2.017 20.761 21.551 1.00 0.00 H new ATOM 878 N PHE A 52 -2.034 23.117 18.821 1.00 0.00 N ATOM 879 CA PHE A 52 -1.379 22.708 17.579 1.00 0.00 C ATOM 880 C PHE A 52 -0.052 23.418 17.444 1.00 0.00 C ATOM 881 O PHE A 52 1.008 22.803 17.395 1.00 0.00 O ATOM 882 CB PHE A 52 -2.185 23.089 16.326 1.00 0.00 C ATOM 883 CG PHE A 52 -1.376 22.882 15.011 1.00 0.00 C ATOM 884 CD1 PHE A 52 -0.512 23.846 14.404 1.00 0.00 C ATOM 885 CD2 PHE A 52 -1.497 21.639 14.366 1.00 0.00 C ATOM 886 CE1 PHE A 52 0.155 23.544 13.200 1.00 0.00 C ATOM 887 CE2 PHE A 52 -0.834 21.349 13.170 1.00 0.00 C ATOM 888 CZ PHE A 52 -0.010 22.306 12.573 1.00 0.00 C ATOM 0 H PHE A 52 -2.966 23.509 18.688 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.277 21.624 17.639 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -3.095 22.490 16.287 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.493 24.132 16.399 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.370 24.810 14.870 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.125 20.881 14.810 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.805 24.282 12.754 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.959 20.382 12.706 1.00 0.00 H new ATOM 0 HZ PHE A 52 0.492 22.092 11.641 1.00 0.00 H new ATOM 898 N HIS A 53 -0.147 24.739 17.343 1.00 0.00 N ATOM 899 CA HIS A 53 0.989 25.597 17.135 1.00 0.00 C ATOM 900 C HIS A 53 2.061 25.394 18.196 1.00 0.00 C ATOM 901 O HIS A 53 3.261 25.417 17.913 1.00 0.00 O ATOM 902 CB HIS A 53 0.484 27.025 16.966 1.00 0.00 C ATOM 903 CG HIS A 53 1.421 27.878 16.177 1.00 0.00 C ATOM 904 ND1 HIS A 53 1.951 27.378 15.016 1.00 0.00 N ATOM 905 CD2 HIS A 53 1.936 29.146 16.295 1.00 0.00 C ATOM 906 CE1 HIS A 53 2.725 28.311 14.473 1.00 0.00 C ATOM 907 NE2 HIS A 53 2.768 29.425 15.209 1.00 0.00 N ATOM 0 H HIS A 53 -1.033 25.241 17.406 1.00 0.00 H new ATOM 0 HA HIS A 53 1.513 25.336 16.215 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -0.487 27.006 16.472 1.00 0.00 H new ATOM 0 HB3 HIS A 53 0.333 27.471 17.949 1.00 0.00 H new ATOM 0 HD2 HIS A 53 1.728 29.826 17.108 1.00 0.00 H new ATOM 0 HE1 HIS A 53 3.259 28.184 13.543 1.00 0.00 H new ATOM 0 HE2 HIS A 53 3.289 30.282 15.021 1.00 0.00 H new ATOM 915 N LYS A 54 1.609 25.158 19.422 1.00 0.00 N ATOM 916 CA LYS A 54 2.501 24.863 20.533 1.00 0.00 C ATOM 917 C LYS A 54 3.249 23.573 20.218 1.00 0.00 C ATOM 918 O LYS A 54 4.458 23.488 20.407 1.00 0.00 O ATOM 919 CB LYS A 54 1.767 24.693 21.878 1.00 0.00 C ATOM 920 CG LYS A 54 1.845 25.899 22.825 1.00 0.00 C ATOM 921 CD LYS A 54 0.835 26.998 22.480 1.00 0.00 C ATOM 922 CE LYS A 54 0.933 28.201 23.427 1.00 0.00 C ATOM 923 NZ LYS A 54 0.542 27.856 24.809 1.00 0.00 N ATOM 0 H LYS A 54 0.620 25.166 19.671 1.00 0.00 H new ATOM 0 HA LYS A 54 3.175 25.712 20.643 1.00 0.00 H new ATOM 0 HB2 LYS A 54 0.718 24.478 21.676 1.00 0.00 H new ATOM 0 HB3 LYS A 54 2.178 23.823 22.390 1.00 0.00 H new ATOM 0 HG2 LYS A 54 1.672 25.563 23.847 1.00 0.00 H new ATOM 0 HG3 LYS A 54 2.852 26.315 22.792 1.00 0.00 H new ATOM 0 HD2 LYS A 54 1.001 27.331 21.455 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -0.174 26.587 22.522 1.00 0.00 H new ATOM 0 HE2 LYS A 54 1.955 28.581 23.424 1.00 0.00 H new ATOM 0 HE3 LYS A 54 0.293 29.004 23.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 0.542 28.716 25.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -0.411 27.439 24.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 1.219 27.171 25.201 1.00 0.00 H new ATOM 937 N THR A 55 2.515 22.570 19.741 1.00 0.00 N ATOM 938 CA THR A 55 3.088 21.265 19.446 1.00 0.00 C ATOM 939 C THR A 55 4.079 21.357 18.308 1.00 0.00 C ATOM 940 O THR A 55 5.139 20.747 18.374 1.00 0.00 O ATOM 941 CB THR A 55 1.979 20.232 19.221 1.00 0.00 C ATOM 942 OG1 THR A 55 1.170 20.130 20.375 1.00 0.00 O ATOM 943 CG2 THR A 55 2.521 18.850 18.884 1.00 0.00 C ATOM 0 H THR A 55 1.515 22.640 19.551 1.00 0.00 H new ATOM 0 HA THR A 55 3.658 20.915 20.306 1.00 0.00 H new ATOM 0 HB THR A 55 1.397 20.583 18.369 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.581 20.911 20.432 1.00 0.00 H new ATOM 0 HG21 THR A 55 1.691 18.160 18.735 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.115 18.905 17.972 1.00 0.00 H new ATOM 0 HG23 THR A 55 3.146 18.495 19.703 1.00 0.00 H new ATOM 951 N LEU A 56 3.764 22.132 17.277 1.00 0.00 N ATOM 952 CA LEU A 56 4.675 22.302 16.169 1.00 0.00 C ATOM 953 C LEU A 56 5.982 22.843 16.699 1.00 0.00 C ATOM 954 O LEU A 56 7.036 22.275 16.444 1.00 0.00 O ATOM 955 CB LEU A 56 4.080 23.259 15.117 1.00 0.00 C ATOM 956 CG LEU A 56 4.769 23.362 13.753 1.00 0.00 C ATOM 957 CD1 LEU A 56 6.173 23.929 13.890 1.00 0.00 C ATOM 958 CD2 LEU A 56 4.880 22.080 12.913 1.00 0.00 C ATOM 0 H LEU A 56 2.888 22.647 17.192 1.00 0.00 H new ATOM 0 HA LEU A 56 4.844 21.341 15.683 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.046 22.961 14.945 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.056 24.258 15.553 1.00 0.00 H new ATOM 0 HG LEU A 56 4.089 24.020 13.212 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.638 23.991 12.906 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.122 24.925 14.330 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.767 23.278 14.532 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.389 22.302 11.975 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.448 21.331 13.465 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.882 21.696 12.702 1.00 0.00 H new ATOM 970 N LYS A 57 5.909 23.945 17.440 1.00 0.00 N ATOM 971 CA LYS A 57 7.109 24.568 17.952 1.00 0.00 C ATOM 972 C LYS A 57 7.852 23.725 18.988 1.00 0.00 C ATOM 973 O LYS A 57 9.056 23.906 19.165 1.00 0.00 O ATOM 974 CB LYS A 57 6.730 25.953 18.489 1.00 0.00 C ATOM 975 CG LYS A 57 6.687 27.030 17.376 1.00 0.00 C ATOM 976 CD LYS A 57 5.361 27.739 17.074 1.00 0.00 C ATOM 977 CE LYS A 57 4.860 28.623 18.222 1.00 0.00 C ATOM 978 NZ LYS A 57 4.264 27.832 19.309 1.00 0.00 N ATOM 0 H LYS A 57 5.040 24.415 17.693 1.00 0.00 H new ATOM 0 HA LYS A 57 7.825 24.664 17.136 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.755 25.897 18.974 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.449 26.252 19.252 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.418 27.797 17.632 1.00 0.00 H new ATOM 0 HG3 LYS A 57 7.027 26.561 16.452 1.00 0.00 H new ATOM 0 HD2 LYS A 57 5.482 28.352 16.181 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.602 26.990 16.846 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.689 29.211 18.615 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.122 29.328 17.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.469 28.358 19.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.920 26.926 18.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.981 27.652 20.041 1.00 0.00 H new ATOM 992 N GLU A 58 7.154 22.812 19.662 1.00 0.00 N ATOM 993 CA GLU A 58 7.744 21.946 20.666 1.00 0.00 C ATOM 994 C GLU A 58 8.479 20.807 19.973 1.00 0.00 C ATOM 995 O GLU A 58 9.662 20.592 20.232 1.00 0.00 O ATOM 996 CB GLU A 58 6.664 21.407 21.632 1.00 0.00 C ATOM 997 CG GLU A 58 6.251 22.561 22.603 1.00 0.00 C ATOM 998 CD GLU A 58 7.219 22.673 23.776 1.00 0.00 C ATOM 999 OE1 GLU A 58 7.428 21.636 24.440 1.00 0.00 O ATOM 1000 OE2 GLU A 58 7.727 23.796 23.991 1.00 0.00 O ATOM 0 H GLU A 58 6.156 22.656 19.521 1.00 0.00 H new ATOM 0 HA GLU A 58 8.455 22.517 21.263 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.798 21.053 21.073 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.049 20.557 22.195 1.00 0.00 H new ATOM 0 HG2 GLU A 58 6.225 23.505 22.059 1.00 0.00 H new ATOM 0 HG3 GLU A 58 5.243 22.381 22.977 1.00 0.00 H new ATOM 1007 N MET A 59 7.787 20.075 19.092 1.00 0.00 N ATOM 1008 CA MET A 59 8.398 18.973 18.381 1.00 0.00 C ATOM 1009 C MET A 59 9.507 19.483 17.468 1.00 0.00 C ATOM 1010 O MET A 59 10.614 18.953 17.494 1.00 0.00 O ATOM 1011 CB MET A 59 7.364 18.220 17.552 1.00 0.00 C ATOM 1012 CG MET A 59 6.122 17.649 18.259 1.00 0.00 C ATOM 1013 SD MET A 59 4.948 16.802 17.158 1.00 0.00 S ATOM 1014 CE MET A 59 4.731 18.050 15.861 1.00 0.00 C ATOM 0 H MET A 59 6.806 20.234 18.863 1.00 0.00 H new ATOM 0 HA MET A 59 8.821 18.291 19.119 1.00 0.00 H new ATOM 0 HB2 MET A 59 7.017 18.892 16.767 1.00 0.00 H new ATOM 0 HB3 MET A 59 7.874 17.392 17.061 1.00 0.00 H new ATOM 0 HG2 MET A 59 6.448 16.949 19.029 1.00 0.00 H new ATOM 0 HG3 MET A 59 5.603 18.462 18.766 1.00 0.00 H new ATOM 0 HE1 MET A 59 3.865 17.794 15.251 1.00 0.00 H new ATOM 0 HE2 MET A 59 4.576 19.027 16.319 1.00 0.00 H new ATOM 0 HE3 MET A 59 5.621 18.081 15.233 1.00 0.00 H new ATOM 1024 N PHE A 60 9.206 20.511 16.667 1.00 0.00 N ATOM 1025 CA PHE A 60 10.142 21.137 15.767 1.00 0.00 C ATOM 1026 C PHE A 60 10.742 22.384 16.468 1.00 0.00 C ATOM 1027 O PHE A 60 10.148 23.456 16.347 1.00 0.00 O ATOM 1028 CB PHE A 60 9.399 21.596 14.512 1.00 0.00 C ATOM 1029 CG PHE A 60 8.696 20.504 13.640 1.00 0.00 C ATOM 1030 CD1 PHE A 60 7.382 20.017 13.899 1.00 0.00 C ATOM 1031 CD2 PHE A 60 9.364 19.948 12.522 1.00 0.00 C ATOM 1032 CE1 PHE A 60 6.788 19.048 13.064 1.00 0.00 C ATOM 1033 CE2 PHE A 60 8.770 18.978 11.698 1.00 0.00 C ATOM 1034 CZ PHE A 60 7.476 18.527 11.966 1.00 0.00 C ATOM 0 H PHE A 60 8.277 20.931 16.637 1.00 0.00 H new ATOM 0 HA PHE A 60 10.929 20.433 15.498 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.643 22.320 14.816 1.00 0.00 H new ATOM 0 HB3 PHE A 60 10.109 22.125 13.877 1.00 0.00 H new ATOM 0 HD1 PHE A 60 6.832 20.396 14.748 1.00 0.00 H new ATOM 0 HD2 PHE A 60 10.366 20.282 12.295 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.787 18.704 13.277 1.00 0.00 H new ATOM 0 HE2 PHE A 60 9.315 18.580 10.855 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.013 17.785 11.332 1.00 0.00 H new ATOM 1044 N PRO A 61 11.883 22.357 17.187 1.00 0.00 N ATOM 1045 CA PRO A 61 12.392 23.575 17.806 1.00 0.00 C ATOM 1046 C PRO A 61 12.981 24.498 16.738 1.00 0.00 C ATOM 1047 O PRO A 61 13.090 25.701 16.943 1.00 0.00 O ATOM 1048 CB PRO A 61 13.413 23.127 18.849 1.00 0.00 C ATOM 1049 CG PRO A 61 13.969 21.844 18.246 1.00 0.00 C ATOM 1050 CD PRO A 61 12.789 21.255 17.468 1.00 0.00 C ATOM 0 HA PRO A 61 11.610 24.158 18.294 1.00 0.00 H new ATOM 0 HB2 PRO A 61 14.192 23.874 18.999 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.949 22.950 19.819 1.00 0.00 H new ATOM 0 HG2 PRO A 61 14.817 22.046 17.592 1.00 0.00 H new ATOM 0 HG3 PRO A 61 14.319 21.159 19.019 1.00 0.00 H new ATOM 0 HD2 PRO A 61 13.129 20.788 16.544 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.289 20.481 18.051 1.00 0.00 H new ATOM 1058 N ILE A 62 13.331 23.932 15.582 1.00 0.00 N ATOM 1059 CA ILE A 62 13.855 24.643 14.437 1.00 0.00 C ATOM 1060 C ILE A 62 12.738 25.474 13.839 1.00 0.00 C ATOM 1061 O ILE A 62 12.941 26.650 13.540 1.00 0.00 O ATOM 1062 CB ILE A 62 14.366 23.653 13.395 1.00 0.00 C ATOM 1063 CG1 ILE A 62 15.376 22.621 13.930 1.00 0.00 C ATOM 1064 CG2 ILE A 62 14.862 24.366 12.150 1.00 0.00 C ATOM 1065 CD1 ILE A 62 16.599 23.251 14.604 1.00 0.00 C ATOM 0 H ILE A 62 13.251 22.928 15.421 1.00 0.00 H new ATOM 0 HA ILE A 62 14.681 25.283 14.746 1.00 0.00 H new ATOM 0 HB ILE A 62 13.500 23.053 13.114 1.00 0.00 H new ATOM 0 HG12 ILE A 62 14.873 21.970 14.645 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.710 21.991 13.106 1.00 0.00 H new ATOM 0 HG21 ILE A 62 15.219 23.632 11.428 1.00 0.00 H new ATOM 0 HG22 ILE A 62 14.047 24.940 11.710 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.677 25.039 12.416 1.00 0.00 H new ATOM 0 HD11 ILE A 62 17.266 22.464 14.956 1.00 0.00 H new ATOM 0 HD12 ILE A 62 17.126 23.880 13.887 1.00 0.00 H new ATOM 0 HD13 ILE A 62 16.276 23.858 15.450 1.00 0.00 H new ATOM 1077 N GLU A 63 11.545 24.884 13.680 1.00 0.00 N ATOM 1078 CA GLU A 63 10.436 25.649 13.145 1.00 0.00 C ATOM 1079 C GLU A 63 10.026 26.740 14.152 1.00 0.00 C ATOM 1080 O GLU A 63 9.187 27.588 13.851 1.00 0.00 O ATOM 1081 CB GLU A 63 9.308 24.742 12.636 1.00 0.00 C ATOM 1082 CG GLU A 63 8.412 25.483 11.624 1.00 0.00 C ATOM 1083 CD GLU A 63 7.583 24.559 10.727 1.00 0.00 C ATOM 1084 OE1 GLU A 63 8.033 23.424 10.460 1.00 0.00 O ATOM 1085 OE2 GLU A 63 6.516 25.030 10.278 1.00 0.00 O ATOM 0 H GLU A 63 11.337 23.912 13.908 1.00 0.00 H new ATOM 0 HA GLU A 63 10.743 26.183 12.246 1.00 0.00 H new ATOM 0 HB2 GLU A 63 9.734 23.855 12.167 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.705 24.400 13.477 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.737 26.144 12.168 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.039 26.115 10.995 1.00 0.00 H new ATOM 1092 N ALA A 64 10.659 26.735 15.338 1.00 0.00 N ATOM 1093 CA ALA A 64 10.478 27.691 16.402 1.00 0.00 C ATOM 1094 C ALA A 64 11.780 28.351 16.791 1.00 0.00 C ATOM 1095 O ALA A 64 11.936 28.789 17.930 1.00 0.00 O ATOM 1096 CB ALA A 64 9.905 26.979 17.622 1.00 0.00 C ATOM 0 H ALA A 64 11.344 26.018 15.575 1.00 0.00 H new ATOM 0 HA ALA A 64 9.797 28.463 16.046 1.00 0.00 H new ATOM 0 HB1 ALA A 64 9.766 27.697 18.430 1.00 0.00 H new ATOM 0 HB2 ALA A 64 8.945 26.532 17.365 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.594 26.198 17.945 1.00 0.00 H new ATOM 1102 N GLY A 65 12.716 28.430 15.850 1.00 0.00 N ATOM 1103 CA GLY A 65 13.979 29.036 16.157 1.00 0.00 C ATOM 1104 C GLY A 65 14.714 29.444 14.912 1.00 0.00 C ATOM 1105 O GLY A 65 15.125 30.597 14.805 1.00 0.00 O ATOM 0 H GLY A 65 12.616 28.087 14.895 1.00 0.00 H new ATOM 0 HA2 GLY A 65 13.820 29.910 16.789 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.590 28.336 16.728 1.00 0.00 H new ATOM 1109 N ALA A 66 14.860 28.511 13.969 1.00 0.00 N ATOM 1110 CA ALA A 66 15.508 28.837 12.721 1.00 0.00 C ATOM 1111 C ALA A 66 14.494 29.380 11.743 1.00 0.00 C ATOM 1112 O ALA A 66 14.876 29.997 10.755 1.00 0.00 O ATOM 1113 CB ALA A 66 16.280 27.657 12.141 1.00 0.00 C ATOM 0 H ALA A 66 14.542 27.546 14.053 1.00 0.00 H new ATOM 0 HA ALA A 66 16.250 29.610 12.919 1.00 0.00 H new ATOM 0 HB1 ALA A 66 16.749 27.955 11.203 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.049 27.343 12.847 1.00 0.00 H new ATOM 0 HB3 ALA A 66 15.595 26.829 11.958 1.00 0.00 H new ATOM 1119 N ILE A 67 13.210 29.151 12.035 1.00 0.00 N ATOM 1120 CA ILE A 67 12.135 29.624 11.172 1.00 0.00 C ATOM 1121 C ILE A 67 11.276 30.643 11.903 1.00 0.00 C ATOM 1122 O ILE A 67 10.259 31.090 11.391 1.00 0.00 O ATOM 1123 CB ILE A 67 11.356 28.404 10.652 1.00 0.00 C ATOM 1124 CG1 ILE A 67 12.389 27.364 10.145 1.00 0.00 C ATOM 1125 CG2 ILE A 67 10.377 28.767 9.526 1.00 0.00 C ATOM 1126 CD1 ILE A 67 11.846 26.155 9.388 1.00 0.00 C ATOM 0 H ILE A 67 12.895 28.642 12.861 1.00 0.00 H new ATOM 0 HA ILE A 67 12.529 30.152 10.304 1.00 0.00 H new ATOM 0 HB ILE A 67 10.753 28.000 11.465 1.00 0.00 H new ATOM 0 HG12 ILE A 67 13.097 27.879 9.496 1.00 0.00 H new ATOM 0 HG13 ILE A 67 12.952 27.000 11.005 1.00 0.00 H new ATOM 0 HG21 ILE A 67 9.853 27.870 9.196 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.654 29.495 9.893 1.00 0.00 H new ATOM 0 HG23 ILE A 67 10.928 29.194 8.688 1.00 0.00 H new ATOM 0 HD11 ILE A 67 12.673 25.510 9.091 1.00 0.00 H new ATOM 0 HD12 ILE A 67 11.165 25.599 10.032 1.00 0.00 H new ATOM 0 HD13 ILE A 67 11.312 26.492 8.500 1.00 0.00 H new ATOM 1138 N ASN A 68 11.699 31.051 13.098 1.00 0.00 N ATOM 1139 CA ASN A 68 10.940 32.018 13.871 1.00 0.00 C ATOM 1140 C ASN A 68 11.288 33.477 13.596 1.00 0.00 C ATOM 1141 O ASN A 68 10.369 34.230 13.297 1.00 0.00 O ATOM 1142 CB ASN A 68 10.934 31.672 15.364 1.00 0.00 C ATOM 1143 CG ASN A 68 9.497 31.559 15.851 1.00 0.00 C ATOM 1144 OD1 ASN A 68 9.043 32.356 16.671 1.00 0.00 O ATOM 1145 ND2 ASN A 68 8.775 30.588 15.293 1.00 0.00 N ATOM 0 H ASN A 68 12.557 30.727 13.545 1.00 0.00 H new ATOM 0 HA ASN A 68 9.915 31.929 13.512 1.00 0.00 H new ATOM 0 HB2 ASN A 68 11.462 30.733 15.533 1.00 0.00 H new ATOM 0 HB3 ASN A 68 11.462 32.441 15.929 1.00 0.00 H new ATOM 0 HD21 ASN A 68 7.792 30.477 15.541 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.206 29.956 14.618 1.00 0.00 H new ATOM 1152 N PRO A 69 12.546 33.926 13.698 1.00 0.00 N ATOM 1153 CA PRO A 69 12.901 35.316 13.489 1.00 0.00 C ATOM 1154 C PRO A 69 13.093 35.748 12.047 1.00 0.00 C ATOM 1155 O PRO A 69 12.534 36.760 11.626 1.00 0.00 O ATOM 1156 CB PRO A 69 14.171 35.515 14.316 1.00 0.00 C ATOM 1157 CG PRO A 69 14.857 34.146 14.243 1.00 0.00 C ATOM 1158 CD PRO A 69 13.703 33.151 14.083 1.00 0.00 C ATOM 0 HA PRO A 69 12.070 35.950 13.798 1.00 0.00 H new ATOM 0 HB2 PRO A 69 14.801 36.303 13.903 1.00 0.00 H new ATOM 0 HB3 PRO A 69 13.942 35.796 15.344 1.00 0.00 H new ATOM 0 HG2 PRO A 69 15.548 34.092 13.402 1.00 0.00 H new ATOM 0 HG3 PRO A 69 15.435 33.943 15.144 1.00 0.00 H new ATOM 0 HD2 PRO A 69 13.938 32.402 13.327 1.00 0.00 H new ATOM 0 HD3 PRO A 69 13.520 32.616 15.015 1.00 0.00 H new ATOM 1166 N GLU A 70 13.898 35.000 11.302 1.00 0.00 N ATOM 1167 CA GLU A 70 14.203 35.329 9.917 1.00 0.00 C ATOM 1168 C GLU A 70 12.944 35.222 9.071 1.00 0.00 C ATOM 1169 O GLU A 70 12.730 36.011 8.151 1.00 0.00 O ATOM 1170 CB GLU A 70 15.329 34.375 9.405 1.00 0.00 C ATOM 1171 CG GLU A 70 14.869 32.877 9.342 1.00 0.00 C ATOM 1172 CD GLU A 70 14.511 32.420 7.927 1.00 0.00 C ATOM 1173 OE1 GLU A 70 14.190 33.294 7.093 1.00 0.00 O ATOM 1174 OE2 GLU A 70 14.544 31.192 7.704 1.00 0.00 O ATOM 0 H GLU A 70 14.355 34.153 11.640 1.00 0.00 H new ATOM 0 HA GLU A 70 14.561 36.356 9.841 1.00 0.00 H new ATOM 0 HB2 GLU A 70 15.648 34.695 8.413 1.00 0.00 H new ATOM 0 HB3 GLU A 70 16.196 34.458 10.061 1.00 0.00 H new ATOM 0 HG2 GLU A 70 15.664 32.242 9.733 1.00 0.00 H new ATOM 0 HG3 GLU A 70 14.004 32.741 9.991 1.00 0.00 H new ATOM 1181 N ASN A 71 12.118 34.239 9.422 1.00 0.00 N ATOM 1182 CA ASN A 71 10.867 33.944 8.771 1.00 0.00 C ATOM 1183 C ASN A 71 9.717 34.237 9.721 1.00 0.00 C ATOM 1184 O ASN A 71 8.766 33.461 9.782 1.00 0.00 O ATOM 1185 CB ASN A 71 10.884 32.465 8.341 1.00 0.00 C ATOM 1186 CG ASN A 71 9.875 32.169 7.238 1.00 0.00 C ATOM 1187 OD1 ASN A 71 9.894 32.783 6.175 1.00 0.00 O ATOM 1188 ND2 ASN A 71 8.985 31.213 7.488 1.00 0.00 N ATOM 0 H ASN A 71 12.320 33.609 10.198 1.00 0.00 H new ATOM 0 HA ASN A 71 10.731 34.567 7.887 1.00 0.00 H new ATOM 0 HB2 ASN A 71 11.884 32.201 7.996 1.00 0.00 H new ATOM 0 HB3 ASN A 71 10.669 31.836 9.205 1.00 0.00 H new ATOM 0 HD21 ASN A 71 8.288 30.969 6.785 1.00 0.00 H new ATOM 0 HD22 ASN A 71 9.000 30.724 8.383 1.00 0.00 H new ATOM 1195 N ARG A 72 9.791 35.372 10.434 1.00 0.00 N ATOM 1196 CA ARG A 72 8.714 35.816 11.324 1.00 0.00 C ATOM 1197 C ARG A 72 7.497 36.297 10.514 1.00 0.00 C ATOM 1198 O ARG A 72 7.121 37.466 10.563 1.00 0.00 O ATOM 1199 CB ARG A 72 9.187 36.882 12.330 1.00 0.00 C ATOM 1200 CG ARG A 72 8.123 37.060 13.431 1.00 0.00 C ATOM 1201 CD ARG A 72 8.689 37.617 14.745 1.00 0.00 C ATOM 1202 NE ARG A 72 9.689 36.731 15.366 1.00 0.00 N ATOM 1203 CZ ARG A 72 9.447 35.544 15.952 1.00 0.00 C ATOM 1204 NH1 ARG A 72 8.219 35.011 15.972 1.00 0.00 N ATOM 1205 NH2 ARG A 72 10.447 34.872 16.534 1.00 0.00 N ATOM 0 H ARG A 72 10.593 36.001 10.408 1.00 0.00 H new ATOM 0 HA ARG A 72 8.405 34.953 11.914 1.00 0.00 H new ATOM 0 HB2 ARG A 72 10.137 36.583 12.773 1.00 0.00 H new ATOM 0 HB3 ARG A 72 9.358 37.829 11.818 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.344 37.730 13.067 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.650 36.098 13.627 1.00 0.00 H new ATOM 0 HD2 ARG A 72 9.143 38.590 14.555 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.870 37.779 15.446 1.00 0.00 H new ATOM 0 HE ARG A 72 10.658 37.048 15.350 1.00 0.00 H new ATOM 0 HH11 ARG A 72 7.441 35.506 15.537 1.00 0.00 H new ATOM 0 HH12 ARG A 72 8.062 34.110 16.423 1.00 0.00 H new ATOM 0 HH21 ARG A 72 11.390 35.260 16.533 1.00 0.00 H new ATOM 0 HH22 ARG A 72 10.266 33.972 16.979 1.00 0.00 H new ATOM 1219 N ILE A 73 6.868 35.369 9.791 1.00 0.00 N ATOM 1220 CA ILE A 73 5.662 35.525 9.004 1.00 0.00 C ATOM 1221 C ILE A 73 4.812 34.353 9.512 1.00 0.00 C ATOM 1222 O ILE A 73 4.317 33.533 8.743 1.00 0.00 O ATOM 1223 CB ILE A 73 5.941 35.480 7.482 1.00 0.00 C ATOM 1224 CG1 ILE A 73 7.013 36.478 6.991 1.00 0.00 C ATOM 1225 CG2 ILE A 73 4.649 35.828 6.719 1.00 0.00 C ATOM 1226 CD1 ILE A 73 8.460 36.015 7.194 1.00 0.00 C ATOM 0 H ILE A 73 7.225 34.415 9.743 1.00 0.00 H new ATOM 0 HA ILE A 73 5.170 36.491 9.121 1.00 0.00 H new ATOM 0 HB ILE A 73 6.305 34.470 7.292 1.00 0.00 H new ATOM 0 HG12 ILE A 73 6.853 36.670 5.930 1.00 0.00 H new ATOM 0 HG13 ILE A 73 6.873 37.426 7.511 1.00 0.00 H new ATOM 0 HG21 ILE A 73 4.840 35.798 5.646 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.873 35.105 6.970 1.00 0.00 H new ATOM 0 HG23 ILE A 73 4.318 36.828 7.000 1.00 0.00 H new ATOM 0 HD11 ILE A 73 9.142 36.779 6.820 1.00 0.00 H new ATOM 0 HD12 ILE A 73 8.644 35.852 8.256 1.00 0.00 H new ATOM 0 HD13 ILE A 73 8.624 35.084 6.651 1.00 0.00 H new ATOM 1238 N ILE A 74 4.689 34.279 10.843 1.00 0.00 N ATOM 1239 CA ILE A 74 3.963 33.278 11.606 1.00 0.00 C ATOM 1240 C ILE A 74 3.150 34.089 12.615 1.00 0.00 C ATOM 1241 O ILE A 74 3.706 35.027 13.188 1.00 0.00 O ATOM 1242 CB ILE A 74 4.940 32.343 12.349 1.00 0.00 C ATOM 1243 CG1 ILE A 74 6.011 31.690 11.457 1.00 0.00 C ATOM 1244 CG2 ILE A 74 4.129 31.232 13.038 1.00 0.00 C ATOM 1245 CD1 ILE A 74 7.246 31.318 12.286 1.00 0.00 C ATOM 0 H ILE A 74 5.129 34.970 11.450 1.00 0.00 H new ATOM 0 HA ILE A 74 3.343 32.645 10.970 1.00 0.00 H new ATOM 0 HB ILE A 74 5.479 32.970 13.060 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.603 30.798 10.982 1.00 0.00 H new ATOM 0 HG13 ILE A 74 6.295 32.375 10.658 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.806 30.562 13.568 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.431 31.677 13.747 1.00 0.00 H new ATOM 0 HG23 ILE A 74 3.574 30.668 12.288 1.00 0.00 H new ATOM 0 HD11 ILE A 74 7.993 30.858 11.639 1.00 0.00 H new ATOM 0 HD12 ILE A 74 7.664 32.217 12.740 1.00 0.00 H new ATOM 0 HD13 ILE A 74 6.961 30.615 13.069 1.00 0.00 H new ATOM 1257 N PRO A 75 1.868 33.780 12.858 1.00 0.00 N ATOM 1258 CA PRO A 75 1.072 34.538 13.800 1.00 0.00 C ATOM 1259 C PRO A 75 1.473 34.216 15.243 1.00 0.00 C ATOM 1260 O PRO A 75 2.175 33.240 15.504 1.00 0.00 O ATOM 1261 CB PRO A 75 -0.370 34.109 13.544 1.00 0.00 C ATOM 1262 CG PRO A 75 -0.192 32.655 13.128 1.00 0.00 C ATOM 1263 CD PRO A 75 1.072 32.719 12.270 1.00 0.00 C ATOM 0 HA PRO A 75 1.213 35.611 13.669 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.990 34.207 14.435 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -0.841 34.704 12.761 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -0.068 31.997 13.988 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.049 32.285 12.565 1.00 0.00 H new ATOM 0 HD2 PRO A 75 1.607 31.770 12.283 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.832 32.935 11.229 1.00 0.00 H new ATOM 1271 N HIS A 76 1.003 35.037 16.187 1.00 0.00 N ATOM 1272 CA HIS A 76 1.248 34.881 17.613 1.00 0.00 C ATOM 1273 C HIS A 76 0.130 35.608 18.371 1.00 0.00 C ATOM 1274 O HIS A 76 -1.025 35.490 17.969 1.00 0.00 O ATOM 1275 CB HIS A 76 2.690 35.297 17.951 1.00 0.00 C ATOM 1276 CG HIS A 76 3.132 36.568 17.274 1.00 0.00 C ATOM 1277 ND1 HIS A 76 2.874 37.834 17.777 1.00 0.00 N ATOM 1278 CD2 HIS A 76 3.827 36.772 16.107 1.00 0.00 C ATOM 1279 CE1 HIS A 76 3.410 38.717 16.917 1.00 0.00 C ATOM 1280 NE2 HIS A 76 4.007 38.132 15.876 1.00 0.00 N ATOM 0 H HIS A 76 0.426 35.849 15.968 1.00 0.00 H new ATOM 0 HA HIS A 76 1.199 33.842 17.938 1.00 0.00 H new ATOM 0 HB2 HIS A 76 2.778 35.422 19.030 1.00 0.00 H new ATOM 0 HB3 HIS A 76 3.367 34.491 17.667 1.00 0.00 H new ATOM 0 HD2 HIS A 76 4.184 35.986 15.459 1.00 0.00 H new ATOM 0 HE1 HIS A 76 3.363 39.787 17.054 1.00 0.00 H new ATOM 0 HE2 HIS A 76 4.484 38.579 15.093 1.00 0.00 H new ATOM 1288 N LEU A 77 0.455 36.336 19.449 1.00 0.00 N ATOM 1289 CA LEU A 77 -0.465 37.063 20.325 1.00 0.00 C ATOM 1290 C LEU A 77 -1.057 36.072 21.339 1.00 0.00 C ATOM 1291 O LEU A 77 -1.306 34.919 20.990 1.00 0.00 O ATOM 1292 CB LEU A 77 -1.556 37.860 19.583 1.00 0.00 C ATOM 1293 CG LEU A 77 -1.031 38.780 18.465 1.00 0.00 C ATOM 1294 CD1 LEU A 77 -2.222 39.451 17.771 1.00 0.00 C ATOM 1295 CD2 LEU A 77 -0.089 39.861 19.008 1.00 0.00 C ATOM 0 H LEU A 77 1.425 36.437 19.747 1.00 0.00 H new ATOM 0 HA LEU A 77 0.107 37.833 20.842 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.270 37.158 19.152 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.101 38.465 20.307 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.466 38.168 17.761 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.860 40.105 16.978 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.872 38.687 17.344 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.783 40.039 18.498 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.258 40.487 18.186 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.621 40.476 19.734 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.767 39.389 19.491 1.00 0.00 H new ATOM 1307 N PRO A 78 -1.259 36.477 22.604 1.00 0.00 N ATOM 1308 CA PRO A 78 -1.756 35.589 23.641 1.00 0.00 C ATOM 1309 C PRO A 78 -3.262 35.321 23.543 1.00 0.00 C ATOM 1310 O PRO A 78 -3.978 35.945 22.757 1.00 0.00 O ATOM 1311 CB PRO A 78 -1.414 36.298 24.952 1.00 0.00 C ATOM 1312 CG PRO A 78 -1.543 37.774 24.578 1.00 0.00 C ATOM 1313 CD PRO A 78 -0.991 37.799 23.152 1.00 0.00 C ATOM 0 HA PRO A 78 -1.299 34.603 23.554 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -2.100 36.022 25.753 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.409 36.053 25.295 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -2.577 38.115 24.620 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.969 38.415 25.247 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -1.475 38.575 22.558 1.00 0.00 H new ATOM 0 HD3 PRO A 78 0.077 38.015 23.149 1.00 0.00 H new ATOM 1321 N ALA A 79 -3.735 34.382 24.376 1.00 0.00 N ATOM 1322 CA ALA A 79 -5.129 33.979 24.465 1.00 0.00 C ATOM 1323 C ALA A 79 -6.002 35.167 24.904 1.00 0.00 C ATOM 1324 O ALA A 79 -5.498 36.092 25.543 1.00 0.00 O ATOM 1325 CB ALA A 79 -5.220 32.791 25.429 1.00 0.00 C ATOM 0 H ALA A 79 -3.132 33.872 25.022 1.00 0.00 H new ATOM 0 HA ALA A 79 -5.508 33.666 23.492 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -6.258 32.469 25.513 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -4.615 31.968 25.050 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -4.852 33.090 26.411 1.00 0.00 H new ATOM 1430 N GLN A 86 -13.061 43.457 23.285 1.00 0.00 N ATOM 1431 CA GLN A 86 -12.726 43.802 21.900 1.00 0.00 C ATOM 1432 C GLN A 86 -11.416 43.135 21.493 1.00 0.00 C ATOM 1433 O GLN A 86 -11.284 42.658 20.369 1.00 0.00 O ATOM 1434 CB GLN A 86 -12.704 45.311 21.616 1.00 0.00 C ATOM 1435 CG GLN A 86 -14.027 46.003 21.964 1.00 0.00 C ATOM 1436 CD GLN A 86 -14.009 47.486 21.592 1.00 0.00 C ATOM 1437 OE1 GLN A 86 -12.973 48.037 21.227 1.00 0.00 O ATOM 1438 NE2 GLN A 86 -15.163 48.146 21.683 1.00 0.00 N ATOM 0 HA GLN A 86 -13.535 43.413 21.282 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -11.898 45.771 22.187 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -12.481 45.474 20.562 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -14.845 45.507 21.441 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -14.222 45.899 23.031 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -16.006 47.660 21.989 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -15.204 49.137 21.446 1.00 0.00 H new ATOM 1447 N ARG A 87 -10.472 43.061 22.435 1.00 0.00 N ATOM 1448 CA ARG A 87 -9.180 42.422 22.257 1.00 0.00 C ATOM 1449 C ARG A 87 -9.285 40.943 22.630 1.00 0.00 C ATOM 1450 O ARG A 87 -8.323 40.200 22.488 1.00 0.00 O ATOM 1451 CB ARG A 87 -8.135 43.160 23.116 1.00 0.00 C ATOM 1452 CG ARG A 87 -7.529 44.317 22.314 1.00 0.00 C ATOM 1453 CD ARG A 87 -6.518 43.815 21.270 1.00 0.00 C ATOM 1454 NE ARG A 87 -6.513 44.657 20.064 1.00 0.00 N ATOM 1455 CZ ARG A 87 -6.024 45.901 19.962 1.00 0.00 C ATOM 1456 NH1 ARG A 87 -5.432 46.496 21.004 1.00 0.00 N ATOM 1457 NH2 ARG A 87 -6.138 46.543 18.794 1.00 0.00 N ATOM 0 H ARG A 87 -10.596 43.458 23.367 1.00 0.00 H new ATOM 0 HA ARG A 87 -8.864 42.477 21.215 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.601 43.540 24.025 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -7.351 42.469 23.425 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -8.325 44.870 21.814 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -7.036 45.012 22.993 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -5.520 43.802 21.708 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -6.759 42.788 20.995 1.00 0.00 H new ATOM 0 HE ARG A 87 -6.922 44.254 19.221 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.347 46.002 21.893 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -5.065 47.443 20.910 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -6.590 46.085 18.003 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -5.773 47.490 18.695 1.00 0.00 H new ATOM 1471 N ALA A 88 -10.480 40.496 23.025 1.00 0.00 N ATOM 1472 CA ALA A 88 -10.788 39.095 23.267 1.00 0.00 C ATOM 1473 C ALA A 88 -11.262 38.550 21.924 1.00 0.00 C ATOM 1474 O ALA A 88 -10.935 37.433 21.529 1.00 0.00 O ATOM 1475 CB ALA A 88 -11.896 38.918 24.315 1.00 0.00 C ATOM 0 H ALA A 88 -11.273 41.116 23.187 1.00 0.00 H new ATOM 0 HA ALA A 88 -9.914 38.573 23.655 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -12.091 37.856 24.462 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -11.579 39.363 25.258 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -12.805 39.410 23.970 1.00 0.00 H new ATOM 1481 N ALA A 89 -12.023 39.383 21.216 1.00 0.00 N ATOM 1482 CA ALA A 89 -12.535 39.084 19.900 1.00 0.00 C ATOM 1483 C ALA A 89 -11.365 39.136 18.926 1.00 0.00 C ATOM 1484 O ALA A 89 -10.966 38.112 18.389 1.00 0.00 O ATOM 1485 CB ALA A 89 -13.664 40.059 19.546 1.00 0.00 C ATOM 0 H ALA A 89 -12.301 40.303 21.558 1.00 0.00 H new ATOM 0 HA ALA A 89 -12.974 38.087 19.853 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.046 39.828 18.552 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.469 39.964 20.275 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.281 41.079 19.559 1.00 0.00 H new ATOM 1491 N GLU A 90 -10.819 40.333 18.714 1.00 0.00 N ATOM 1492 CA GLU A 90 -9.718 40.624 17.799 1.00 0.00 C ATOM 1493 C GLU A 90 -8.420 39.843 18.028 1.00 0.00 C ATOM 1494 O GLU A 90 -7.606 39.768 17.110 1.00 0.00 O ATOM 1495 CB GLU A 90 -9.495 42.147 17.807 1.00 0.00 C ATOM 1496 CG GLU A 90 -8.570 42.677 16.707 1.00 0.00 C ATOM 1497 CD GLU A 90 -8.399 44.183 16.843 1.00 0.00 C ATOM 1498 OE1 GLU A 90 -9.279 44.916 16.346 1.00 0.00 O ATOM 1499 OE2 GLU A 90 -7.395 44.580 17.476 1.00 0.00 O ATOM 0 H GLU A 90 -11.150 41.167 19.200 1.00 0.00 H new ATOM 0 HA GLU A 90 -10.019 40.270 16.813 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -10.463 42.640 17.715 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -9.083 42.433 18.775 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -7.599 42.186 16.771 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -8.984 42.438 15.727 1.00 0.00 H new ATOM 1506 N ASN A 91 -8.197 39.245 19.204 1.00 0.00 N ATOM 1507 CA ASN A 91 -6.973 38.477 19.419 1.00 0.00 C ATOM 1508 C ASN A 91 -7.173 37.194 18.640 1.00 0.00 C ATOM 1509 O ASN A 91 -6.504 36.961 17.638 1.00 0.00 O ATOM 1510 CB ASN A 91 -6.700 38.152 20.911 1.00 0.00 C ATOM 1511 CG ASN A 91 -5.738 39.157 21.550 1.00 0.00 C ATOM 1512 OD1 ASN A 91 -5.752 40.342 21.226 1.00 0.00 O ATOM 1513 ND2 ASN A 91 -4.874 38.688 22.452 1.00 0.00 N ATOM 0 H ASN A 91 -8.833 39.278 20.001 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.109 39.055 19.092 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -7.642 38.152 21.460 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.283 37.148 20.993 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.203 39.318 22.891 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -4.885 37.699 22.702 1.00 0.00 H new ATOM 1520 N ARG A 92 -8.116 36.363 19.090 1.00 0.00 N ATOM 1521 CA ARG A 92 -8.376 35.114 18.405 1.00 0.00 C ATOM 1522 C ARG A 92 -8.865 35.321 16.977 1.00 0.00 C ATOM 1523 O ARG A 92 -8.596 34.480 16.124 1.00 0.00 O ATOM 1524 CB ARG A 92 -9.300 34.206 19.233 1.00 0.00 C ATOM 1525 CG ARG A 92 -10.779 34.611 19.152 1.00 0.00 C ATOM 1526 CD ARG A 92 -11.647 33.699 20.024 1.00 0.00 C ATOM 1527 NE ARG A 92 -13.065 33.796 19.647 1.00 0.00 N ATOM 1528 CZ ARG A 92 -13.990 32.866 19.935 1.00 0.00 C ATOM 1529 NH1 ARG A 92 -13.721 31.893 20.812 1.00 0.00 N ATOM 1530 NH2 ARG A 92 -15.186 32.891 19.335 1.00 0.00 N ATOM 0 H ARG A 92 -8.697 36.535 19.910 1.00 0.00 H new ATOM 0 HA ARG A 92 -7.424 34.591 18.310 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.192 33.178 18.888 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.981 34.227 20.275 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.894 35.646 19.475 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.117 34.560 18.117 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -11.311 32.667 19.923 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.527 33.972 21.072 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.366 34.624 19.133 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.809 31.854 21.267 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.428 31.190 21.026 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.400 33.620 18.654 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -15.884 32.181 19.559 1.00 0.00 H new ATOM 1544 N GLN A 93 -9.571 36.427 16.712 1.00 0.00 N ATOM 1545 CA GLN A 93 -10.104 36.706 15.378 1.00 0.00 C ATOM 1546 C GLN A 93 -9.065 37.328 14.446 1.00 0.00 C ATOM 1547 O GLN A 93 -9.380 37.591 13.289 1.00 0.00 O ATOM 1548 CB GLN A 93 -11.391 37.537 15.432 1.00 0.00 C ATOM 1549 CG GLN A 93 -12.547 36.751 16.072 1.00 0.00 C ATOM 1550 CD GLN A 93 -13.819 37.586 16.199 1.00 0.00 C ATOM 1551 OE1 GLN A 93 -13.776 38.812 16.183 1.00 0.00 O ATOM 1552 NE2 GLN A 93 -14.969 36.922 16.333 1.00 0.00 N ATOM 0 H GLN A 93 -9.785 37.143 17.407 1.00 0.00 H new ATOM 0 HA GLN A 93 -10.365 35.739 14.948 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.212 38.449 16.001 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.671 37.840 14.423 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -12.756 35.865 15.473 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -12.244 36.404 17.060 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -14.971 35.902 16.343 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -15.846 37.435 16.426 1.00 0.00 H new ATOM 1561 N GLY A 94 -7.835 37.537 14.923 1.00 0.00 N ATOM 1562 CA GLY A 94 -6.728 38.056 14.129 1.00 0.00 C ATOM 1563 C GLY A 94 -5.713 36.928 13.991 1.00 0.00 C ATOM 1564 O GLY A 94 -5.250 36.632 12.894 1.00 0.00 O ATOM 0 H GLY A 94 -7.580 37.345 15.892 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -7.076 38.384 13.149 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -6.278 38.923 14.614 1.00 0.00 H new ATOM 1568 N THR A 95 -5.386 36.284 15.114 1.00 0.00 N ATOM 1569 CA THR A 95 -4.455 35.171 15.190 1.00 0.00 C ATOM 1570 C THR A 95 -4.947 34.000 14.363 1.00 0.00 C ATOM 1571 O THR A 95 -4.169 33.426 13.612 1.00 0.00 O ATOM 1572 CB THR A 95 -4.262 34.785 16.665 1.00 0.00 C ATOM 1573 OG1 THR A 95 -3.742 35.887 17.377 1.00 0.00 O ATOM 1574 CG2 THR A 95 -3.326 33.584 16.846 1.00 0.00 C ATOM 0 H THR A 95 -5.778 36.536 16.021 1.00 0.00 H new ATOM 0 HA THR A 95 -3.492 35.467 14.775 1.00 0.00 H new ATOM 0 HB THR A 95 -5.240 34.500 17.052 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.799 35.724 17.590 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.227 33.357 17.907 1.00 0.00 H new ATOM 0 HG22 THR A 95 -3.739 32.719 16.327 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.346 33.821 16.433 1.00 0.00 H new ATOM 1582 N LEU A 96 -6.229 33.654 14.476 1.00 0.00 N ATOM 1583 CA LEU A 96 -6.793 32.578 13.676 1.00 0.00 C ATOM 1584 C LEU A 96 -6.776 33.048 12.229 1.00 0.00 C ATOM 1585 O LEU A 96 -6.215 32.382 11.373 1.00 0.00 O ATOM 1586 CB LEU A 96 -8.197 32.254 14.183 1.00 0.00 C ATOM 1587 CG LEU A 96 -8.989 31.179 13.430 1.00 0.00 C ATOM 1588 CD1 LEU A 96 -9.128 31.411 11.970 1.00 0.00 C ATOM 1589 CD2 LEU A 96 -8.606 29.712 13.532 1.00 0.00 C ATOM 0 H LEU A 96 -6.890 34.103 15.111 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.219 31.655 13.752 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -8.116 31.944 15.225 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -8.781 33.174 14.169 1.00 0.00 H new ATOM 0 HG LEU A 96 -9.903 31.325 14.005 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -9.703 30.598 11.526 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -9.644 32.356 11.799 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -8.140 31.449 11.512 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -9.288 29.115 12.927 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -7.587 29.576 13.171 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -8.668 29.391 14.572 1.00 0.00 H new ATOM 1601 N THR A 97 -7.390 34.203 11.973 1.00 0.00 N ATOM 1602 CA THR A 97 -7.493 34.848 10.662 1.00 0.00 C ATOM 1603 C THR A 97 -6.175 34.856 9.913 1.00 0.00 C ATOM 1604 O THR A 97 -6.159 34.680 8.695 1.00 0.00 O ATOM 1605 CB THR A 97 -8.061 36.266 10.842 1.00 0.00 C ATOM 1606 OG1 THR A 97 -9.460 36.172 10.999 1.00 0.00 O ATOM 1607 CG2 THR A 97 -7.711 37.275 9.749 1.00 0.00 C ATOM 0 H THR A 97 -7.851 34.740 12.707 1.00 0.00 H new ATOM 0 HA THR A 97 -8.175 34.266 10.043 1.00 0.00 H new ATOM 0 HB THR A 97 -7.576 36.671 11.731 1.00 0.00 H new ATOM 0 HG1 THR A 97 -9.731 36.651 11.810 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.166 38.238 9.983 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.628 37.389 9.692 1.00 0.00 H new ATOM 0 HG23 THR A 97 -8.089 36.919 8.791 1.00 0.00 H new ATOM 1615 N GLU A 98 -5.079 35.028 10.644 1.00 0.00 N ATOM 1616 CA GLU A 98 -3.776 35.046 10.028 1.00 0.00 C ATOM 1617 C GLU A 98 -3.256 33.631 9.977 1.00 0.00 C ATOM 1618 O GLU A 98 -2.687 33.259 8.957 1.00 0.00 O ATOM 1619 CB GLU A 98 -2.850 36.004 10.792 1.00 0.00 C ATOM 1620 CG GLU A 98 -1.528 36.224 10.047 1.00 0.00 C ATOM 1621 CD GLU A 98 -0.456 36.835 10.944 1.00 0.00 C ATOM 1622 OE1 GLU A 98 -0.810 37.755 11.711 1.00 0.00 O ATOM 1623 OE2 GLU A 98 0.695 36.352 10.860 1.00 0.00 O ATOM 0 H GLU A 98 -5.076 35.155 11.656 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.826 35.421 9.006 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -3.352 36.961 10.934 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.647 35.601 11.784 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -1.171 35.272 9.654 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -1.699 36.877 9.192 1.00 0.00 H new ATOM 1630 N TYR A 99 -3.464 32.818 11.014 1.00 0.00 N ATOM 1631 CA TYR A 99 -2.979 31.453 10.929 1.00 0.00 C ATOM 1632 C TYR A 99 -3.610 30.699 9.795 1.00 0.00 C ATOM 1633 O TYR A 99 -2.899 29.946 9.181 1.00 0.00 O ATOM 1634 CB TYR A 99 -3.065 30.557 12.176 1.00 0.00 C ATOM 1635 CG TYR A 99 -1.936 29.495 12.309 1.00 0.00 C ATOM 1636 CD1 TYR A 99 -0.659 29.639 11.693 1.00 0.00 C ATOM 1637 CD2 TYR A 99 -2.158 28.330 13.076 1.00 0.00 C ATOM 1638 CE1 TYR A 99 0.350 28.671 11.850 1.00 0.00 C ATOM 1639 CE2 TYR A 99 -1.144 27.362 13.236 1.00 0.00 C ATOM 1640 CZ TYR A 99 0.098 27.532 12.614 1.00 0.00 C ATOM 1641 OH TYR A 99 1.067 26.584 12.722 1.00 0.00 O ATOM 0 H TYR A 99 -3.942 33.069 11.880 1.00 0.00 H new ATOM 0 HA TYR A 99 -1.916 31.642 10.780 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -3.050 31.192 13.062 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -4.026 30.043 12.169 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.461 30.513 11.091 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.118 28.178 13.547 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.313 28.809 11.382 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -1.327 26.486 13.841 1.00 0.00 H new ATOM 0 HH TYR A 99 1.322 26.482 13.663 1.00 0.00 H new ATOM 1651 N CYS A 100 -4.892 30.850 9.489 1.00 0.00 N ATOM 1652 CA CYS A 100 -5.464 30.103 8.377 1.00 0.00 C ATOM 1653 C CYS A 100 -4.713 30.448 7.102 1.00 0.00 C ATOM 1654 O CYS A 100 -4.308 29.556 6.356 1.00 0.00 O ATOM 1655 CB CYS A 100 -6.961 30.384 8.229 1.00 0.00 C ATOM 1656 SG CYS A 100 -7.657 29.227 7.020 1.00 0.00 S ATOM 0 H CYS A 100 -5.541 31.465 9.980 1.00 0.00 H new ATOM 0 HA CYS A 100 -5.359 29.037 8.576 1.00 0.00 H new ATOM 0 HB2 CYS A 100 -7.463 30.272 9.190 1.00 0.00 H new ATOM 0 HB3 CYS A 100 -7.122 31.412 7.903 1.00 0.00 H new ATOM 0 HG CYS A 100 -8.276 28.268 7.643 1.00 0.00 H new ATOM 1662 N SER A 101 -4.506 31.745 6.872 1.00 0.00 N ATOM 1663 CA SER A 101 -3.769 32.174 5.692 1.00 0.00 C ATOM 1664 C SER A 101 -2.290 31.772 5.719 1.00 0.00 C ATOM 1665 O SER A 101 -1.699 31.509 4.674 1.00 0.00 O ATOM 1666 CB SER A 101 -3.913 33.694 5.565 1.00 0.00 C ATOM 1667 OG SER A 101 -5.279 34.038 5.446 1.00 0.00 O ATOM 0 H SER A 101 -4.832 32.500 7.475 1.00 0.00 H new ATOM 0 HA SER A 101 -4.193 31.668 4.825 1.00 0.00 H new ATOM 0 HB2 SER A 101 -3.480 34.184 6.437 1.00 0.00 H new ATOM 0 HB3 SER A 101 -3.362 34.049 4.694 1.00 0.00 H new ATOM 0 HG SER A 101 -5.366 35.011 5.367 1.00 0.00 H new ATOM 1673 N THR A 102 -1.692 31.750 6.908 1.00 0.00 N ATOM 1674 CA THR A 102 -0.288 31.474 7.164 1.00 0.00 C ATOM 1675 C THR A 102 0.055 30.000 7.262 1.00 0.00 C ATOM 1676 O THR A 102 1.162 29.630 6.901 1.00 0.00 O ATOM 1677 CB THR A 102 0.188 32.346 8.335 1.00 0.00 C ATOM 1678 OG1 THR A 102 0.004 33.699 7.974 1.00 0.00 O ATOM 1679 CG2 THR A 102 1.652 32.166 8.698 1.00 0.00 C ATOM 0 H THR A 102 -2.209 31.936 7.767 1.00 0.00 H new ATOM 0 HA THR A 102 0.291 31.763 6.287 1.00 0.00 H new ATOM 0 HB THR A 102 -0.396 32.043 9.204 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.946 33.929 8.042 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.903 32.819 9.534 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.832 31.129 8.981 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.274 32.421 7.840 1.00 0.00 H new ATOM 1687 N LEU A 103 -0.875 29.148 7.686 1.00 0.00 N ATOM 1688 CA LEU A 103 -0.695 27.695 7.762 1.00 0.00 C ATOM 1689 C LEU A 103 -0.495 27.253 6.302 1.00 0.00 C ATOM 1690 O LEU A 103 0.274 26.330 6.040 1.00 0.00 O ATOM 1691 CB LEU A 103 -1.886 27.025 8.518 1.00 0.00 C ATOM 1692 CG LEU A 103 -1.729 26.265 9.867 1.00 0.00 C ATOM 1693 CD1 LEU A 103 -3.079 26.112 10.577 1.00 0.00 C ATOM 1694 CD2 LEU A 103 -1.173 24.828 9.825 1.00 0.00 C ATOM 0 H LEU A 103 -1.798 29.453 7.994 1.00 0.00 H new ATOM 0 HA LEU A 103 0.167 27.382 8.351 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.620 27.812 8.693 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.335 26.320 7.819 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.002 26.902 10.371 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.938 25.577 11.516 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.497 27.098 10.780 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -3.764 25.552 9.940 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.121 24.428 10.838 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.829 24.201 9.221 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.175 24.837 9.386 1.00 0.00 H new ATOM 1706 N MET A 104 -1.147 27.947 5.350 1.00 0.00 N ATOM 1707 CA MET A 104 -0.999 27.717 3.913 1.00 0.00 C ATOM 1708 C MET A 104 0.102 28.549 3.259 1.00 0.00 C ATOM 1709 O MET A 104 0.429 28.321 2.095 1.00 0.00 O ATOM 1710 CB MET A 104 -2.335 27.973 3.205 1.00 0.00 C ATOM 1711 CG MET A 104 -2.475 27.110 1.948 1.00 0.00 C ATOM 1712 SD MET A 104 -3.371 25.556 2.172 1.00 0.00 S ATOM 1713 CE MET A 104 -2.612 24.868 3.663 1.00 0.00 C ATOM 0 H MET A 104 -1.803 28.697 5.570 1.00 0.00 H new ATOM 0 HA MET A 104 -0.698 26.675 3.802 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.157 27.760 3.888 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.410 29.026 2.935 1.00 0.00 H new ATOM 0 HG2 MET A 104 -2.982 27.695 1.181 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.478 26.884 1.570 1.00 0.00 H new ATOM 0 HE1 MET A 104 -3.091 23.921 3.912 1.00 0.00 H new ATOM 0 HE2 MET A 104 -1.549 24.701 3.487 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.737 25.566 4.490 1.00 0.00 H new ATOM 1723 N SER A 105 0.667 29.498 3.996 1.00 0.00 N ATOM 1724 CA SER A 105 1.728 30.360 3.501 1.00 0.00 C ATOM 1725 C SER A 105 3.065 29.714 3.816 1.00 0.00 C ATOM 1726 O SER A 105 3.971 29.758 2.985 1.00 0.00 O ATOM 1727 CB SER A 105 1.662 31.788 4.100 1.00 0.00 C ATOM 1728 OG SER A 105 2.416 32.674 3.300 1.00 0.00 O ATOM 0 H SER A 105 0.398 29.691 4.961 1.00 0.00 H new ATOM 0 HA SER A 105 1.603 30.472 2.424 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.626 32.123 4.154 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.049 31.784 5.119 1.00 0.00 H new ATOM 0 HG SER A 105 2.371 33.576 3.680 1.00 0.00 H new ATOM 1734 N LEU A 106 3.178 29.130 5.018 1.00 0.00 N ATOM 1735 CA LEU A 106 4.345 28.492 5.526 1.00 0.00 C ATOM 1736 C LEU A 106 5.237 27.836 4.478 1.00 0.00 C ATOM 1737 O LEU A 106 4.741 27.048 3.673 1.00 0.00 O ATOM 1738 CB LEU A 106 3.996 27.597 6.715 1.00 0.00 C ATOM 1739 CG LEU A 106 3.610 28.278 8.050 1.00 0.00 C ATOM 1740 CD1 LEU A 106 4.161 27.430 9.190 1.00 0.00 C ATOM 1741 CD2 LEU A 106 4.092 29.721 8.269 1.00 0.00 C ATOM 0 H LEU A 106 2.401 29.103 5.678 1.00 0.00 H new ATOM 0 HA LEU A 106 4.992 29.286 5.899 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.168 26.954 6.417 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.851 26.948 6.906 1.00 0.00 H new ATOM 0 HG LEU A 106 2.523 28.346 8.017 1.00 0.00 H new ATOM 0 HD11 LEU A 106 3.902 27.890 10.144 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.731 26.430 9.140 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.245 27.363 9.102 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.752 30.074 9.242 1.00 0.00 H new ATOM 0 HD22 LEU A 106 5.181 29.750 8.232 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.685 30.363 7.488 1.00 0.00 H new ATOM 1753 N PRO A 107 6.553 28.144 4.470 1.00 0.00 N ATOM 1754 CA PRO A 107 7.449 27.550 3.499 1.00 0.00 C ATOM 1755 C PRO A 107 7.856 26.158 3.911 1.00 0.00 C ATOM 1756 O PRO A 107 8.396 25.387 3.121 1.00 0.00 O ATOM 1757 CB PRO A 107 8.662 28.449 3.434 1.00 0.00 C ATOM 1758 CG PRO A 107 8.759 28.993 4.862 1.00 0.00 C ATOM 1759 CD PRO A 107 7.312 29.012 5.375 1.00 0.00 C ATOM 0 HA PRO A 107 6.960 27.462 2.529 1.00 0.00 H new ATOM 0 HB2 PRO A 107 9.559 27.898 3.149 1.00 0.00 H new ATOM 0 HB3 PRO A 107 8.534 29.249 2.704 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.391 28.359 5.484 1.00 0.00 H new ATOM 0 HG3 PRO A 107 9.197 29.991 4.876 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.257 28.649 6.401 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.910 30.025 5.373 1.00 0.00 H new ATOM 1767 N THR A 108 7.544 25.831 5.155 1.00 0.00 N ATOM 1768 CA THR A 108 7.774 24.542 5.738 1.00 0.00 C ATOM 1769 C THR A 108 6.605 23.671 5.345 1.00 0.00 C ATOM 1770 O THR A 108 6.152 22.860 6.131 1.00 0.00 O ATOM 1771 CB THR A 108 7.808 24.733 7.254 1.00 0.00 C ATOM 1772 OG1 THR A 108 6.850 25.691 7.657 1.00 0.00 O ATOM 1773 CG2 THR A 108 9.183 25.176 7.711 1.00 0.00 C ATOM 0 H THR A 108 7.108 26.489 5.801 1.00 0.00 H new ATOM 0 HA THR A 108 8.706 24.085 5.406 1.00 0.00 H new ATOM 0 HB THR A 108 7.572 23.773 7.714 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.635 25.560 8.604 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.183 25.305 8.793 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.919 24.420 7.436 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.438 26.122 7.233 1.00 0.00 H new ATOM 1781 N LYS A 109 6.098 23.802 4.125 1.00 0.00 N ATOM 1782 CA LYS A 109 4.977 22.970 3.722 1.00 0.00 C ATOM 1783 C LYS A 109 5.382 21.511 3.578 1.00 0.00 C ATOM 1784 O LYS A 109 4.509 20.660 3.468 1.00 0.00 O ATOM 1785 CB LYS A 109 4.345 23.537 2.427 1.00 0.00 C ATOM 1786 CG LYS A 109 2.897 23.072 2.230 1.00 0.00 C ATOM 1787 CD LYS A 109 2.266 23.787 1.027 1.00 0.00 C ATOM 1788 CE LYS A 109 0.820 23.321 0.808 1.00 0.00 C ATOM 1789 NZ LYS A 109 0.187 24.007 -0.336 1.00 0.00 N ATOM 0 H LYS A 109 6.434 24.456 3.418 1.00 0.00 H new ATOM 0 HA LYS A 109 4.221 22.995 4.507 1.00 0.00 H new ATOM 0 HB2 LYS A 109 4.373 24.626 2.459 1.00 0.00 H new ATOM 0 HB3 LYS A 109 4.943 23.228 1.569 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.872 21.993 2.074 1.00 0.00 H new ATOM 0 HG3 LYS A 109 2.316 23.278 3.129 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.284 24.865 1.189 1.00 0.00 H new ATOM 0 HD3 LYS A 109 2.855 23.589 0.132 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.808 22.244 0.638 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.238 23.508 1.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -0.788 23.664 -0.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 0.175 25.032 -0.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 0.727 23.808 -1.202 1.00 0.00 H new ATOM 1803 N ILE A 110 6.687 21.232 3.617 1.00 0.00 N ATOM 1804 CA ILE A 110 7.247 19.893 3.571 1.00 0.00 C ATOM 1805 C ILE A 110 7.459 19.375 4.998 1.00 0.00 C ATOM 1806 O ILE A 110 7.288 18.184 5.252 1.00 0.00 O ATOM 1807 CB ILE A 110 8.551 19.892 2.750 1.00 0.00 C ATOM 1808 CG1 ILE A 110 8.382 20.542 1.363 1.00 0.00 C ATOM 1809 CG2 ILE A 110 9.113 18.470 2.611 1.00 0.00 C ATOM 1810 CD1 ILE A 110 7.296 19.902 0.491 1.00 0.00 C ATOM 0 H ILE A 110 7.399 21.959 3.684 1.00 0.00 H new ATOM 0 HA ILE A 110 6.553 19.216 3.073 1.00 0.00 H new ATOM 0 HB ILE A 110 9.265 20.502 3.304 1.00 0.00 H new ATOM 0 HG12 ILE A 110 8.148 21.598 1.496 1.00 0.00 H new ATOM 0 HG13 ILE A 110 9.333 20.491 0.833 1.00 0.00 H new ATOM 0 HG21 ILE A 110 10.033 18.498 2.027 1.00 0.00 H new ATOM 0 HG22 ILE A 110 9.323 18.063 3.600 1.00 0.00 H new ATOM 0 HG23 ILE A 110 8.382 17.838 2.107 1.00 0.00 H new ATOM 0 HD11 ILE A 110 7.245 20.421 -0.466 1.00 0.00 H new ATOM 0 HD12 ILE A 110 7.537 18.852 0.322 1.00 0.00 H new ATOM 0 HD13 ILE A 110 6.333 19.977 0.996 1.00 0.00 H new ATOM 1822 N SER A 111 7.830 20.262 5.931 1.00 0.00 N ATOM 1823 CA SER A 111 8.086 19.911 7.321 1.00 0.00 C ATOM 1824 C SER A 111 6.795 19.845 8.124 1.00 0.00 C ATOM 1825 O SER A 111 6.566 18.896 8.872 1.00 0.00 O ATOM 1826 CB SER A 111 9.089 20.886 7.948 1.00 0.00 C ATOM 1827 OG SER A 111 10.292 20.888 7.206 1.00 0.00 O ATOM 0 H SER A 111 7.960 21.254 5.732 1.00 0.00 H new ATOM 0 HA SER A 111 8.528 18.915 7.342 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.666 21.890 7.972 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.290 20.600 8.980 1.00 0.00 H new ATOM 0 HG SER A 111 10.926 21.515 7.613 1.00 0.00 H new ATOM 1833 N ARG A 112 5.951 20.861 7.951 1.00 0.00 N ATOM 1834 CA ARG A 112 4.668 20.978 8.623 1.00 0.00 C ATOM 1835 C ARG A 112 3.564 20.261 7.843 1.00 0.00 C ATOM 1836 O ARG A 112 2.413 20.285 8.279 1.00 0.00 O ATOM 1837 CB ARG A 112 4.381 22.449 8.971 1.00 0.00 C ATOM 1838 CG ARG A 112 3.715 23.257 7.851 1.00 0.00 C ATOM 1839 CD ARG A 112 2.255 23.568 8.202 1.00 0.00 C ATOM 1840 NE ARG A 112 1.511 24.032 7.026 1.00 0.00 N ATOM 1841 CZ ARG A 112 1.072 23.246 6.031 1.00 0.00 C ATOM 1842 NH1 ARG A 112 1.294 21.926 6.041 1.00 0.00 N ATOM 1843 NH2 ARG A 112 0.401 23.799 5.019 1.00 0.00 N ATOM 0 H ARG A 112 6.149 21.641 7.324 1.00 0.00 H new ATOM 0 HA ARG A 112 4.700 20.456 9.579 1.00 0.00 H new ATOM 0 HB2 ARG A 112 3.741 22.481 9.853 1.00 0.00 H new ATOM 0 HB3 ARG A 112 5.319 22.934 9.241 1.00 0.00 H new ATOM 0 HG2 ARG A 112 4.262 24.186 7.692 1.00 0.00 H new ATOM 0 HG3 ARG A 112 3.758 22.697 6.917 1.00 0.00 H new ATOM 0 HD2 ARG A 112 1.778 22.676 8.608 1.00 0.00 H new ATOM 0 HD3 ARG A 112 2.220 24.330 8.981 1.00 0.00 H new ATOM 0 HE ARG A 112 1.312 25.030 6.959 1.00 0.00 H new ATOM 0 HH11 ARG A 112 1.805 21.501 6.814 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.952 21.346 5.275 1.00 0.00 H new ATOM 0 HH21 ARG A 112 0.229 24.804 5.010 1.00 0.00 H new ATOM 0 HH22 ARG A 112 0.060 23.216 4.254 1.00 0.00 H new ATOM 1857 N CYS A 113 3.889 19.609 6.712 1.00 0.00 N ATOM 1858 CA CYS A 113 2.914 18.839 5.943 1.00 0.00 C ATOM 1859 C CYS A 113 2.164 17.872 6.865 1.00 0.00 C ATOM 1860 O CYS A 113 0.955 18.030 7.024 1.00 0.00 O ATOM 1861 CB CYS A 113 3.536 18.088 4.752 1.00 0.00 C ATOM 1862 SG CYS A 113 2.321 18.016 3.410 1.00 0.00 S ATOM 0 H CYS A 113 4.828 19.605 6.314 1.00 0.00 H new ATOM 0 HA CYS A 113 2.211 19.554 5.515 1.00 0.00 H new ATOM 0 HB2 CYS A 113 4.440 18.596 4.416 1.00 0.00 H new ATOM 0 HB3 CYS A 113 3.828 17.081 5.051 1.00 0.00 H new ATOM 0 HG CYS A 113 2.833 17.386 2.395 1.00 0.00 H new ATOM 1868 N PRO A 114 2.839 16.890 7.499 1.00 0.00 N ATOM 1869 CA PRO A 114 2.174 15.949 8.383 1.00 0.00 C ATOM 1870 C PRO A 114 1.485 16.622 9.542 1.00 0.00 C ATOM 1871 O PRO A 114 0.477 16.103 10.000 1.00 0.00 O ATOM 1872 CB PRO A 114 3.235 14.945 8.839 1.00 0.00 C ATOM 1873 CG PRO A 114 4.526 15.752 8.721 1.00 0.00 C ATOM 1874 CD PRO A 114 4.266 16.580 7.464 1.00 0.00 C ATOM 0 HA PRO A 114 1.369 15.441 7.852 1.00 0.00 H new ATOM 0 HB2 PRO A 114 3.060 14.606 9.860 1.00 0.00 H new ATOM 0 HB3 PRO A 114 3.252 14.057 8.207 1.00 0.00 H new ATOM 0 HG2 PRO A 114 4.697 16.380 9.596 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.401 15.110 8.614 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.867 17.490 7.460 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.526 16.022 6.564 1.00 0.00 H new ATOM 1882 N HIS A 115 1.987 17.765 10.007 1.00 0.00 N ATOM 1883 CA HIS A 115 1.313 18.433 11.099 1.00 0.00 C ATOM 1884 C HIS A 115 -0.065 18.893 10.606 1.00 0.00 C ATOM 1885 O HIS A 115 -1.081 18.538 11.203 1.00 0.00 O ATOM 1886 CB HIS A 115 2.198 19.484 11.785 1.00 0.00 C ATOM 1887 CG HIS A 115 1.905 19.650 13.264 1.00 0.00 C ATOM 1888 ND1 HIS A 115 1.531 18.598 14.092 1.00 0.00 N ATOM 1889 CD2 HIS A 115 1.921 20.747 14.090 1.00 0.00 C ATOM 1890 CE1 HIS A 115 1.343 19.096 15.325 1.00 0.00 C ATOM 1891 NE2 HIS A 115 1.568 20.407 15.390 1.00 0.00 N ATOM 0 H HIS A 115 2.826 18.227 9.656 1.00 0.00 H new ATOM 0 HA HIS A 115 1.124 17.747 11.925 1.00 0.00 H new ATOM 0 HB2 HIS A 115 3.244 19.205 11.659 1.00 0.00 H new ATOM 0 HB3 HIS A 115 2.062 20.443 11.286 1.00 0.00 H new ATOM 0 HD2 HIS A 115 2.176 21.747 13.770 1.00 0.00 H new ATOM 0 HE1 HIS A 115 1.042 18.498 16.172 1.00 0.00 H new ATOM 0 HE2 HIS A 115 1.498 21.018 16.204 1.00 0.00 H new ATOM 1899 N LEU A 116 -0.143 19.651 9.502 1.00 0.00 N ATOM 1900 CA LEU A 116 -1.439 20.061 9.001 1.00 0.00 C ATOM 1901 C LEU A 116 -2.364 18.860 8.756 1.00 0.00 C ATOM 1902 O LEU A 116 -3.505 18.815 9.215 1.00 0.00 O ATOM 1903 CB LEU A 116 -1.363 20.933 7.743 1.00 0.00 C ATOM 1904 CG LEU A 116 -2.604 21.828 7.555 1.00 0.00 C ATOM 1905 CD1 LEU A 116 -3.219 21.799 6.142 1.00 0.00 C ATOM 1906 CD2 LEU A 116 -3.795 21.559 8.432 1.00 0.00 C ATOM 0 H LEU A 116 0.657 19.979 8.961 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.865 20.679 9.791 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.474 21.561 7.796 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -1.249 20.291 6.869 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.133 22.777 7.813 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -4.086 22.459 6.109 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.479 22.135 5.416 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -3.528 20.782 5.901 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -4.591 22.263 8.190 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.147 20.541 8.265 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.511 21.678 9.478 1.00 0.00 H new ATOM 1918 N LEU A 117 -1.863 17.852 8.047 1.00 0.00 N ATOM 1919 CA LEU A 117 -2.618 16.625 7.830 1.00 0.00 C ATOM 1920 C LEU A 117 -3.101 16.088 9.178 1.00 0.00 C ATOM 1921 O LEU A 117 -4.241 15.670 9.283 1.00 0.00 O ATOM 1922 CB LEU A 117 -1.831 15.581 7.037 1.00 0.00 C ATOM 1923 CG LEU A 117 -1.737 15.799 5.507 1.00 0.00 C ATOM 1924 CD1 LEU A 117 -0.458 16.470 5.019 1.00 0.00 C ATOM 1925 CD2 LEU A 117 -1.826 14.430 4.868 1.00 0.00 C ATOM 0 H LEU A 117 -0.939 17.862 7.614 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.485 16.857 7.211 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.818 15.541 7.438 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.284 14.606 7.215 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.544 16.478 5.231 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.493 16.575 3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.367 17.455 5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 117 0.402 15.860 5.296 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.764 14.530 3.784 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.004 13.809 5.223 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.774 13.964 5.136 1.00 0.00 H new ATOM 1937 N ASP A 118 -2.278 16.138 10.222 1.00 0.00 N ATOM 1938 CA ASP A 118 -2.653 15.724 11.574 1.00 0.00 C ATOM 1939 C ASP A 118 -3.529 16.752 12.327 1.00 0.00 C ATOM 1940 O ASP A 118 -3.978 16.482 13.436 1.00 0.00 O ATOM 1941 CB ASP A 118 -1.368 15.554 12.398 1.00 0.00 C ATOM 1942 CG ASP A 118 -0.578 14.285 12.088 1.00 0.00 C ATOM 1943 OD1 ASP A 118 -0.945 13.585 11.118 1.00 0.00 O ATOM 1944 OD2 ASP A 118 0.390 14.033 12.835 1.00 0.00 O ATOM 0 H ASP A 118 -1.317 16.472 10.153 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.230 14.806 11.465 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.725 16.417 12.227 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -1.628 15.555 13.457 1.00 0.00 H new ATOM 1949 N PHE A 119 -3.777 17.927 11.748 1.00 0.00 N ATOM 1950 CA PHE A 119 -4.585 19.033 12.272 1.00 0.00 C ATOM 1951 C PHE A 119 -6.017 18.681 11.898 1.00 0.00 C ATOM 1952 O PHE A 119 -6.963 18.859 12.662 1.00 0.00 O ATOM 1953 CB PHE A 119 -4.155 20.355 11.541 1.00 0.00 C ATOM 1954 CG PHE A 119 -4.058 21.715 12.229 1.00 0.00 C ATOM 1955 CD1 PHE A 119 -4.982 22.003 13.230 1.00 0.00 C ATOM 1956 CD2 PHE A 119 -3.073 22.689 11.909 1.00 0.00 C ATOM 1957 CE1 PHE A 119 -4.961 23.200 13.958 1.00 0.00 C ATOM 1958 CE2 PHE A 119 -3.049 23.880 12.655 1.00 0.00 C ATOM 1959 CZ PHE A 119 -3.977 24.147 13.670 1.00 0.00 C ATOM 0 H PHE A 119 -3.390 18.149 10.831 1.00 0.00 H new ATOM 0 HA PHE A 119 -4.468 19.178 13.346 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -3.173 20.160 11.111 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -4.848 20.483 10.709 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -5.746 21.274 13.455 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -2.362 22.518 11.114 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -5.694 23.387 14.729 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.288 24.615 12.438 1.00 0.00 H new ATOM 0 HZ PHE A 119 -3.932 25.074 14.223 1.00 0.00 H new ATOM 1969 N PHE A 120 -6.126 18.199 10.662 1.00 0.00 N ATOM 1970 CA PHE A 120 -7.346 17.854 9.973 1.00 0.00 C ATOM 1971 C PHE A 120 -7.785 16.397 10.075 1.00 0.00 C ATOM 1972 O PHE A 120 -8.927 16.120 10.433 1.00 0.00 O ATOM 1973 CB PHE A 120 -7.024 18.241 8.527 1.00 0.00 C ATOM 1974 CG PHE A 120 -6.925 19.730 8.238 1.00 0.00 C ATOM 1975 CD1 PHE A 120 -7.224 20.710 9.206 1.00 0.00 C ATOM 1976 CD2 PHE A 120 -6.539 20.134 6.953 1.00 0.00 C ATOM 1977 CE1 PHE A 120 -7.195 22.070 8.869 1.00 0.00 C ATOM 1978 CE2 PHE A 120 -6.511 21.492 6.610 1.00 0.00 C ATOM 1979 CZ PHE A 120 -6.853 22.462 7.568 1.00 0.00 C ATOM 0 H PHE A 120 -5.302 18.031 10.085 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.198 18.368 10.417 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.079 17.774 8.250 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -7.791 17.816 7.880 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -7.477 20.411 10.213 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.260 19.391 6.220 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -7.436 22.816 9.612 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -6.227 21.793 5.612 1.00 0.00 H new ATOM 0 HZ PHE A 120 -6.852 23.509 7.302 1.00 0.00 H new ATOM 1989 N LYS A 121 -6.904 15.456 9.749 1.00 0.00 N ATOM 1990 CA LYS A 121 -7.212 14.032 9.793 1.00 0.00 C ATOM 1991 C LYS A 121 -7.562 13.567 11.207 1.00 0.00 C ATOM 1992 O LYS A 121 -8.260 12.568 11.365 1.00 0.00 O ATOM 1993 CB LYS A 121 -6.157 13.184 9.066 1.00 0.00 C ATOM 1994 CG LYS A 121 -5.073 12.640 9.995 1.00 0.00 C ATOM 1995 CD LYS A 121 -3.834 12.209 9.204 1.00 0.00 C ATOM 1996 CE LYS A 121 -2.882 11.392 10.086 1.00 0.00 C ATOM 1997 NZ LYS A 121 -1.494 11.479 9.600 1.00 0.00 N ATOM 0 H LYS A 121 -5.952 15.662 9.446 1.00 0.00 H new ATOM 0 HA LYS A 121 -8.124 13.867 9.219 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.652 12.350 8.569 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -5.689 13.787 8.288 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -4.797 13.403 10.722 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.463 11.791 10.556 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.136 11.616 8.341 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.317 13.089 8.821 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -2.933 11.754 11.113 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -3.200 10.350 10.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -0.927 10.722 10.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.481 11.373 8.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.093 12.403 9.859 1.00 0.00 H new ATOM 2011 N VAL A 122 -7.089 14.302 12.220 1.00 0.00 N ATOM 2012 CA VAL A 122 -7.344 14.012 13.619 1.00 0.00 C ATOM 2013 C VAL A 122 -8.585 14.763 14.076 1.00 0.00 C ATOM 2014 O VAL A 122 -9.469 14.128 14.647 1.00 0.00 O ATOM 2015 CB VAL A 122 -6.102 14.289 14.469 1.00 0.00 C ATOM 2016 CG1 VAL A 122 -6.293 13.789 15.904 1.00 0.00 C ATOM 2017 CG2 VAL A 122 -4.927 13.545 13.822 1.00 0.00 C ATOM 0 H VAL A 122 -6.508 15.129 12.078 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.552 12.950 13.750 1.00 0.00 H new ATOM 0 HB VAL A 122 -5.918 15.362 14.513 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -5.395 13.999 16.485 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -7.145 14.297 16.356 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.475 12.714 15.894 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.021 13.720 14.403 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -5.142 12.477 13.798 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.782 13.909 12.805 1.00 0.00 H new ATOM 2027 N ARG A 123 -8.668 16.079 13.798 1.00 0.00 N ATOM 2028 CA ARG A 123 -9.839 16.898 14.130 1.00 0.00 C ATOM 2029 C ARG A 123 -10.493 16.528 15.458 1.00 0.00 C ATOM 2030 O ARG A 123 -11.611 16.006 15.472 1.00 0.00 O ATOM 2031 CB ARG A 123 -10.843 16.888 12.967 1.00 0.00 C ATOM 2032 CG ARG A 123 -11.195 15.482 12.451 1.00 0.00 C ATOM 2033 CD ARG A 123 -12.083 15.543 11.208 1.00 0.00 C ATOM 2034 NE ARG A 123 -12.729 14.250 10.967 1.00 0.00 N ATOM 2035 CZ ARG A 123 -12.115 13.147 10.522 1.00 0.00 C ATOM 2036 NH1 ARG A 123 -10.828 13.194 10.157 1.00 0.00 N ATOM 2037 NH2 ARG A 123 -12.796 11.998 10.454 1.00 0.00 N ATOM 0 H ARG A 123 -7.922 16.600 13.337 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.481 17.917 14.273 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -11.759 17.385 13.288 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -10.434 17.473 12.143 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -10.279 14.940 12.218 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -11.705 14.923 13.236 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -12.841 16.316 11.335 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -11.484 15.823 10.341 1.00 0.00 H new ATOM 0 HE ARG A 123 -13.730 14.185 11.154 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -10.312 14.072 10.218 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -10.363 12.352 9.818 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -13.775 11.968 10.740 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -12.337 11.152 10.116 1.00 0.00 H new ATOM 2051 N PRO A 124 -9.837 16.811 16.596 1.00 0.00 N ATOM 2052 CA PRO A 124 -10.386 16.501 17.899 1.00 0.00 C ATOM 2053 C PRO A 124 -11.489 17.464 18.335 1.00 0.00 C ATOM 2054 O PRO A 124 -11.649 17.758 19.518 1.00 0.00 O ATOM 2055 CB PRO A 124 -9.176 16.475 18.835 1.00 0.00 C ATOM 2056 CG PRO A 124 -8.307 17.584 18.238 1.00 0.00 C ATOM 2057 CD PRO A 124 -8.527 17.428 16.730 1.00 0.00 C ATOM 0 HA PRO A 124 -10.905 15.543 17.902 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -9.452 16.682 19.869 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -8.671 15.509 18.827 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -8.614 18.569 18.590 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -7.258 17.462 18.507 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -8.493 18.394 16.225 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -7.752 16.807 16.281 1.00 0.00 H new ATOM 2065 N ASP A 125 -12.281 17.916 17.362 1.00 0.00 N ATOM 2066 CA ASP A 125 -13.433 18.765 17.557 1.00 0.00 C ATOM 2067 C ASP A 125 -14.519 18.433 16.520 1.00 0.00 C ATOM 2068 O ASP A 125 -15.573 19.063 16.498 1.00 0.00 O ATOM 2069 CB ASP A 125 -12.941 20.228 17.583 1.00 0.00 C ATOM 2070 CG ASP A 125 -13.893 21.268 18.165 1.00 0.00 C ATOM 2071 OD1 ASP A 125 -14.973 20.899 18.669 1.00 0.00 O ATOM 2072 OD2 ASP A 125 -13.491 22.452 18.189 1.00 0.00 O ATOM 0 H ASP A 125 -12.122 17.685 16.381 1.00 0.00 H new ATOM 0 HA ASP A 125 -13.928 18.591 18.513 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -12.012 20.263 18.152 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -12.700 20.523 16.562 1.00 0.00 H new ATOM 2077 N ASP A 126 -14.287 17.404 15.688 1.00 0.00 N ATOM 2078 CA ASP A 126 -15.235 16.889 14.718 1.00 0.00 C ATOM 2079 C ASP A 126 -15.833 15.607 15.285 1.00 0.00 C ATOM 2080 O ASP A 126 -17.050 15.503 15.426 1.00 0.00 O ATOM 2081 CB ASP A 126 -14.523 16.578 13.398 1.00 0.00 C ATOM 2082 CG ASP A 126 -15.364 15.710 12.462 1.00 0.00 C ATOM 2083 OD1 ASP A 126 -16.295 16.260 11.841 1.00 0.00 O ATOM 2084 OD2 ASP A 126 -15.038 14.508 12.364 1.00 0.00 O ATOM 0 H ASP A 126 -13.401 16.899 15.682 1.00 0.00 H new ATOM 0 HA ASP A 126 -16.013 17.628 14.526 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -14.276 17.513 12.895 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -13.582 16.071 13.609 1.00 0.00 H new