USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 914 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: B 163 SER OG : rot -170:sc= 0.0415 USER MOD Set 1.2: B 165 THR OG1 : rot 180:sc= 0.0117 USER MOD Set 2.1: A 120 HIS : no HD1:sc= 1.04 K(o=3.3,f=-10!) USER MOD Set 2.2: A 123 LYS NZ :NH3+ -178:sc= 2.31 (180deg=0.968) USER MOD Set 3.1: A 115 LYS NZ :NH3+ -148:sc= -0.322 (180deg=-0.612) USER MOD Set 3.2: A 116 SER OG : rot 109:sc= 0.615 USER MOD Set 4.1: A 54 SER OG : rot 129:sc= 0.592 USER MOD Set 4.2: A 62 LYS NZ :NH3+ 159:sc= 0.615 (180deg=-0.424) USER MOD Set 4.3: A 65 SER OG : rot 80:sc= -0.635 USER MOD Set 5.1: A 53 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 61 HIS : no HD1:sc= -2.74! C(o=-2.7!,f=-8!) USER MOD Set 6.1: A 27 SER OG : rot 180:sc= 0.0805 USER MOD Set 6.2: A 31 LYS NZ :NH3+ 177:sc= 0.0804 (180deg=-0.0137) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 9 ASN : amide:sc= -0.0173 K(o=-0.017,f=-1.2) USER MOD Single : A 13 THR OG1 : rot 86:sc= 1.28 USER MOD Single : A 16 SER OG : rot 180:sc= 0.356 USER MOD Single : A 18 LYS NZ :NH3+ 160:sc= 1.23 (180deg=0.885) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0407) USER MOD Single : A 33 THR OG1 : rot -75:sc= 1.12 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc=-0.00148 X(o=-0.0015,f=-0.062) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 165:sc= 1.02 (180deg=0.863) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 160:sc= -0.162 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -27:sc= -0.431 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -149:sc= 0 USER MOD Single : A 93 THR OG1 : rot -4:sc= 0.698 USER MOD Single : A 94 CYS SG : rot 180:sc= -0.479 USER MOD Single : A 96 HIS : no HD1:sc= 0.0298 K(o=0.03,f=-0.94) USER MOD Single : A 99 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 100 THR OG1 : rot 79:sc= 1.22 USER MOD Single : A 106 GLN : amide:sc= 0.217 K(o=0.22,f=-0.84) USER MOD Single : A 110 SER OG : rot 180:sc= -0.26 USER MOD Single : A 117 ASN : amide:sc= -1.09 X(o=-1.1,f=-1.2) USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl -164:sc= 0 (180deg=-0.0795) USER MOD Single : B 161 SER OG : rot 180:sc= 0 USER MOD Single : B 162 TYR OH : rot -26:sc= 1.45 USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 -3.129 -4.961 19.721 1.00 0.00 N ATOM 79 CA ASP A 6 -2.793 -3.574 19.434 1.00 0.00 C ATOM 80 C ASP A 6 -1.928 -3.495 18.175 1.00 0.00 C ATOM 81 O ASP A 6 -2.036 -4.347 17.294 1.00 0.00 O ATOM 82 CB ASP A 6 -2.087 -2.999 20.665 1.00 0.00 C ATOM 83 CG ASP A 6 -0.936 -3.893 21.109 1.00 0.00 C ATOM 84 OD1 ASP A 6 0.192 -3.683 20.611 1.00 0.00 O ATOM 85 OD2 ASP A 6 -1.205 -4.781 21.949 1.00 0.00 O ATOM 0 HA ASP A 6 -3.687 -2.983 19.234 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -1.710 -2.002 20.438 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -2.802 -2.891 21.480 1.00 0.00 H new ATOM 90 N PHE A 7 -1.069 -2.477 18.078 1.00 0.00 N ATOM 91 CA PHE A 7 -0.161 -2.304 16.952 1.00 0.00 C ATOM 92 C PHE A 7 0.693 -3.555 16.747 1.00 0.00 C ATOM 93 O PHE A 7 1.295 -3.729 15.689 1.00 0.00 O ATOM 94 CB PHE A 7 0.722 -1.086 17.229 1.00 0.00 C ATOM 95 CG PHE A 7 1.542 -0.610 16.048 1.00 0.00 C ATOM 96 CD1 PHE A 7 0.918 -0.340 14.821 1.00 0.00 C ATOM 97 CD2 PHE A 7 2.929 -0.435 16.180 1.00 0.00 C ATOM 98 CE1 PHE A 7 1.679 0.108 13.731 1.00 0.00 C ATOM 99 CE2 PHE A 7 3.688 0.015 15.089 1.00 0.00 C ATOM 100 CZ PHE A 7 3.061 0.286 13.864 1.00 0.00 C ATOM 0 H PHE A 7 -0.987 -1.747 18.786 1.00 0.00 H new ATOM 0 HA PHE A 7 -0.733 -2.147 16.037 1.00 0.00 H new ATOM 0 HB2 PHE A 7 0.089 -0.266 17.567 1.00 0.00 H new ATOM 0 HB3 PHE A 7 1.399 -1.325 18.049 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.148 -0.477 14.716 1.00 0.00 H new ATOM 0 HD2 PHE A 7 3.412 -0.647 17.122 1.00 0.00 H new ATOM 0 HE1 PHE A 7 1.197 0.316 12.787 1.00 0.00 H new ATOM 0 HE2 PHE A 7 4.754 0.153 15.192 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.644 0.632 13.024 1.00 0.00 H new ATOM 110 N GLN A 8 0.748 -4.427 17.756 1.00 0.00 N ATOM 111 CA GLN A 8 1.401 -5.717 17.649 1.00 0.00 C ATOM 112 C GLN A 8 0.840 -6.497 16.465 1.00 0.00 C ATOM 113 O GLN A 8 1.607 -7.161 15.774 1.00 0.00 O ATOM 114 CB GLN A 8 1.179 -6.476 18.959 1.00 0.00 C ATOM 115 CG GLN A 8 1.657 -7.924 18.845 1.00 0.00 C ATOM 116 CD GLN A 8 1.571 -8.661 20.178 1.00 0.00 C ATOM 117 OE1 GLN A 8 1.157 -8.103 21.191 1.00 0.00 O ATOM 118 NE2 GLN A 8 1.963 -9.934 20.187 1.00 0.00 N ATOM 0 H GLN A 8 0.336 -4.249 18.672 1.00 0.00 H new ATOM 0 HA GLN A 8 2.470 -5.586 17.479 1.00 0.00 H new ATOM 0 HB2 GLN A 8 1.713 -5.976 19.767 1.00 0.00 H new ATOM 0 HB3 GLN A 8 0.120 -6.459 19.218 1.00 0.00 H new ATOM 0 HG2 GLN A 8 1.055 -8.447 18.102 1.00 0.00 H new ATOM 0 HG3 GLN A 8 2.687 -7.939 18.488 1.00 0.00 H new ATOM 0 HE21 GLN A 8 2.302 -10.369 19.329 1.00 0.00 H new ATOM 0 HE22 GLN A 8 1.924 -10.474 21.052 1.00 0.00 H new ATOM 127 N ASN A 9 -0.471 -6.436 16.213 1.00 0.00 N ATOM 128 CA ASN A 9 -1.036 -7.138 15.069 1.00 0.00 C ATOM 129 C ASN A 9 -0.496 -6.549 13.770 1.00 0.00 C ATOM 130 O ASN A 9 -0.162 -7.297 12.855 1.00 0.00 O ATOM 131 CB ASN A 9 -2.564 -7.074 15.093 1.00 0.00 C ATOM 132 CG ASN A 9 -3.154 -7.994 16.153 1.00 0.00 C ATOM 133 OD1 ASN A 9 -2.434 -8.682 16.868 1.00 0.00 O ATOM 134 ND2 ASN A 9 -4.479 -8.015 16.267 1.00 0.00 N ATOM 0 H ASN A 9 -1.145 -5.917 16.776 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.740 -8.186 15.127 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -2.881 -6.049 15.284 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -2.954 -7.351 14.114 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.922 -8.615 16.963 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -5.053 -7.431 15.658 1.00 0.00 H new ATOM 141 N PHE A 10 -0.403 -5.221 13.673 1.00 0.00 N ATOM 142 CA PHE A 10 0.064 -4.593 12.451 1.00 0.00 C ATOM 143 C PHE A 10 1.523 -4.963 12.185 1.00 0.00 C ATOM 144 O PHE A 10 1.863 -5.391 11.083 1.00 0.00 O ATOM 145 CB PHE A 10 -0.123 -3.080 12.550 1.00 0.00 C ATOM 146 CG PHE A 10 0.116 -2.353 11.243 1.00 0.00 C ATOM 147 CD1 PHE A 10 1.422 -2.090 10.811 1.00 0.00 C ATOM 148 CD2 PHE A 10 -0.972 -1.942 10.462 1.00 0.00 C ATOM 149 CE1 PHE A 10 1.643 -1.435 9.592 1.00 0.00 C ATOM 150 CE2 PHE A 10 -0.755 -1.287 9.244 1.00 0.00 C ATOM 151 CZ PHE A 10 0.553 -1.042 8.805 1.00 0.00 C ATOM 0 H PHE A 10 -0.644 -4.572 14.422 1.00 0.00 H new ATOM 0 HA PHE A 10 -0.523 -4.956 11.608 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -1.136 -2.869 12.894 1.00 0.00 H new ATOM 0 HB3 PHE A 10 0.558 -2.687 13.305 1.00 0.00 H new ATOM 0 HD1 PHE A 10 2.261 -2.393 11.419 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -1.980 -2.131 10.800 1.00 0.00 H new ATOM 0 HE1 PHE A 10 2.651 -1.234 9.260 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -1.595 -0.971 8.643 1.00 0.00 H new ATOM 0 HZ PHE A 10 0.721 -0.550 7.859 1.00 0.00 H new ATOM 161 N VAL A 11 2.388 -4.800 13.190 1.00 0.00 N ATOM 162 CA VAL A 11 3.802 -5.106 13.043 1.00 0.00 C ATOM 163 C VAL A 11 3.993 -6.593 12.775 1.00 0.00 C ATOM 164 O VAL A 11 4.630 -6.969 11.795 1.00 0.00 O ATOM 165 CB VAL A 11 4.572 -4.674 14.297 1.00 0.00 C ATOM 166 CG1 VAL A 11 6.051 -5.037 14.167 1.00 0.00 C ATOM 167 CG2 VAL A 11 4.461 -3.163 14.499 1.00 0.00 C ATOM 0 H VAL A 11 2.127 -4.457 14.114 1.00 0.00 H new ATOM 0 HA VAL A 11 4.197 -4.551 12.192 1.00 0.00 H new ATOM 0 HB VAL A 11 4.137 -5.194 15.150 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.583 -4.724 15.065 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.151 -6.115 14.043 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.475 -4.531 13.299 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.013 -2.874 15.393 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.878 -2.649 13.633 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.413 -2.887 14.615 1.00 0.00 H new ATOM 177 N ALA A 12 3.443 -7.445 13.646 1.00 0.00 N ATOM 178 CA ALA A 12 3.582 -8.886 13.531 1.00 0.00 C ATOM 179 C ALA A 12 3.039 -9.398 12.200 1.00 0.00 C ATOM 180 O ALA A 12 3.538 -10.395 11.681 1.00 0.00 O ATOM 181 CB ALA A 12 2.845 -9.540 14.697 1.00 0.00 C ATOM 0 H ALA A 12 2.890 -7.147 14.449 1.00 0.00 H new ATOM 0 HA ALA A 12 4.640 -9.145 13.564 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.940 -10.624 14.625 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.277 -9.199 15.638 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.791 -9.265 14.661 1.00 0.00 H new ATOM 187 N THR A 13 2.024 -8.736 11.633 1.00 0.00 N ATOM 188 CA THR A 13 1.502 -9.140 10.338 1.00 0.00 C ATOM 189 C THR A 13 2.456 -8.731 9.225 1.00 0.00 C ATOM 190 O THR A 13 2.688 -9.507 8.298 1.00 0.00 O ATOM 191 CB THR A 13 0.118 -8.530 10.102 1.00 0.00 C ATOM 192 OG1 THR A 13 -0.792 -9.061 11.038 1.00 0.00 O ATOM 193 CG2 THR A 13 -0.372 -8.908 8.710 1.00 0.00 C ATOM 0 H THR A 13 1.558 -7.930 12.050 1.00 0.00 H new ATOM 0 HA THR A 13 1.408 -10.226 10.332 1.00 0.00 H new ATOM 0 HB THR A 13 0.185 -7.447 10.203 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.748 -8.542 11.868 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.358 -8.474 8.541 1.00 0.00 H new ATOM 0 HG22 THR A 13 0.325 -8.528 7.963 1.00 0.00 H new ATOM 0 HG23 THR A 13 -0.434 -9.993 8.628 1.00 0.00 H new ATOM 201 N LEU A 14 3.018 -7.521 9.299 1.00 0.00 N ATOM 202 CA LEU A 14 3.956 -7.064 8.287 1.00 0.00 C ATOM 203 C LEU A 14 5.240 -7.897 8.352 1.00 0.00 C ATOM 204 O LEU A 14 5.917 -8.093 7.347 1.00 0.00 O ATOM 205 CB LEU A 14 4.229 -5.575 8.507 1.00 0.00 C ATOM 206 CG LEU A 14 4.956 -4.909 7.333 1.00 0.00 C ATOM 207 CD1 LEU A 14 4.147 -5.001 6.039 1.00 0.00 C ATOM 208 CD2 LEU A 14 5.148 -3.436 7.673 1.00 0.00 C ATOM 0 H LEU A 14 2.837 -6.850 10.045 1.00 0.00 H new ATOM 0 HA LEU A 14 3.536 -7.194 7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.283 -5.061 8.677 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.826 -5.452 9.411 1.00 0.00 H new ATOM 0 HG LEU A 14 5.906 -5.420 7.179 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.696 -4.517 5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.980 -6.048 5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.187 -4.503 6.174 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.664 -2.937 6.853 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.176 -2.968 7.827 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.742 -3.347 8.583 1.00 0.00 H new ATOM 220 N GLU A 15 5.573 -8.387 9.548 1.00 0.00 N ATOM 221 CA GLU A 15 6.701 -9.281 9.778 1.00 0.00 C ATOM 222 C GLU A 15 6.401 -10.654 9.192 1.00 0.00 C ATOM 223 O GLU A 15 7.271 -11.296 8.608 1.00 0.00 O ATOM 224 CB GLU A 15 6.928 -9.411 11.285 1.00 0.00 C ATOM 225 CG GLU A 15 7.395 -8.095 11.904 1.00 0.00 C ATOM 226 CD GLU A 15 8.920 -7.979 11.887 1.00 0.00 C ATOM 227 OE1 GLU A 15 9.458 -7.553 10.841 1.00 0.00 O ATOM 228 OE2 GLU A 15 9.539 -8.318 12.918 1.00 0.00 O ATOM 0 H GLU A 15 5.054 -8.167 10.398 1.00 0.00 H new ATOM 0 HA GLU A 15 7.592 -8.876 9.298 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.003 -9.731 11.766 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.671 -10.186 11.475 1.00 0.00 H new ATOM 0 HG2 GLU A 15 6.959 -7.259 11.357 1.00 0.00 H new ATOM 0 HG3 GLU A 15 7.035 -8.026 12.931 1.00 0.00 H new ATOM 235 N SER A 16 5.157 -11.109 9.349 1.00 0.00 N ATOM 236 CA SER A 16 4.706 -12.338 8.711 1.00 0.00 C ATOM 237 C SER A 16 4.747 -12.167 7.194 1.00 0.00 C ATOM 238 O SER A 16 4.930 -13.138 6.465 1.00 0.00 O ATOM 239 CB SER A 16 3.296 -12.674 9.196 1.00 0.00 C ATOM 240 OG SER A 16 2.859 -13.885 8.619 1.00 0.00 O ATOM 0 H SER A 16 4.447 -10.642 9.913 1.00 0.00 H new ATOM 0 HA SER A 16 5.364 -13.165 8.978 1.00 0.00 H new ATOM 0 HB2 SER A 16 3.287 -12.756 10.283 1.00 0.00 H new ATOM 0 HB3 SER A 16 2.611 -11.868 8.932 1.00 0.00 H new ATOM 0 HG SER A 16 1.956 -14.092 8.937 1.00 0.00 H new ATOM 246 N PHE A 17 4.577 -10.929 6.717 1.00 0.00 N ATOM 247 CA PHE A 17 4.701 -10.614 5.305 1.00 0.00 C ATOM 248 C PHE A 17 6.175 -10.591 4.902 1.00 0.00 C ATOM 249 O PHE A 17 6.517 -10.930 3.769 1.00 0.00 O ATOM 250 CB PHE A 17 4.029 -9.267 5.030 1.00 0.00 C ATOM 251 CG PHE A 17 3.098 -9.282 3.836 1.00 0.00 C ATOM 252 CD1 PHE A 17 3.469 -9.925 2.645 1.00 0.00 C ATOM 253 CD2 PHE A 17 1.853 -8.644 3.922 1.00 0.00 C ATOM 254 CE1 PHE A 17 2.590 -9.945 1.552 1.00 0.00 C ATOM 255 CE2 PHE A 17 0.976 -8.664 2.829 1.00 0.00 C ATOM 256 CZ PHE A 17 1.342 -9.318 1.647 1.00 0.00 C ATOM 0 H PHE A 17 4.351 -10.126 7.303 1.00 0.00 H new ATOM 0 HA PHE A 17 4.205 -11.379 4.708 1.00 0.00 H new ATOM 0 HB2 PHE A 17 3.467 -8.965 5.914 1.00 0.00 H new ATOM 0 HB3 PHE A 17 4.800 -8.513 4.869 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.433 -10.405 2.570 1.00 0.00 H new ATOM 0 HD2 PHE A 17 1.569 -8.136 4.832 1.00 0.00 H new ATOM 0 HE1 PHE A 17 2.876 -10.444 0.638 1.00 0.00 H new ATOM 0 HE2 PHE A 17 0.016 -8.174 2.899 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.662 -9.339 0.808 1.00 0.00 H new ATOM 266 N LYS A 18 7.056 -10.190 5.826 1.00 0.00 N ATOM 267 CA LYS A 18 8.493 -10.195 5.596 1.00 0.00 C ATOM 268 C LYS A 18 9.004 -11.630 5.482 1.00 0.00 C ATOM 269 O LYS A 18 9.944 -11.894 4.735 1.00 0.00 O ATOM 270 CB LYS A 18 9.172 -9.431 6.737 1.00 0.00 C ATOM 271 CG LYS A 18 10.670 -9.249 6.486 1.00 0.00 C ATOM 272 CD LYS A 18 11.317 -8.499 7.652 1.00 0.00 C ATOM 273 CE LYS A 18 10.754 -7.082 7.772 1.00 0.00 C ATOM 274 NZ LYS A 18 11.236 -6.425 9.000 1.00 0.00 N ATOM 0 H LYS A 18 6.786 -9.855 6.751 1.00 0.00 H new ATOM 0 HA LYS A 18 8.731 -9.698 4.655 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.701 -8.455 6.851 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.023 -9.968 7.674 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.146 -10.222 6.362 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.826 -8.697 5.559 1.00 0.00 H new ATOM 0 HD2 LYS A 18 11.143 -9.043 8.580 1.00 0.00 H new ATOM 0 HD3 LYS A 18 12.396 -8.454 7.506 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.048 -6.495 6.902 1.00 0.00 H new ATOM 0 HE3 LYS A 18 9.665 -7.119 7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 11.135 -5.394 8.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.676 -6.754 9.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 12.237 -6.663 9.151 1.00 0.00 H new ATOM 359 N ILE A 24 1.115 -12.963 -2.293 1.00 0.00 N ATOM 360 CA ILE A 24 0.620 -11.722 -1.711 1.00 0.00 C ATOM 361 C ILE A 24 -0.702 -12.008 -1.004 1.00 0.00 C ATOM 362 O ILE A 24 -1.764 -11.558 -1.430 1.00 0.00 O ATOM 363 CB ILE A 24 0.478 -10.654 -2.810 1.00 0.00 C ATOM 364 CG1 ILE A 24 1.725 -10.564 -3.702 1.00 0.00 C ATOM 365 CG2 ILE A 24 0.196 -9.276 -2.192 1.00 0.00 C ATOM 366 CD1 ILE A 24 2.965 -10.087 -2.948 1.00 0.00 C ATOM 0 HA ILE A 24 1.321 -11.331 -0.974 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.362 -10.959 -3.434 1.00 0.00 H new ATOM 0 HG12 ILE A 24 1.925 -11.543 -4.137 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.525 -9.883 -4.529 1.00 0.00 H new ATOM 0 HG21 ILE A 24 0.099 -8.535 -2.985 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -0.730 -9.317 -1.618 1.00 0.00 H new ATOM 0 HG23 ILE A 24 1.019 -8.997 -1.534 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.813 -10.044 -3.632 1.00 0.00 H new ATOM 0 HD12 ILE A 24 2.781 -9.095 -2.536 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.187 -10.781 -2.138 1.00 0.00 H new ATOM 378 N SER A 25 -0.629 -12.772 0.092 1.00 0.00 N ATOM 379 CA SER A 25 -1.802 -13.225 0.825 1.00 0.00 C ATOM 380 C SER A 25 -2.648 -12.066 1.342 1.00 0.00 C ATOM 381 O SER A 25 -2.132 -11.116 1.933 1.00 0.00 O ATOM 382 CB SER A 25 -1.369 -14.116 1.986 1.00 0.00 C ATOM 383 OG SER A 25 -0.765 -15.291 1.495 1.00 0.00 O ATOM 0 H SER A 25 0.253 -13.091 0.492 1.00 0.00 H new ATOM 0 HA SER A 25 -2.424 -13.792 0.132 1.00 0.00 H new ATOM 0 HB2 SER A 25 -0.670 -13.578 2.626 1.00 0.00 H new ATOM 0 HB3 SER A 25 -2.232 -14.371 2.601 1.00 0.00 H new ATOM 0 HG SER A 25 -0.489 -15.856 2.247 1.00 0.00 H new ATOM 389 N GLY A 26 -3.962 -12.160 1.112 1.00 0.00 N ATOM 390 CA GLY A 26 -4.935 -11.166 1.529 1.00 0.00 C ATOM 391 C GLY A 26 -5.072 -11.081 3.044 1.00 0.00 C ATOM 392 O GLY A 26 -5.495 -10.048 3.552 1.00 0.00 O ATOM 0 H GLY A 26 -4.380 -12.950 0.619 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -4.643 -10.191 1.139 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.905 -11.407 1.093 1.00 0.00 H new ATOM 396 N SER A 27 -4.727 -12.146 3.778 1.00 0.00 N ATOM 397 CA SER A 27 -4.926 -12.169 5.220 1.00 0.00 C ATOM 398 C SER A 27 -4.052 -11.126 5.893 1.00 0.00 C ATOM 399 O SER A 27 -4.481 -10.439 6.818 1.00 0.00 O ATOM 400 CB SER A 27 -4.597 -13.563 5.760 1.00 0.00 C ATOM 401 OG SER A 27 -4.840 -13.607 7.154 1.00 0.00 O ATOM 0 H SER A 27 -4.312 -12.995 3.394 1.00 0.00 H new ATOM 0 HA SER A 27 -5.968 -11.935 5.438 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.204 -14.312 5.252 1.00 0.00 H new ATOM 0 HB3 SER A 27 -3.554 -13.805 5.556 1.00 0.00 H new ATOM 0 HG SER A 27 -4.629 -14.501 7.495 1.00 0.00 H new ATOM 407 N ARG A 28 -2.810 -11.008 5.418 1.00 0.00 N ATOM 408 CA ARG A 28 -1.878 -10.042 5.966 1.00 0.00 C ATOM 409 C ARG A 28 -2.335 -8.634 5.590 1.00 0.00 C ATOM 410 O ARG A 28 -2.233 -7.716 6.401 1.00 0.00 O ATOM 411 CB ARG A 28 -0.472 -10.369 5.460 1.00 0.00 C ATOM 412 CG ARG A 28 -0.048 -11.748 5.982 1.00 0.00 C ATOM 413 CD ARG A 28 1.312 -12.139 5.405 1.00 0.00 C ATOM 414 NE ARG A 28 1.761 -13.432 5.942 1.00 0.00 N ATOM 415 CZ ARG A 28 1.276 -14.626 5.588 1.00 0.00 C ATOM 416 NH1 ARG A 28 0.318 -14.734 4.669 1.00 0.00 N ATOM 417 NH2 ARG A 28 1.756 -15.728 6.160 1.00 0.00 N ATOM 0 H ARG A 28 -2.434 -11.572 4.656 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.852 -10.090 7.055 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -0.455 -10.360 4.370 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.233 -9.609 5.796 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.002 -11.732 7.071 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -0.795 -12.493 5.708 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.247 -12.195 4.318 1.00 0.00 H new ATOM 0 HD3 ARG A 28 2.046 -11.369 5.641 1.00 0.00 H new ATOM 0 HE ARG A 28 2.503 -13.416 6.642 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.057 -13.897 4.223 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.040 -15.654 4.411 1.00 0.00 H new ATOM 0 HH21 ARG A 28 2.490 -15.659 6.865 1.00 0.00 H new ATOM 0 HH22 ARG A 28 1.390 -16.642 5.894 1.00 0.00 H new ATOM 431 N ILE A 29 -2.841 -8.456 4.368 1.00 0.00 N ATOM 432 CA ILE A 29 -3.375 -7.169 3.945 1.00 0.00 C ATOM 433 C ILE A 29 -4.598 -6.822 4.798 1.00 0.00 C ATOM 434 O ILE A 29 -4.777 -5.667 5.174 1.00 0.00 O ATOM 435 CB ILE A 29 -3.731 -7.224 2.451 1.00 0.00 C ATOM 436 CG1 ILE A 29 -2.469 -7.523 1.630 1.00 0.00 C ATOM 437 CG2 ILE A 29 -4.337 -5.892 2.010 1.00 0.00 C ATOM 438 CD1 ILE A 29 -2.776 -7.661 0.138 1.00 0.00 C ATOM 0 H ILE A 29 -2.890 -9.187 3.659 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.627 -6.388 4.085 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.462 -8.016 2.286 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.742 -6.724 1.778 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.010 -8.443 1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.587 -5.939 0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.240 -5.694 2.587 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.617 -5.091 2.178 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.855 -7.872 -0.405 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -3.482 -8.477 -0.014 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.210 -6.732 -0.232 1.00 0.00 H new ATOM 450 N LYS A 30 -5.439 -7.815 5.107 1.00 0.00 N ATOM 451 CA LYS A 30 -6.650 -7.600 5.885 1.00 0.00 C ATOM 452 C LYS A 30 -6.325 -7.216 7.329 1.00 0.00 C ATOM 453 O LYS A 30 -7.030 -6.393 7.906 1.00 0.00 O ATOM 454 CB LYS A 30 -7.554 -8.836 5.775 1.00 0.00 C ATOM 455 CG LYS A 30 -8.273 -8.839 4.424 1.00 0.00 C ATOM 456 CD LYS A 30 -9.392 -7.795 4.388 1.00 0.00 C ATOM 457 CE LYS A 30 -9.890 -7.610 2.957 1.00 0.00 C ATOM 458 NZ LYS A 30 -10.472 -8.853 2.410 1.00 0.00 N ATOM 0 H LYS A 30 -5.295 -8.784 4.823 1.00 0.00 H new ATOM 0 HA LYS A 30 -7.201 -6.753 5.477 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.959 -9.743 5.882 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.284 -8.837 6.585 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -7.557 -8.635 3.628 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -8.689 -9.828 4.233 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.215 -8.110 5.030 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -9.027 -6.846 4.780 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -10.638 -6.818 2.933 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -9.063 -7.287 2.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -10.919 -8.653 1.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.721 -9.561 2.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -11.186 -9.221 3.070 1.00 0.00 H new ATOM 472 N LYS A 31 -5.274 -7.792 7.926 1.00 0.00 N ATOM 473 CA LYS A 31 -4.850 -7.398 9.271 1.00 0.00 C ATOM 474 C LYS A 31 -4.269 -5.984 9.262 1.00 0.00 C ATOM 475 O LYS A 31 -4.580 -5.183 10.144 1.00 0.00 O ATOM 476 CB LYS A 31 -3.832 -8.404 9.817 1.00 0.00 C ATOM 477 CG LYS A 31 -4.352 -9.126 11.065 1.00 0.00 C ATOM 478 CD LYS A 31 -5.644 -9.915 10.828 1.00 0.00 C ATOM 479 CE LYS A 31 -5.529 -10.906 9.673 1.00 0.00 C ATOM 480 NZ LYS A 31 -4.478 -11.915 9.909 1.00 0.00 N ATOM 0 H LYS A 31 -4.707 -8.526 7.501 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.721 -7.397 9.926 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.597 -9.137 9.045 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.904 -7.886 10.058 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.582 -9.807 11.427 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.524 -8.393 11.853 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.907 -10.454 11.738 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.457 -9.219 10.623 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -6.486 -11.407 9.529 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -5.311 -10.365 8.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -4.469 -12.597 9.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.552 -11.445 9.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -4.671 -12.415 10.800 1.00 0.00 H new ATOM 494 N LEU A 32 -3.428 -5.672 8.271 1.00 0.00 N ATOM 495 CA LEU A 32 -2.819 -4.356 8.174 1.00 0.00 C ATOM 496 C LEU A 32 -3.889 -3.281 7.974 1.00 0.00 C ATOM 497 O LEU A 32 -3.969 -2.338 8.762 1.00 0.00 O ATOM 498 CB LEU A 32 -1.785 -4.349 7.045 1.00 0.00 C ATOM 499 CG LEU A 32 -0.565 -5.231 7.346 1.00 0.00 C ATOM 500 CD1 LEU A 32 0.325 -5.298 6.110 1.00 0.00 C ATOM 501 CD2 LEU A 32 0.258 -4.670 8.499 1.00 0.00 C ATOM 0 H LEU A 32 -3.158 -6.317 7.529 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.304 -4.125 9.106 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.257 -4.693 6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.453 -3.326 6.870 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.928 -6.221 7.621 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.193 -5.924 6.320 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.237 -5.724 5.279 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.657 -4.294 5.846 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.114 -5.319 8.685 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.610 -3.671 8.243 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.360 -4.618 9.396 1.00 0.00 H new ATOM 513 N THR A 33 -4.714 -3.411 6.928 1.00 0.00 N ATOM 514 CA THR A 33 -5.795 -2.468 6.672 1.00 0.00 C ATOM 515 C THR A 33 -6.742 -2.339 7.856 1.00 0.00 C ATOM 516 O THR A 33 -7.045 -1.222 8.267 1.00 0.00 O ATOM 517 CB THR A 33 -6.601 -2.914 5.452 1.00 0.00 C ATOM 518 OG1 THR A 33 -7.077 -4.228 5.628 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.737 -2.884 4.204 1.00 0.00 C ATOM 0 H THR A 33 -4.648 -4.166 6.245 1.00 0.00 H new ATOM 0 HA THR A 33 -5.332 -1.497 6.495 1.00 0.00 H new ATOM 0 HB THR A 33 -7.440 -2.227 5.340 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.340 -4.862 5.506 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.327 -3.204 3.345 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.374 -1.870 4.037 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.889 -3.556 4.333 1.00 0.00 H new ATOM 527 N THR A 34 -7.216 -3.455 8.415 1.00 0.00 N ATOM 528 CA THR A 34 -8.209 -3.362 9.471 1.00 0.00 C ATOM 529 C THR A 34 -7.650 -2.627 10.681 1.00 0.00 C ATOM 530 O THR A 34 -8.346 -1.783 11.244 1.00 0.00 O ATOM 531 CB THR A 34 -8.780 -4.736 9.833 1.00 0.00 C ATOM 532 OG1 THR A 34 -10.044 -4.563 10.437 1.00 0.00 O ATOM 533 CG2 THR A 34 -7.899 -5.535 10.793 1.00 0.00 C ATOM 0 H THR A 34 -6.936 -4.402 8.160 1.00 0.00 H new ATOM 0 HA THR A 34 -9.045 -2.772 9.096 1.00 0.00 H new ATOM 0 HB THR A 34 -8.841 -5.300 8.902 1.00 0.00 H new ATOM 0 HG1 THR A 34 -10.417 -5.438 10.671 1.00 0.00 H new ATOM 0 HG21 THR A 34 -8.368 -6.496 11.003 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.922 -5.700 10.339 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.777 -4.980 11.723 1.00 0.00 H new ATOM 541 N TYR A 35 -6.413 -2.925 11.098 1.00 0.00 N ATOM 542 CA TYR A 35 -5.882 -2.233 12.263 1.00 0.00 C ATOM 543 C TYR A 35 -5.631 -0.754 11.970 1.00 0.00 C ATOM 544 O TYR A 35 -5.825 0.084 12.849 1.00 0.00 O ATOM 545 CB TYR A 35 -4.626 -2.909 12.804 1.00 0.00 C ATOM 546 CG TYR A 35 -4.248 -2.307 14.140 1.00 0.00 C ATOM 547 CD1 TYR A 35 -4.935 -2.708 15.295 1.00 0.00 C ATOM 548 CD2 TYR A 35 -3.231 -1.346 14.224 1.00 0.00 C ATOM 549 CE1 TYR A 35 -4.637 -2.118 16.530 1.00 0.00 C ATOM 550 CE2 TYR A 35 -2.929 -0.751 15.458 1.00 0.00 C ATOM 551 CZ TYR A 35 -3.641 -1.125 16.614 1.00 0.00 C ATOM 552 OH TYR A 35 -3.369 -0.528 17.808 1.00 0.00 O ATOM 0 H TYR A 35 -5.791 -3.608 10.666 1.00 0.00 H new ATOM 0 HA TYR A 35 -6.642 -2.293 13.042 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -4.798 -3.980 12.914 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -3.805 -2.789 12.097 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -5.695 -3.473 15.232 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -2.680 -1.064 13.339 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -5.171 -2.424 17.418 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -2.150 -0.006 15.521 1.00 0.00 H new ATOM 0 HH TYR A 35 -2.655 0.132 17.688 1.00 0.00 H new ATOM 562 N ALA A 36 -5.204 -0.417 10.749 1.00 0.00 N ATOM 563 CA ALA A 36 -5.063 0.977 10.358 1.00 0.00 C ATOM 564 C ALA A 36 -6.404 1.699 10.483 1.00 0.00 C ATOM 565 O ALA A 36 -6.508 2.688 11.210 1.00 0.00 O ATOM 566 CB ALA A 36 -4.526 1.038 8.928 1.00 0.00 C ATOM 0 H ALA A 36 -4.953 -1.089 10.024 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.358 1.481 11.019 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.416 2.079 8.625 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.556 0.543 8.882 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.222 0.536 8.256 1.00 0.00 H new ATOM 572 N LEU A 37 -7.424 1.207 9.780 1.00 0.00 N ATOM 573 CA LEU A 37 -8.737 1.839 9.740 1.00 0.00 C ATOM 574 C LEU A 37 -9.488 1.729 11.072 1.00 0.00 C ATOM 575 O LEU A 37 -10.457 2.460 11.278 1.00 0.00 O ATOM 576 CB LEU A 37 -9.561 1.226 8.596 1.00 0.00 C ATOM 577 CG LEU A 37 -9.236 1.776 7.198 1.00 0.00 C ATOM 578 CD1 LEU A 37 -9.613 3.254 7.102 1.00 0.00 C ATOM 579 CD2 LEU A 37 -7.764 1.620 6.813 1.00 0.00 C ATOM 0 H LEU A 37 -7.360 0.356 9.221 1.00 0.00 H new ATOM 0 HA LEU A 37 -8.590 2.904 9.561 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.404 0.147 8.592 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -10.619 1.393 8.799 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.827 1.182 6.501 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.376 3.626 6.105 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.681 3.370 7.288 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.052 3.822 7.844 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.604 2.028 5.815 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.142 2.157 7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.496 0.563 6.820 1.00 0.00 H new ATOM 591 N ASP A 38 -9.068 0.837 11.976 1.00 0.00 N ATOM 592 CA ASP A 38 -9.733 0.667 13.262 1.00 0.00 C ATOM 593 C ASP A 38 -9.751 1.939 14.117 1.00 0.00 C ATOM 594 O ASP A 38 -10.658 2.095 14.933 1.00 0.00 O ATOM 595 CB ASP A 38 -9.050 -0.464 14.036 1.00 0.00 C ATOM 596 CG ASP A 38 -9.736 -0.710 15.379 1.00 0.00 C ATOM 597 OD1 ASP A 38 -10.856 -1.268 15.356 1.00 0.00 O ATOM 598 OD2 ASP A 38 -9.140 -0.339 16.413 1.00 0.00 O ATOM 0 H ASP A 38 -8.267 0.222 11.835 1.00 0.00 H new ATOM 0 HA ASP A 38 -10.774 0.424 13.050 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.070 -1.378 13.442 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -8.002 -0.214 14.201 1.00 0.00 H new ATOM 603 N HIS A 39 -8.783 2.848 13.958 1.00 0.00 N ATOM 604 CA HIS A 39 -8.735 4.031 14.819 1.00 0.00 C ATOM 605 C HIS A 39 -8.078 5.255 14.183 1.00 0.00 C ATOM 606 O HIS A 39 -8.364 6.373 14.605 1.00 0.00 O ATOM 607 CB HIS A 39 -7.992 3.650 16.102 1.00 0.00 C ATOM 608 CG HIS A 39 -8.040 4.707 17.174 1.00 0.00 C ATOM 609 ND1 HIS A 39 -6.943 5.156 17.911 1.00 0.00 N ATOM 610 CD2 HIS A 39 -9.160 5.376 17.583 1.00 0.00 C ATOM 611 CE1 HIS A 39 -7.431 6.089 18.745 1.00 0.00 C ATOM 612 NE2 HIS A 39 -8.755 6.244 18.571 1.00 0.00 N ATOM 0 H HIS A 39 -8.041 2.790 13.260 1.00 0.00 H new ATOM 0 HA HIS A 39 -9.765 4.330 15.013 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -8.418 2.727 16.496 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -6.950 3.441 15.858 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -10.164 5.248 17.205 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -6.839 6.641 19.460 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -9.355 6.892 19.082 1.00 0.00 H new ATOM 620 N ILE A 40 -7.213 5.063 13.183 1.00 0.00 N ATOM 621 CA ILE A 40 -6.503 6.150 12.513 1.00 0.00 C ATOM 622 C ILE A 40 -5.902 7.140 13.520 1.00 0.00 C ATOM 623 O ILE A 40 -6.408 8.246 13.711 1.00 0.00 O ATOM 624 CB ILE A 40 -7.406 6.824 11.469 1.00 0.00 C ATOM 625 CG1 ILE A 40 -7.929 5.799 10.452 1.00 0.00 C ATOM 626 CG2 ILE A 40 -6.632 7.924 10.732 1.00 0.00 C ATOM 627 CD1 ILE A 40 -6.814 5.222 9.576 1.00 0.00 C ATOM 0 H ILE A 40 -6.986 4.140 12.814 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.656 5.728 11.973 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.255 7.263 11.992 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -8.427 4.987 10.982 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -8.678 6.272 9.817 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -7.282 8.395 9.995 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.294 8.673 11.448 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -5.769 7.487 10.229 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.237 4.503 8.875 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.332 6.028 9.023 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.077 4.724 10.206 1.00 0.00 H new ATOM 639 N ASP A 41 -4.811 6.728 14.166 1.00 0.00 N ATOM 640 CA ASP A 41 -4.107 7.526 15.161 1.00 0.00 C ATOM 641 C ASP A 41 -2.608 7.219 15.106 1.00 0.00 C ATOM 642 O ASP A 41 -1.872 7.466 16.060 1.00 0.00 O ATOM 643 CB ASP A 41 -4.687 7.224 16.545 1.00 0.00 C ATOM 644 CG ASP A 41 -4.156 8.175 17.619 1.00 0.00 C ATOM 645 OD1 ASP A 41 -4.224 9.403 17.389 1.00 0.00 O ATOM 646 OD2 ASP A 41 -3.687 7.665 18.662 1.00 0.00 O ATOM 0 H ASP A 41 -4.387 5.814 14.007 1.00 0.00 H new ATOM 0 HA ASP A 41 -4.238 8.588 14.953 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -5.774 7.296 16.504 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -4.446 6.197 16.821 1.00 0.00 H new ATOM 651 N ILE A 42 -2.164 6.674 13.971 1.00 0.00 N ATOM 652 CA ILE A 42 -0.821 6.145 13.786 1.00 0.00 C ATOM 653 C ILE A 42 -0.378 6.353 12.341 1.00 0.00 C ATOM 654 O ILE A 42 0.325 5.530 11.762 1.00 0.00 O ATOM 655 CB ILE A 42 -0.738 4.669 14.212 1.00 0.00 C ATOM 656 CG1 ILE A 42 -2.074 3.945 14.013 1.00 0.00 C ATOM 657 CG2 ILE A 42 -0.261 4.565 15.660 1.00 0.00 C ATOM 658 CD1 ILE A 42 -1.897 2.448 14.255 1.00 0.00 C ATOM 0 H ILE A 42 -2.747 6.589 13.138 1.00 0.00 H new ATOM 0 HA ILE A 42 -0.133 6.691 14.432 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.010 4.172 13.570 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -2.821 4.347 14.698 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.444 4.117 13.002 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.206 3.516 15.951 1.00 0.00 H new ATOM 0 HG22 ILE A 42 0.726 5.019 15.752 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.962 5.086 16.312 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.851 1.941 14.112 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -1.165 2.050 13.552 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -1.548 2.283 15.274 1.00 0.00 H new ATOM 670 N GLU A 43 -0.798 7.472 11.759 1.00 0.00 N ATOM 671 CA GLU A 43 -0.535 7.820 10.375 1.00 0.00 C ATOM 672 C GLU A 43 0.940 7.705 9.984 1.00 0.00 C ATOM 673 O GLU A 43 1.281 6.962 9.065 1.00 0.00 O ATOM 674 CB GLU A 43 -1.076 9.235 10.121 1.00 0.00 C ATOM 675 CG GLU A 43 -0.414 10.348 10.947 1.00 0.00 C ATOM 676 CD GLU A 43 -0.427 10.062 12.449 1.00 0.00 C ATOM 677 OE1 GLU A 43 -1.542 9.947 13.004 1.00 0.00 O ATOM 678 OE2 GLU A 43 0.676 9.961 13.033 1.00 0.00 O ATOM 0 H GLU A 43 -1.344 8.177 12.253 1.00 0.00 H new ATOM 0 HA GLU A 43 -1.048 7.098 9.740 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -0.954 9.468 9.063 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.146 9.240 10.327 1.00 0.00 H new ATOM 0 HG2 GLU A 43 0.616 10.476 10.615 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -0.929 11.290 10.757 1.00 0.00 H new ATOM 685 N SER A 44 1.826 8.429 10.670 1.00 0.00 N ATOM 686 CA SER A 44 3.232 8.489 10.299 1.00 0.00 C ATOM 687 C SER A 44 3.973 7.203 10.627 1.00 0.00 C ATOM 688 O SER A 44 4.967 6.890 9.974 1.00 0.00 O ATOM 689 CB SER A 44 3.895 9.671 11.005 1.00 0.00 C ATOM 690 OG SER A 44 3.263 10.880 10.627 1.00 0.00 O ATOM 0 H SER A 44 1.587 8.985 11.491 1.00 0.00 H new ATOM 0 HA SER A 44 3.284 8.621 9.218 1.00 0.00 H new ATOM 0 HB2 SER A 44 3.832 9.541 12.085 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.954 9.710 10.750 1.00 0.00 H new ATOM 0 HG SER A 44 3.693 11.631 11.086 1.00 0.00 H new ATOM 696 N LYS A 45 3.507 6.451 11.629 1.00 0.00 N ATOM 697 CA LYS A 45 4.158 5.218 12.039 1.00 0.00 C ATOM 698 C LYS A 45 3.715 4.070 11.138 1.00 0.00 C ATOM 699 O LYS A 45 4.554 3.280 10.715 1.00 0.00 O ATOM 700 CB LYS A 45 3.953 4.951 13.539 1.00 0.00 C ATOM 701 CG LYS A 45 2.670 5.500 14.154 1.00 0.00 C ATOM 702 CD LYS A 45 2.587 7.034 14.175 1.00 0.00 C ATOM 703 CE LYS A 45 2.002 7.529 15.492 1.00 0.00 C ATOM 704 NZ LYS A 45 1.835 8.996 15.482 1.00 0.00 N ATOM 0 H LYS A 45 2.674 6.683 12.170 1.00 0.00 H new ATOM 0 HA LYS A 45 5.236 5.315 11.912 1.00 0.00 H new ATOM 0 HB2 LYS A 45 3.976 3.873 13.701 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.800 5.373 14.080 1.00 0.00 H new ATOM 0 HG2 LYS A 45 1.818 5.109 13.598 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.582 5.129 15.175 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.581 7.458 14.032 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.970 7.380 13.346 1.00 0.00 H new ATOM 0 HE2 LYS A 45 1.038 7.051 15.667 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.655 7.240 16.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.213 9.280 16.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.763 9.452 15.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.411 9.291 14.579 1.00 0.00 H new ATOM 718 N ILE A 46 2.416 3.965 10.837 1.00 0.00 N ATOM 719 CA ILE A 46 1.935 3.008 9.850 1.00 0.00 C ATOM 720 C ILE A 46 2.647 3.239 8.519 1.00 0.00 C ATOM 721 O ILE A 46 3.196 2.302 7.939 1.00 0.00 O ATOM 722 CB ILE A 46 0.412 3.145 9.703 1.00 0.00 C ATOM 723 CG1 ILE A 46 -0.245 2.424 10.885 1.00 0.00 C ATOM 724 CG2 ILE A 46 -0.106 2.570 8.382 1.00 0.00 C ATOM 725 CD1 ILE A 46 -1.771 2.500 10.823 1.00 0.00 C ATOM 0 H ILE A 46 1.685 4.533 11.265 1.00 0.00 H new ATOM 0 HA ILE A 46 2.156 1.992 10.178 1.00 0.00 H new ATOM 0 HB ILE A 46 0.158 4.205 9.698 1.00 0.00 H new ATOM 0 HG12 ILE A 46 0.066 1.379 10.892 1.00 0.00 H new ATOM 0 HG13 ILE A 46 0.103 2.866 11.819 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.188 2.693 8.331 1.00 0.00 H new ATOM 0 HG22 ILE A 46 0.359 3.097 7.549 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.141 1.510 8.325 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.196 1.976 11.679 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -2.084 3.544 10.843 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.121 2.034 9.902 1.00 0.00 H new ATOM 737 N ILE A 47 2.643 4.482 8.026 1.00 0.00 N ATOM 738 CA ILE A 47 3.229 4.782 6.727 1.00 0.00 C ATOM 739 C ILE A 47 4.739 4.592 6.731 1.00 0.00 C ATOM 740 O ILE A 47 5.273 3.932 5.842 1.00 0.00 O ATOM 741 CB ILE A 47 2.835 6.197 6.298 1.00 0.00 C ATOM 742 CG1 ILE A 47 1.347 6.266 5.954 1.00 0.00 C ATOM 743 CG2 ILE A 47 3.645 6.635 5.076 1.00 0.00 C ATOM 744 CD1 ILE A 47 0.871 5.165 5.003 1.00 0.00 C ATOM 0 H ILE A 47 2.242 5.287 8.507 1.00 0.00 H new ATOM 0 HA ILE A 47 2.834 4.076 5.997 1.00 0.00 H new ATOM 0 HB ILE A 47 3.045 6.864 7.134 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.769 6.208 6.877 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.134 7.236 5.504 1.00 0.00 H new ATOM 0 HG21 ILE A 47 3.350 7.644 4.787 1.00 0.00 H new ATOM 0 HG22 ILE A 47 4.707 6.623 5.320 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.455 5.950 4.249 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.195 5.286 4.810 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.420 5.233 4.064 1.00 0.00 H new ATOM 0 HD13 ILE A 47 1.049 4.190 5.457 1.00 0.00 H new ATOM 756 N SER A 48 5.440 5.160 7.715 1.00 0.00 N ATOM 757 CA SER A 48 6.880 4.983 7.776 1.00 0.00 C ATOM 758 C SER A 48 7.212 3.497 7.818 1.00 0.00 C ATOM 759 O SER A 48 8.205 3.077 7.228 1.00 0.00 O ATOM 760 CB SER A 48 7.446 5.701 9.000 1.00 0.00 C ATOM 761 OG SER A 48 8.854 5.593 9.022 1.00 0.00 O ATOM 0 H SER A 48 5.041 5.731 8.460 1.00 0.00 H new ATOM 0 HA SER A 48 7.336 5.417 6.886 1.00 0.00 H new ATOM 0 HB2 SER A 48 7.155 6.751 8.981 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.027 5.270 9.909 1.00 0.00 H new ATOM 0 HG SER A 48 9.205 6.058 9.810 1.00 0.00 H new ATOM 767 N LEU A 49 6.395 2.694 8.509 1.00 0.00 N ATOM 768 CA LEU A 49 6.651 1.267 8.644 1.00 0.00 C ATOM 769 C LEU A 49 6.457 0.506 7.328 1.00 0.00 C ATOM 770 O LEU A 49 7.277 -0.358 7.025 1.00 0.00 O ATOM 771 CB LEU A 49 5.776 0.708 9.769 1.00 0.00 C ATOM 772 CG LEU A 49 6.024 -0.780 10.011 1.00 0.00 C ATOM 773 CD1 LEU A 49 7.486 -1.067 10.352 1.00 0.00 C ATOM 774 CD2 LEU A 49 5.153 -1.250 11.170 1.00 0.00 C ATOM 0 H LEU A 49 5.550 3.015 8.982 1.00 0.00 H new ATOM 0 HA LEU A 49 7.700 1.125 8.904 1.00 0.00 H new ATOM 0 HB2 LEU A 49 5.972 1.261 10.688 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.726 0.864 9.521 1.00 0.00 H new ATOM 0 HG LEU A 49 5.776 -1.312 9.092 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.618 -2.136 10.516 1.00 0.00 H new ATOM 0 HD12 LEU A 49 8.122 -0.745 9.527 1.00 0.00 H new ATOM 0 HD13 LEU A 49 7.762 -0.524 11.256 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.326 -2.312 11.348 1.00 0.00 H new ATOM 0 HD22 LEU A 49 5.406 -0.686 12.068 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.103 -1.089 10.925 1.00 0.00 H new ATOM 786 N ILE A 50 5.412 0.788 6.539 1.00 0.00 N ATOM 787 CA ILE A 50 5.240 0.054 5.286 1.00 0.00 C ATOM 788 C ILE A 50 6.261 0.486 4.230 1.00 0.00 C ATOM 789 O ILE A 50 6.754 -0.349 3.470 1.00 0.00 O ATOM 790 CB ILE A 50 3.803 0.155 4.753 1.00 0.00 C ATOM 791 CG1 ILE A 50 3.438 1.594 4.365 1.00 0.00 C ATOM 792 CG2 ILE A 50 2.834 -0.411 5.794 1.00 0.00 C ATOM 793 CD1 ILE A 50 2.026 1.693 3.787 1.00 0.00 C ATOM 0 H ILE A 50 4.700 1.491 6.737 1.00 0.00 H new ATOM 0 HA ILE A 50 5.427 -0.997 5.508 1.00 0.00 H new ATOM 0 HB ILE A 50 3.727 -0.437 3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.516 2.236 5.242 1.00 0.00 H new ATOM 0 HG13 ILE A 50 4.156 1.965 3.633 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.814 -0.340 5.418 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.078 -1.456 5.988 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.920 0.159 6.719 1.00 0.00 H new ATOM 0 HD11 ILE A 50 1.811 2.729 3.527 1.00 0.00 H new ATOM 0 HD12 ILE A 50 1.954 1.072 2.894 1.00 0.00 H new ATOM 0 HD13 ILE A 50 1.305 1.348 4.528 1.00 0.00 H new ATOM 805 N ILE A 51 6.589 1.781 4.170 1.00 0.00 N ATOM 806 CA ILE A 51 7.579 2.265 3.220 1.00 0.00 C ATOM 807 C ILE A 51 8.929 1.634 3.544 1.00 0.00 C ATOM 808 O ILE A 51 9.609 1.096 2.671 1.00 0.00 O ATOM 809 CB ILE A 51 7.683 3.788 3.319 1.00 0.00 C ATOM 810 CG1 ILE A 51 6.360 4.453 2.912 1.00 0.00 C ATOM 811 CG2 ILE A 51 8.824 4.291 2.427 1.00 0.00 C ATOM 812 CD1 ILE A 51 6.375 5.930 3.292 1.00 0.00 C ATOM 0 H ILE A 51 6.183 2.503 4.766 1.00 0.00 H new ATOM 0 HA ILE A 51 7.282 1.994 2.207 1.00 0.00 H new ATOM 0 HB ILE A 51 7.894 4.054 4.355 1.00 0.00 H new ATOM 0 HG12 ILE A 51 6.207 4.348 1.838 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.526 3.952 3.404 1.00 0.00 H new ATOM 0 HG21 ILE A 51 8.893 5.376 2.502 1.00 0.00 H new ATOM 0 HG22 ILE A 51 9.764 3.844 2.752 1.00 0.00 H new ATOM 0 HG23 ILE A 51 8.628 4.010 1.392 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.432 6.391 2.998 1.00 0.00 H new ATOM 0 HD12 ILE A 51 6.506 6.027 4.370 1.00 0.00 H new ATOM 0 HD13 ILE A 51 7.198 6.429 2.780 1.00 0.00 H new ATOM 824 N ASP A 52 9.312 1.709 4.821 1.00 0.00 N ATOM 825 CA ASP A 52 10.541 1.115 5.314 1.00 0.00 C ATOM 826 C ASP A 52 10.551 -0.392 5.067 1.00 0.00 C ATOM 827 O ASP A 52 11.575 -0.948 4.671 1.00 0.00 O ATOM 828 CB ASP A 52 10.636 1.422 6.804 1.00 0.00 C ATOM 829 CG ASP A 52 11.973 0.992 7.400 1.00 0.00 C ATOM 830 OD1 ASP A 52 13.014 1.456 6.887 1.00 0.00 O ATOM 831 OD2 ASP A 52 11.938 0.201 8.366 1.00 0.00 O ATOM 0 H ASP A 52 8.770 2.188 5.540 1.00 0.00 H new ATOM 0 HA ASP A 52 11.400 1.531 4.788 1.00 0.00 H new ATOM 0 HB2 ASP A 52 10.498 2.492 6.962 1.00 0.00 H new ATOM 0 HB3 ASP A 52 9.827 0.915 7.329 1.00 0.00 H new ATOM 836 N TYR A 53 9.414 -1.057 5.296 1.00 0.00 N ATOM 837 CA TYR A 53 9.289 -2.480 5.032 1.00 0.00 C ATOM 838 C TYR A 53 9.648 -2.768 3.578 1.00 0.00 C ATOM 839 O TYR A 53 10.306 -3.768 3.284 1.00 0.00 O ATOM 840 CB TYR A 53 7.857 -2.927 5.325 1.00 0.00 C ATOM 841 CG TYR A 53 7.443 -4.194 4.608 1.00 0.00 C ATOM 842 CD1 TYR A 53 7.727 -5.451 5.164 1.00 0.00 C ATOM 843 CD2 TYR A 53 6.769 -4.106 3.381 1.00 0.00 C ATOM 844 CE1 TYR A 53 7.326 -6.618 4.496 1.00 0.00 C ATOM 845 CE2 TYR A 53 6.373 -5.267 2.704 1.00 0.00 C ATOM 846 CZ TYR A 53 6.651 -6.531 3.261 1.00 0.00 C ATOM 847 OH TYR A 53 6.265 -7.663 2.603 1.00 0.00 O ATOM 0 H TYR A 53 8.568 -0.623 5.665 1.00 0.00 H new ATOM 0 HA TYR A 53 9.972 -3.033 5.676 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.748 -3.079 6.399 1.00 0.00 H new ATOM 0 HB3 TYR A 53 7.174 -2.125 5.046 1.00 0.00 H new ATOM 0 HD1 TYR A 53 8.253 -5.520 6.105 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.554 -3.137 2.955 1.00 0.00 H new ATOM 0 HE1 TYR A 53 7.535 -7.585 4.929 1.00 0.00 H new ATOM 0 HE2 TYR A 53 5.856 -5.193 1.758 1.00 0.00 H new ATOM 0 HH TYR A 53 5.812 -7.418 1.769 1.00 0.00 H new ATOM 857 N SER A 54 9.217 -1.894 2.662 1.00 0.00 N ATOM 858 CA SER A 54 9.516 -2.070 1.250 1.00 0.00 C ATOM 859 C SER A 54 10.997 -1.892 0.941 1.00 0.00 C ATOM 860 O SER A 54 11.599 -2.763 0.320 1.00 0.00 O ATOM 861 CB SER A 54 8.700 -1.083 0.425 1.00 0.00 C ATOM 862 OG SER A 54 8.873 -1.367 -0.950 1.00 0.00 O ATOM 0 H SER A 54 8.664 -1.065 2.878 1.00 0.00 H new ATOM 0 HA SER A 54 9.249 -3.094 0.988 1.00 0.00 H new ATOM 0 HB2 SER A 54 7.646 -1.152 0.692 1.00 0.00 H new ATOM 0 HB3 SER A 54 9.017 -0.062 0.640 1.00 0.00 H new ATOM 0 HG SER A 54 7.996 -1.445 -1.381 1.00 0.00 H new ATOM 868 N ARG A 55 11.597 -0.772 1.364 1.00 0.00 N ATOM 869 CA ARG A 55 12.971 -0.463 0.989 1.00 0.00 C ATOM 870 C ARG A 55 13.987 -1.403 1.639 1.00 0.00 C ATOM 871 O ARG A 55 15.089 -1.555 1.119 1.00 0.00 O ATOM 872 CB ARG A 55 13.256 1.017 1.260 1.00 0.00 C ATOM 873 CG ARG A 55 13.338 1.372 2.746 1.00 0.00 C ATOM 874 CD ARG A 55 14.752 1.183 3.300 1.00 0.00 C ATOM 875 NE ARG A 55 14.786 1.499 4.730 1.00 0.00 N ATOM 876 CZ ARG A 55 15.875 1.879 5.405 1.00 0.00 C ATOM 877 NH1 ARG A 55 17.057 1.996 4.800 1.00 0.00 N ATOM 878 NH2 ARG A 55 15.772 2.143 6.705 1.00 0.00 N ATOM 0 H ARG A 55 11.152 -0.074 1.961 1.00 0.00 H new ATOM 0 HA ARG A 55 13.086 -0.637 -0.081 1.00 0.00 H new ATOM 0 HB2 ARG A 55 14.196 1.290 0.779 1.00 0.00 H new ATOM 0 HB3 ARG A 55 12.474 1.618 0.796 1.00 0.00 H new ATOM 0 HG2 ARG A 55 13.027 2.407 2.890 1.00 0.00 H new ATOM 0 HG3 ARG A 55 12.642 0.749 3.307 1.00 0.00 H new ATOM 0 HD2 ARG A 55 15.078 0.155 3.140 1.00 0.00 H new ATOM 0 HD3 ARG A 55 15.449 1.826 2.762 1.00 0.00 H new ATOM 0 HE ARG A 55 13.912 1.423 5.250 1.00 0.00 H new ATOM 0 HH11 ARG A 55 17.142 1.794 3.804 1.00 0.00 H new ATOM 0 HH12 ARG A 55 17.876 2.288 5.333 1.00 0.00 H new ATOM 0 HH21 ARG A 55 14.870 2.054 7.174 1.00 0.00 H new ATOM 0 HH22 ARG A 55 16.595 2.434 7.233 1.00 0.00 H new ATOM 892 N LEU A 56 13.628 -2.031 2.763 1.00 0.00 N ATOM 893 CA LEU A 56 14.512 -2.982 3.432 1.00 0.00 C ATOM 894 C LEU A 56 14.484 -4.378 2.812 1.00 0.00 C ATOM 895 O LEU A 56 15.372 -5.181 3.099 1.00 0.00 O ATOM 896 CB LEU A 56 14.109 -3.091 4.902 1.00 0.00 C ATOM 897 CG LEU A 56 14.500 -1.862 5.726 1.00 0.00 C ATOM 898 CD1 LEU A 56 14.021 -2.064 7.160 1.00 0.00 C ATOM 899 CD2 LEU A 56 16.015 -1.654 5.742 1.00 0.00 C ATOM 0 H LEU A 56 12.730 -1.896 3.227 1.00 0.00 H new ATOM 0 HA LEU A 56 15.527 -2.600 3.320 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.031 -3.236 4.967 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.576 -3.975 5.336 1.00 0.00 H new ATOM 0 HG LEU A 56 14.038 -0.985 5.274 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.293 -1.196 7.760 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.938 -2.186 7.168 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.490 -2.955 7.578 1.00 0.00 H new ATOM 0 HD21 LEU A 56 16.255 -0.772 6.336 1.00 0.00 H new ATOM 0 HD22 LEU A 56 16.498 -2.528 6.178 1.00 0.00 H new ATOM 0 HD23 LEU A 56 16.374 -1.513 4.722 1.00 0.00 H new ATOM 911 N CYS A 57 13.488 -4.678 1.972 1.00 0.00 N ATOM 912 CA CYS A 57 13.268 -6.038 1.498 1.00 0.00 C ATOM 913 C CYS A 57 13.206 -6.151 -0.036 1.00 0.00 C ATOM 914 O CYS A 57 12.929 -5.167 -0.719 1.00 0.00 O ATOM 915 CB CYS A 57 12.001 -6.559 2.170 1.00 0.00 C ATOM 916 SG CYS A 57 12.230 -6.575 3.968 1.00 0.00 S ATOM 0 H CYS A 57 12.824 -3.994 1.609 1.00 0.00 H new ATOM 0 HA CYS A 57 14.124 -6.655 1.772 1.00 0.00 H new ATOM 0 HB2 CYS A 57 11.152 -5.928 1.907 1.00 0.00 H new ATOM 0 HB3 CYS A 57 11.775 -7.564 1.813 1.00 0.00 H new ATOM 0 HG CYS A 57 11.069 -6.599 4.553 1.00 0.00 H new ATOM 922 N PRO A 58 13.463 -7.356 -0.575 1.00 0.00 N ATOM 923 CA PRO A 58 13.533 -7.644 -2.004 1.00 0.00 C ATOM 924 C PRO A 58 12.171 -7.696 -2.715 1.00 0.00 C ATOM 925 O PRO A 58 11.146 -7.275 -2.183 1.00 0.00 O ATOM 926 CB PRO A 58 14.259 -8.994 -2.080 1.00 0.00 C ATOM 927 CG PRO A 58 13.768 -9.702 -0.824 1.00 0.00 C ATOM 928 CD PRO A 58 13.737 -8.563 0.187 1.00 0.00 C ATOM 0 HA PRO A 58 14.050 -6.840 -2.528 1.00 0.00 H new ATOM 0 HB2 PRO A 58 13.999 -9.544 -2.984 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.342 -8.873 -2.081 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.784 -10.149 -0.966 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.441 -10.503 -0.517 1.00 0.00 H new ATOM 0 HD2 PRO A 58 12.968 -8.731 0.941 1.00 0.00 H new ATOM 0 HD3 PRO A 58 14.688 -8.484 0.714 1.00 0.00 H new ATOM 936 N ASP A 59 12.193 -8.229 -3.943 1.00 0.00 N ATOM 937 CA ASP A 59 11.107 -8.298 -4.916 1.00 0.00 C ATOM 938 C ASP A 59 9.721 -8.587 -4.332 1.00 0.00 C ATOM 939 O ASP A 59 8.789 -7.801 -4.534 1.00 0.00 O ATOM 940 CB ASP A 59 11.491 -9.401 -5.914 1.00 0.00 C ATOM 941 CG ASP A 59 10.481 -9.601 -7.045 1.00 0.00 C ATOM 942 OD1 ASP A 59 9.294 -9.838 -6.736 1.00 0.00 O ATOM 943 OD2 ASP A 59 10.909 -9.516 -8.217 1.00 0.00 O ATOM 0 H ASP A 59 13.044 -8.657 -4.307 1.00 0.00 H new ATOM 0 HA ASP A 59 11.005 -7.313 -5.372 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.462 -9.162 -6.347 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.606 -10.341 -5.374 1.00 0.00 H new ATOM 948 N SER A 60 9.577 -9.706 -3.615 1.00 0.00 N ATOM 949 CA SER A 60 8.281 -10.127 -3.103 1.00 0.00 C ATOM 950 C SER A 60 7.694 -9.055 -2.193 1.00 0.00 C ATOM 951 O SER A 60 6.477 -8.892 -2.116 1.00 0.00 O ATOM 952 CB SER A 60 8.461 -11.433 -2.328 1.00 0.00 C ATOM 953 OG SER A 60 7.207 -11.934 -1.914 1.00 0.00 O ATOM 0 H SER A 60 10.346 -10.333 -3.379 1.00 0.00 H new ATOM 0 HA SER A 60 7.593 -10.280 -3.934 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.965 -12.169 -2.954 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.097 -11.264 -1.459 1.00 0.00 H new ATOM 0 HG SER A 60 7.336 -12.771 -1.420 1.00 0.00 H new ATOM 959 N HIS A 61 8.566 -8.320 -1.503 1.00 0.00 N ATOM 960 CA HIS A 61 8.166 -7.290 -0.570 1.00 0.00 C ATOM 961 C HIS A 61 7.856 -5.981 -1.290 1.00 0.00 C ATOM 962 O HIS A 61 7.103 -5.167 -0.760 1.00 0.00 O ATOM 963 CB HIS A 61 9.271 -7.119 0.468 1.00 0.00 C ATOM 964 CG HIS A 61 9.710 -8.433 1.059 1.00 0.00 C ATOM 965 ND1 HIS A 61 10.445 -9.417 0.387 1.00 0.00 N ATOM 966 CD2 HIS A 61 9.464 -8.854 2.331 1.00 0.00 C ATOM 967 CE1 HIS A 61 10.626 -10.400 1.282 1.00 0.00 C ATOM 968 NE2 HIS A 61 10.050 -10.093 2.457 1.00 0.00 N ATOM 0 H HIS A 61 9.577 -8.431 -1.583 1.00 0.00 H new ATOM 0 HA HIS A 61 7.246 -7.587 -0.066 1.00 0.00 H new ATOM 0 HB2 HIS A 61 10.127 -6.627 0.006 1.00 0.00 H new ATOM 0 HB3 HIS A 61 8.919 -6.464 1.265 1.00 0.00 H new ATOM 0 HD2 HIS A 61 8.916 -8.319 3.093 1.00 0.00 H new ATOM 0 HE1 HIS A 61 11.163 -11.316 1.085 1.00 0.00 H new ATOM 0 HE2 HIS A 61 10.048 -10.675 3.294 1.00 0.00 H new ATOM 976 N LYS A 62 8.417 -5.762 -2.489 1.00 0.00 N ATOM 977 CA LYS A 62 8.033 -4.618 -3.306 1.00 0.00 C ATOM 978 C LYS A 62 6.604 -4.809 -3.791 1.00 0.00 C ATOM 979 O LYS A 62 5.808 -3.874 -3.738 1.00 0.00 O ATOM 980 CB LYS A 62 8.983 -4.466 -4.498 1.00 0.00 C ATOM 981 CG LYS A 62 10.082 -3.448 -4.208 1.00 0.00 C ATOM 982 CD LYS A 62 10.888 -3.827 -2.965 1.00 0.00 C ATOM 983 CE LYS A 62 11.988 -2.799 -2.721 1.00 0.00 C ATOM 984 NZ LYS A 62 11.422 -1.455 -2.496 1.00 0.00 N ATOM 0 H LYS A 62 9.131 -6.360 -2.905 1.00 0.00 H new ATOM 0 HA LYS A 62 8.095 -3.710 -2.706 1.00 0.00 H new ATOM 0 HB2 LYS A 62 9.432 -5.431 -4.733 1.00 0.00 H new ATOM 0 HB3 LYS A 62 8.419 -4.154 -5.377 1.00 0.00 H new ATOM 0 HG2 LYS A 62 10.749 -3.378 -5.067 1.00 0.00 H new ATOM 0 HG3 LYS A 62 9.638 -2.463 -4.068 1.00 0.00 H new ATOM 0 HD2 LYS A 62 10.230 -3.880 -2.098 1.00 0.00 H new ATOM 0 HD3 LYS A 62 11.326 -4.817 -3.094 1.00 0.00 H new ATOM 0 HE2 LYS A 62 12.582 -3.096 -1.856 1.00 0.00 H new ATOM 0 HE3 LYS A 62 12.662 -2.774 -3.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 12.117 -0.865 -1.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 11.192 -1.018 -3.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 10.558 -1.534 -1.923 1.00 0.00 H new ATOM 998 N LEU A 63 6.271 -6.016 -4.260 1.00 0.00 N ATOM 999 CA LEU A 63 4.911 -6.281 -4.713 1.00 0.00 C ATOM 1000 C LEU A 63 3.937 -6.218 -3.533 1.00 0.00 C ATOM 1001 O LEU A 63 2.875 -5.599 -3.626 1.00 0.00 O ATOM 1002 CB LEU A 63 4.866 -7.636 -5.417 1.00 0.00 C ATOM 1003 CG LEU A 63 3.482 -7.942 -6.005 1.00 0.00 C ATOM 1004 CD1 LEU A 63 3.064 -6.894 -7.037 1.00 0.00 C ATOM 1005 CD2 LEU A 63 3.526 -9.307 -6.687 1.00 0.00 C ATOM 0 H LEU A 63 6.912 -6.806 -4.333 1.00 0.00 H new ATOM 0 HA LEU A 63 4.603 -5.517 -5.427 1.00 0.00 H new ATOM 0 HB2 LEU A 63 5.609 -7.653 -6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.139 -8.419 -4.710 1.00 0.00 H new ATOM 0 HG LEU A 63 2.757 -7.932 -5.191 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.079 -7.144 -7.431 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.027 -5.912 -6.564 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.787 -6.877 -7.852 1.00 0.00 H new ATOM 0 HD21 LEU A 63 2.547 -9.535 -7.109 1.00 0.00 H new ATOM 0 HD22 LEU A 63 4.270 -9.292 -7.484 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.793 -10.070 -5.956 1.00 0.00 H new ATOM 1017 N GLY A 64 4.298 -6.862 -2.419 1.00 0.00 N ATOM 1018 CA GLY A 64 3.485 -6.840 -1.216 1.00 0.00 C ATOM 1019 C GLY A 64 3.306 -5.406 -0.729 1.00 0.00 C ATOM 1020 O GLY A 64 2.203 -5.012 -0.362 1.00 0.00 O ATOM 0 H GLY A 64 5.156 -7.407 -2.333 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.512 -7.288 -1.417 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.957 -7.440 -0.438 1.00 0.00 H new ATOM 1024 N SER A 65 4.391 -4.627 -0.729 1.00 0.00 N ATOM 1025 CA SER A 65 4.339 -3.232 -0.329 1.00 0.00 C ATOM 1026 C SER A 65 3.309 -2.488 -1.164 1.00 0.00 C ATOM 1027 O SER A 65 2.460 -1.799 -0.608 1.00 0.00 O ATOM 1028 CB SER A 65 5.707 -2.580 -0.505 1.00 0.00 C ATOM 1029 OG SER A 65 5.575 -1.192 -0.304 1.00 0.00 O ATOM 0 H SER A 65 5.319 -4.949 -1.005 1.00 0.00 H new ATOM 0 HA SER A 65 4.054 -3.183 0.722 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.419 -2.999 0.206 1.00 0.00 H new ATOM 0 HB3 SER A 65 6.096 -2.782 -1.503 1.00 0.00 H new ATOM 0 HG SER A 65 5.554 -1.001 0.657 1.00 0.00 H new ATOM 1035 N LEU A 66 3.370 -2.615 -2.493 1.00 0.00 N ATOM 1036 CA LEU A 66 2.408 -1.929 -3.340 1.00 0.00 C ATOM 1037 C LEU A 66 0.975 -2.338 -3.010 1.00 0.00 C ATOM 1038 O LEU A 66 0.100 -1.475 -3.011 1.00 0.00 O ATOM 1039 CB LEU A 66 2.706 -2.186 -4.818 1.00 0.00 C ATOM 1040 CG LEU A 66 3.976 -1.482 -5.311 1.00 0.00 C ATOM 1041 CD1 LEU A 66 4.081 -1.710 -6.817 1.00 0.00 C ATOM 1042 CD2 LEU A 66 3.933 0.026 -5.053 1.00 0.00 C ATOM 0 H LEU A 66 4.062 -3.175 -2.991 1.00 0.00 H new ATOM 0 HA LEU A 66 2.505 -0.861 -3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.807 -3.259 -4.980 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.858 -1.852 -5.416 1.00 0.00 H new ATOM 0 HG LEU A 66 4.831 -1.891 -4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.977 -1.220 -7.198 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.139 -2.779 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.202 -1.294 -7.310 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.852 0.484 -5.418 1.00 0.00 H new ATOM 0 HD22 LEU A 66 3.080 0.460 -5.574 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.836 0.209 -3.983 1.00 0.00 H new ATOM 1054 N TYR A 67 0.712 -3.622 -2.731 1.00 0.00 N ATOM 1055 CA TYR A 67 -0.647 -4.035 -2.391 1.00 0.00 C ATOM 1056 C TYR A 67 -1.083 -3.490 -1.023 1.00 0.00 C ATOM 1057 O TYR A 67 -2.271 -3.257 -0.803 1.00 0.00 O ATOM 1058 CB TYR A 67 -0.772 -5.559 -2.459 1.00 0.00 C ATOM 1059 CG TYR A 67 -1.067 -6.086 -3.851 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -0.250 -5.720 -4.931 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -2.161 -6.945 -4.061 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -0.535 -6.187 -6.222 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -2.449 -7.416 -5.348 1.00 0.00 C ATOM 1064 CZ TYR A 67 -1.640 -7.035 -6.437 1.00 0.00 C ATOM 1065 OH TYR A 67 -1.921 -7.485 -7.692 1.00 0.00 O ATOM 0 H TYR A 67 1.404 -4.371 -2.734 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.325 -3.605 -3.128 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.154 -6.007 -2.099 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -1.565 -5.880 -1.783 1.00 0.00 H new ATOM 0 HD1 TYR A 67 0.602 -5.076 -4.767 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -2.780 -7.242 -3.228 1.00 0.00 H new ATOM 0 HE1 TYR A 67 0.092 -5.897 -7.052 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.292 -8.072 -5.506 1.00 0.00 H new ATOM 0 HH TYR A 67 -2.714 -8.060 -7.663 1.00 0.00 H new ATOM 1075 N ILE A 68 -0.140 -3.282 -0.096 1.00 0.00 N ATOM 1076 CA ILE A 68 -0.444 -2.734 1.227 1.00 0.00 C ATOM 1077 C ILE A 68 -0.620 -1.213 1.153 1.00 0.00 C ATOM 1078 O ILE A 68 -1.493 -0.654 1.815 1.00 0.00 O ATOM 1079 CB ILE A 68 0.672 -3.152 2.190 1.00 0.00 C ATOM 1080 CG1 ILE A 68 0.665 -4.679 2.330 1.00 0.00 C ATOM 1081 CG2 ILE A 68 0.490 -2.498 3.562 1.00 0.00 C ATOM 1082 CD1 ILE A 68 2.002 -5.193 2.863 1.00 0.00 C ATOM 0 H ILE A 68 0.848 -3.488 -0.242 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.389 -3.131 1.599 1.00 0.00 H new ATOM 0 HB ILE A 68 1.629 -2.820 1.787 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.138 -4.981 3.003 1.00 0.00 H new ATOM 0 HG13 ILE A 68 0.458 -5.134 1.362 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.296 -2.813 4.225 1.00 0.00 H new ATOM 0 HG22 ILE A 68 0.511 -1.414 3.454 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -0.467 -2.802 3.986 1.00 0.00 H new ATOM 0 HD11 ILE A 68 1.965 -6.279 2.951 1.00 0.00 H new ATOM 0 HD12 ILE A 68 2.800 -4.911 2.176 1.00 0.00 H new ATOM 0 HD13 ILE A 68 2.195 -4.756 3.843 1.00 0.00 H new ATOM 1094 N ILE A 69 0.210 -0.538 0.348 1.00 0.00 N ATOM 1095 CA ILE A 69 0.104 0.893 0.107 1.00 0.00 C ATOM 1096 C ILE A 69 -1.217 1.166 -0.612 1.00 0.00 C ATOM 1097 O ILE A 69 -1.866 2.185 -0.381 1.00 0.00 O ATOM 1098 CB ILE A 69 1.295 1.330 -0.757 1.00 0.00 C ATOM 1099 CG1 ILE A 69 2.588 1.259 0.064 1.00 0.00 C ATOM 1100 CG2 ILE A 69 1.099 2.751 -1.281 1.00 0.00 C ATOM 1101 CD1 ILE A 69 3.817 1.335 -0.840 1.00 0.00 C ATOM 0 H ILE A 69 0.979 -0.981 -0.156 1.00 0.00 H new ATOM 0 HA ILE A 69 0.121 1.453 1.042 1.00 0.00 H new ATOM 0 HB ILE A 69 1.364 0.654 -1.609 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.611 2.077 0.784 1.00 0.00 H new ATOM 0 HG13 ILE A 69 2.609 0.331 0.635 1.00 0.00 H new ATOM 0 HG21 ILE A 69 1.957 3.036 -1.890 1.00 0.00 H new ATOM 0 HG22 ILE A 69 0.194 2.794 -1.887 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.006 3.439 -0.441 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.720 1.282 -0.232 1.00 0.00 H new ATOM 0 HD12 ILE A 69 3.804 0.502 -1.543 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.805 2.275 -1.392 1.00 0.00 H new ATOM 1113 N ASP A 70 -1.604 0.238 -1.487 1.00 0.00 N ATOM 1114 CA ASP A 70 -2.848 0.262 -2.233 1.00 0.00 C ATOM 1115 C ASP A 70 -4.030 0.134 -1.284 1.00 0.00 C ATOM 1116 O ASP A 70 -4.940 0.959 -1.330 1.00 0.00 O ATOM 1117 CB ASP A 70 -2.778 -0.885 -3.245 1.00 0.00 C ATOM 1118 CG ASP A 70 -4.127 -1.421 -3.703 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -4.914 -0.635 -4.260 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -4.361 -2.628 -3.486 1.00 0.00 O ATOM 0 H ASP A 70 -1.033 -0.580 -1.699 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.988 1.205 -2.762 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -2.223 -0.545 -4.119 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.209 -1.704 -2.805 1.00 0.00 H new ATOM 1125 N SER A 71 -4.045 -0.882 -0.423 1.00 0.00 N ATOM 1126 CA SER A 71 -5.193 -1.093 0.426 1.00 0.00 C ATOM 1127 C SER A 71 -5.371 0.035 1.438 1.00 0.00 C ATOM 1128 O SER A 71 -6.455 0.608 1.531 1.00 0.00 O ATOM 1129 CB SER A 71 -5.047 -2.447 1.115 1.00 0.00 C ATOM 1130 OG SER A 71 -3.873 -2.454 1.902 1.00 0.00 O ATOM 0 H SER A 71 -3.287 -1.554 -0.303 1.00 0.00 H new ATOM 0 HA SER A 71 -6.094 -1.091 -0.187 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.918 -2.644 1.741 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.003 -3.242 0.371 1.00 0.00 H new ATOM 0 HG SER A 71 -3.224 -1.823 1.527 1.00 0.00 H new ATOM 1136 N ILE A 72 -4.321 0.357 2.198 1.00 0.00 N ATOM 1137 CA ILE A 72 -4.392 1.413 3.191 1.00 0.00 C ATOM 1138 C ILE A 72 -4.545 2.776 2.518 1.00 0.00 C ATOM 1139 O ILE A 72 -5.218 3.652 3.054 1.00 0.00 O ATOM 1140 CB ILE A 72 -3.156 1.343 4.100 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -3.158 -0.016 4.818 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -3.176 2.481 5.122 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -2.035 -0.140 5.847 1.00 0.00 C ATOM 0 H ILE A 72 -3.413 -0.104 2.139 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.275 1.274 3.815 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.252 1.447 3.500 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -4.118 -0.159 5.315 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.059 -0.812 4.080 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.293 2.415 5.757 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.177 3.438 4.601 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.072 2.402 5.737 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.084 -1.119 6.323 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.072 -0.027 5.350 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.147 0.637 6.603 1.00 0.00 H new ATOM 1155 N GLY A 73 -3.928 2.965 1.348 1.00 0.00 N ATOM 1156 CA GLY A 73 -4.009 4.226 0.627 1.00 0.00 C ATOM 1157 C GLY A 73 -5.430 4.519 0.163 1.00 0.00 C ATOM 1158 O GLY A 73 -5.941 5.613 0.395 1.00 0.00 O ATOM 0 H GLY A 73 -3.365 2.253 0.883 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.662 5.035 1.269 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.343 4.195 -0.236 1.00 0.00 H new ATOM 1162 N ARG A 74 -6.075 3.548 -0.494 1.00 0.00 N ATOM 1163 CA ARG A 74 -7.447 3.699 -0.966 1.00 0.00 C ATOM 1164 C ARG A 74 -8.419 3.770 0.205 1.00 0.00 C ATOM 1165 O ARG A 74 -9.393 4.516 0.144 1.00 0.00 O ATOM 1166 CB ARG A 74 -7.788 2.516 -1.870 1.00 0.00 C ATOM 1167 CG ARG A 74 -7.332 2.790 -3.303 1.00 0.00 C ATOM 1168 CD ARG A 74 -6.764 1.520 -3.927 1.00 0.00 C ATOM 1169 NE ARG A 74 -7.759 0.466 -4.168 1.00 0.00 N ATOM 1170 CZ ARG A 74 -7.823 -0.626 -3.403 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -7.079 -0.729 -2.309 1.00 0.00 N ATOM 1172 NH2 ARG A 74 -8.625 -1.634 -3.718 1.00 0.00 N ATOM 0 H ARG A 74 -5.659 2.642 -0.710 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.536 4.630 -1.526 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -7.306 1.613 -1.495 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.863 2.335 -1.852 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -8.172 3.151 -3.897 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.576 3.576 -3.308 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -6.287 1.776 -4.873 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -5.985 1.126 -3.274 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.418 0.571 -4.940 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -6.451 0.030 -2.046 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.135 -1.568 -1.731 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.205 -1.582 -4.556 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -8.662 -2.461 -3.123 1.00 0.00 H new ATOM 1186 N ALA A 75 -8.165 3.005 1.266 1.00 0.00 N ATOM 1187 CA ALA A 75 -9.027 3.024 2.436 1.00 0.00 C ATOM 1188 C ALA A 75 -8.925 4.371 3.157 1.00 0.00 C ATOM 1189 O ALA A 75 -9.937 4.907 3.607 1.00 0.00 O ATOM 1190 CB ALA A 75 -8.644 1.861 3.347 1.00 0.00 C ATOM 0 H ALA A 75 -7.371 2.368 1.335 1.00 0.00 H new ATOM 0 HA ALA A 75 -10.068 2.904 2.136 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -9.284 1.864 4.229 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.771 0.921 2.810 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.603 1.966 3.653 1.00 0.00 H new ATOM 1196 N TYR A 76 -7.715 4.926 3.273 1.00 0.00 N ATOM 1197 CA TYR A 76 -7.515 6.247 3.855 1.00 0.00 C ATOM 1198 C TYR A 76 -8.174 7.303 2.989 1.00 0.00 C ATOM 1199 O TYR A 76 -8.853 8.181 3.516 1.00 0.00 O ATOM 1200 CB TYR A 76 -6.020 6.559 3.963 1.00 0.00 C ATOM 1201 CG TYR A 76 -5.282 5.941 5.131 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -5.881 4.968 5.951 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -3.970 6.359 5.391 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -5.176 4.443 7.042 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -3.265 5.840 6.487 1.00 0.00 C ATOM 1206 CZ TYR A 76 -3.872 4.890 7.327 1.00 0.00 C ATOM 1207 OH TYR A 76 -3.194 4.414 8.409 1.00 0.00 O ATOM 0 H TYR A 76 -6.855 4.472 2.967 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.962 6.254 4.849 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.536 6.232 3.043 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -5.901 7.641 4.019 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -6.883 4.626 5.740 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -3.499 7.085 4.744 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -5.635 3.692 7.667 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -2.256 6.170 6.686 1.00 0.00 H new ATOM 0 HH TYR A 76 -2.308 4.832 8.450 1.00 0.00 H new ATOM 1217 N LEU A 77 -7.975 7.220 1.671 1.00 0.00 N ATOM 1218 CA LEU A 77 -8.497 8.203 0.740 1.00 0.00 C ATOM 1219 C LEU A 77 -10.019 8.271 0.843 1.00 0.00 C ATOM 1220 O LEU A 77 -10.602 9.354 0.878 1.00 0.00 O ATOM 1221 CB LEU A 77 -8.043 7.806 -0.667 1.00 0.00 C ATOM 1222 CG LEU A 77 -8.482 8.807 -1.734 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -7.955 10.204 -1.419 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -7.936 8.364 -3.089 1.00 0.00 C ATOM 0 H LEU A 77 -7.447 6.468 1.228 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.118 9.198 0.974 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.957 7.718 -0.682 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.446 6.823 -0.910 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.571 8.840 -1.753 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -8.281 10.899 -2.193 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.341 10.529 -0.453 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.866 10.183 -1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -8.246 9.074 -3.856 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.847 8.326 -3.048 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -8.325 7.375 -3.332 1.00 0.00 H new ATOM 1236 N ASP A 78 -10.673 7.107 0.895 1.00 0.00 N ATOM 1237 CA ASP A 78 -12.119 7.050 1.038 1.00 0.00 C ATOM 1238 C ASP A 78 -12.537 7.588 2.399 1.00 0.00 C ATOM 1239 O ASP A 78 -13.496 8.347 2.500 1.00 0.00 O ATOM 1240 CB ASP A 78 -12.578 5.602 0.899 1.00 0.00 C ATOM 1241 CG ASP A 78 -14.100 5.504 0.883 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -14.689 5.835 -0.169 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -14.664 5.100 1.926 1.00 0.00 O ATOM 0 H ASP A 78 -10.219 6.195 0.840 1.00 0.00 H new ATOM 0 HA ASP A 78 -12.580 7.662 0.263 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -12.174 5.176 -0.020 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -12.182 5.011 1.725 1.00 0.00 H new ATOM 1248 N GLU A 79 -11.820 7.196 3.455 1.00 0.00 N ATOM 1249 CA GLU A 79 -12.178 7.586 4.808 1.00 0.00 C ATOM 1250 C GLU A 79 -12.005 9.091 5.029 1.00 0.00 C ATOM 1251 O GLU A 79 -12.700 9.663 5.864 1.00 0.00 O ATOM 1252 CB GLU A 79 -11.340 6.774 5.800 1.00 0.00 C ATOM 1253 CG GLU A 79 -11.758 7.027 7.252 1.00 0.00 C ATOM 1254 CD GLU A 79 -13.228 6.684 7.500 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -13.654 5.597 7.051 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -13.917 7.513 8.138 1.00 0.00 O ATOM 0 H GLU A 79 -10.989 6.608 3.392 1.00 0.00 H new ATOM 0 HA GLU A 79 -13.234 7.371 4.970 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.440 5.712 5.574 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.287 7.028 5.677 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -11.131 6.433 7.917 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -11.584 8.074 7.501 1.00 0.00 H new ATOM 1263 N THR A 80 -11.094 9.742 4.298 1.00 0.00 N ATOM 1264 CA THR A 80 -10.863 11.169 4.481 1.00 0.00 C ATOM 1265 C THR A 80 -11.677 12.032 3.518 1.00 0.00 C ATOM 1266 O THR A 80 -11.931 13.195 3.825 1.00 0.00 O ATOM 1267 CB THR A 80 -9.360 11.469 4.434 1.00 0.00 C ATOM 1268 OG1 THR A 80 -9.132 12.794 4.857 1.00 0.00 O ATOM 1269 CG2 THR A 80 -8.758 11.294 3.039 1.00 0.00 C ATOM 0 H THR A 80 -10.513 9.305 3.583 1.00 0.00 H new ATOM 0 HA THR A 80 -11.227 11.445 5.471 1.00 0.00 H new ATOM 0 HB THR A 80 -8.876 10.751 5.096 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.344 13.153 4.398 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.692 11.521 3.072 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.900 10.265 2.708 1.00 0.00 H new ATOM 0 HG23 THR A 80 -9.252 11.971 2.342 1.00 0.00 H new ATOM 1277 N ARG A 81 -12.098 11.499 2.361 1.00 0.00 N ATOM 1278 CA ARG A 81 -12.945 12.267 1.450 1.00 0.00 C ATOM 1279 C ARG A 81 -14.435 12.046 1.707 1.00 0.00 C ATOM 1280 O ARG A 81 -15.223 12.971 1.527 1.00 0.00 O ATOM 1281 CB ARG A 81 -12.613 11.926 -0.005 1.00 0.00 C ATOM 1282 CG ARG A 81 -11.194 12.377 -0.368 1.00 0.00 C ATOM 1283 CD ARG A 81 -10.969 12.232 -1.874 1.00 0.00 C ATOM 1284 NE ARG A 81 -11.231 10.862 -2.331 1.00 0.00 N ATOM 1285 CZ ARG A 81 -10.973 10.427 -3.567 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -10.437 11.231 -4.482 1.00 0.00 N ATOM 1287 NH2 ARG A 81 -11.251 9.170 -3.901 1.00 0.00 N ATOM 0 H ARG A 81 -11.869 10.557 2.042 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.734 13.320 1.638 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -12.707 10.851 -0.160 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -13.332 12.408 -0.668 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -11.045 13.414 -0.068 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.463 11.779 0.177 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.620 12.925 -2.408 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -9.943 12.507 -2.117 1.00 0.00 H new ATOM 0 HE ARG A 81 -11.634 10.203 -1.665 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -10.216 12.198 -4.244 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -10.247 10.880 -5.421 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -11.661 8.538 -3.213 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -11.054 8.838 -4.845 1.00 0.00 H new ATOM 1441 N THR A 93 -3.006 12.866 10.261 1.00 0.00 N ATOM 1442 CA THR A 93 -3.743 11.605 10.210 1.00 0.00 C ATOM 1443 C THR A 93 -3.687 11.011 8.800 1.00 0.00 C ATOM 1444 O THR A 93 -2.778 11.328 8.038 1.00 0.00 O ATOM 1445 CB THR A 93 -5.185 11.788 10.711 1.00 0.00 C ATOM 1446 OG1 THR A 93 -5.506 13.144 10.934 1.00 0.00 O ATOM 1447 CG2 THR A 93 -5.294 11.014 12.024 1.00 0.00 C ATOM 0 HA THR A 93 -3.266 10.892 10.883 1.00 0.00 H new ATOM 0 HB THR A 93 -5.882 11.422 9.957 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.710 13.697 10.787 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.304 11.113 12.422 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.076 9.961 11.845 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.580 11.415 12.743 1.00 0.00 H new ATOM 1455 N CYS A 94 -4.644 10.149 8.440 1.00 0.00 N ATOM 1456 CA CYS A 94 -4.672 9.455 7.157 1.00 0.00 C ATOM 1457 C CYS A 94 -4.446 10.377 5.953 1.00 0.00 C ATOM 1458 O CYS A 94 -3.866 9.945 4.958 1.00 0.00 O ATOM 1459 CB CYS A 94 -6.013 8.734 7.040 1.00 0.00 C ATOM 1460 SG CYS A 94 -7.375 9.909 7.253 1.00 0.00 S ATOM 0 H CYS A 94 -5.431 9.913 9.044 1.00 0.00 H new ATOM 0 HA CYS A 94 -3.842 8.749 7.137 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -6.090 8.249 6.067 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -6.079 7.949 7.793 1.00 0.00 H new ATOM 0 HG CYS A 94 -8.509 9.282 7.149 1.00 0.00 H new ATOM 1466 N ALA A 95 -4.887 11.635 6.014 1.00 0.00 N ATOM 1467 CA ALA A 95 -4.632 12.575 4.931 1.00 0.00 C ATOM 1468 C ALA A 95 -3.127 12.821 4.792 1.00 0.00 C ATOM 1469 O ALA A 95 -2.576 12.793 3.691 1.00 0.00 O ATOM 1470 CB ALA A 95 -5.375 13.877 5.231 1.00 0.00 C ATOM 0 H ALA A 95 -5.417 12.020 6.796 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.990 12.167 3.986 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.194 14.592 4.429 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -6.444 13.677 5.305 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -5.017 14.291 6.174 1.00 0.00 H new ATOM 1476 N HIS A 96 -2.460 13.064 5.925 1.00 0.00 N ATOM 1477 CA HIS A 96 -1.024 13.281 5.967 1.00 0.00 C ATOM 1478 C HIS A 96 -0.278 12.005 5.596 1.00 0.00 C ATOM 1479 O HIS A 96 0.822 12.067 5.052 1.00 0.00 O ATOM 1480 CB HIS A 96 -0.634 13.724 7.377 1.00 0.00 C ATOM 1481 CG HIS A 96 -1.297 15.015 7.785 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -2.631 15.146 8.178 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -0.689 16.237 7.831 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -2.791 16.448 8.455 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -1.648 17.127 8.255 1.00 0.00 N ATOM 0 H HIS A 96 -2.910 13.114 6.839 1.00 0.00 H new ATOM 0 HA HIS A 96 -0.754 14.053 5.247 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.903 12.942 8.087 1.00 0.00 H new ATOM 0 HB3 HIS A 96 0.448 13.843 7.430 1.00 0.00 H new ATOM 0 HD2 HIS A 96 0.339 16.460 7.584 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -3.715 16.892 8.794 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -1.515 18.129 8.394 1.00 0.00 H new ATOM 1493 N ALA A 97 -0.872 10.848 5.890 1.00 0.00 N ATOM 1494 CA ALA A 97 -0.299 9.557 5.553 1.00 0.00 C ATOM 1495 C ALA A 97 -0.230 9.383 4.039 1.00 0.00 C ATOM 1496 O ALA A 97 0.800 8.963 3.512 1.00 0.00 O ATOM 1497 CB ALA A 97 -1.162 8.477 6.189 1.00 0.00 C ATOM 0 H ALA A 97 -1.769 10.786 6.371 1.00 0.00 H new ATOM 0 HA ALA A 97 0.720 9.484 5.934 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.752 7.496 5.950 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.175 8.611 7.271 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.179 8.549 5.802 1.00 0.00 H new ATOM 1503 N ILE A 98 -1.322 9.702 3.333 1.00 0.00 N ATOM 1504 CA ILE A 98 -1.321 9.645 1.878 1.00 0.00 C ATOM 1505 C ILE A 98 -0.303 10.650 1.342 1.00 0.00 C ATOM 1506 O ILE A 98 0.452 10.349 0.416 1.00 0.00 O ATOM 1507 CB ILE A 98 -2.730 9.944 1.350 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -3.714 8.867 1.823 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -2.724 9.985 -0.179 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -5.156 9.275 1.533 1.00 0.00 C ATOM 0 H ILE A 98 -2.206 9.999 3.747 1.00 0.00 H new ATOM 0 HA ILE A 98 -1.039 8.649 1.538 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.043 10.914 1.737 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -3.492 7.923 1.324 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.588 8.700 2.893 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -3.730 10.198 -0.541 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -2.043 10.765 -0.519 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -2.395 9.021 -0.568 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.832 8.493 1.879 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -5.382 10.206 2.053 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.285 9.418 0.460 1.00 0.00 H new ATOM 1522 N ASN A 99 -0.273 11.853 1.925 1.00 0.00 N ATOM 1523 CA ASN A 99 0.667 12.878 1.510 1.00 0.00 C ATOM 1524 C ASN A 99 2.113 12.419 1.718 1.00 0.00 C ATOM 1525 O ASN A 99 2.993 12.776 0.935 1.00 0.00 O ATOM 1526 CB ASN A 99 0.374 14.148 2.310 1.00 0.00 C ATOM 1527 CG ASN A 99 1.100 15.371 1.762 1.00 0.00 C ATOM 1528 OD1 ASN A 99 1.662 15.347 0.670 1.00 0.00 O ATOM 1529 ND2 ASN A 99 1.093 16.462 2.522 1.00 0.00 N ATOM 0 H ASN A 99 -0.893 12.133 2.685 1.00 0.00 H new ATOM 0 HA ASN A 99 0.549 13.076 0.445 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.700 14.336 2.305 1.00 0.00 H new ATOM 0 HB3 ASN A 99 0.665 13.993 3.349 1.00 0.00 H new ATOM 0 HD21 ASN A 99 1.563 17.309 2.203 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.618 16.452 3.424 1.00 0.00 H new ATOM 1536 N THR A 100 2.370 11.629 2.765 1.00 0.00 N ATOM 1537 CA THR A 100 3.707 11.133 3.056 1.00 0.00 C ATOM 1538 C THR A 100 4.110 10.046 2.068 1.00 0.00 C ATOM 1539 O THR A 100 5.247 10.038 1.607 1.00 0.00 O ATOM 1540 CB THR A 100 3.789 10.625 4.496 1.00 0.00 C ATOM 1541 OG1 THR A 100 3.473 11.667 5.392 1.00 0.00 O ATOM 1542 CG2 THR A 100 5.213 10.154 4.799 1.00 0.00 C ATOM 0 H THR A 100 1.658 11.320 3.427 1.00 0.00 H new ATOM 0 HA THR A 100 4.410 11.959 2.947 1.00 0.00 H new ATOM 0 HB THR A 100 3.085 9.801 4.613 1.00 0.00 H new ATOM 0 HG1 THR A 100 2.500 11.779 5.434 1.00 0.00 H new ATOM 0 HG21 THR A 100 5.266 9.793 5.826 1.00 0.00 H new ATOM 0 HG22 THR A 100 5.482 9.348 4.117 1.00 0.00 H new ATOM 0 HG23 THR A 100 5.906 10.985 4.670 1.00 0.00 H new ATOM 1550 N LEU A 101 3.205 9.120 1.726 1.00 0.00 N ATOM 1551 CA LEU A 101 3.507 8.140 0.689 1.00 0.00 C ATOM 1552 C LEU A 101 3.797 8.877 -0.619 1.00 0.00 C ATOM 1553 O LEU A 101 4.591 8.410 -1.433 1.00 0.00 O ATOM 1554 CB LEU A 101 2.315 7.208 0.479 1.00 0.00 C ATOM 1555 CG LEU A 101 2.112 6.223 1.627 1.00 0.00 C ATOM 1556 CD1 LEU A 101 0.697 5.660 1.542 1.00 0.00 C ATOM 1557 CD2 LEU A 101 3.111 5.073 1.501 1.00 0.00 C ATOM 0 H LEU A 101 2.279 9.033 2.145 1.00 0.00 H new ATOM 0 HA LEU A 101 4.372 7.551 0.994 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.412 7.806 0.358 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.456 6.652 -0.448 1.00 0.00 H new ATOM 0 HG LEU A 101 2.263 6.732 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.537 4.954 2.357 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -0.024 6.474 1.620 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.565 5.149 0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.964 4.371 2.322 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.956 4.559 0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.126 5.467 1.539 1.00 0.00 H new ATOM 1569 N GLY A 102 3.152 10.031 -0.817 1.00 0.00 N ATOM 1570 CA GLY A 102 3.340 10.863 -1.996 1.00 0.00 C ATOM 1571 C GLY A 102 4.786 11.309 -2.226 1.00 0.00 C ATOM 1572 O GLY A 102 5.099 11.778 -3.319 1.00 0.00 O ATOM 0 H GLY A 102 2.479 10.412 -0.152 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.997 10.314 -2.873 1.00 0.00 H new ATOM 0 HA3 GLY A 102 2.709 11.747 -1.907 1.00 0.00 H new ATOM 1576 N GLU A 103 5.672 11.176 -1.230 1.00 0.00 N ATOM 1577 CA GLU A 103 7.060 11.591 -1.390 1.00 0.00 C ATOM 1578 C GLU A 103 7.989 10.403 -1.645 1.00 0.00 C ATOM 1579 O GLU A 103 9.174 10.596 -1.918 1.00 0.00 O ATOM 1580 CB GLU A 103 7.506 12.443 -0.193 1.00 0.00 C ATOM 1581 CG GLU A 103 8.096 11.626 0.956 1.00 0.00 C ATOM 1582 CD GLU A 103 8.443 12.528 2.140 1.00 0.00 C ATOM 1583 OE1 GLU A 103 7.510 12.891 2.886 1.00 0.00 O ATOM 1584 OE2 GLU A 103 9.645 12.845 2.288 1.00 0.00 O ATOM 0 H GLU A 103 5.449 10.787 -0.314 1.00 0.00 H new ATOM 0 HA GLU A 103 7.127 12.215 -2.281 1.00 0.00 H new ATOM 0 HB2 GLU A 103 8.247 13.168 -0.530 1.00 0.00 H new ATOM 0 HB3 GLU A 103 6.652 13.010 0.177 1.00 0.00 H new ATOM 0 HG2 GLU A 103 7.383 10.864 1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 103 8.991 11.104 0.616 1.00 0.00 H new ATOM 1591 N VAL A 104 7.462 9.177 -1.561 1.00 0.00 N ATOM 1592 CA VAL A 104 8.242 7.959 -1.757 1.00 0.00 C ATOM 1593 C VAL A 104 7.683 7.103 -2.889 1.00 0.00 C ATOM 1594 O VAL A 104 8.397 6.251 -3.415 1.00 0.00 O ATOM 1595 CB VAL A 104 8.283 7.140 -0.467 1.00 0.00 C ATOM 1596 CG1 VAL A 104 9.035 7.902 0.623 1.00 0.00 C ATOM 1597 CG2 VAL A 104 6.864 6.819 0.005 1.00 0.00 C ATOM 0 H VAL A 104 6.478 9.005 -1.354 1.00 0.00 H new ATOM 0 HA VAL A 104 9.253 8.263 -2.030 1.00 0.00 H new ATOM 0 HB VAL A 104 8.807 6.206 -0.669 1.00 0.00 H new ATOM 0 HG11 VAL A 104 9.056 7.306 1.535 1.00 0.00 H new ATOM 0 HG12 VAL A 104 10.056 8.096 0.293 1.00 0.00 H new ATOM 0 HG13 VAL A 104 8.531 8.848 0.819 1.00 0.00 H new ATOM 0 HG21 VAL A 104 6.910 6.235 0.924 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.324 7.747 0.191 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.346 6.245 -0.763 1.00 0.00 H new ATOM 1607 N ILE A 105 6.417 7.311 -3.273 1.00 0.00 N ATOM 1608 CA ILE A 105 5.773 6.538 -4.324 1.00 0.00 C ATOM 1609 C ILE A 105 6.601 6.514 -5.608 1.00 0.00 C ATOM 1610 O ILE A 105 6.498 5.567 -6.384 1.00 0.00 O ATOM 1611 CB ILE A 105 4.369 7.121 -4.540 1.00 0.00 C ATOM 1612 CG1 ILE A 105 3.471 6.191 -5.357 1.00 0.00 C ATOM 1613 CG2 ILE A 105 4.431 8.491 -5.216 1.00 0.00 C ATOM 1614 CD1 ILE A 105 3.274 4.868 -4.615 1.00 0.00 C ATOM 0 H ILE A 105 5.816 8.023 -2.858 1.00 0.00 H new ATOM 0 HA ILE A 105 5.691 5.494 -4.022 1.00 0.00 H new ATOM 0 HB ILE A 105 3.932 7.230 -3.547 1.00 0.00 H new ATOM 0 HG12 ILE A 105 2.506 6.666 -5.533 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.918 6.006 -6.334 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.420 8.875 -5.354 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.999 9.180 -4.591 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.919 8.396 -6.186 1.00 0.00 H new ATOM 0 HD11 ILE A 105 2.633 4.212 -5.204 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.241 4.389 -4.462 1.00 0.00 H new ATOM 0 HD13 ILE A 105 2.807 5.059 -3.649 1.00 0.00 H new ATOM 1626 N GLN A 106 7.419 7.545 -5.835 1.00 0.00 N ATOM 1627 CA GLN A 106 8.292 7.619 -6.993 1.00 0.00 C ATOM 1628 C GLN A 106 9.267 6.444 -7.035 1.00 0.00 C ATOM 1629 O GLN A 106 9.301 5.697 -8.011 1.00 0.00 O ATOM 1630 CB GLN A 106 9.008 8.975 -7.016 1.00 0.00 C ATOM 1631 CG GLN A 106 9.638 9.358 -5.669 1.00 0.00 C ATOM 1632 CD GLN A 106 10.269 10.745 -5.711 1.00 0.00 C ATOM 1633 OE1 GLN A 106 10.482 11.319 -6.775 1.00 0.00 O ATOM 1634 NE2 GLN A 106 10.575 11.302 -4.541 1.00 0.00 N ATOM 0 H GLN A 106 7.489 8.351 -5.214 1.00 0.00 H new ATOM 0 HA GLN A 106 7.688 7.542 -7.897 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.786 8.953 -7.779 1.00 0.00 H new ATOM 0 HB3 GLN A 106 8.297 9.748 -7.308 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.876 9.329 -4.890 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.396 8.622 -5.400 1.00 0.00 H new ATOM 0 HE21 GLN A 106 10.386 10.801 -3.673 1.00 0.00 H new ATOM 0 HE22 GLN A 106 10.998 12.230 -4.513 1.00 0.00 H new ATOM 1643 N GLU A 107 10.064 6.269 -5.979 1.00 0.00 N ATOM 1644 CA GLU A 107 11.071 5.217 -5.944 1.00 0.00 C ATOM 1645 C GLU A 107 10.441 3.851 -5.684 1.00 0.00 C ATOM 1646 O GLU A 107 10.931 2.839 -6.183 1.00 0.00 O ATOM 1647 CB GLU A 107 12.153 5.560 -4.916 1.00 0.00 C ATOM 1648 CG GLU A 107 11.590 5.733 -3.505 1.00 0.00 C ATOM 1649 CD GLU A 107 12.711 6.053 -2.519 1.00 0.00 C ATOM 1650 OE1 GLU A 107 13.023 7.256 -2.372 1.00 0.00 O ATOM 1651 OE2 GLU A 107 13.246 5.095 -1.921 1.00 0.00 O ATOM 0 H GLU A 107 10.028 6.845 -5.138 1.00 0.00 H new ATOM 0 HA GLU A 107 11.547 5.156 -6.923 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.905 4.771 -4.909 1.00 0.00 H new ATOM 0 HB3 GLU A 107 12.657 6.478 -5.217 1.00 0.00 H new ATOM 0 HG2 GLU A 107 10.851 6.534 -3.497 1.00 0.00 H new ATOM 0 HG3 GLU A 107 11.076 4.822 -3.198 1.00 0.00 H new ATOM 1658 N LEU A 108 9.355 3.814 -4.905 1.00 0.00 N ATOM 1659 CA LEU A 108 8.672 2.565 -4.609 1.00 0.00 C ATOM 1660 C LEU A 108 8.151 1.948 -5.900 1.00 0.00 C ATOM 1661 O LEU A 108 8.377 0.766 -6.151 1.00 0.00 O ATOM 1662 CB LEU A 108 7.527 2.812 -3.624 1.00 0.00 C ATOM 1663 CG LEU A 108 8.025 3.233 -2.237 1.00 0.00 C ATOM 1664 CD1 LEU A 108 6.814 3.548 -1.363 1.00 0.00 C ATOM 1665 CD2 LEU A 108 8.834 2.125 -1.566 1.00 0.00 C ATOM 0 H LEU A 108 8.936 4.637 -4.472 1.00 0.00 H new ATOM 0 HA LEU A 108 9.373 1.870 -4.148 1.00 0.00 H new ATOM 0 HB2 LEU A 108 6.871 3.587 -4.021 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.930 1.905 -3.532 1.00 0.00 H new ATOM 0 HG LEU A 108 8.670 4.103 -2.354 1.00 0.00 H new ATOM 0 HD11 LEU A 108 7.150 3.850 -0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.241 4.358 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.185 2.661 -1.279 1.00 0.00 H new ATOM 0 HD21 LEU A 108 9.169 2.462 -0.585 1.00 0.00 H new ATOM 0 HD22 LEU A 108 8.211 1.238 -1.451 1.00 0.00 H new ATOM 0 HD23 LEU A 108 9.700 1.883 -2.182 1.00 0.00 H new ATOM 1677 N LEU A 109 7.454 2.737 -6.724 1.00 0.00 N ATOM 1678 CA LEU A 109 6.970 2.262 -8.007 1.00 0.00 C ATOM 1679 C LEU A 109 8.140 1.950 -8.919 1.00 0.00 C ATOM 1680 O LEU A 109 8.244 0.812 -9.364 1.00 0.00 O ATOM 1681 CB LEU A 109 6.034 3.291 -8.640 1.00 0.00 C ATOM 1682 CG LEU A 109 4.686 3.338 -7.912 1.00 0.00 C ATOM 1683 CD1 LEU A 109 3.840 4.449 -8.520 1.00 0.00 C ATOM 1684 CD2 LEU A 109 3.931 2.015 -8.063 1.00 0.00 C ATOM 0 H LEU A 109 7.216 3.707 -6.517 1.00 0.00 H new ATOM 0 HA LEU A 109 6.401 1.345 -7.855 1.00 0.00 H new ATOM 0 HB2 LEU A 109 6.500 4.276 -8.611 1.00 0.00 H new ATOM 0 HB3 LEU A 109 5.875 3.044 -9.690 1.00 0.00 H new ATOM 0 HG LEU A 109 4.870 3.518 -6.853 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.877 4.493 -8.011 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.355 5.403 -8.406 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.681 4.247 -9.579 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.979 2.077 -7.537 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.749 1.818 -9.120 1.00 0.00 H new ATOM 0 HD23 LEU A 109 4.527 1.206 -7.641 1.00 0.00 H new ATOM 1696 N SER A 110 9.018 2.918 -9.205 1.00 0.00 N ATOM 1697 CA SER A 110 10.064 2.682 -10.193 1.00 0.00 C ATOM 1698 C SER A 110 10.822 1.378 -9.917 1.00 0.00 C ATOM 1699 O SER A 110 11.079 0.620 -10.849 1.00 0.00 O ATOM 1700 CB SER A 110 11.021 3.872 -10.260 1.00 0.00 C ATOM 1701 OG SER A 110 11.708 4.034 -9.039 1.00 0.00 O ATOM 0 H SER A 110 9.024 3.844 -8.778 1.00 0.00 H new ATOM 0 HA SER A 110 9.583 2.575 -11.165 1.00 0.00 H new ATOM 0 HB2 SER A 110 11.737 3.723 -11.068 1.00 0.00 H new ATOM 0 HB3 SER A 110 10.464 4.780 -10.492 1.00 0.00 H new ATOM 0 HG SER A 110 12.316 4.800 -9.105 1.00 0.00 H new ATOM 1707 N ASP A 111 11.181 1.105 -8.659 1.00 0.00 N ATOM 1708 CA ASP A 111 11.851 -0.146 -8.335 1.00 0.00 C ATOM 1709 C ASP A 111 10.900 -1.331 -8.507 1.00 0.00 C ATOM 1710 O ASP A 111 11.235 -2.285 -9.200 1.00 0.00 O ATOM 1711 CB ASP A 111 12.403 -0.103 -6.909 1.00 0.00 C ATOM 1712 CG ASP A 111 13.559 0.886 -6.751 1.00 0.00 C ATOM 1713 OD1 ASP A 111 14.274 1.120 -7.750 1.00 0.00 O ATOM 1714 OD2 ASP A 111 13.716 1.401 -5.622 1.00 0.00 O ATOM 0 H ASP A 111 11.020 1.725 -7.865 1.00 0.00 H new ATOM 0 HA ASP A 111 12.685 -0.276 -9.025 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.602 0.169 -6.222 1.00 0.00 H new ATOM 0 HB3 ASP A 111 12.742 -1.099 -6.625 1.00 0.00 H new ATOM 1719 N ALA A 112 9.720 -1.271 -7.882 1.00 0.00 N ATOM 1720 CA ALA A 112 8.733 -2.342 -7.917 1.00 0.00 C ATOM 1721 C ALA A 112 8.316 -2.741 -9.328 1.00 0.00 C ATOM 1722 O ALA A 112 8.027 -3.914 -9.551 1.00 0.00 O ATOM 1723 CB ALA A 112 7.489 -1.900 -7.158 1.00 0.00 C ATOM 0 H ALA A 112 9.425 -0.465 -7.332 1.00 0.00 H new ATOM 0 HA ALA A 112 9.203 -3.212 -7.458 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.746 -2.698 -7.181 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.753 -1.679 -6.124 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.076 -1.006 -7.626 1.00 0.00 H new ATOM 1729 N ILE A 113 8.271 -1.819 -10.294 1.00 0.00 N ATOM 1730 CA ILE A 113 7.972 -2.233 -11.655 1.00 0.00 C ATOM 1731 C ILE A 113 9.219 -2.653 -12.420 1.00 0.00 C ATOM 1732 O ILE A 113 9.156 -3.582 -13.221 1.00 0.00 O ATOM 1733 CB ILE A 113 7.216 -1.171 -12.453 1.00 0.00 C ATOM 1734 CG1 ILE A 113 6.644 -0.049 -11.580 1.00 0.00 C ATOM 1735 CG2 ILE A 113 6.147 -1.919 -13.239 1.00 0.00 C ATOM 1736 CD1 ILE A 113 5.488 0.723 -12.199 1.00 0.00 C ATOM 0 H ILE A 113 8.432 -0.820 -10.162 1.00 0.00 H new ATOM 0 HA ILE A 113 7.319 -3.099 -11.546 1.00 0.00 H new ATOM 0 HB ILE A 113 7.893 -0.642 -13.124 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.310 -0.479 -10.636 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.445 0.652 -11.345 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.570 -1.211 -13.833 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.622 -2.644 -13.900 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.484 -2.438 -12.547 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.153 1.494 -11.506 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.817 1.188 -13.128 1.00 0.00 H new ATOM 0 HD13 ILE A 113 4.664 0.040 -12.407 1.00 0.00 H new ATOM 1748 N ALA A 114 10.355 -1.990 -12.191 1.00 0.00 N ATOM 1749 CA ALA A 114 11.562 -2.355 -12.914 1.00 0.00 C ATOM 1750 C ALA A 114 12.087 -3.713 -12.442 1.00 0.00 C ATOM 1751 O ALA A 114 12.773 -4.409 -13.191 1.00 0.00 O ATOM 1752 CB ALA A 114 12.612 -1.261 -12.737 1.00 0.00 C ATOM 0 H ALA A 114 10.459 -1.221 -11.530 1.00 0.00 H new ATOM 0 HA ALA A 114 11.331 -2.448 -13.975 1.00 0.00 H new ATOM 0 HB1 ALA A 114 13.517 -1.534 -13.279 1.00 0.00 H new ATOM 0 HB2 ALA A 114 12.226 -0.319 -13.127 1.00 0.00 H new ATOM 0 HB3 ALA A 114 12.844 -1.147 -11.678 1.00 0.00 H new ATOM 1758 N LYS A 115 11.764 -4.090 -11.200 1.00 0.00 N ATOM 1759 CA LYS A 115 12.137 -5.376 -10.624 1.00 0.00 C ATOM 1760 C LYS A 115 11.187 -6.474 -11.103 1.00 0.00 C ATOM 1761 O LYS A 115 11.522 -7.655 -11.041 1.00 0.00 O ATOM 1762 CB LYS A 115 12.147 -5.235 -9.092 1.00 0.00 C ATOM 1763 CG LYS A 115 10.742 -5.134 -8.492 1.00 0.00 C ATOM 1764 CD LYS A 115 10.105 -6.493 -8.200 1.00 0.00 C ATOM 1765 CE LYS A 115 8.639 -6.323 -7.805 1.00 0.00 C ATOM 1766 NZ LYS A 115 7.986 -7.630 -7.595 1.00 0.00 N ATOM 0 H LYS A 115 11.229 -3.499 -10.563 1.00 0.00 H new ATOM 0 HA LYS A 115 13.134 -5.669 -10.953 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.661 -6.092 -8.657 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.718 -4.348 -8.818 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.791 -4.558 -7.568 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.101 -4.581 -9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.179 -7.132 -9.080 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.649 -6.991 -7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.572 -5.730 -6.893 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.112 -5.771 -8.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.983 -7.564 -7.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 8.454 -8.350 -8.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 8.060 -7.898 -6.593 1.00 0.00 H new ATOM 1780 N SER A 116 10.000 -6.080 -11.576 1.00 0.00 N ATOM 1781 CA SER A 116 8.913 -6.992 -11.905 1.00 0.00 C ATOM 1782 C SER A 116 9.101 -7.727 -13.233 1.00 0.00 C ATOM 1783 O SER A 116 9.852 -7.304 -14.108 1.00 0.00 O ATOM 1784 CB SER A 116 7.591 -6.225 -11.950 1.00 0.00 C ATOM 1785 OG SER A 116 7.097 -6.057 -10.641 1.00 0.00 O ATOM 0 H SER A 116 9.769 -5.100 -11.742 1.00 0.00 H new ATOM 0 HA SER A 116 8.908 -7.748 -11.120 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.739 -5.253 -12.421 1.00 0.00 H new ATOM 0 HB3 SER A 116 6.865 -6.767 -12.557 1.00 0.00 H new ATOM 0 HG SER A 116 7.180 -5.117 -10.378 1.00 0.00 H new ATOM 1791 N ASN A 117 8.386 -8.848 -13.352 1.00 0.00 N ATOM 1792 CA ASN A 117 8.239 -9.613 -14.580 1.00 0.00 C ATOM 1793 C ASN A 117 7.006 -9.083 -15.319 1.00 0.00 C ATOM 1794 O ASN A 117 6.306 -8.218 -14.798 1.00 0.00 O ATOM 1795 CB ASN A 117 8.117 -11.096 -14.211 1.00 0.00 C ATOM 1796 CG ASN A 117 8.028 -11.995 -15.440 1.00 0.00 C ATOM 1797 OD1 ASN A 117 6.953 -12.476 -15.786 1.00 0.00 O ATOM 1798 ND2 ASN A 117 9.159 -12.221 -16.101 1.00 0.00 N ATOM 0 H ASN A 117 7.879 -9.257 -12.567 1.00 0.00 H new ATOM 0 HA ASN A 117 9.099 -9.508 -15.242 1.00 0.00 H new ATOM 0 HB2 ASN A 117 8.978 -11.390 -13.610 1.00 0.00 H new ATOM 0 HB3 ASN A 117 7.232 -11.242 -13.592 1.00 0.00 H new ATOM 0 HD21 ASN A 117 9.155 -12.814 -16.931 1.00 0.00 H new ATOM 0 HD22 ASN A 117 10.031 -11.801 -15.779 1.00 0.00 H new ATOM 1805 N GLN A 118 6.725 -9.585 -16.524 1.00 0.00 N ATOM 1806 CA GLN A 118 5.601 -9.101 -17.320 1.00 0.00 C ATOM 1807 C GLN A 118 4.276 -9.198 -16.562 1.00 0.00 C ATOM 1808 O GLN A 118 3.453 -8.286 -16.641 1.00 0.00 O ATOM 1809 CB GLN A 118 5.520 -9.905 -18.620 1.00 0.00 C ATOM 1810 CG GLN A 118 6.780 -9.706 -19.469 1.00 0.00 C ATOM 1811 CD GLN A 118 6.709 -10.476 -20.785 1.00 0.00 C ATOM 1812 OE1 GLN A 118 5.737 -11.173 -21.072 1.00 0.00 O ATOM 1813 NE2 GLN A 118 7.749 -10.355 -21.607 1.00 0.00 N ATOM 0 H GLN A 118 7.264 -10.328 -16.968 1.00 0.00 H new ATOM 0 HA GLN A 118 5.772 -8.047 -17.539 1.00 0.00 H new ATOM 0 HB2 GLN A 118 5.396 -10.963 -18.390 1.00 0.00 H new ATOM 0 HB3 GLN A 118 4.642 -9.597 -19.188 1.00 0.00 H new ATOM 0 HG2 GLN A 118 6.913 -8.644 -19.677 1.00 0.00 H new ATOM 0 HG3 GLN A 118 7.653 -10.033 -18.904 1.00 0.00 H new ATOM 0 HE21 GLN A 118 8.542 -9.770 -21.343 1.00 0.00 H new ATOM 0 HE22 GLN A 118 7.753 -10.847 -22.500 1.00 0.00 H new ATOM 1822 N ASP A 119 4.053 -10.290 -15.825 1.00 0.00 N ATOM 1823 CA ASP A 119 2.813 -10.466 -15.080 1.00 0.00 C ATOM 1824 C ASP A 119 2.745 -9.486 -13.905 1.00 0.00 C ATOM 1825 O ASP A 119 1.677 -8.970 -13.575 1.00 0.00 O ATOM 1826 CB ASP A 119 2.728 -11.912 -14.594 1.00 0.00 C ATOM 1827 CG ASP A 119 1.391 -12.207 -13.920 1.00 0.00 C ATOM 1828 OD1 ASP A 119 0.360 -12.134 -14.623 1.00 0.00 O ATOM 1829 OD2 ASP A 119 1.407 -12.502 -12.703 1.00 0.00 O ATOM 0 H ASP A 119 4.715 -11.060 -15.731 1.00 0.00 H new ATOM 0 HA ASP A 119 1.963 -10.256 -15.730 1.00 0.00 H new ATOM 0 HB2 ASP A 119 2.866 -12.588 -15.438 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.539 -12.108 -13.893 1.00 0.00 H new ATOM 1834 N HIS A 120 3.887 -9.224 -13.266 1.00 0.00 N ATOM 1835 CA HIS A 120 3.922 -8.336 -12.118 1.00 0.00 C ATOM 1836 C HIS A 120 3.800 -6.878 -12.555 1.00 0.00 C ATOM 1837 O HIS A 120 3.067 -6.131 -11.917 1.00 0.00 O ATOM 1838 CB HIS A 120 5.179 -8.594 -11.293 1.00 0.00 C ATOM 1839 CG HIS A 120 5.197 -9.954 -10.650 1.00 0.00 C ATOM 1840 ND1 HIS A 120 4.081 -10.625 -10.143 1.00 0.00 N ATOM 1841 CD2 HIS A 120 6.307 -10.730 -10.466 1.00 0.00 C ATOM 1842 CE1 HIS A 120 4.552 -11.788 -9.658 1.00 0.00 C ATOM 1843 NE2 HIS A 120 5.879 -11.878 -9.843 1.00 0.00 N ATOM 0 H HIS A 120 4.792 -9.615 -13.528 1.00 0.00 H new ATOM 0 HA HIS A 120 3.064 -8.543 -11.479 1.00 0.00 H new ATOM 0 HB2 HIS A 120 6.054 -8.491 -11.934 1.00 0.00 H new ATOM 0 HB3 HIS A 120 5.260 -7.832 -10.518 1.00 0.00 H new ATOM 0 HD2 HIS A 120 7.320 -10.489 -10.753 1.00 0.00 H new ATOM 0 HE1 HIS A 120 3.946 -12.546 -9.184 1.00 0.00 H new ATOM 0 HE2 HIS A 120 6.468 -12.664 -9.568 1.00 0.00 H new ATOM 1851 N LYS A 121 4.489 -6.448 -13.620 1.00 0.00 N ATOM 1852 CA LYS A 121 4.316 -5.082 -14.089 1.00 0.00 C ATOM 1853 C LYS A 121 2.895 -4.886 -14.588 1.00 0.00 C ATOM 1854 O LYS A 121 2.344 -3.800 -14.442 1.00 0.00 O ATOM 1855 CB LYS A 121 5.358 -4.720 -15.160 1.00 0.00 C ATOM 1856 CG LYS A 121 5.073 -5.346 -16.528 1.00 0.00 C ATOM 1857 CD LYS A 121 4.133 -4.477 -17.375 1.00 0.00 C ATOM 1858 CE LYS A 121 3.429 -5.297 -18.459 1.00 0.00 C ATOM 1859 NZ LYS A 121 4.376 -5.773 -19.487 1.00 0.00 N ATOM 0 H LYS A 121 5.150 -7.012 -14.154 1.00 0.00 H new ATOM 0 HA LYS A 121 4.481 -4.400 -13.255 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.396 -3.636 -15.267 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.343 -5.042 -14.821 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.012 -5.491 -17.063 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.629 -6.332 -16.390 1.00 0.00 H new ATOM 0 HD2 LYS A 121 3.388 -4.011 -16.730 1.00 0.00 H new ATOM 0 HD3 LYS A 121 4.702 -3.671 -17.840 1.00 0.00 H new ATOM 0 HE2 LYS A 121 2.929 -6.151 -18.002 1.00 0.00 H new ATOM 0 HE3 LYS A 121 2.656 -4.690 -18.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 3.862 -6.324 -20.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 4.835 -4.957 -19.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 5.099 -6.373 -19.042 1.00 0.00 H new ATOM 1873 N GLU A 122 2.293 -5.927 -15.173 1.00 0.00 N ATOM 1874 CA GLU A 122 0.920 -5.818 -15.627 1.00 0.00 C ATOM 1875 C GLU A 122 -0.005 -5.570 -14.439 1.00 0.00 C ATOM 1876 O GLU A 122 -0.864 -4.691 -14.502 1.00 0.00 O ATOM 1877 CB GLU A 122 0.531 -7.089 -16.379 1.00 0.00 C ATOM 1878 CG GLU A 122 -0.844 -6.890 -17.007 1.00 0.00 C ATOM 1879 CD GLU A 122 -1.278 -8.131 -17.786 1.00 0.00 C ATOM 1880 OE1 GLU A 122 -0.894 -8.233 -18.974 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -1.989 -8.969 -17.187 1.00 0.00 O ATOM 0 H GLU A 122 2.731 -6.833 -15.337 1.00 0.00 H new ATOM 0 HA GLU A 122 0.823 -4.972 -16.307 1.00 0.00 H new ATOM 0 HB2 GLU A 122 1.269 -7.312 -17.150 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.515 -7.940 -15.698 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -1.575 -6.672 -16.228 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -0.821 -6.028 -17.674 1.00 0.00 H new ATOM 1888 N LYS A 123 0.160 -6.334 -13.353 1.00 0.00 N ATOM 1889 CA LYS A 123 -0.644 -6.116 -12.160 1.00 0.00 C ATOM 1890 C LYS A 123 -0.376 -4.744 -11.541 1.00 0.00 C ATOM 1891 O LYS A 123 -1.304 -4.103 -11.051 1.00 0.00 O ATOM 1892 CB LYS A 123 -0.361 -7.212 -11.132 1.00 0.00 C ATOM 1893 CG LYS A 123 -1.014 -8.527 -11.569 1.00 0.00 C ATOM 1894 CD LYS A 123 -0.990 -9.563 -10.442 1.00 0.00 C ATOM 1895 CE LYS A 123 0.429 -9.815 -9.924 1.00 0.00 C ATOM 1896 NZ LYS A 123 1.293 -10.363 -10.988 1.00 0.00 N ATOM 0 H LYS A 123 0.834 -7.096 -13.282 1.00 0.00 H new ATOM 0 HA LYS A 123 -1.693 -6.151 -12.456 1.00 0.00 H new ATOM 0 HB2 LYS A 123 0.715 -7.350 -11.023 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -0.744 -6.914 -10.156 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -2.044 -8.340 -11.872 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -0.492 -8.923 -12.440 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -1.620 -9.220 -9.621 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -1.416 -10.500 -10.801 1.00 0.00 H new ATOM 0 HE2 LYS A 123 0.854 -8.883 -9.550 1.00 0.00 H new ATOM 0 HE3 LYS A 123 0.395 -10.510 -9.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 2.239 -10.556 -10.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 0.880 -11.246 -11.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 1.370 -9.673 -11.763 1.00 0.00 H new ATOM 1910 N ILE A 124 0.878 -4.285 -11.558 1.00 0.00 N ATOM 1911 CA ILE A 124 1.227 -2.981 -11.016 1.00 0.00 C ATOM 1912 C ILE A 124 0.626 -1.884 -11.895 1.00 0.00 C ATOM 1913 O ILE A 124 0.209 -0.849 -11.385 1.00 0.00 O ATOM 1914 CB ILE A 124 2.753 -2.870 -10.896 1.00 0.00 C ATOM 1915 CG1 ILE A 124 3.236 -3.834 -9.805 1.00 0.00 C ATOM 1916 CG2 ILE A 124 3.191 -1.445 -10.536 1.00 0.00 C ATOM 1917 CD1 ILE A 124 4.755 -3.975 -9.824 1.00 0.00 C ATOM 0 H ILE A 124 1.667 -4.804 -11.944 1.00 0.00 H new ATOM 0 HA ILE A 124 0.811 -2.858 -10.016 1.00 0.00 H new ATOM 0 HB ILE A 124 3.191 -3.124 -11.861 1.00 0.00 H new ATOM 0 HG12 ILE A 124 2.914 -3.472 -8.828 1.00 0.00 H new ATOM 0 HG13 ILE A 124 2.776 -4.811 -9.950 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.278 -1.407 -10.460 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.857 -0.755 -11.311 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.750 -1.159 -9.581 1.00 0.00 H new ATOM 0 HD11 ILE A 124 5.066 -4.665 -9.039 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.073 -4.361 -10.793 1.00 0.00 H new ATOM 0 HD13 ILE A 124 5.213 -3.001 -9.653 1.00 0.00 H new ATOM 1929 N ARG A 125 0.574 -2.103 -13.212 1.00 0.00 N ATOM 1930 CA ARG A 125 -0.039 -1.148 -14.123 1.00 0.00 C ATOM 1931 C ARG A 125 -1.538 -1.043 -13.850 1.00 0.00 C ATOM 1932 O ARG A 125 -2.092 0.052 -13.887 1.00 0.00 O ATOM 1933 CB ARG A 125 0.222 -1.578 -15.568 1.00 0.00 C ATOM 1934 CG ARG A 125 -0.222 -0.474 -16.529 1.00 0.00 C ATOM 1935 CD ARG A 125 -0.081 -0.934 -17.980 1.00 0.00 C ATOM 1936 NE ARG A 125 -1.043 -2.000 -18.289 1.00 0.00 N ATOM 1937 CZ ARG A 125 -1.890 -1.986 -19.324 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -1.888 -0.988 -20.207 1.00 0.00 N ATOM 1939 NH2 ARG A 125 -2.755 -2.983 -19.482 1.00 0.00 N ATOM 0 H ARG A 125 0.951 -2.935 -13.666 1.00 0.00 H new ATOM 0 HA ARG A 125 0.402 -0.164 -13.965 1.00 0.00 H new ATOM 0 HB2 ARG A 125 1.282 -1.789 -15.708 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.318 -2.500 -15.785 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -1.258 -0.204 -16.327 1.00 0.00 H new ATOM 0 HG3 ARG A 125 0.379 0.421 -16.366 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -0.241 -0.089 -18.650 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.933 -1.292 -18.155 1.00 0.00 H new ATOM 0 HE ARG A 125 -1.067 -2.810 -17.669 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -1.232 -0.214 -20.101 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -2.543 -0.998 -20.989 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -2.771 -3.755 -18.815 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -3.403 -2.976 -20.270 1.00 0.00 H new ATOM 1953 N MET A 126 -2.191 -2.176 -13.576 1.00 0.00 N ATOM 1954 CA MET A 126 -3.605 -2.184 -13.218 1.00 0.00 C ATOM 1955 C MET A 126 -3.816 -1.405 -11.919 1.00 0.00 C ATOM 1956 O MET A 126 -4.760 -0.626 -11.806 1.00 0.00 O ATOM 1957 CB MET A 126 -4.072 -3.633 -13.068 1.00 0.00 C ATOM 1958 CG MET A 126 -5.498 -3.725 -12.522 1.00 0.00 C ATOM 1959 SD MET A 126 -6.069 -5.429 -12.306 1.00 0.00 S ATOM 1960 CE MET A 126 -7.613 -5.120 -11.409 1.00 0.00 C ATOM 0 H MET A 126 -1.758 -3.099 -13.596 1.00 0.00 H new ATOM 0 HA MET A 126 -4.191 -1.702 -14.000 1.00 0.00 H new ATOM 0 HB2 MET A 126 -4.022 -4.131 -14.036 1.00 0.00 H new ATOM 0 HB3 MET A 126 -3.394 -4.165 -12.401 1.00 0.00 H new ATOM 0 HG2 MET A 126 -5.548 -3.208 -11.564 1.00 0.00 H new ATOM 0 HG3 MET A 126 -6.174 -3.205 -13.200 1.00 0.00 H new ATOM 0 HE1 MET A 126 -7.956 -6.045 -10.946 1.00 0.00 H new ATOM 0 HE2 MET A 126 -7.441 -4.370 -10.637 1.00 0.00 H new ATOM 0 HE3 MET A 126 -8.371 -4.758 -12.104 1.00 0.00 H new ATOM 1970 N LEU A 127 -2.931 -1.620 -10.941 1.00 0.00 N ATOM 1971 CA LEU A 127 -2.981 -0.920 -9.669 1.00 0.00 C ATOM 1972 C LEU A 127 -2.899 0.587 -9.906 1.00 0.00 C ATOM 1973 O LEU A 127 -3.655 1.345 -9.302 1.00 0.00 O ATOM 1974 CB LEU A 127 -1.840 -1.465 -8.797 1.00 0.00 C ATOM 1975 CG LEU A 127 -1.878 -1.043 -7.325 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -0.961 -1.986 -6.546 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -1.372 0.385 -7.115 1.00 0.00 C ATOM 0 H LEU A 127 -2.162 -2.286 -11.016 1.00 0.00 H new ATOM 0 HA LEU A 127 -3.922 -1.090 -9.145 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -1.857 -2.554 -8.846 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.892 -1.141 -9.226 1.00 0.00 H new ATOM 0 HG LEU A 127 -2.913 -1.088 -6.985 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -0.967 -1.710 -5.491 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.316 -3.011 -6.655 1.00 0.00 H new ATOM 0 HD13 LEU A 127 0.054 -1.910 -6.935 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.419 0.636 -6.055 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.341 0.460 -7.460 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -1.995 1.078 -7.680 1.00 0.00 H new ATOM 1989 N LEU A 128 -1.987 1.028 -10.782 1.00 0.00 N ATOM 1990 CA LEU A 128 -1.812 2.443 -11.075 1.00 0.00 C ATOM 1991 C LEU A 128 -2.972 3.012 -11.886 1.00 0.00 C ATOM 1992 O LEU A 128 -3.304 4.185 -11.726 1.00 0.00 O ATOM 1993 CB LEU A 128 -0.497 2.650 -11.827 1.00 0.00 C ATOM 1994 CG LEU A 128 0.717 2.348 -10.946 1.00 0.00 C ATOM 1995 CD1 LEU A 128 1.982 2.487 -11.789 1.00 0.00 C ATOM 1996 CD2 LEU A 128 0.804 3.317 -9.772 1.00 0.00 C ATOM 0 H LEU A 128 -1.358 0.414 -11.300 1.00 0.00 H new ATOM 0 HA LEU A 128 -1.788 2.978 -10.126 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -0.476 2.007 -12.707 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.440 3.679 -12.183 1.00 0.00 H new ATOM 0 HG LEU A 128 0.616 1.336 -10.554 1.00 0.00 H new ATOM 0 HD11 LEU A 128 2.855 2.274 -11.172 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.944 1.783 -12.620 1.00 0.00 H new ATOM 0 HD13 LEU A 128 2.051 3.503 -12.177 1.00 0.00 H new ATOM 0 HD21 LEU A 128 1.677 3.076 -9.165 1.00 0.00 H new ATOM 0 HD22 LEU A 128 0.893 4.336 -10.147 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -0.096 3.232 -9.163 1.00 0.00 H new ATOM 2008 N ASP A 129 -3.594 2.208 -12.752 1.00 0.00 N ATOM 2009 CA ASP A 129 -4.748 2.672 -13.508 1.00 0.00 C ATOM 2010 C ASP A 129 -5.894 2.970 -12.546 1.00 0.00 C ATOM 2011 O ASP A 129 -6.575 3.988 -12.674 1.00 0.00 O ATOM 2012 CB ASP A 129 -5.148 1.606 -14.529 1.00 0.00 C ATOM 2013 CG ASP A 129 -6.349 2.052 -15.357 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -6.155 2.939 -16.216 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -7.451 1.503 -15.124 1.00 0.00 O ATOM 0 H ASP A 129 -3.318 1.245 -12.942 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.503 3.588 -14.046 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -4.306 1.398 -15.189 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -5.385 0.676 -14.012 1.00 0.00 H new ATOM 2512 N PRO B 160 -6.796 -14.862 1.988 1.00 0.00 N ATOM 2513 CA PRO B 160 -7.966 -15.422 1.326 1.00 0.00 C ATOM 2514 C PRO B 160 -8.036 -14.968 -0.132 1.00 0.00 C ATOM 2515 O PRO B 160 -7.921 -15.789 -1.041 1.00 0.00 O ATOM 2516 CB PRO B 160 -9.162 -14.897 2.130 1.00 0.00 C ATOM 2517 CG PRO B 160 -8.658 -13.573 2.715 1.00 0.00 C ATOM 2518 CD PRO B 160 -7.194 -13.880 2.975 1.00 0.00 C ATOM 0 HA PRO B 160 -7.942 -16.511 1.299 1.00 0.00 H new ATOM 0 HB2 PRO B 160 -10.035 -14.747 1.495 1.00 0.00 H new ATOM 0 HB3 PRO B 160 -9.454 -15.595 2.914 1.00 0.00 H new ATOM 0 HG2 PRO B 160 -8.784 -12.745 2.018 1.00 0.00 H new ATOM 0 HG3 PRO B 160 -9.187 -13.303 3.629 1.00 0.00 H new ATOM 0 HD2 PRO B 160 -6.588 -12.978 2.890 1.00 0.00 H new ATOM 0 HD3 PRO B 160 -7.052 -14.266 3.985 1.00 0.00 H new ATOM 2526 N SER B 161 -8.223 -13.661 -0.345 1.00 0.00 N ATOM 2527 CA SER B 161 -8.213 -13.037 -1.660 1.00 0.00 C ATOM 2528 C SER B 161 -8.170 -11.520 -1.479 1.00 0.00 C ATOM 2529 O SER B 161 -8.756 -10.999 -0.530 1.00 0.00 O ATOM 2530 CB SER B 161 -9.481 -13.423 -2.425 1.00 0.00 C ATOM 2531 OG SER B 161 -9.466 -12.846 -3.714 1.00 0.00 O ATOM 0 H SER B 161 -8.389 -12.999 0.413 1.00 0.00 H new ATOM 0 HA SER B 161 -7.342 -13.373 -2.223 1.00 0.00 H new ATOM 0 HB2 SER B 161 -9.551 -14.508 -2.505 1.00 0.00 H new ATOM 0 HB3 SER B 161 -10.362 -13.086 -1.878 1.00 0.00 H new ATOM 0 HG SER B 161 -10.281 -13.100 -4.196 1.00 0.00 H new ATOM 2537 N TYR B 162 -7.486 -10.803 -2.377 1.00 0.00 N ATOM 2538 CA TYR B 162 -7.479 -9.347 -2.356 1.00 0.00 C ATOM 2539 C TYR B 162 -7.117 -8.769 -3.728 1.00 0.00 C ATOM 2540 O TYR B 162 -6.211 -9.264 -4.399 1.00 0.00 O ATOM 2541 CB TYR B 162 -6.482 -8.827 -1.319 1.00 0.00 C ATOM 2542 CG TYR B 162 -6.370 -7.323 -1.396 1.00 0.00 C ATOM 2543 CD1 TYR B 162 -5.466 -6.750 -2.299 1.00 0.00 C ATOM 2544 CD2 TYR B 162 -7.176 -6.508 -0.586 1.00 0.00 C ATOM 2545 CE1 TYR B 162 -5.398 -5.360 -2.437 1.00 0.00 C ATOM 2546 CE2 TYR B 162 -7.113 -5.114 -0.717 1.00 0.00 C ATOM 2547 CZ TYR B 162 -6.237 -4.536 -1.662 1.00 0.00 C ATOM 2548 OH TYR B 162 -6.206 -3.184 -1.825 1.00 0.00 O ATOM 0 H TYR B 162 -6.930 -11.214 -3.127 1.00 0.00 H new ATOM 0 HA TYR B 162 -8.486 -9.025 -2.092 1.00 0.00 H new ATOM 0 HB2 TYR B 162 -6.801 -9.122 -0.320 1.00 0.00 H new ATOM 0 HB3 TYR B 162 -5.505 -9.279 -1.488 1.00 0.00 H new ATOM 0 HD1 TYR B 162 -4.820 -7.383 -2.890 1.00 0.00 H new ATOM 0 HD2 TYR B 162 -7.843 -6.954 0.137 1.00 0.00 H new ATOM 0 HE1 TYR B 162 -4.703 -4.919 -3.137 1.00 0.00 H new ATOM 0 HE2 TYR B 162 -7.733 -4.483 -0.097 1.00 0.00 H new ATOM 0 HH TYR B 162 -5.327 -2.916 -2.166 1.00 0.00 H new ATOM 2558 N SER B 163 -7.838 -7.716 -4.128 1.00 0.00 N ATOM 2559 CA SER B 163 -7.655 -7.050 -5.408 1.00 0.00 C ATOM 2560 C SER B 163 -7.662 -5.534 -5.224 1.00 0.00 C ATOM 2561 O SER B 163 -8.390 -5.016 -4.376 1.00 0.00 O ATOM 2562 CB SER B 163 -8.775 -7.468 -6.362 1.00 0.00 C ATOM 2563 OG SER B 163 -8.817 -6.612 -7.486 1.00 0.00 O ATOM 0 H SER B 163 -8.575 -7.301 -3.558 1.00 0.00 H new ATOM 0 HA SER B 163 -6.693 -7.342 -5.828 1.00 0.00 H new ATOM 0 HB2 SER B 163 -8.618 -8.496 -6.687 1.00 0.00 H new ATOM 0 HB3 SER B 163 -9.732 -7.441 -5.842 1.00 0.00 H new ATOM 0 HG SER B 163 -9.630 -6.791 -8.004 1.00 0.00 H new ATOM 2569 N PRO B 164 -6.859 -4.803 -6.011 1.00 0.00 N ATOM 2570 CA PRO B 164 -6.790 -3.352 -5.949 1.00 0.00 C ATOM 2571 C PRO B 164 -8.098 -2.727 -6.437 1.00 0.00 C ATOM 2572 O PRO B 164 -8.231 -1.503 -6.456 1.00 0.00 O ATOM 2573 CB PRO B 164 -5.601 -2.965 -6.830 1.00 0.00 C ATOM 2574 CG PRO B 164 -5.553 -4.094 -7.854 1.00 0.00 C ATOM 2575 CD PRO B 164 -5.960 -5.315 -7.030 1.00 0.00 C ATOM 0 HA PRO B 164 -6.654 -2.987 -4.931 1.00 0.00 H new ATOM 0 HB2 PRO B 164 -5.749 -1.995 -7.305 1.00 0.00 H new ATOM 0 HB3 PRO B 164 -4.677 -2.901 -6.256 1.00 0.00 H new ATOM 0 HG2 PRO B 164 -6.239 -3.918 -8.683 1.00 0.00 H new ATOM 0 HG3 PRO B 164 -4.558 -4.209 -8.283 1.00 0.00 H new ATOM 0 HD2 PRO B 164 -6.453 -6.063 -7.651 1.00 0.00 H new ATOM 0 HD3 PRO B 164 -5.090 -5.796 -6.582 1.00 0.00 H new ATOM 2583 N THR B 165 -9.069 -3.558 -6.833 1.00 0.00 N ATOM 2584 CA THR B 165 -10.367 -3.085 -7.291 1.00 0.00 C ATOM 2585 C THR B 165 -11.181 -2.528 -6.119 1.00 0.00 C ATOM 2586 O THR B 165 -11.990 -1.622 -6.321 1.00 0.00 O ATOM 2587 CB THR B 165 -11.104 -4.238 -7.973 1.00 0.00 C ATOM 2588 OG1 THR B 165 -10.290 -4.787 -8.988 1.00 0.00 O ATOM 2589 CG2 THR B 165 -12.409 -3.760 -8.612 1.00 0.00 C ATOM 0 H THR B 165 -8.971 -4.573 -6.843 1.00 0.00 H new ATOM 0 HA THR B 165 -10.229 -2.276 -8.008 1.00 0.00 H new ATOM 0 HB THR B 165 -11.330 -4.985 -7.212 1.00 0.00 H new ATOM 0 HG1 THR B 165 -10.763 -5.527 -9.423 1.00 0.00 H new ATOM 0 HG21 THR B 165 -12.910 -4.602 -9.089 1.00 0.00 H new ATOM 0 HG22 THR B 165 -13.058 -3.339 -7.844 1.00 0.00 H new ATOM 0 HG23 THR B 165 -12.190 -2.997 -9.359 1.00 0.00 H new