USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1005 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 LYS NZ :NH3+ -134:sc= 2.25 (180deg=0.847) USER MOD Set 1.2: A 136 THR OG1 : rot 75:sc= 2.13 USER MOD Set 2.1: A 46 THR OG1 : rot 83:sc= 1.25 USER MOD Set 2.2: A 81 TYR OH : rot 180:sc= -0.0038 USER MOD Set 3.1: A 74 ASN : amide:sc= -0.87 X(o=-0.58,f=-0.39) USER MOD Set 3.2: A 77 SER OG : rot 180:sc= 0.285 USER MOD Set 4.1: A 70 TYR OH : rot 14:sc= 1.03 USER MOD Set 4.2: A 105 GLN : amide:sc= 2.09 K(o=3.1,f=1.9) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -96:sc= 0.731 USER MOD Single : A 13 THR OG1 : rot 72:sc= 1.28 USER MOD Single : A 16 MET CE :methyl 153:sc= -0.0361 (180deg=-0.255) USER MOD Single : A 21 SER OG : rot 100:sc= 1.28 USER MOD Single : A 23 HIS : no HD1:sc= -0.0675 X(o=-0.068,f=-0.21) USER MOD Single : A 28 GLN : amide:sc= 0.871 K(o=0.87,f=0) USER MOD Single : A 31 LYS NZ :NH3+ -171:sc= 1.25 (180deg=0.839) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.449 X(o=-0.45,f=-0.11) USER MOD Single : A 42 SER OG : rot 62:sc= 1.22 USER MOD Single : A 44 SER OG : rot 66:sc= 0.581 USER MOD Single : A 47 LYS NZ :NH3+ 169:sc= 1.29 (180deg=1.2) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot -136:sc= 1.99 USER MOD Single : A 55 THR OG1 : rot -112:sc= 0.353 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 2.16 K(o=2.2,f=-0.063) USER MOD Single : A 67 SER OG : rot -166:sc= 0.739 USER MOD Single : A 68 LYS NZ :NH3+ -174:sc= 0.99 (180deg=0.847) USER MOD Single : A 72 LYS NZ :NH3+ 171:sc= 1.24 (180deg=1.15) USER MOD Single : A 75 GLN : amide:sc= 0.291 K(o=0.29,f=-1.2) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot -72:sc= 1.29 USER MOD Single : A 89 SER OG : rot 74:sc= 1.2 USER MOD Single : A 90 LYS NZ :NH3+ 157:sc= 1.24 (180deg=0.904) USER MOD Single : A 95 SER OG : rot 67:sc= 1.21 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ -156:sc= 2.52 (180deg=2.12) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 SER OG : rot 81:sc= 1.26 USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N ASN A 4 5.251 7.776 5.433 1.00 0.00 N ATOM 53 CA ASN A 4 5.874 9.011 5.909 1.00 0.00 C ATOM 54 C ASN A 4 6.908 8.795 7.015 1.00 0.00 C ATOM 55 O ASN A 4 7.908 9.504 7.029 1.00 0.00 O ATOM 56 CB ASN A 4 4.792 9.993 6.382 1.00 0.00 C ATOM 57 CG ASN A 4 5.408 11.273 6.946 1.00 0.00 C ATOM 58 OD1 ASN A 4 5.478 11.459 8.157 1.00 0.00 O ATOM 59 ND2 ASN A 4 5.864 12.177 6.092 1.00 0.00 N ATOM 0 HA ASN A 4 6.419 9.427 5.062 1.00 0.00 H new ATOM 0 HB2 ASN A 4 4.134 10.241 5.549 1.00 0.00 H new ATOM 0 HB3 ASN A 4 4.175 9.517 7.145 1.00 0.00 H new ATOM 0 HD21 ASN A 4 6.280 13.041 6.438 1.00 0.00 H new ATOM 0 HD22 ASN A 4 5.799 12.009 5.088 1.00 0.00 H new ATOM 66 N HIS A 5 6.705 7.819 7.906 1.00 0.00 N ATOM 67 CA HIS A 5 7.652 7.527 8.980 1.00 0.00 C ATOM 68 C HIS A 5 9.033 7.163 8.419 1.00 0.00 C ATOM 69 O HIS A 5 10.047 7.682 8.890 1.00 0.00 O ATOM 70 CB HIS A 5 7.094 6.393 9.856 1.00 0.00 C ATOM 71 CG HIS A 5 8.000 6.026 11.006 1.00 0.00 C ATOM 72 ND1 HIS A 5 8.105 6.687 12.211 1.00 0.00 N ATOM 73 CD2 HIS A 5 8.886 4.981 11.042 1.00 0.00 C ATOM 74 CE1 HIS A 5 9.030 6.054 12.954 1.00 0.00 C ATOM 75 NE2 HIS A 5 9.538 5.003 12.283 1.00 0.00 N ATOM 0 H HIS A 5 5.884 7.214 7.901 1.00 0.00 H new ATOM 0 HA HIS A 5 7.780 8.420 9.592 1.00 0.00 H new ATOM 0 HB2 HIS A 5 6.122 6.692 10.249 1.00 0.00 H new ATOM 0 HB3 HIS A 5 6.930 5.512 9.236 1.00 0.00 H new ATOM 0 HD2 HIS A 5 9.053 4.265 10.251 1.00 0.00 H new ATOM 0 HE1 HIS A 5 9.325 6.348 13.951 1.00 0.00 H new ATOM 0 HE2 HIS A 5 10.253 4.354 12.611 1.00 0.00 H new ATOM 83 N GLU A 6 9.085 6.299 7.398 1.00 0.00 N ATOM 84 CA GLU A 6 10.350 5.934 6.771 1.00 0.00 C ATOM 85 C GLU A 6 10.894 7.140 6.011 1.00 0.00 C ATOM 86 O GLU A 6 12.078 7.446 6.084 1.00 0.00 O ATOM 87 CB GLU A 6 10.179 4.771 5.785 1.00 0.00 C ATOM 88 CG GLU A 6 9.809 3.433 6.436 1.00 0.00 C ATOM 89 CD GLU A 6 9.707 2.339 5.365 1.00 0.00 C ATOM 90 OE1 GLU A 6 8.709 2.319 4.613 1.00 0.00 O ATOM 91 OE2 GLU A 6 10.646 1.521 5.217 1.00 0.00 O ATOM 0 H GLU A 6 8.267 5.844 6.994 1.00 0.00 H new ATOM 0 HA GLU A 6 11.038 5.622 7.557 1.00 0.00 H new ATOM 0 HB2 GLU A 6 9.407 5.035 5.063 1.00 0.00 H new ATOM 0 HB3 GLU A 6 11.107 4.645 5.228 1.00 0.00 H new ATOM 0 HG2 GLU A 6 10.560 3.159 7.177 1.00 0.00 H new ATOM 0 HG3 GLU A 6 8.860 3.526 6.964 1.00 0.00 H new ATOM 98 N ILE A 7 10.038 7.843 5.274 1.00 0.00 N ATOM 99 CA ILE A 7 10.505 8.891 4.381 1.00 0.00 C ATOM 100 C ILE A 7 11.111 10.043 5.193 1.00 0.00 C ATOM 101 O ILE A 7 12.173 10.546 4.830 1.00 0.00 O ATOM 102 CB ILE A 7 9.343 9.309 3.451 1.00 0.00 C ATOM 103 CG1 ILE A 7 8.877 8.139 2.548 1.00 0.00 C ATOM 104 CG2 ILE A 7 9.660 10.546 2.598 1.00 0.00 C ATOM 105 CD1 ILE A 7 9.867 7.675 1.469 1.00 0.00 C ATOM 0 H ILE A 7 9.027 7.706 5.279 1.00 0.00 H new ATOM 0 HA ILE A 7 11.310 8.534 3.738 1.00 0.00 H new ATOM 0 HB ILE A 7 8.526 9.582 4.118 1.00 0.00 H new ATOM 0 HG12 ILE A 7 8.643 7.287 3.186 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.950 8.434 2.057 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.802 10.784 1.969 1.00 0.00 H new ATOM 0 HG22 ILE A 7 9.878 11.392 3.250 1.00 0.00 H new ATOM 0 HG23 ILE A 7 10.526 10.342 1.968 1.00 0.00 H new ATOM 0 HD11 ILE A 7 9.429 6.853 0.903 1.00 0.00 H new ATOM 0 HD12 ILE A 7 10.086 8.504 0.796 1.00 0.00 H new ATOM 0 HD13 ILE A 7 10.790 7.338 1.942 1.00 0.00 H new ATOM 117 N ASP A 8 10.495 10.420 6.314 1.00 0.00 N ATOM 118 CA ASP A 8 11.008 11.468 7.188 1.00 0.00 C ATOM 119 C ASP A 8 12.323 11.055 7.847 1.00 0.00 C ATOM 120 O ASP A 8 13.252 11.862 7.901 1.00 0.00 O ATOM 121 CB ASP A 8 9.975 11.801 8.269 1.00 0.00 C ATOM 122 CG ASP A 8 10.522 12.858 9.242 1.00 0.00 C ATOM 123 OD1 ASP A 8 10.549 14.056 8.880 1.00 0.00 O ATOM 124 OD2 ASP A 8 10.885 12.504 10.386 1.00 0.00 O ATOM 0 H ASP A 8 9.623 10.003 6.640 1.00 0.00 H new ATOM 0 HA ASP A 8 11.197 12.349 6.574 1.00 0.00 H new ATOM 0 HB2 ASP A 8 9.060 12.168 7.803 1.00 0.00 H new ATOM 0 HB3 ASP A 8 9.712 10.897 8.818 1.00 0.00 H new ATOM 129 N THR A 9 12.435 9.802 8.313 1.00 0.00 N ATOM 130 CA THR A 9 13.657 9.345 8.964 1.00 0.00 C ATOM 131 C THR A 9 14.797 9.292 7.934 1.00 0.00 C ATOM 132 O THR A 9 15.919 9.711 8.234 1.00 0.00 O ATOM 133 CB THR A 9 13.394 8.027 9.734 1.00 0.00 C ATOM 134 OG1 THR A 9 14.161 7.983 10.922 1.00 0.00 O ATOM 135 CG2 THR A 9 13.666 6.732 8.958 1.00 0.00 C ATOM 0 H THR A 9 11.699 9.099 8.249 1.00 0.00 H new ATOM 0 HA THR A 9 13.985 10.050 9.728 1.00 0.00 H new ATOM 0 HB THR A 9 12.322 8.056 9.931 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.981 7.145 11.397 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.448 5.874 9.594 1.00 0.00 H new ATOM 0 HG22 THR A 9 13.031 6.698 8.073 1.00 0.00 H new ATOM 0 HG23 THR A 9 14.713 6.702 8.655 1.00 0.00 H new ATOM 143 N ILE A 10 14.510 8.856 6.700 1.00 0.00 N ATOM 144 CA ILE A 10 15.475 8.855 5.610 1.00 0.00 C ATOM 145 C ILE A 10 15.909 10.292 5.341 1.00 0.00 C ATOM 146 O ILE A 10 17.110 10.548 5.324 1.00 0.00 O ATOM 147 CB ILE A 10 14.878 8.160 4.365 1.00 0.00 C ATOM 148 CG1 ILE A 10 14.775 6.640 4.615 1.00 0.00 C ATOM 149 CG2 ILE A 10 15.705 8.439 3.095 1.00 0.00 C ATOM 150 CD1 ILE A 10 13.836 5.950 3.624 1.00 0.00 C ATOM 0 H ILE A 10 13.594 8.493 6.436 1.00 0.00 H new ATOM 0 HA ILE A 10 16.362 8.282 5.880 1.00 0.00 H new ATOM 0 HB ILE A 10 13.882 8.571 4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 10 15.767 6.194 4.542 1.00 0.00 H new ATOM 0 HG13 ILE A 10 14.420 6.464 5.631 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.249 7.931 2.245 1.00 0.00 H new ATOM 0 HG22 ILE A 10 15.730 9.512 2.906 1.00 0.00 H new ATOM 0 HG23 ILE A 10 16.722 8.071 3.235 1.00 0.00 H new ATOM 0 HD11 ILE A 10 13.798 4.883 3.842 1.00 0.00 H new ATOM 0 HD12 ILE A 10 12.836 6.375 3.714 1.00 0.00 H new ATOM 0 HD13 ILE A 10 14.204 6.100 2.609 1.00 0.00 H new ATOM 162 N LEU A 11 14.975 11.233 5.168 1.00 0.00 N ATOM 163 CA LEU A 11 15.332 12.593 4.778 1.00 0.00 C ATOM 164 C LEU A 11 16.225 13.248 5.822 1.00 0.00 C ATOM 165 O LEU A 11 17.243 13.839 5.472 1.00 0.00 O ATOM 166 CB LEU A 11 14.091 13.464 4.505 1.00 0.00 C ATOM 167 CG LEU A 11 14.002 14.046 3.084 1.00 0.00 C ATOM 168 CD1 LEU A 11 15.281 14.749 2.600 1.00 0.00 C ATOM 169 CD2 LEU A 11 13.592 12.961 2.085 1.00 0.00 C ATOM 0 H LEU A 11 13.975 11.076 5.292 1.00 0.00 H new ATOM 0 HA LEU A 11 15.890 12.516 3.845 1.00 0.00 H new ATOM 0 HB2 LEU A 11 13.199 12.867 4.693 1.00 0.00 H new ATOM 0 HB3 LEU A 11 14.080 14.287 5.219 1.00 0.00 H new ATOM 0 HG LEU A 11 13.237 14.821 3.138 1.00 0.00 H new ATOM 0 HD11 LEU A 11 15.128 15.128 1.590 1.00 0.00 H new ATOM 0 HD12 LEU A 11 15.515 15.579 3.267 1.00 0.00 H new ATOM 0 HD13 LEU A 11 16.108 14.039 2.600 1.00 0.00 H new ATOM 0 HD21 LEU A 11 13.534 13.390 1.085 1.00 0.00 H new ATOM 0 HD22 LEU A 11 14.331 12.160 2.094 1.00 0.00 H new ATOM 0 HD23 LEU A 11 12.618 12.559 2.364 1.00 0.00 H new ATOM 181 N SER A 12 15.890 13.119 7.103 1.00 0.00 N ATOM 182 CA SER A 12 16.710 13.667 8.171 1.00 0.00 C ATOM 183 C SER A 12 18.032 12.920 8.329 1.00 0.00 C ATOM 184 O SER A 12 19.025 13.560 8.674 1.00 0.00 O ATOM 185 CB SER A 12 15.905 13.721 9.468 1.00 0.00 C ATOM 186 OG SER A 12 14.818 14.616 9.284 1.00 0.00 O ATOM 0 H SER A 12 15.051 12.636 7.424 1.00 0.00 H new ATOM 0 HA SER A 12 16.986 14.687 7.903 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.539 12.728 9.729 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.536 14.055 10.292 1.00 0.00 H new ATOM 0 HG SER A 12 15.061 15.501 9.629 1.00 0.00 H new ATOM 192 N THR A 13 18.110 11.621 8.024 1.00 0.00 N ATOM 193 CA THR A 13 19.399 10.944 7.998 1.00 0.00 C ATOM 194 C THR A 13 20.260 11.491 6.853 1.00 0.00 C ATOM 195 O THR A 13 21.427 11.819 7.053 1.00 0.00 O ATOM 196 CB THR A 13 19.255 9.422 7.911 1.00 0.00 C ATOM 197 OG1 THR A 13 18.429 8.939 8.952 1.00 0.00 O ATOM 198 CG2 THR A 13 20.654 8.813 8.056 1.00 0.00 C ATOM 0 H THR A 13 17.309 11.031 7.796 1.00 0.00 H new ATOM 0 HA THR A 13 19.901 11.151 8.943 1.00 0.00 H new ATOM 0 HB THR A 13 18.801 9.148 6.958 1.00 0.00 H new ATOM 0 HG1 THR A 13 17.499 9.194 8.777 1.00 0.00 H new ATOM 0 HG21 THR A 13 20.586 7.727 7.998 1.00 0.00 H new ATOM 0 HG22 THR A 13 21.295 9.179 7.254 1.00 0.00 H new ATOM 0 HG23 THR A 13 21.077 9.099 9.019 1.00 0.00 H new ATOM 206 N LEU A 14 19.691 11.634 5.659 1.00 0.00 N ATOM 207 CA LEU A 14 20.401 12.192 4.517 1.00 0.00 C ATOM 208 C LEU A 14 20.894 13.589 4.876 1.00 0.00 C ATOM 209 O LEU A 14 22.077 13.865 4.716 1.00 0.00 O ATOM 210 CB LEU A 14 19.491 12.220 3.278 1.00 0.00 C ATOM 211 CG LEU A 14 19.162 10.817 2.733 1.00 0.00 C ATOM 212 CD1 LEU A 14 17.935 10.893 1.825 1.00 0.00 C ATOM 213 CD2 LEU A 14 20.340 10.202 1.968 1.00 0.00 C ATOM 0 H LEU A 14 18.727 11.366 5.458 1.00 0.00 H new ATOM 0 HA LEU A 14 21.260 11.566 4.274 1.00 0.00 H new ATOM 0 HB2 LEU A 14 18.562 12.732 3.529 1.00 0.00 H new ATOM 0 HB3 LEU A 14 19.974 12.803 2.494 1.00 0.00 H new ATOM 0 HG LEU A 14 18.955 10.171 3.587 1.00 0.00 H new ATOM 0 HD11 LEU A 14 17.705 9.899 1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 14 17.084 11.269 2.394 1.00 0.00 H new ATOM 0 HD13 LEU A 14 18.140 11.565 0.992 1.00 0.00 H new ATOM 0 HD21 LEU A 14 20.061 9.214 1.603 1.00 0.00 H new ATOM 0 HD22 LEU A 14 20.599 10.841 1.124 1.00 0.00 H new ATOM 0 HD23 LEU A 14 21.199 10.114 2.633 1.00 0.00 H new ATOM 225 N ARG A 15 20.033 14.445 5.435 1.00 0.00 N ATOM 226 CA ARG A 15 20.421 15.794 5.839 1.00 0.00 C ATOM 227 C ARG A 15 21.530 15.762 6.893 1.00 0.00 C ATOM 228 O ARG A 15 22.511 16.488 6.737 1.00 0.00 O ATOM 229 CB ARG A 15 19.198 16.604 6.305 1.00 0.00 C ATOM 230 CG ARG A 15 18.286 16.980 5.121 1.00 0.00 C ATOM 231 CD ARG A 15 17.053 17.802 5.522 1.00 0.00 C ATOM 232 NE ARG A 15 16.101 17.052 6.374 1.00 0.00 N ATOM 233 CZ ARG A 15 14.793 16.862 6.134 1.00 0.00 C ATOM 234 NH1 ARG A 15 14.223 17.340 5.031 1.00 0.00 N ATOM 235 NH2 ARG A 15 14.047 16.180 6.998 1.00 0.00 N ATOM 0 H ARG A 15 19.055 14.222 5.618 1.00 0.00 H new ATOM 0 HA ARG A 15 20.830 16.304 4.967 1.00 0.00 H new ATOM 0 HB2 ARG A 15 18.631 16.023 7.032 1.00 0.00 H new ATOM 0 HB3 ARG A 15 19.531 17.510 6.811 1.00 0.00 H new ATOM 0 HG2 ARG A 15 18.867 17.546 4.393 1.00 0.00 H new ATOM 0 HG3 ARG A 15 17.956 16.067 4.625 1.00 0.00 H new ATOM 0 HD2 ARG A 15 17.378 18.697 6.053 1.00 0.00 H new ATOM 0 HD3 ARG A 15 16.538 18.136 4.621 1.00 0.00 H new ATOM 0 HE ARG A 15 16.476 16.639 7.228 1.00 0.00 H new ATOM 0 HH11 ARG A 15 14.780 17.859 4.353 1.00 0.00 H new ATOM 0 HH12 ARG A 15 13.229 17.187 4.864 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.468 15.800 7.846 1.00 0.00 H new ATOM 0 HH22 ARG A 15 13.054 16.037 6.813 1.00 0.00 H new ATOM 249 N MET A 16 21.427 14.936 7.941 1.00 0.00 N ATOM 250 CA MET A 16 22.468 14.915 8.975 1.00 0.00 C ATOM 251 C MET A 16 23.817 14.419 8.431 1.00 0.00 C ATOM 252 O MET A 16 24.864 14.878 8.893 1.00 0.00 O ATOM 253 CB MET A 16 22.029 14.142 10.235 1.00 0.00 C ATOM 254 CG MET A 16 22.091 12.622 10.108 1.00 0.00 C ATOM 255 SD MET A 16 21.634 11.672 11.588 1.00 0.00 S ATOM 256 CE MET A 16 19.900 12.162 11.821 1.00 0.00 C ATOM 0 H MET A 16 20.654 14.288 8.094 1.00 0.00 H new ATOM 0 HA MET A 16 22.617 15.950 9.284 1.00 0.00 H new ATOM 0 HB2 MET A 16 22.659 14.449 11.070 1.00 0.00 H new ATOM 0 HB3 MET A 16 21.008 14.430 10.483 1.00 0.00 H new ATOM 0 HG2 MET A 16 21.435 12.320 9.291 1.00 0.00 H new ATOM 0 HG3 MET A 16 23.105 12.343 9.822 1.00 0.00 H new ATOM 0 HE1 MET A 16 19.363 11.365 12.335 1.00 0.00 H new ATOM 0 HE2 MET A 16 19.856 13.073 12.418 1.00 0.00 H new ATOM 0 HE3 MET A 16 19.439 12.343 10.850 1.00 0.00 H new ATOM 266 N GLU A 17 23.812 13.493 7.468 1.00 0.00 N ATOM 267 CA GLU A 17 25.034 12.902 6.921 1.00 0.00 C ATOM 268 C GLU A 17 25.653 13.782 5.827 1.00 0.00 C ATOM 269 O GLU A 17 26.868 13.737 5.610 1.00 0.00 O ATOM 270 CB GLU A 17 24.741 11.504 6.347 1.00 0.00 C ATOM 271 CG GLU A 17 24.453 10.466 7.428 1.00 0.00 C ATOM 272 CD GLU A 17 24.375 9.031 6.883 1.00 0.00 C ATOM 273 OE1 GLU A 17 23.667 8.769 5.887 1.00 0.00 O ATOM 274 OE2 GLU A 17 24.985 8.120 7.490 1.00 0.00 O ATOM 0 H GLU A 17 22.957 13.132 7.045 1.00 0.00 H new ATOM 0 HA GLU A 17 25.749 12.822 7.740 1.00 0.00 H new ATOM 0 HB2 GLU A 17 23.887 11.565 5.673 1.00 0.00 H new ATOM 0 HB3 GLU A 17 25.593 11.175 5.752 1.00 0.00 H new ATOM 0 HG2 GLU A 17 25.232 10.517 8.189 1.00 0.00 H new ATOM 0 HG3 GLU A 17 23.512 10.713 7.919 1.00 0.00 H new ATOM 281 N ALA A 18 24.833 14.559 5.120 1.00 0.00 N ATOM 282 CA ALA A 18 25.223 15.300 3.939 1.00 0.00 C ATOM 283 C ALA A 18 25.921 16.613 4.281 1.00 0.00 C ATOM 284 O ALA A 18 25.780 17.173 5.371 1.00 0.00 O ATOM 285 CB ALA A 18 23.958 15.586 3.126 1.00 0.00 C ATOM 0 H ALA A 18 23.852 14.689 5.367 1.00 0.00 H new ATOM 0 HA ALA A 18 25.936 14.702 3.371 1.00 0.00 H new ATOM 0 HB1 ALA A 18 24.221 16.145 2.228 1.00 0.00 H new ATOM 0 HB2 ALA A 18 23.487 14.645 2.843 1.00 0.00 H new ATOM 0 HB3 ALA A 18 23.264 16.173 3.728 1.00 0.00 H new ATOM 291 N ASP A 19 26.668 17.105 3.296 1.00 0.00 N ATOM 292 CA ASP A 19 27.235 18.455 3.320 1.00 0.00 C ATOM 293 C ASP A 19 26.083 19.470 3.178 1.00 0.00 C ATOM 294 O ASP A 19 25.216 19.254 2.323 1.00 0.00 O ATOM 295 CB ASP A 19 28.237 18.639 2.173 1.00 0.00 C ATOM 296 CG ASP A 19 28.877 20.033 2.231 1.00 0.00 C ATOM 297 OD1 ASP A 19 28.253 21.005 1.751 1.00 0.00 O ATOM 298 OD2 ASP A 19 30.006 20.156 2.757 1.00 0.00 O ATOM 0 H ASP A 19 26.899 16.578 2.454 1.00 0.00 H new ATOM 0 HA ASP A 19 27.763 18.613 4.260 1.00 0.00 H new ATOM 0 HB2 ASP A 19 29.012 17.875 2.234 1.00 0.00 H new ATOM 0 HB3 ASP A 19 27.732 18.505 1.217 1.00 0.00 H new ATOM 303 N PRO A 20 26.041 20.569 3.958 1.00 0.00 N ATOM 304 CA PRO A 20 24.980 21.574 3.887 1.00 0.00 C ATOM 305 C PRO A 20 24.651 22.092 2.480 1.00 0.00 C ATOM 306 O PRO A 20 23.499 22.439 2.216 1.00 0.00 O ATOM 307 CB PRO A 20 25.433 22.717 4.797 1.00 0.00 C ATOM 308 CG PRO A 20 26.279 22.004 5.847 1.00 0.00 C ATOM 309 CD PRO A 20 26.951 20.887 5.050 1.00 0.00 C ATOM 0 HA PRO A 20 24.045 21.113 4.204 1.00 0.00 H new ATOM 0 HB2 PRO A 20 26.011 23.463 4.251 1.00 0.00 H new ATOM 0 HB3 PRO A 20 24.586 23.236 5.245 1.00 0.00 H new ATOM 0 HG2 PRO A 20 27.011 22.674 6.298 1.00 0.00 H new ATOM 0 HG3 PRO A 20 25.667 21.609 6.658 1.00 0.00 H new ATOM 0 HD2 PRO A 20 27.920 21.208 4.669 1.00 0.00 H new ATOM 0 HD3 PRO A 20 27.129 20.013 5.677 1.00 0.00 H new ATOM 317 N SER A 21 25.622 22.127 1.563 1.00 0.00 N ATOM 318 CA SER A 21 25.432 22.613 0.197 1.00 0.00 C ATOM 319 C SER A 21 24.392 21.788 -0.580 1.00 0.00 C ATOM 320 O SER A 21 23.834 22.270 -1.566 1.00 0.00 O ATOM 321 CB SER A 21 26.775 22.593 -0.551 1.00 0.00 C ATOM 322 OG SER A 21 27.839 23.061 0.258 1.00 0.00 O ATOM 0 H SER A 21 26.574 21.814 1.753 1.00 0.00 H new ATOM 0 HA SER A 21 25.053 23.633 0.264 1.00 0.00 H new ATOM 0 HB2 SER A 21 26.991 21.577 -0.882 1.00 0.00 H new ATOM 0 HB3 SER A 21 26.701 23.211 -1.446 1.00 0.00 H new ATOM 0 HG SER A 21 28.339 22.297 0.615 1.00 0.00 H new ATOM 328 N LEU A 22 24.128 20.549 -0.147 1.00 0.00 N ATOM 329 CA LEU A 22 23.210 19.620 -0.800 1.00 0.00 C ATOM 330 C LEU A 22 21.773 19.814 -0.297 1.00 0.00 C ATOM 331 O LEU A 22 20.842 19.281 -0.901 1.00 0.00 O ATOM 332 CB LEU A 22 23.671 18.182 -0.506 1.00 0.00 C ATOM 333 CG LEU A 22 25.075 17.845 -1.041 1.00 0.00 C ATOM 334 CD1 LEU A 22 25.649 16.700 -0.212 1.00 0.00 C ATOM 335 CD2 LEU A 22 25.070 17.463 -2.524 1.00 0.00 C ATOM 0 H LEU A 22 24.561 20.159 0.690 1.00 0.00 H new ATOM 0 HA LEU A 22 23.219 19.811 -1.873 1.00 0.00 H new ATOM 0 HB2 LEU A 22 23.658 18.022 0.572 1.00 0.00 H new ATOM 0 HB3 LEU A 22 22.953 17.487 -0.940 1.00 0.00 H new ATOM 0 HG LEU A 22 25.692 18.739 -0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 22 26.644 16.449 -0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 22 25.713 17.004 0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 22 25.000 15.828 -0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 22 26.087 17.236 -2.845 1.00 0.00 H new ATOM 0 HD22 LEU A 22 24.439 16.587 -2.672 1.00 0.00 H new ATOM 0 HD23 LEU A 22 24.681 18.294 -3.112 1.00 0.00 H new ATOM 347 N HIS A 23 21.567 20.545 0.806 1.00 0.00 N ATOM 348 CA HIS A 23 20.254 20.650 1.438 1.00 0.00 C ATOM 349 C HIS A 23 19.191 21.266 0.515 1.00 0.00 C ATOM 350 O HIS A 23 18.105 20.690 0.463 1.00 0.00 O ATOM 351 CB HIS A 23 20.332 21.385 2.786 1.00 0.00 C ATOM 352 CG HIS A 23 21.086 20.663 3.881 1.00 0.00 C ATOM 353 ND1 HIS A 23 21.163 21.072 5.196 1.00 0.00 N ATOM 354 CD2 HIS A 23 21.792 19.490 3.789 1.00 0.00 C ATOM 355 CE1 HIS A 23 21.893 20.171 5.874 1.00 0.00 C ATOM 356 NE2 HIS A 23 22.301 19.187 5.055 1.00 0.00 N ATOM 0 H HIS A 23 22.300 21.074 1.278 1.00 0.00 H new ATOM 0 HA HIS A 23 19.928 19.629 1.636 1.00 0.00 H new ATOM 0 HB2 HIS A 23 20.802 22.355 2.624 1.00 0.00 H new ATOM 0 HB3 HIS A 23 19.317 21.577 3.134 1.00 0.00 H new ATOM 0 HD2 HIS A 23 21.930 18.903 2.893 1.00 0.00 H new ATOM 0 HE1 HIS A 23 22.120 20.229 6.928 1.00 0.00 H new ATOM 0 HE2 HIS A 23 22.870 18.379 5.307 1.00 0.00 H new ATOM 364 N PRO A 24 19.435 22.354 -0.248 1.00 0.00 N ATOM 365 CA PRO A 24 18.430 22.896 -1.163 1.00 0.00 C ATOM 366 C PRO A 24 17.927 21.860 -2.173 1.00 0.00 C ATOM 367 O PRO A 24 16.732 21.810 -2.474 1.00 0.00 O ATOM 368 CB PRO A 24 19.097 24.083 -1.868 1.00 0.00 C ATOM 369 CG PRO A 24 20.171 24.525 -0.878 1.00 0.00 C ATOM 370 CD PRO A 24 20.614 23.208 -0.247 1.00 0.00 C ATOM 0 HA PRO A 24 17.542 23.201 -0.610 1.00 0.00 H new ATOM 0 HB2 PRO A 24 19.529 23.791 -2.825 1.00 0.00 H new ATOM 0 HB3 PRO A 24 18.384 24.882 -2.071 1.00 0.00 H new ATOM 0 HG2 PRO A 24 20.997 25.032 -1.377 1.00 0.00 H new ATOM 0 HG3 PRO A 24 19.775 25.217 -0.134 1.00 0.00 H new ATOM 0 HD2 PRO A 24 21.426 22.755 -0.816 1.00 0.00 H new ATOM 0 HD3 PRO A 24 20.983 23.364 0.767 1.00 0.00 H new ATOM 378 N LEU A 25 18.818 21.016 -2.706 1.00 0.00 N ATOM 379 CA LEU A 25 18.441 19.949 -3.615 1.00 0.00 C ATOM 380 C LEU A 25 17.570 18.922 -2.896 1.00 0.00 C ATOM 381 O LEU A 25 16.565 18.484 -3.457 1.00 0.00 O ATOM 382 CB LEU A 25 19.721 19.319 -4.176 1.00 0.00 C ATOM 383 CG LEU A 25 19.483 18.292 -5.294 1.00 0.00 C ATOM 384 CD1 LEU A 25 18.731 18.898 -6.485 1.00 0.00 C ATOM 385 CD2 LEU A 25 20.854 17.803 -5.759 1.00 0.00 C ATOM 0 H LEU A 25 19.819 21.061 -2.514 1.00 0.00 H new ATOM 0 HA LEU A 25 17.849 20.343 -4.441 1.00 0.00 H new ATOM 0 HB2 LEU A 25 20.365 20.111 -4.558 1.00 0.00 H new ATOM 0 HB3 LEU A 25 20.260 18.834 -3.362 1.00 0.00 H new ATOM 0 HG LEU A 25 18.869 17.479 -4.907 1.00 0.00 H new ATOM 0 HD11 LEU A 25 18.586 18.135 -7.250 1.00 0.00 H new ATOM 0 HD12 LEU A 25 17.761 19.268 -6.153 1.00 0.00 H new ATOM 0 HD13 LEU A 25 19.311 19.722 -6.900 1.00 0.00 H new ATOM 0 HD21 LEU A 25 20.728 17.070 -6.555 1.00 0.00 H new ATOM 0 HD22 LEU A 25 21.434 18.647 -6.132 1.00 0.00 H new ATOM 0 HD23 LEU A 25 21.379 17.343 -4.922 1.00 0.00 H new ATOM 397 N PHE A 26 17.906 18.566 -1.652 1.00 0.00 N ATOM 398 CA PHE A 26 17.103 17.611 -0.903 1.00 0.00 C ATOM 399 C PHE A 26 15.751 18.175 -0.462 1.00 0.00 C ATOM 400 O PHE A 26 14.795 17.410 -0.369 1.00 0.00 O ATOM 401 CB PHE A 26 17.871 16.979 0.272 1.00 0.00 C ATOM 402 CG PHE A 26 18.531 15.649 -0.062 1.00 0.00 C ATOM 403 CD1 PHE A 26 17.815 14.649 -0.757 1.00 0.00 C ATOM 404 CD2 PHE A 26 19.857 15.391 0.339 1.00 0.00 C ATOM 405 CE1 PHE A 26 18.425 13.436 -1.104 1.00 0.00 C ATOM 406 CE2 PHE A 26 20.453 14.154 0.037 1.00 0.00 C ATOM 407 CZ PHE A 26 19.742 13.181 -0.690 1.00 0.00 C ATOM 0 H PHE A 26 18.720 18.923 -1.152 1.00 0.00 H new ATOM 0 HA PHE A 26 16.885 16.807 -1.606 1.00 0.00 H new ATOM 0 HB2 PHE A 26 18.636 17.678 0.610 1.00 0.00 H new ATOM 0 HB3 PHE A 26 17.183 16.832 1.105 1.00 0.00 H new ATOM 0 HD1 PHE A 26 16.783 14.822 -1.025 1.00 0.00 H new ATOM 0 HD2 PHE A 26 20.415 16.143 0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 26 17.886 12.703 -1.686 1.00 0.00 H new ATOM 0 HE2 PHE A 26 21.462 13.949 0.365 1.00 0.00 H new ATOM 0 HZ PHE A 26 20.210 12.238 -0.930 1.00 0.00 H new ATOM 417 N GLU A 27 15.626 19.484 -0.236 1.00 0.00 N ATOM 418 CA GLU A 27 14.332 20.103 0.045 1.00 0.00 C ATOM 419 C GLU A 27 13.413 19.982 -1.177 1.00 0.00 C ATOM 420 O GLU A 27 12.227 19.680 -1.030 1.00 0.00 O ATOM 421 CB GLU A 27 14.511 21.574 0.453 1.00 0.00 C ATOM 422 CG GLU A 27 15.065 21.718 1.877 1.00 0.00 C ATOM 423 CD GLU A 27 15.202 23.196 2.284 1.00 0.00 C ATOM 424 OE1 GLU A 27 14.206 23.799 2.748 1.00 0.00 O ATOM 425 OE2 GLU A 27 16.308 23.770 2.166 1.00 0.00 O ATOM 0 H GLU A 27 16.409 20.137 -0.242 1.00 0.00 H new ATOM 0 HA GLU A 27 13.867 19.578 0.880 1.00 0.00 H new ATOM 0 HB2 GLU A 27 15.186 22.064 -0.249 1.00 0.00 H new ATOM 0 HB3 GLU A 27 13.552 22.087 0.385 1.00 0.00 H new ATOM 0 HG2 GLU A 27 14.406 21.206 2.578 1.00 0.00 H new ATOM 0 HG3 GLU A 27 16.038 21.231 1.941 1.00 0.00 H new ATOM 432 N GLN A 28 13.956 20.161 -2.387 1.00 0.00 N ATOM 433 CA GLN A 28 13.192 19.979 -3.618 1.00 0.00 C ATOM 434 C GLN A 28 12.809 18.505 -3.780 1.00 0.00 C ATOM 435 O GLN A 28 11.648 18.203 -4.041 1.00 0.00 O ATOM 436 CB GLN A 28 13.998 20.490 -4.822 1.00 0.00 C ATOM 437 CG GLN A 28 14.118 22.021 -4.818 1.00 0.00 C ATOM 438 CD GLN A 28 15.233 22.489 -5.750 1.00 0.00 C ATOM 439 OE1 GLN A 28 15.016 22.787 -6.922 1.00 0.00 O ATOM 440 NE2 GLN A 28 16.454 22.550 -5.243 1.00 0.00 N ATOM 0 H GLN A 28 14.928 20.433 -2.536 1.00 0.00 H new ATOM 0 HA GLN A 28 12.272 20.561 -3.564 1.00 0.00 H new ATOM 0 HB2 GLN A 28 14.994 20.047 -4.807 1.00 0.00 H new ATOM 0 HB3 GLN A 28 13.518 20.165 -5.745 1.00 0.00 H new ATOM 0 HG2 GLN A 28 13.171 22.464 -5.128 1.00 0.00 H new ATOM 0 HG3 GLN A 28 14.317 22.370 -3.805 1.00 0.00 H new ATOM 0 HE21 GLN A 28 16.614 22.299 -4.268 1.00 0.00 H new ATOM 0 HE22 GLN A 28 17.235 22.848 -5.828 1.00 0.00 H new ATOM 449 N PHE A 29 13.756 17.588 -3.570 1.00 0.00 N ATOM 450 CA PHE A 29 13.522 16.146 -3.641 1.00 0.00 C ATOM 451 C PHE A 29 12.396 15.730 -2.682 1.00 0.00 C ATOM 452 O PHE A 29 11.481 15.017 -3.089 1.00 0.00 O ATOM 453 CB PHE A 29 14.852 15.450 -3.319 1.00 0.00 C ATOM 454 CG PHE A 29 14.810 13.966 -3.024 1.00 0.00 C ATOM 455 CD1 PHE A 29 14.556 13.521 -1.711 1.00 0.00 C ATOM 456 CD2 PHE A 29 15.104 13.029 -4.029 1.00 0.00 C ATOM 457 CE1 PHE A 29 14.584 12.150 -1.409 1.00 0.00 C ATOM 458 CE2 PHE A 29 15.100 11.656 -3.729 1.00 0.00 C ATOM 459 CZ PHE A 29 14.844 11.216 -2.422 1.00 0.00 C ATOM 0 H PHE A 29 14.720 17.831 -3.343 1.00 0.00 H new ATOM 0 HA PHE A 29 13.191 15.851 -4.637 1.00 0.00 H new ATOM 0 HB2 PHE A 29 15.526 15.607 -4.161 1.00 0.00 H new ATOM 0 HB3 PHE A 29 15.295 15.952 -2.459 1.00 0.00 H new ATOM 0 HD1 PHE A 29 14.339 14.238 -0.933 1.00 0.00 H new ATOM 0 HD2 PHE A 29 15.333 13.363 -5.030 1.00 0.00 H new ATOM 0 HE1 PHE A 29 14.406 11.815 -0.398 1.00 0.00 H new ATOM 0 HE2 PHE A 29 15.295 10.935 -4.509 1.00 0.00 H new ATOM 0 HZ PHE A 29 14.847 10.160 -2.196 1.00 0.00 H new ATOM 469 N GLU A 30 12.423 16.217 -1.436 1.00 0.00 N ATOM 470 CA GLU A 30 11.391 15.955 -0.438 1.00 0.00 C ATOM 471 C GLU A 30 10.022 16.389 -0.970 1.00 0.00 C ATOM 472 O GLU A 30 9.083 15.588 -1.008 1.00 0.00 O ATOM 473 CB GLU A 30 11.768 16.691 0.863 1.00 0.00 C ATOM 474 CG GLU A 30 10.630 16.744 1.892 1.00 0.00 C ATOM 475 CD GLU A 30 11.061 17.459 3.186 1.00 0.00 C ATOM 476 OE1 GLU A 30 11.691 16.824 4.062 1.00 0.00 O ATOM 477 OE2 GLU A 30 10.759 18.663 3.345 1.00 0.00 O ATOM 0 H GLU A 30 13.176 16.813 -1.092 1.00 0.00 H new ATOM 0 HA GLU A 30 11.325 14.888 -0.225 1.00 0.00 H new ATOM 0 HB2 GLU A 30 12.630 16.198 1.312 1.00 0.00 H new ATOM 0 HB3 GLU A 30 12.074 17.708 0.619 1.00 0.00 H new ATOM 0 HG2 GLU A 30 9.773 17.260 1.460 1.00 0.00 H new ATOM 0 HG3 GLU A 30 10.306 15.730 2.128 1.00 0.00 H new ATOM 484 N LYS A 31 9.908 17.650 -1.403 1.00 0.00 N ATOM 485 CA LYS A 31 8.643 18.187 -1.895 1.00 0.00 C ATOM 486 C LYS A 31 8.183 17.412 -3.129 1.00 0.00 C ATOM 487 O LYS A 31 6.991 17.137 -3.247 1.00 0.00 O ATOM 488 CB LYS A 31 8.745 19.726 -2.034 1.00 0.00 C ATOM 489 CG LYS A 31 8.157 20.418 -3.276 1.00 0.00 C ATOM 490 CD LYS A 31 9.056 20.272 -4.516 1.00 0.00 C ATOM 491 CE LYS A 31 8.937 21.427 -5.521 1.00 0.00 C ATOM 492 NZ LYS A 31 7.557 21.610 -6.027 1.00 0.00 N ATOM 0 H LYS A 31 10.681 18.315 -1.421 1.00 0.00 H new ATOM 0 HA LYS A 31 7.836 18.035 -1.179 1.00 0.00 H new ATOM 0 HB2 LYS A 31 8.266 20.165 -1.159 1.00 0.00 H new ATOM 0 HB3 LYS A 31 9.802 19.989 -1.984 1.00 0.00 H new ATOM 0 HG2 LYS A 31 7.175 19.996 -3.492 1.00 0.00 H new ATOM 0 HG3 LYS A 31 8.009 21.476 -3.062 1.00 0.00 H new ATOM 0 HD2 LYS A 31 10.094 20.194 -4.191 1.00 0.00 H new ATOM 0 HD3 LYS A 31 8.809 19.339 -5.022 1.00 0.00 H new ATOM 0 HE2 LYS A 31 9.270 22.350 -5.047 1.00 0.00 H new ATOM 0 HE3 LYS A 31 9.605 21.241 -6.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.562 22.296 -6.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 7.189 20.699 -6.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 6.950 21.964 -5.260 1.00 0.00 H new ATOM 506 N PHE A 32 9.090 16.991 -4.011 1.00 0.00 N ATOM 507 CA PHE A 32 8.703 16.281 -5.218 1.00 0.00 C ATOM 508 C PHE A 32 8.205 14.873 -4.908 1.00 0.00 C ATOM 509 O PHE A 32 7.244 14.444 -5.544 1.00 0.00 O ATOM 510 CB PHE A 32 9.835 16.291 -6.258 1.00 0.00 C ATOM 511 CG PHE A 32 9.912 17.581 -7.061 1.00 0.00 C ATOM 512 CD1 PHE A 32 8.777 18.022 -7.764 1.00 0.00 C ATOM 513 CD2 PHE A 32 11.103 18.328 -7.150 1.00 0.00 C ATOM 514 CE1 PHE A 32 8.812 19.175 -8.559 1.00 0.00 C ATOM 515 CE2 PHE A 32 11.135 19.512 -7.911 1.00 0.00 C ATOM 516 CZ PHE A 32 9.992 19.937 -8.616 1.00 0.00 C ATOM 0 H PHE A 32 10.095 17.132 -3.907 1.00 0.00 H new ATOM 0 HA PHE A 32 7.862 16.813 -5.663 1.00 0.00 H new ATOM 0 HB2 PHE A 32 10.786 16.132 -5.749 1.00 0.00 H new ATOM 0 HB3 PHE A 32 9.696 15.454 -6.943 1.00 0.00 H new ATOM 0 HD1 PHE A 32 7.858 17.460 -7.689 1.00 0.00 H new ATOM 0 HD2 PHE A 32 11.991 17.993 -6.635 1.00 0.00 H new ATOM 0 HE1 PHE A 32 7.941 19.475 -9.123 1.00 0.00 H new ATOM 0 HE2 PHE A 32 12.041 20.098 -7.955 1.00 0.00 H new ATOM 0 HZ PHE A 32 10.022 20.846 -9.199 1.00 0.00 H new ATOM 526 N TYR A 33 8.765 14.161 -3.923 1.00 0.00 N ATOM 527 CA TYR A 33 8.191 12.884 -3.505 1.00 0.00 C ATOM 528 C TYR A 33 6.773 13.104 -2.968 1.00 0.00 C ATOM 529 O TYR A 33 5.858 12.371 -3.340 1.00 0.00 O ATOM 530 CB TYR A 33 9.065 12.204 -2.448 1.00 0.00 C ATOM 531 CG TYR A 33 8.512 10.874 -1.967 1.00 0.00 C ATOM 532 CD1 TYR A 33 8.792 9.699 -2.689 1.00 0.00 C ATOM 533 CD2 TYR A 33 7.703 10.810 -0.814 1.00 0.00 C ATOM 534 CE1 TYR A 33 8.291 8.464 -2.249 1.00 0.00 C ATOM 535 CE2 TYR A 33 7.181 9.576 -0.380 1.00 0.00 C ATOM 536 CZ TYR A 33 7.482 8.392 -1.095 1.00 0.00 C ATOM 537 OH TYR A 33 7.015 7.175 -0.698 1.00 0.00 O ATOM 0 H TYR A 33 9.600 14.444 -3.410 1.00 0.00 H new ATOM 0 HA TYR A 33 8.147 12.225 -4.372 1.00 0.00 H new ATOM 0 HB2 TYR A 33 10.062 12.046 -2.860 1.00 0.00 H new ATOM 0 HB3 TYR A 33 9.175 12.873 -1.594 1.00 0.00 H new ATOM 0 HD1 TYR A 33 9.394 9.748 -3.584 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.483 11.711 -0.261 1.00 0.00 H new ATOM 0 HE1 TYR A 33 8.526 7.563 -2.797 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.552 9.533 0.497 1.00 0.00 H new ATOM 0 HH TYR A 33 6.473 7.281 0.112 1.00 0.00 H new ATOM 547 N GLU A 34 6.572 14.132 -2.135 1.00 0.00 N ATOM 548 CA GLU A 34 5.272 14.426 -1.537 1.00 0.00 C ATOM 549 C GLU A 34 4.232 14.787 -2.613 1.00 0.00 C ATOM 550 O GLU A 34 3.067 14.406 -2.505 1.00 0.00 O ATOM 551 CB GLU A 34 5.439 15.539 -0.489 1.00 0.00 C ATOM 552 CG GLU A 34 4.164 15.756 0.337 1.00 0.00 C ATOM 553 CD GLU A 34 4.384 16.792 1.452 1.00 0.00 C ATOM 554 OE1 GLU A 34 4.197 18.006 1.210 1.00 0.00 O ATOM 555 OE2 GLU A 34 4.721 16.402 2.595 1.00 0.00 O ATOM 0 H GLU A 34 7.309 14.781 -1.859 1.00 0.00 H new ATOM 0 HA GLU A 34 4.892 13.536 -1.035 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.263 15.286 0.178 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.708 16.469 -0.990 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.358 16.089 -0.317 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.848 14.810 0.776 1.00 0.00 H new ATOM 562 N GLU A 35 4.649 15.465 -3.685 1.00 0.00 N ATOM 563 CA GLU A 35 3.803 15.787 -4.834 1.00 0.00 C ATOM 564 C GLU A 35 3.559 14.574 -5.751 1.00 0.00 C ATOM 565 O GLU A 35 2.844 14.699 -6.746 1.00 0.00 O ATOM 566 CB GLU A 35 4.428 16.947 -5.625 1.00 0.00 C ATOM 567 CG GLU A 35 4.294 18.280 -4.877 1.00 0.00 C ATOM 568 CD GLU A 35 4.914 19.445 -5.662 1.00 0.00 C ATOM 569 OE1 GLU A 35 6.070 19.332 -6.126 1.00 0.00 O ATOM 570 OE2 GLU A 35 4.257 20.505 -5.792 1.00 0.00 O ATOM 0 H GLU A 35 5.604 15.812 -3.779 1.00 0.00 H new ATOM 0 HA GLU A 35 2.827 16.086 -4.451 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.482 16.737 -5.808 1.00 0.00 H new ATOM 0 HB3 GLU A 35 3.945 17.026 -6.599 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.240 18.488 -4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.779 18.200 -3.904 1.00 0.00 H new ATOM 577 N LYS A 36 4.125 13.401 -5.433 1.00 0.00 N ATOM 578 CA LYS A 36 4.112 12.204 -6.277 1.00 0.00 C ATOM 579 C LYS A 36 4.729 12.503 -7.653 1.00 0.00 C ATOM 580 O LYS A 36 4.219 12.093 -8.696 1.00 0.00 O ATOM 581 CB LYS A 36 2.695 11.590 -6.299 1.00 0.00 C ATOM 582 CG LYS A 36 2.699 10.132 -6.782 1.00 0.00 C ATOM 583 CD LYS A 36 1.326 9.453 -6.664 1.00 0.00 C ATOM 584 CE LYS A 36 0.278 10.105 -7.580 1.00 0.00 C ATOM 585 NZ LYS A 36 -1.036 9.417 -7.509 1.00 0.00 N ATOM 0 H LYS A 36 4.620 13.258 -4.552 1.00 0.00 H new ATOM 0 HA LYS A 36 4.752 11.429 -5.857 1.00 0.00 H new ATOM 0 HB2 LYS A 36 2.265 11.638 -5.298 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.054 12.184 -6.950 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.024 10.101 -7.822 1.00 0.00 H new ATOM 0 HG3 LYS A 36 3.428 9.566 -6.203 1.00 0.00 H new ATOM 0 HD2 LYS A 36 1.421 8.397 -6.917 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.985 9.503 -5.630 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.154 11.151 -7.300 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.638 10.091 -8.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.711 9.891 -8.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.925 8.425 -7.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.394 9.452 -6.533 1.00 0.00 H new ATOM 599 N LEU A 37 5.841 13.241 -7.659 1.00 0.00 N ATOM 600 CA LEU A 37 6.573 13.666 -8.845 1.00 0.00 C ATOM 601 C LEU A 37 7.900 12.944 -8.893 1.00 0.00 C ATOM 602 O LEU A 37 8.979 13.526 -8.781 1.00 0.00 O ATOM 603 CB LEU A 37 6.664 15.199 -8.915 1.00 0.00 C ATOM 604 CG LEU A 37 5.308 15.850 -9.229 1.00 0.00 C ATOM 605 CD1 LEU A 37 5.442 17.372 -9.307 1.00 0.00 C ATOM 606 CD2 LEU A 37 4.760 15.320 -10.554 1.00 0.00 C ATOM 0 H LEU A 37 6.272 13.572 -6.796 1.00 0.00 H new ATOM 0 HA LEU A 37 6.038 13.385 -9.752 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.037 15.582 -7.965 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.387 15.483 -9.680 1.00 0.00 H new ATOM 0 HG LEU A 37 4.618 15.597 -8.424 1.00 0.00 H new ATOM 0 HD11 LEU A 37 4.470 17.812 -9.530 1.00 0.00 H new ATOM 0 HD12 LEU A 37 5.803 17.755 -8.352 1.00 0.00 H new ATOM 0 HD13 LEU A 37 6.149 17.635 -10.094 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.799 15.790 -10.764 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.460 15.552 -11.356 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.629 14.240 -10.488 1.00 0.00 H new ATOM 618 N TRP A 38 7.762 11.637 -9.088 1.00 0.00 N ATOM 619 CA TRP A 38 8.872 10.693 -9.214 1.00 0.00 C ATOM 620 C TRP A 38 9.888 11.152 -10.266 1.00 0.00 C ATOM 621 O TRP A 38 11.092 10.982 -10.082 1.00 0.00 O ATOM 622 CB TRP A 38 8.376 9.291 -9.610 1.00 0.00 C ATOM 623 CG TRP A 38 7.033 8.824 -9.138 1.00 0.00 C ATOM 624 CD1 TRP A 38 5.935 8.712 -9.919 1.00 0.00 C ATOM 625 CD2 TRP A 38 6.644 8.294 -7.835 1.00 0.00 C ATOM 626 NE1 TRP A 38 4.905 8.141 -9.202 1.00 0.00 N ATOM 627 CE2 TRP A 38 5.294 7.833 -7.916 1.00 0.00 C ATOM 628 CE3 TRP A 38 7.306 8.128 -6.601 1.00 0.00 C ATOM 629 CZ2 TRP A 38 4.646 7.216 -6.836 1.00 0.00 C ATOM 630 CZ3 TRP A 38 6.655 7.529 -5.505 1.00 0.00 C ATOM 631 CH2 TRP A 38 5.331 7.072 -5.619 1.00 0.00 C ATOM 0 H TRP A 38 6.849 11.190 -9.165 1.00 0.00 H new ATOM 0 HA TRP A 38 9.350 10.654 -8.235 1.00 0.00 H new ATOM 0 HB2 TRP A 38 8.376 9.240 -10.699 1.00 0.00 H new ATOM 0 HB3 TRP A 38 9.115 8.571 -9.257 1.00 0.00 H new ATOM 0 HD1 TRP A 38 5.874 9.024 -10.951 1.00 0.00 H new ATOM 0 HE1 TRP A 38 3.972 7.968 -9.576 1.00 0.00 H new ATOM 0 HE3 TRP A 38 8.327 8.465 -6.495 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 3.633 6.856 -6.939 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 7.179 7.420 -4.567 1.00 0.00 H new ATOM 0 HH2 TRP A 38 4.842 6.612 -4.773 1.00 0.00 H new ATOM 642 N PHE A 39 9.408 11.706 -11.382 1.00 0.00 N ATOM 643 CA PHE A 39 10.254 12.054 -12.518 1.00 0.00 C ATOM 644 C PHE A 39 11.131 13.257 -12.165 1.00 0.00 C ATOM 645 O PHE A 39 12.346 13.214 -12.343 1.00 0.00 O ATOM 646 CB PHE A 39 9.379 12.326 -13.754 1.00 0.00 C ATOM 647 CG PHE A 39 8.213 11.363 -13.920 1.00 0.00 C ATOM 648 CD1 PHE A 39 8.444 9.990 -14.142 1.00 0.00 C ATOM 649 CD2 PHE A 39 6.890 11.832 -13.782 1.00 0.00 C ATOM 650 CE1 PHE A 39 7.360 9.098 -14.234 1.00 0.00 C ATOM 651 CE2 PHE A 39 5.809 10.937 -13.873 1.00 0.00 C ATOM 652 CZ PHE A 39 6.043 9.570 -14.099 1.00 0.00 C ATOM 0 H PHE A 39 8.421 11.925 -11.520 1.00 0.00 H new ATOM 0 HA PHE A 39 10.916 11.221 -12.755 1.00 0.00 H new ATOM 0 HB2 PHE A 39 8.990 13.342 -13.692 1.00 0.00 H new ATOM 0 HB3 PHE A 39 10.005 12.278 -14.645 1.00 0.00 H new ATOM 0 HD1 PHE A 39 9.455 9.622 -14.242 1.00 0.00 H new ATOM 0 HD2 PHE A 39 6.707 12.882 -13.606 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.540 8.048 -14.409 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.797 11.301 -13.769 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.212 8.883 -14.169 1.00 0.00 H new ATOM 662 N GLN A 40 10.534 14.304 -11.585 1.00 0.00 N ATOM 663 CA GLN A 40 11.253 15.464 -11.063 1.00 0.00 C ATOM 664 C GLN A 40 12.232 15.065 -9.963 1.00 0.00 C ATOM 665 O GLN A 40 13.362 15.550 -9.904 1.00 0.00 O ATOM 666 CB GLN A 40 10.214 16.427 -10.479 1.00 0.00 C ATOM 667 CG GLN A 40 9.583 17.335 -11.546 1.00 0.00 C ATOM 668 CD GLN A 40 10.598 18.345 -12.085 1.00 0.00 C ATOM 669 OE1 GLN A 40 10.696 18.590 -13.285 1.00 0.00 O ATOM 670 NE2 GLN A 40 11.391 18.925 -11.198 1.00 0.00 N ATOM 0 H GLN A 40 9.523 14.367 -11.465 1.00 0.00 H new ATOM 0 HA GLN A 40 11.824 15.926 -11.868 1.00 0.00 H new ATOM 0 HB2 GLN A 40 9.429 15.853 -9.986 1.00 0.00 H new ATOM 0 HB3 GLN A 40 10.686 17.045 -9.715 1.00 0.00 H new ATOM 0 HG2 GLN A 40 9.202 16.726 -12.366 1.00 0.00 H new ATOM 0 HG3 GLN A 40 8.731 17.864 -11.119 1.00 0.00 H new ATOM 0 HE21 GLN A 40 11.292 18.707 -10.206 1.00 0.00 H new ATOM 0 HE22 GLN A 40 12.101 19.590 -11.506 1.00 0.00 H new ATOM 679 N LEU A 41 11.801 14.170 -9.082 1.00 0.00 N ATOM 680 CA LEU A 41 12.650 13.627 -8.045 1.00 0.00 C ATOM 681 C LEU A 41 13.834 12.859 -8.645 1.00 0.00 C ATOM 682 O LEU A 41 14.941 12.971 -8.126 1.00 0.00 O ATOM 683 CB LEU A 41 11.755 12.802 -7.123 1.00 0.00 C ATOM 684 CG LEU A 41 12.546 11.918 -6.148 1.00 0.00 C ATOM 685 CD1 LEU A 41 11.826 11.864 -4.809 1.00 0.00 C ATOM 686 CD2 LEU A 41 12.719 10.494 -6.678 1.00 0.00 C ATOM 0 H LEU A 41 10.849 13.804 -9.072 1.00 0.00 H new ATOM 0 HA LEU A 41 13.122 14.410 -7.451 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.112 13.474 -6.555 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.103 12.172 -7.728 1.00 0.00 H new ATOM 0 HG LEU A 41 13.536 12.360 -6.033 1.00 0.00 H new ATOM 0 HD11 LEU A 41 12.389 11.236 -4.118 1.00 0.00 H new ATOM 0 HD12 LEU A 41 11.744 12.871 -4.399 1.00 0.00 H new ATOM 0 HD13 LEU A 41 10.829 11.446 -4.949 1.00 0.00 H new ATOM 0 HD21 LEU A 41 13.284 9.903 -5.957 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.739 10.041 -6.830 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.257 10.521 -7.626 1.00 0.00 H new ATOM 698 N SER A 42 13.642 12.137 -9.748 1.00 0.00 N ATOM 699 CA SER A 42 14.733 11.465 -10.446 1.00 0.00 C ATOM 700 C SER A 42 15.668 12.491 -11.091 1.00 0.00 C ATOM 701 O SER A 42 16.880 12.307 -11.081 1.00 0.00 O ATOM 702 CB SER A 42 14.177 10.492 -11.489 1.00 0.00 C ATOM 703 OG SER A 42 13.287 9.577 -10.880 1.00 0.00 O ATOM 0 H SER A 42 12.728 12.003 -10.181 1.00 0.00 H new ATOM 0 HA SER A 42 15.312 10.891 -9.723 1.00 0.00 H new ATOM 0 HB2 SER A 42 13.661 11.045 -12.274 1.00 0.00 H new ATOM 0 HB3 SER A 42 14.995 9.952 -11.965 1.00 0.00 H new ATOM 0 HG SER A 42 12.530 10.065 -10.494 1.00 0.00 H new ATOM 709 N GLU A 43 15.140 13.608 -11.594 1.00 0.00 N ATOM 710 CA GLU A 43 15.931 14.752 -12.041 1.00 0.00 C ATOM 711 C GLU A 43 16.776 15.283 -10.868 1.00 0.00 C ATOM 712 O GLU A 43 17.963 15.569 -11.038 1.00 0.00 O ATOM 713 CB GLU A 43 14.975 15.779 -12.699 1.00 0.00 C ATOM 714 CG GLU A 43 15.058 17.254 -12.268 1.00 0.00 C ATOM 715 CD GLU A 43 16.283 18.034 -12.777 1.00 0.00 C ATOM 716 OE1 GLU A 43 17.023 17.560 -13.668 1.00 0.00 O ATOM 717 OE2 GLU A 43 16.472 19.180 -12.308 1.00 0.00 O ATOM 0 H GLU A 43 14.135 13.744 -11.703 1.00 0.00 H new ATOM 0 HA GLU A 43 16.658 14.484 -12.808 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.140 15.740 -13.776 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.954 15.440 -12.521 1.00 0.00 H new ATOM 0 HG2 GLU A 43 14.158 17.764 -12.611 1.00 0.00 H new ATOM 0 HG3 GLU A 43 15.052 17.295 -11.179 1.00 0.00 H new ATOM 724 N SER A 44 16.211 15.336 -9.657 1.00 0.00 N ATOM 725 CA SER A 44 16.924 15.823 -8.480 1.00 0.00 C ATOM 726 C SER A 44 18.043 14.841 -8.101 1.00 0.00 C ATOM 727 O SER A 44 19.187 15.248 -7.896 1.00 0.00 O ATOM 728 CB SER A 44 15.933 16.051 -7.329 1.00 0.00 C ATOM 729 OG SER A 44 14.844 16.874 -7.729 1.00 0.00 O ATOM 0 H SER A 44 15.252 15.043 -9.470 1.00 0.00 H new ATOM 0 HA SER A 44 17.395 16.781 -8.701 1.00 0.00 H new ATOM 0 HB2 SER A 44 15.554 15.091 -6.979 1.00 0.00 H new ATOM 0 HB3 SER A 44 16.451 16.515 -6.489 1.00 0.00 H new ATOM 0 HG SER A 44 14.305 16.401 -8.397 1.00 0.00 H new ATOM 735 N LEU A 45 17.737 13.539 -8.089 1.00 0.00 N ATOM 736 CA LEU A 45 18.726 12.483 -7.891 1.00 0.00 C ATOM 737 C LEU A 45 19.795 12.485 -8.982 1.00 0.00 C ATOM 738 O LEU A 45 20.942 12.166 -8.690 1.00 0.00 O ATOM 739 CB LEU A 45 18.076 11.094 -7.829 1.00 0.00 C ATOM 740 CG LEU A 45 17.285 10.802 -6.547 1.00 0.00 C ATOM 741 CD1 LEU A 45 16.667 9.404 -6.658 1.00 0.00 C ATOM 742 CD2 LEU A 45 18.173 10.884 -5.295 1.00 0.00 C ATOM 0 H LEU A 45 16.787 13.190 -8.218 1.00 0.00 H new ATOM 0 HA LEU A 45 19.200 12.697 -6.933 1.00 0.00 H new ATOM 0 HB2 LEU A 45 17.407 10.984 -8.683 1.00 0.00 H new ATOM 0 HB3 LEU A 45 18.856 10.340 -7.936 1.00 0.00 H new ATOM 0 HG LEU A 45 16.506 11.557 -6.442 1.00 0.00 H new ATOM 0 HD11 LEU A 45 16.101 9.183 -5.753 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.001 9.368 -7.520 1.00 0.00 H new ATOM 0 HD13 LEU A 45 17.459 8.665 -6.780 1.00 0.00 H new ATOM 0 HD21 LEU A 45 17.574 10.671 -4.410 1.00 0.00 H new ATOM 0 HD22 LEU A 45 18.979 10.154 -5.372 1.00 0.00 H new ATOM 0 HD23 LEU A 45 18.596 11.885 -5.214 1.00 0.00 H new ATOM 754 N THR A 46 19.468 12.860 -10.216 1.00 0.00 N ATOM 755 CA THR A 46 20.444 12.959 -11.293 1.00 0.00 C ATOM 756 C THR A 46 21.430 14.094 -10.991 1.00 0.00 C ATOM 757 O THR A 46 22.638 13.885 -11.086 1.00 0.00 O ATOM 758 CB THR A 46 19.713 13.126 -12.636 1.00 0.00 C ATOM 759 OG1 THR A 46 18.862 12.015 -12.853 1.00 0.00 O ATOM 760 CG2 THR A 46 20.675 13.219 -13.822 1.00 0.00 C ATOM 0 H THR A 46 18.518 13.104 -10.496 1.00 0.00 H new ATOM 0 HA THR A 46 21.032 12.044 -11.367 1.00 0.00 H new ATOM 0 HB THR A 46 19.150 14.057 -12.574 1.00 0.00 H new ATOM 0 HG1 THR A 46 18.018 12.151 -12.374 1.00 0.00 H new ATOM 0 HG21 THR A 46 20.106 13.336 -14.744 1.00 0.00 H new ATOM 0 HG22 THR A 46 21.333 14.078 -13.690 1.00 0.00 H new ATOM 0 HG23 THR A 46 21.273 12.309 -13.878 1.00 0.00 H new ATOM 768 N LYS A 47 20.959 15.270 -10.560 1.00 0.00 N ATOM 769 CA LYS A 47 21.858 16.355 -10.157 1.00 0.00 C ATOM 770 C LYS A 47 22.692 15.949 -8.943 1.00 0.00 C ATOM 771 O LYS A 47 23.892 16.213 -8.917 1.00 0.00 O ATOM 772 CB LYS A 47 21.059 17.638 -9.886 1.00 0.00 C ATOM 773 CG LYS A 47 20.688 18.317 -11.210 1.00 0.00 C ATOM 774 CD LYS A 47 19.755 19.512 -10.992 1.00 0.00 C ATOM 775 CE LYS A 47 19.574 20.257 -12.322 1.00 0.00 C ATOM 776 NZ LYS A 47 18.392 21.148 -12.301 1.00 0.00 N ATOM 0 H LYS A 47 19.967 15.493 -10.482 1.00 0.00 H new ATOM 0 HA LYS A 47 22.549 16.556 -10.976 1.00 0.00 H new ATOM 0 HB2 LYS A 47 20.156 17.401 -9.324 1.00 0.00 H new ATOM 0 HB3 LYS A 47 21.647 18.319 -9.271 1.00 0.00 H new ATOM 0 HG2 LYS A 47 21.595 18.651 -11.714 1.00 0.00 H new ATOM 0 HG3 LYS A 47 20.205 17.594 -11.867 1.00 0.00 H new ATOM 0 HD2 LYS A 47 18.790 19.172 -10.617 1.00 0.00 H new ATOM 0 HD3 LYS A 47 20.171 20.182 -10.239 1.00 0.00 H new ATOM 0 HE2 LYS A 47 20.467 20.845 -12.533 1.00 0.00 H new ATOM 0 HE3 LYS A 47 19.469 19.534 -13.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 18.409 21.767 -13.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 17.525 20.574 -12.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 18.411 21.730 -11.439 1.00 0.00 H new ATOM 790 N PHE A 48 22.082 15.268 -7.972 1.00 0.00 N ATOM 791 CA PHE A 48 22.761 14.769 -6.781 1.00 0.00 C ATOM 792 C PHE A 48 23.893 13.820 -7.193 1.00 0.00 C ATOM 793 O PHE A 48 25.032 13.976 -6.755 1.00 0.00 O ATOM 794 CB PHE A 48 21.692 14.087 -5.903 1.00 0.00 C ATOM 795 CG PHE A 48 22.111 13.590 -4.536 1.00 0.00 C ATOM 796 CD1 PHE A 48 22.707 14.470 -3.614 1.00 0.00 C ATOM 797 CD2 PHE A 48 21.808 12.270 -4.144 1.00 0.00 C ATOM 798 CE1 PHE A 48 23.037 14.023 -2.324 1.00 0.00 C ATOM 799 CE2 PHE A 48 22.123 11.830 -2.847 1.00 0.00 C ATOM 800 CZ PHE A 48 22.753 12.700 -1.945 1.00 0.00 C ATOM 0 H PHE A 48 21.087 15.045 -7.994 1.00 0.00 H new ATOM 0 HA PHE A 48 23.229 15.569 -6.207 1.00 0.00 H new ATOM 0 HB2 PHE A 48 20.872 14.792 -5.766 1.00 0.00 H new ATOM 0 HB3 PHE A 48 21.293 13.239 -6.460 1.00 0.00 H new ATOM 0 HD1 PHE A 48 22.911 15.492 -3.899 1.00 0.00 H new ATOM 0 HD2 PHE A 48 21.333 11.596 -4.842 1.00 0.00 H new ATOM 0 HE1 PHE A 48 23.509 14.696 -1.623 1.00 0.00 H new ATOM 0 HE2 PHE A 48 21.880 10.822 -2.545 1.00 0.00 H new ATOM 0 HZ PHE A 48 23.020 12.353 -0.958 1.00 0.00 H new ATOM 810 N PHE A 49 23.596 12.865 -8.078 1.00 0.00 N ATOM 811 CA PHE A 49 24.547 11.899 -8.613 1.00 0.00 C ATOM 812 C PHE A 49 25.665 12.584 -9.402 1.00 0.00 C ATOM 813 O PHE A 49 26.828 12.214 -9.244 1.00 0.00 O ATOM 814 CB PHE A 49 23.768 10.894 -9.479 1.00 0.00 C ATOM 815 CG PHE A 49 24.609 9.901 -10.260 1.00 0.00 C ATOM 816 CD1 PHE A 49 25.036 10.222 -11.564 1.00 0.00 C ATOM 817 CD2 PHE A 49 24.938 8.648 -9.707 1.00 0.00 C ATOM 818 CE1 PHE A 49 25.806 9.307 -12.303 1.00 0.00 C ATOM 819 CE2 PHE A 49 25.710 7.737 -10.449 1.00 0.00 C ATOM 820 CZ PHE A 49 26.145 8.063 -11.744 1.00 0.00 C ATOM 0 H PHE A 49 22.655 12.743 -8.451 1.00 0.00 H new ATOM 0 HA PHE A 49 25.040 11.373 -7.795 1.00 0.00 H new ATOM 0 HB2 PHE A 49 23.089 10.337 -8.833 1.00 0.00 H new ATOM 0 HB3 PHE A 49 23.152 11.452 -10.184 1.00 0.00 H new ATOM 0 HD1 PHE A 49 24.771 11.175 -11.997 1.00 0.00 H new ATOM 0 HD2 PHE A 49 24.598 8.388 -8.715 1.00 0.00 H new ATOM 0 HE1 PHE A 49 26.137 9.560 -13.300 1.00 0.00 H new ATOM 0 HE2 PHE A 49 25.970 6.780 -10.020 1.00 0.00 H new ATOM 0 HZ PHE A 49 26.739 7.359 -12.309 1.00 0.00 H new ATOM 830 N ASP A 50 25.345 13.589 -10.222 1.00 0.00 N ATOM 831 CA ASP A 50 26.322 14.269 -11.070 1.00 0.00 C ATOM 832 C ASP A 50 27.287 15.116 -10.238 1.00 0.00 C ATOM 833 O ASP A 50 28.475 15.189 -10.551 1.00 0.00 O ATOM 834 CB ASP A 50 25.602 15.158 -12.089 1.00 0.00 C ATOM 835 CG ASP A 50 26.612 15.933 -12.953 1.00 0.00 C ATOM 836 OD1 ASP A 50 27.257 15.318 -13.833 1.00 0.00 O ATOM 837 OD2 ASP A 50 26.742 17.165 -12.785 1.00 0.00 O ATOM 0 H ASP A 50 24.397 13.954 -10.315 1.00 0.00 H new ATOM 0 HA ASP A 50 26.900 13.507 -11.593 1.00 0.00 H new ATOM 0 HB2 ASP A 50 24.967 14.545 -12.728 1.00 0.00 H new ATOM 0 HB3 ASP A 50 24.949 15.859 -11.569 1.00 0.00 H new ATOM 842 N ASP A 51 26.795 15.719 -9.149 1.00 0.00 N ATOM 843 CA ASP A 51 27.612 16.494 -8.212 1.00 0.00 C ATOM 844 C ASP A 51 28.563 15.604 -7.394 1.00 0.00 C ATOM 845 O ASP A 51 29.518 16.101 -6.800 1.00 0.00 O ATOM 846 CB ASP A 51 26.707 17.306 -7.279 1.00 0.00 C ATOM 847 CG ASP A 51 27.527 18.284 -6.420 1.00 0.00 C ATOM 848 OD1 ASP A 51 28.088 19.256 -6.978 1.00 0.00 O ATOM 849 OD2 ASP A 51 27.572 18.116 -5.183 1.00 0.00 O ATOM 0 H ASP A 51 25.809 15.681 -8.892 1.00 0.00 H new ATOM 0 HA ASP A 51 28.233 17.171 -8.799 1.00 0.00 H new ATOM 0 HB2 ASP A 51 25.977 17.860 -7.868 1.00 0.00 H new ATOM 0 HB3 ASP A 51 26.148 16.630 -6.632 1.00 0.00 H new ATOM 854 N ALA A 52 28.326 14.285 -7.394 1.00 0.00 N ATOM 855 CA ALA A 52 29.124 13.213 -6.794 1.00 0.00 C ATOM 856 C ALA A 52 29.321 13.274 -5.270 1.00 0.00 C ATOM 857 O ALA A 52 29.735 12.270 -4.685 1.00 0.00 O ATOM 858 CB ALA A 52 30.454 13.048 -7.544 1.00 0.00 C ATOM 0 H ALA A 52 27.497 13.911 -7.855 1.00 0.00 H new ATOM 0 HA ALA A 52 28.517 12.316 -6.920 1.00 0.00 H new ATOM 0 HB1 ALA A 52 31.034 12.247 -7.085 1.00 0.00 H new ATOM 0 HB2 ALA A 52 30.255 12.800 -8.587 1.00 0.00 H new ATOM 0 HB3 ALA A 52 31.018 13.979 -7.494 1.00 0.00 H new ATOM 864 N LYS A 53 28.987 14.380 -4.594 1.00 0.00 N ATOM 865 CA LYS A 53 28.923 14.487 -3.130 1.00 0.00 C ATOM 866 C LYS A 53 27.653 13.768 -2.649 1.00 0.00 C ATOM 867 O LYS A 53 26.782 14.361 -2.019 1.00 0.00 O ATOM 868 CB LYS A 53 29.011 15.971 -2.722 1.00 0.00 C ATOM 869 CG LYS A 53 29.252 16.210 -1.217 1.00 0.00 C ATOM 870 CD LYS A 53 30.678 15.927 -0.725 1.00 0.00 C ATOM 871 CE LYS A 53 31.718 16.868 -1.355 1.00 0.00 C ATOM 872 NZ LYS A 53 33.082 16.637 -0.817 1.00 0.00 N ATOM 0 H LYS A 53 28.746 15.252 -5.065 1.00 0.00 H new ATOM 0 HA LYS A 53 29.766 13.997 -2.644 1.00 0.00 H new ATOM 0 HB2 LYS A 53 29.817 16.442 -3.285 1.00 0.00 H new ATOM 0 HB3 LYS A 53 28.086 16.469 -3.012 1.00 0.00 H new ATOM 0 HG2 LYS A 53 29.006 17.247 -0.987 1.00 0.00 H new ATOM 0 HG3 LYS A 53 28.560 15.585 -0.652 1.00 0.00 H new ATOM 0 HD2 LYS A 53 30.711 16.029 0.360 1.00 0.00 H new ATOM 0 HD3 LYS A 53 30.940 14.895 -0.956 1.00 0.00 H new ATOM 0 HE2 LYS A 53 31.727 16.726 -2.436 1.00 0.00 H new ATOM 0 HE3 LYS A 53 31.427 17.903 -1.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 33.750 17.293 -1.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 33.082 16.798 0.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 33.372 15.658 -1.014 1.00 0.00 H new ATOM 886 N SER A 54 27.507 12.496 -3.009 1.00 0.00 N ATOM 887 CA SER A 54 26.269 11.756 -2.832 1.00 0.00 C ATOM 888 C SER A 54 26.453 10.242 -2.797 1.00 0.00 C ATOM 889 O SER A 54 25.517 9.544 -2.421 1.00 0.00 O ATOM 890 CB SER A 54 25.365 12.140 -4.009 1.00 0.00 C ATOM 891 OG SER A 54 26.043 12.033 -5.258 1.00 0.00 O ATOM 0 H SER A 54 28.254 11.948 -3.436 1.00 0.00 H new ATOM 0 HA SER A 54 25.841 12.016 -1.864 1.00 0.00 H new ATOM 0 HB2 SER A 54 24.486 11.495 -4.017 1.00 0.00 H new ATOM 0 HB3 SER A 54 25.010 13.162 -3.875 1.00 0.00 H new ATOM 0 HG SER A 54 25.837 12.816 -5.810 1.00 0.00 H new ATOM 897 N THR A 55 27.619 9.718 -3.184 1.00 0.00 N ATOM 898 CA THR A 55 27.833 8.294 -3.411 1.00 0.00 C ATOM 899 C THR A 55 27.386 7.386 -2.246 1.00 0.00 C ATOM 900 O THR A 55 26.392 6.683 -2.435 1.00 0.00 O ATOM 901 CB THR A 55 29.241 8.126 -4.011 1.00 0.00 C ATOM 902 OG1 THR A 55 29.264 8.857 -5.225 1.00 0.00 O ATOM 903 CG2 THR A 55 29.593 6.688 -4.353 1.00 0.00 C ATOM 0 H THR A 55 28.451 10.284 -3.350 1.00 0.00 H new ATOM 0 HA THR A 55 27.148 7.893 -4.158 1.00 0.00 H new ATOM 0 HB THR A 55 29.958 8.472 -3.267 1.00 0.00 H new ATOM 0 HG1 THR A 55 29.337 8.236 -5.980 1.00 0.00 H new ATOM 0 HG21 THR A 55 30.599 6.649 -4.771 1.00 0.00 H new ATOM 0 HG22 THR A 55 29.551 6.079 -3.450 1.00 0.00 H new ATOM 0 HG23 THR A 55 28.882 6.303 -5.084 1.00 0.00 H new ATOM 911 N PRO A 56 27.989 7.379 -1.047 1.00 0.00 N ATOM 912 CA PRO A 56 27.476 6.582 0.066 1.00 0.00 C ATOM 913 C PRO A 56 26.033 6.912 0.473 1.00 0.00 C ATOM 914 O PRO A 56 25.294 6.004 0.856 1.00 0.00 O ATOM 915 CB PRO A 56 28.461 6.804 1.216 1.00 0.00 C ATOM 916 CG PRO A 56 29.766 7.043 0.462 1.00 0.00 C ATOM 917 CD PRO A 56 29.319 7.862 -0.739 1.00 0.00 C ATOM 0 HA PRO A 56 27.413 5.535 -0.229 1.00 0.00 H new ATOM 0 HB2 PRO A 56 28.183 7.658 1.834 1.00 0.00 H new ATOM 0 HB3 PRO A 56 28.522 5.939 1.876 1.00 0.00 H new ATOM 0 HG2 PRO A 56 30.492 7.582 1.071 1.00 0.00 H new ATOM 0 HG3 PRO A 56 30.236 6.107 0.160 1.00 0.00 H new ATOM 0 HD2 PRO A 56 29.309 8.927 -0.509 1.00 0.00 H new ATOM 0 HD3 PRO A 56 29.994 7.725 -1.584 1.00 0.00 H new ATOM 925 N LEU A 57 25.596 8.176 0.370 1.00 0.00 N ATOM 926 CA LEU A 57 24.223 8.549 0.728 1.00 0.00 C ATOM 927 C LEU A 57 23.219 7.866 -0.208 1.00 0.00 C ATOM 928 O LEU A 57 22.164 7.405 0.235 1.00 0.00 O ATOM 929 CB LEU A 57 24.008 10.077 0.698 1.00 0.00 C ATOM 930 CG LEU A 57 24.843 10.939 1.671 1.00 0.00 C ATOM 931 CD1 LEU A 57 24.152 12.275 1.929 1.00 0.00 C ATOM 932 CD2 LEU A 57 25.061 10.343 3.060 1.00 0.00 C ATOM 0 H LEU A 57 26.171 8.952 0.043 1.00 0.00 H new ATOM 0 HA LEU A 57 24.057 8.209 1.750 1.00 0.00 H new ATOM 0 HB2 LEU A 57 24.210 10.424 -0.315 1.00 0.00 H new ATOM 0 HB3 LEU A 57 22.954 10.271 0.898 1.00 0.00 H new ATOM 0 HG LEU A 57 25.804 11.021 1.164 1.00 0.00 H new ATOM 0 HD11 LEU A 57 24.754 12.869 2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 57 24.038 12.813 0.988 1.00 0.00 H new ATOM 0 HD13 LEU A 57 23.170 12.098 2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 57 25.658 11.029 3.661 1.00 0.00 H new ATOM 0 HD22 LEU A 57 24.097 10.183 3.543 1.00 0.00 H new ATOM 0 HD23 LEU A 57 25.583 9.391 2.969 1.00 0.00 H new ATOM 944 N ARG A 58 23.551 7.741 -1.499 1.00 0.00 N ATOM 945 CA ARG A 58 22.711 7.059 -2.480 1.00 0.00 C ATOM 946 C ARG A 58 22.521 5.576 -2.167 1.00 0.00 C ATOM 947 O ARG A 58 21.557 4.996 -2.664 1.00 0.00 O ATOM 948 CB ARG A 58 23.236 7.281 -3.909 1.00 0.00 C ATOM 949 CG ARG A 58 22.673 8.580 -4.501 1.00 0.00 C ATOM 950 CD ARG A 58 23.121 8.836 -5.943 1.00 0.00 C ATOM 951 NE ARG A 58 24.472 9.420 -6.004 1.00 0.00 N ATOM 952 CZ ARG A 58 25.631 8.780 -6.187 1.00 0.00 C ATOM 953 NH1 ARG A 58 25.692 7.451 -6.252 1.00 0.00 N ATOM 954 NH2 ARG A 58 26.737 9.502 -6.297 1.00 0.00 N ATOM 0 H ARG A 58 24.416 8.114 -1.890 1.00 0.00 H new ATOM 0 HA ARG A 58 21.720 7.509 -2.415 1.00 0.00 H new ATOM 0 HB2 ARG A 58 24.325 7.323 -3.899 1.00 0.00 H new ATOM 0 HB3 ARG A 58 22.955 6.437 -4.539 1.00 0.00 H new ATOM 0 HG2 ARG A 58 21.584 8.544 -4.468 1.00 0.00 H new ATOM 0 HG3 ARG A 58 22.983 9.419 -3.878 1.00 0.00 H new ATOM 0 HD2 ARG A 58 23.105 7.899 -6.500 1.00 0.00 H new ATOM 0 HD3 ARG A 58 22.413 9.507 -6.429 1.00 0.00 H new ATOM 0 HE ARG A 58 24.530 10.432 -5.894 1.00 0.00 H new ATOM 0 HH11 ARG A 58 24.841 6.896 -6.161 1.00 0.00 H new ATOM 0 HH12 ARG A 58 26.590 6.988 -6.392 1.00 0.00 H new ATOM 0 HH21 ARG A 58 26.690 10.519 -6.241 1.00 0.00 H new ATOM 0 HH22 ARG A 58 27.636 9.040 -6.437 1.00 0.00 H new ATOM 968 N LEU A 59 23.352 4.964 -1.316 1.00 0.00 N ATOM 969 CA LEU A 59 23.148 3.583 -0.904 1.00 0.00 C ATOM 970 C LEU A 59 21.853 3.466 -0.092 1.00 0.00 C ATOM 971 O LEU A 59 21.031 2.599 -0.383 1.00 0.00 O ATOM 972 CB LEU A 59 24.378 3.096 -0.115 1.00 0.00 C ATOM 973 CG LEU A 59 24.512 1.568 -0.006 1.00 0.00 C ATOM 974 CD1 LEU A 59 24.532 0.852 -1.364 1.00 0.00 C ATOM 975 CD2 LEU A 59 25.826 1.245 0.715 1.00 0.00 C ATOM 0 H LEU A 59 24.171 5.409 -0.902 1.00 0.00 H new ATOM 0 HA LEU A 59 23.040 2.942 -1.779 1.00 0.00 H new ATOM 0 HB2 LEU A 59 25.276 3.492 -0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 59 24.336 3.515 0.890 1.00 0.00 H new ATOM 0 HG LEU A 59 23.636 1.214 0.537 1.00 0.00 H new ATOM 0 HD11 LEU A 59 24.629 -0.222 -1.207 1.00 0.00 H new ATOM 0 HD12 LEU A 59 23.605 1.059 -1.898 1.00 0.00 H new ATOM 0 HD13 LEU A 59 25.377 1.210 -1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 59 25.938 0.164 0.801 1.00 0.00 H new ATOM 0 HD22 LEU A 59 26.662 1.652 0.147 1.00 0.00 H new ATOM 0 HD23 LEU A 59 25.814 1.689 1.710 1.00 0.00 H new ATOM 987 N ARG A 60 21.629 4.381 0.866 1.00 0.00 N ATOM 988 CA ARG A 60 20.364 4.444 1.615 1.00 0.00 C ATOM 989 C ARG A 60 19.208 4.785 0.681 1.00 0.00 C ATOM 990 O ARG A 60 18.125 4.213 0.796 1.00 0.00 O ATOM 991 CB ARG A 60 20.396 5.510 2.727 1.00 0.00 C ATOM 992 CG ARG A 60 21.477 5.315 3.797 1.00 0.00 C ATOM 993 CD ARG A 60 21.208 6.299 4.947 1.00 0.00 C ATOM 994 NE ARG A 60 22.308 6.353 5.919 1.00 0.00 N ATOM 995 CZ ARG A 60 22.570 5.493 6.909 1.00 0.00 C ATOM 996 NH1 ARG A 60 21.823 4.406 7.091 1.00 0.00 N ATOM 997 NH2 ARG A 60 23.590 5.740 7.721 1.00 0.00 N ATOM 0 H ARG A 60 22.310 5.089 1.140 1.00 0.00 H new ATOM 0 HA ARG A 60 20.226 3.461 2.065 1.00 0.00 H new ATOM 0 HB2 ARG A 60 20.538 6.487 2.266 1.00 0.00 H new ATOM 0 HB3 ARG A 60 19.423 5.528 3.218 1.00 0.00 H new ATOM 0 HG2 ARG A 60 21.465 4.289 4.165 1.00 0.00 H new ATOM 0 HG3 ARG A 60 22.466 5.489 3.373 1.00 0.00 H new ATOM 0 HD2 ARG A 60 21.043 7.295 4.536 1.00 0.00 H new ATOM 0 HD3 ARG A 60 20.290 6.010 5.459 1.00 0.00 H new ATOM 0 HE ARG A 60 22.949 7.141 5.828 1.00 0.00 H new ATOM 0 HH11 ARG A 60 21.036 4.218 6.470 1.00 0.00 H new ATOM 0 HH12 ARG A 60 22.038 3.761 7.851 1.00 0.00 H new ATOM 0 HH21 ARG A 60 24.160 6.575 7.585 1.00 0.00 H new ATOM 0 HH22 ARG A 60 23.804 5.095 8.481 1.00 0.00 H new ATOM 1011 N LEU A 61 19.450 5.735 -0.227 1.00 0.00 N ATOM 1012 CA LEU A 61 18.461 6.238 -1.172 1.00 0.00 C ATOM 1013 C LEU A 61 17.922 5.085 -2.023 1.00 0.00 C ATOM 1014 O LEU A 61 16.709 4.949 -2.172 1.00 0.00 O ATOM 1015 CB LEU A 61 19.106 7.355 -2.015 1.00 0.00 C ATOM 1016 CG LEU A 61 18.187 8.505 -2.452 1.00 0.00 C ATOM 1017 CD1 LEU A 61 16.989 8.034 -3.268 1.00 0.00 C ATOM 1018 CD2 LEU A 61 17.716 9.333 -1.255 1.00 0.00 C ATOM 0 H LEU A 61 20.361 6.183 -0.324 1.00 0.00 H new ATOM 0 HA LEU A 61 17.605 6.667 -0.650 1.00 0.00 H new ATOM 0 HB2 LEU A 61 19.933 7.778 -1.445 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.534 6.903 -2.909 1.00 0.00 H new ATOM 0 HG LEU A 61 18.793 9.137 -3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.378 8.893 -3.547 1.00 0.00 H new ATOM 0 HD12 LEU A 61 17.338 7.529 -4.169 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.393 7.342 -2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 61 17.068 10.138 -1.602 1.00 0.00 H new ATOM 0 HD22 LEU A 61 17.164 8.694 -0.565 1.00 0.00 H new ATOM 0 HD23 LEU A 61 18.580 9.758 -0.744 1.00 0.00 H new ATOM 1030 N TYR A 62 18.790 4.206 -2.526 1.00 0.00 N ATOM 1031 CA TYR A 62 18.338 2.987 -3.174 1.00 0.00 C ATOM 1032 C TYR A 62 17.618 2.083 -2.168 1.00 0.00 C ATOM 1033 O TYR A 62 16.452 1.753 -2.380 1.00 0.00 O ATOM 1034 CB TYR A 62 19.515 2.233 -3.821 1.00 0.00 C ATOM 1035 CG TYR A 62 19.150 0.791 -4.135 1.00 0.00 C ATOM 1036 CD1 TYR A 62 18.254 0.504 -5.184 1.00 0.00 C ATOM 1037 CD2 TYR A 62 19.571 -0.240 -3.272 1.00 0.00 C ATOM 1038 CE1 TYR A 62 17.759 -0.801 -5.348 1.00 0.00 C ATOM 1039 CE2 TYR A 62 19.092 -1.550 -3.439 1.00 0.00 C ATOM 1040 CZ TYR A 62 18.171 -1.834 -4.474 1.00 0.00 C ATOM 1041 OH TYR A 62 17.673 -3.092 -4.628 1.00 0.00 O ATOM 0 H TYR A 62 19.803 4.320 -2.495 1.00 0.00 H new ATOM 0 HA TYR A 62 17.639 3.265 -3.963 1.00 0.00 H new ATOM 0 HB2 TYR A 62 19.814 2.741 -4.738 1.00 0.00 H new ATOM 0 HB3 TYR A 62 20.374 2.254 -3.150 1.00 0.00 H new ATOM 0 HD1 TYR A 62 17.948 1.287 -5.862 1.00 0.00 H new ATOM 0 HD2 TYR A 62 20.267 -0.022 -2.476 1.00 0.00 H new ATOM 0 HE1 TYR A 62 17.062 -1.016 -6.144 1.00 0.00 H new ATOM 0 HE2 TYR A 62 19.426 -2.337 -2.779 1.00 0.00 H new ATOM 0 HH TYR A 62 18.059 -3.682 -3.947 1.00 0.00 H new ATOM 1051 N ASP A 63 18.295 1.723 -1.071 1.00 0.00 N ATOM 1052 CA ASP A 63 17.849 0.678 -0.150 1.00 0.00 C ATOM 1053 C ASP A 63 16.444 0.834 0.406 1.00 0.00 C ATOM 1054 O ASP A 63 15.705 -0.152 0.467 1.00 0.00 O ATOM 1055 CB ASP A 63 18.783 0.596 1.061 1.00 0.00 C ATOM 1056 CG ASP A 63 18.439 -0.621 1.936 1.00 0.00 C ATOM 1057 OD1 ASP A 63 18.664 -1.771 1.496 1.00 0.00 O ATOM 1058 OD2 ASP A 63 17.981 -0.434 3.085 1.00 0.00 O ATOM 0 H ASP A 63 19.177 2.156 -0.797 1.00 0.00 H new ATOM 0 HA ASP A 63 17.861 -0.219 -0.769 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.817 0.526 0.724 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.701 1.509 1.651 1.00 0.00 H new ATOM 1063 N ASN A 64 16.058 2.053 0.790 1.00 0.00 N ATOM 1064 CA ASN A 64 14.839 2.255 1.566 1.00 0.00 C ATOM 1065 C ASN A 64 13.918 3.343 1.003 1.00 0.00 C ATOM 1066 O ASN A 64 12.881 3.617 1.608 1.00 0.00 O ATOM 1067 CB ASN A 64 15.261 2.507 3.032 1.00 0.00 C ATOM 1068 CG ASN A 64 14.286 1.909 4.044 1.00 0.00 C ATOM 1069 OD1 ASN A 64 14.651 1.077 4.870 1.00 0.00 O ATOM 1070 ND2 ASN A 64 13.032 2.302 3.989 1.00 0.00 N ATOM 0 H ASN A 64 16.571 2.909 0.576 1.00 0.00 H new ATOM 0 HA ASN A 64 14.220 1.360 1.506 1.00 0.00 H new ATOM 0 HB2 ASN A 64 16.252 2.084 3.197 1.00 0.00 H new ATOM 0 HB3 ASN A 64 15.340 3.581 3.202 1.00 0.00 H new ATOM 0 HD21 ASN A 64 12.347 1.915 4.638 1.00 0.00 H new ATOM 0 HD22 ASN A 64 12.744 2.994 3.297 1.00 0.00 H new ATOM 1077 N PHE A 65 14.243 3.959 -0.138 1.00 0.00 N ATOM 1078 CA PHE A 65 13.437 5.042 -0.697 1.00 0.00 C ATOM 1079 C PHE A 65 13.053 4.688 -2.134 1.00 0.00 C ATOM 1080 O PHE A 65 11.890 4.386 -2.388 1.00 0.00 O ATOM 1081 CB PHE A 65 14.194 6.372 -0.538 1.00 0.00 C ATOM 1082 CG PHE A 65 13.387 7.635 -0.759 1.00 0.00 C ATOM 1083 CD1 PHE A 65 12.905 7.959 -2.040 1.00 0.00 C ATOM 1084 CD2 PHE A 65 13.173 8.529 0.307 1.00 0.00 C ATOM 1085 CE1 PHE A 65 12.177 9.143 -2.240 1.00 0.00 C ATOM 1086 CE2 PHE A 65 12.504 9.743 0.090 1.00 0.00 C ATOM 1087 CZ PHE A 65 11.984 10.042 -1.179 1.00 0.00 C ATOM 0 H PHE A 65 15.065 3.722 -0.694 1.00 0.00 H new ATOM 0 HA PHE A 65 12.498 5.170 -0.159 1.00 0.00 H new ATOM 0 HB2 PHE A 65 14.616 6.407 0.466 1.00 0.00 H new ATOM 0 HB3 PHE A 65 15.031 6.375 -1.236 1.00 0.00 H new ATOM 0 HD1 PHE A 65 13.095 7.296 -2.871 1.00 0.00 H new ATOM 0 HD2 PHE A 65 13.526 8.279 1.297 1.00 0.00 H new ATOM 0 HE1 PHE A 65 11.764 9.363 -3.213 1.00 0.00 H new ATOM 0 HE2 PHE A 65 12.389 10.448 0.900 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.438 10.960 -1.339 1.00 0.00 H new ATOM 1097 N VAL A 66 14.007 4.642 -3.068 1.00 0.00 N ATOM 1098 CA VAL A 66 13.727 4.303 -4.465 1.00 0.00 C ATOM 1099 C VAL A 66 13.284 2.836 -4.588 1.00 0.00 C ATOM 1100 O VAL A 66 12.481 2.521 -5.468 1.00 0.00 O ATOM 1101 CB VAL A 66 14.939 4.697 -5.339 1.00 0.00 C ATOM 1102 CG1 VAL A 66 14.925 4.116 -6.759 1.00 0.00 C ATOM 1103 CG2 VAL A 66 14.991 6.229 -5.475 1.00 0.00 C ATOM 0 H VAL A 66 14.990 4.838 -2.878 1.00 0.00 H new ATOM 0 HA VAL A 66 12.882 4.878 -4.844 1.00 0.00 H new ATOM 0 HB VAL A 66 15.807 4.283 -4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 66 15.814 4.447 -7.296 1.00 0.00 H new ATOM 0 HG12 VAL A 66 14.917 3.027 -6.707 1.00 0.00 H new ATOM 0 HG13 VAL A 66 14.034 4.461 -7.284 1.00 0.00 H new ATOM 0 HG21 VAL A 66 15.845 6.511 -6.091 1.00 0.00 H new ATOM 0 HG22 VAL A 66 14.073 6.584 -5.943 1.00 0.00 H new ATOM 0 HG23 VAL A 66 15.092 6.679 -4.487 1.00 0.00 H new ATOM 1113 N SER A 67 13.692 1.950 -3.671 1.00 0.00 N ATOM 1114 CA SER A 67 13.188 0.583 -3.584 1.00 0.00 C ATOM 1115 C SER A 67 11.656 0.511 -3.527 1.00 0.00 C ATOM 1116 O SER A 67 11.064 -0.461 -4.000 1.00 0.00 O ATOM 1117 CB SER A 67 13.808 -0.098 -2.360 1.00 0.00 C ATOM 1118 OG SER A 67 13.680 0.711 -1.203 1.00 0.00 O ATOM 0 H SER A 67 14.391 2.170 -2.961 1.00 0.00 H new ATOM 0 HA SER A 67 13.479 0.061 -4.495 1.00 0.00 H new ATOM 0 HB2 SER A 67 13.322 -1.059 -2.190 1.00 0.00 H new ATOM 0 HB3 SER A 67 14.862 -0.302 -2.549 1.00 0.00 H new ATOM 0 HG SER A 67 14.272 0.371 -0.499 1.00 0.00 H new ATOM 1124 N LYS A 68 11.000 1.538 -2.971 1.00 0.00 N ATOM 1125 CA LYS A 68 9.551 1.566 -2.812 1.00 0.00 C ATOM 1126 C LYS A 68 8.828 1.800 -4.146 1.00 0.00 C ATOM 1127 O LYS A 68 7.626 1.537 -4.207 1.00 0.00 O ATOM 1128 CB LYS A 68 9.154 2.644 -1.783 1.00 0.00 C ATOM 1129 CG LYS A 68 9.887 2.595 -0.427 1.00 0.00 C ATOM 1130 CD LYS A 68 9.608 1.332 0.399 1.00 0.00 C ATOM 1131 CE LYS A 68 10.316 1.470 1.756 1.00 0.00 C ATOM 1132 NZ LYS A 68 9.953 0.398 2.714 1.00 0.00 N ATOM 0 H LYS A 68 11.467 2.374 -2.619 1.00 0.00 H new ATOM 0 HA LYS A 68 9.239 0.588 -2.447 1.00 0.00 H new ATOM 0 HB2 LYS A 68 9.325 3.623 -2.230 1.00 0.00 H new ATOM 0 HB3 LYS A 68 8.083 2.562 -1.597 1.00 0.00 H new ATOM 0 HG2 LYS A 68 10.960 2.668 -0.605 1.00 0.00 H new ATOM 0 HG3 LYS A 68 9.600 3.468 0.159 1.00 0.00 H new ATOM 0 HD2 LYS A 68 8.535 1.203 0.543 1.00 0.00 H new ATOM 0 HD3 LYS A 68 9.968 0.448 -0.128 1.00 0.00 H new ATOM 0 HE2 LYS A 68 11.395 1.459 1.599 1.00 0.00 H new ATOM 0 HE3 LYS A 68 10.068 2.438 2.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 10.381 0.601 3.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 8.919 0.356 2.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 10.305 -0.515 2.363 1.00 0.00 H new ATOM 1146 N PHE A 69 9.499 2.297 -5.198 1.00 0.00 N ATOM 1147 CA PHE A 69 8.836 2.732 -6.433 1.00 0.00 C ATOM 1148 C PHE A 69 9.694 2.572 -7.697 1.00 0.00 C ATOM 1149 O PHE A 69 9.399 3.216 -8.704 1.00 0.00 O ATOM 1150 CB PHE A 69 8.316 4.178 -6.274 1.00 0.00 C ATOM 1151 CG PHE A 69 9.370 5.234 -5.984 1.00 0.00 C ATOM 1152 CD1 PHE A 69 10.050 5.891 -7.029 1.00 0.00 C ATOM 1153 CD2 PHE A 69 9.640 5.589 -4.651 1.00 0.00 C ATOM 1154 CE1 PHE A 69 11.003 6.885 -6.736 1.00 0.00 C ATOM 1155 CE2 PHE A 69 10.588 6.580 -4.359 1.00 0.00 C ATOM 1156 CZ PHE A 69 11.273 7.228 -5.399 1.00 0.00 C ATOM 0 H PHE A 69 10.513 2.407 -5.214 1.00 0.00 H new ATOM 0 HA PHE A 69 7.991 2.060 -6.585 1.00 0.00 H new ATOM 0 HB2 PHE A 69 7.791 4.457 -7.188 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.583 4.193 -5.468 1.00 0.00 H new ATOM 0 HD1 PHE A 69 9.840 5.632 -8.056 1.00 0.00 H new ATOM 0 HD2 PHE A 69 9.114 5.096 -3.847 1.00 0.00 H new ATOM 0 HE1 PHE A 69 11.527 7.384 -7.538 1.00 0.00 H new ATOM 0 HE2 PHE A 69 10.792 6.845 -3.332 1.00 0.00 H new ATOM 0 HZ PHE A 69 12.006 7.988 -5.173 1.00 0.00 H new ATOM 1166 N TYR A 70 10.728 1.721 -7.714 1.00 0.00 N ATOM 1167 CA TYR A 70 11.584 1.560 -8.897 1.00 0.00 C ATOM 1168 C TYR A 70 10.855 1.060 -10.159 1.00 0.00 C ATOM 1169 O TYR A 70 11.426 1.093 -11.249 1.00 0.00 O ATOM 1170 CB TYR A 70 12.860 0.767 -8.589 1.00 0.00 C ATOM 1171 CG TYR A 70 12.733 -0.575 -7.896 1.00 0.00 C ATOM 1172 CD1 TYR A 70 11.750 -1.511 -8.272 1.00 0.00 C ATOM 1173 CD2 TYR A 70 13.668 -0.912 -6.901 1.00 0.00 C ATOM 1174 CE1 TYR A 70 11.685 -2.759 -7.639 1.00 0.00 C ATOM 1175 CE2 TYR A 70 13.607 -2.160 -6.262 1.00 0.00 C ATOM 1176 CZ TYR A 70 12.612 -3.095 -6.628 1.00 0.00 C ATOM 1177 OH TYR A 70 12.563 -4.311 -6.019 1.00 0.00 O ATOM 0 H TYR A 70 10.992 1.134 -6.923 1.00 0.00 H new ATOM 0 HA TYR A 70 11.894 2.573 -9.156 1.00 0.00 H new ATOM 0 HB2 TYR A 70 13.384 0.604 -9.531 1.00 0.00 H new ATOM 0 HB3 TYR A 70 13.501 1.398 -7.973 1.00 0.00 H new ATOM 0 HD1 TYR A 70 11.044 -1.266 -9.051 1.00 0.00 H new ATOM 0 HD2 TYR A 70 14.438 -0.206 -6.627 1.00 0.00 H new ATOM 0 HE1 TYR A 70 10.922 -3.468 -7.926 1.00 0.00 H new ATOM 0 HE2 TYR A 70 14.321 -2.406 -5.490 1.00 0.00 H new ATOM 0 HH TYR A 70 11.986 -4.912 -6.535 1.00 0.00 H new ATOM 1187 N ASP A 71 9.602 0.609 -10.051 1.00 0.00 N ATOM 1188 CA ASP A 71 8.745 0.296 -11.198 1.00 0.00 C ATOM 1189 C ASP A 71 8.273 1.565 -11.932 1.00 0.00 C ATOM 1190 O ASP A 71 7.945 1.510 -13.117 1.00 0.00 O ATOM 1191 CB ASP A 71 7.527 -0.495 -10.702 1.00 0.00 C ATOM 1192 CG ASP A 71 6.541 -0.831 -11.832 1.00 0.00 C ATOM 1193 OD1 ASP A 71 6.906 -1.611 -12.741 1.00 0.00 O ATOM 1194 OD2 ASP A 71 5.385 -0.352 -11.774 1.00 0.00 O ATOM 0 H ASP A 71 9.148 0.449 -9.152 1.00 0.00 H new ATOM 0 HA ASP A 71 9.326 -0.293 -11.908 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.865 -1.419 -10.233 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.011 0.082 -9.934 1.00 0.00 H new ATOM 1199 N LYS A 72 8.248 2.716 -11.247 1.00 0.00 N ATOM 1200 CA LYS A 72 7.625 3.954 -11.727 1.00 0.00 C ATOM 1201 C LYS A 72 8.616 4.905 -12.397 1.00 0.00 C ATOM 1202 O LYS A 72 8.182 5.918 -12.945 1.00 0.00 O ATOM 1203 CB LYS A 72 6.902 4.669 -10.564 1.00 0.00 C ATOM 1204 CG LYS A 72 5.958 3.784 -9.726 1.00 0.00 C ATOM 1205 CD LYS A 72 4.934 3.010 -10.570 1.00 0.00 C ATOM 1206 CE LYS A 72 4.090 2.088 -9.680 1.00 0.00 C ATOM 1207 NZ LYS A 72 3.360 1.077 -10.481 1.00 0.00 N ATOM 0 H LYS A 72 8.670 2.813 -10.323 1.00 0.00 H new ATOM 0 HA LYS A 72 6.904 3.667 -12.492 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.653 5.098 -9.901 1.00 0.00 H new ATOM 0 HB3 LYS A 72 6.326 5.499 -10.973 1.00 0.00 H new ATOM 0 HG2 LYS A 72 6.553 3.075 -9.151 1.00 0.00 H new ATOM 0 HG3 LYS A 72 5.427 4.410 -9.009 1.00 0.00 H new ATOM 0 HD2 LYS A 72 4.285 3.710 -11.097 1.00 0.00 H new ATOM 0 HD3 LYS A 72 5.450 2.421 -11.328 1.00 0.00 H new ATOM 0 HE2 LYS A 72 4.736 1.586 -8.960 1.00 0.00 H new ATOM 0 HE3 LYS A 72 3.378 2.684 -9.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.924 0.379 -9.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 2.620 1.546 -11.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 4.024 0.595 -11.120 1.00 0.00 H new ATOM 1221 N ILE A 73 9.916 4.604 -12.375 1.00 0.00 N ATOM 1222 CA ILE A 73 10.961 5.435 -12.971 1.00 0.00 C ATOM 1223 C ILE A 73 11.948 4.550 -13.724 1.00 0.00 C ATOM 1224 O ILE A 73 11.918 3.327 -13.597 1.00 0.00 O ATOM 1225 CB ILE A 73 11.658 6.321 -11.910 1.00 0.00 C ATOM 1226 CG1 ILE A 73 12.276 5.514 -10.745 1.00 0.00 C ATOM 1227 CG2 ILE A 73 10.662 7.373 -11.406 1.00 0.00 C ATOM 1228 CD1 ILE A 73 13.294 6.333 -9.939 1.00 0.00 C ATOM 0 H ILE A 73 10.278 3.759 -11.933 1.00 0.00 H new ATOM 0 HA ILE A 73 10.505 6.121 -13.684 1.00 0.00 H new ATOM 0 HB ILE A 73 12.504 6.814 -12.389 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.481 5.173 -10.081 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.763 4.624 -11.142 1.00 0.00 H new ATOM 0 HG21 ILE A 73 11.145 8.002 -10.658 1.00 0.00 H new ATOM 0 HG22 ILE A 73 10.332 7.991 -12.241 1.00 0.00 H new ATOM 0 HG23 ILE A 73 9.801 6.875 -10.960 1.00 0.00 H new ATOM 0 HD11 ILE A 73 13.698 5.720 -9.133 1.00 0.00 H new ATOM 0 HD12 ILE A 73 14.105 6.652 -10.594 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.803 7.210 -9.517 1.00 0.00 H new ATOM 1240 N ASN A 74 12.808 5.179 -14.527 1.00 0.00 N ATOM 1241 CA ASN A 74 13.779 4.489 -15.365 1.00 0.00 C ATOM 1242 C ASN A 74 14.698 3.606 -14.520 1.00 0.00 C ATOM 1243 O ASN A 74 15.412 4.109 -13.649 1.00 0.00 O ATOM 1244 CB ASN A 74 14.593 5.528 -16.148 1.00 0.00 C ATOM 1245 CG ASN A 74 15.819 4.926 -16.828 1.00 0.00 C ATOM 1246 OD1 ASN A 74 15.787 3.813 -17.344 1.00 0.00 O ATOM 1247 ND2 ASN A 74 16.937 5.627 -16.802 1.00 0.00 N ATOM 0 H ASN A 74 12.847 6.195 -14.612 1.00 0.00 H new ATOM 0 HA ASN A 74 13.253 3.840 -16.065 1.00 0.00 H new ATOM 0 HB2 ASN A 74 13.955 5.990 -16.901 1.00 0.00 H new ATOM 0 HB3 ASN A 74 14.911 6.320 -15.470 1.00 0.00 H new ATOM 0 HD21 ASN A 74 17.788 5.245 -17.214 1.00 0.00 H new ATOM 0 HD22 ASN A 74 16.950 6.551 -16.370 1.00 0.00 H new ATOM 1254 N GLN A 75 14.726 2.300 -14.792 1.00 0.00 N ATOM 1255 CA GLN A 75 15.535 1.365 -14.018 1.00 0.00 C ATOM 1256 C GLN A 75 17.035 1.641 -14.176 1.00 0.00 C ATOM 1257 O GLN A 75 17.789 1.373 -13.244 1.00 0.00 O ATOM 1258 CB GLN A 75 15.210 -0.093 -14.387 1.00 0.00 C ATOM 1259 CG GLN A 75 13.826 -0.556 -13.896 1.00 0.00 C ATOM 1260 CD GLN A 75 12.648 0.029 -14.680 1.00 0.00 C ATOM 1261 OE1 GLN A 75 12.697 0.172 -15.900 1.00 0.00 O ATOM 1262 NE2 GLN A 75 11.568 0.393 -14.012 1.00 0.00 N ATOM 0 H GLN A 75 14.194 1.867 -15.547 1.00 0.00 H new ATOM 0 HA GLN A 75 15.280 1.517 -12.969 1.00 0.00 H new ATOM 0 HB2 GLN A 75 15.259 -0.205 -15.470 1.00 0.00 H new ATOM 0 HB3 GLN A 75 15.974 -0.746 -13.964 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.779 -1.644 -13.952 1.00 0.00 H new ATOM 0 HG3 GLN A 75 13.718 -0.286 -12.846 1.00 0.00 H new ATOM 0 HE21 GLN A 75 11.530 0.273 -13.000 1.00 0.00 H new ATOM 0 HE22 GLN A 75 10.772 0.794 -14.508 1.00 0.00 H new ATOM 1271 N LEU A 76 17.489 2.210 -15.300 1.00 0.00 N ATOM 1272 CA LEU A 76 18.898 2.582 -15.438 1.00 0.00 C ATOM 1273 C LEU A 76 19.239 3.743 -14.502 1.00 0.00 C ATOM 1274 O LEU A 76 20.359 3.775 -14.001 1.00 0.00 O ATOM 1275 CB LEU A 76 19.287 2.868 -16.899 1.00 0.00 C ATOM 1276 CG LEU A 76 19.100 1.669 -17.856 1.00 0.00 C ATOM 1277 CD1 LEU A 76 19.598 2.046 -19.254 1.00 0.00 C ATOM 1278 CD2 LEU A 76 19.834 0.406 -17.385 1.00 0.00 C ATOM 0 H LEU A 76 16.910 2.419 -16.113 1.00 0.00 H new ATOM 0 HA LEU A 76 19.501 1.726 -15.136 1.00 0.00 H new ATOM 0 HB2 LEU A 76 18.691 3.705 -17.264 1.00 0.00 H new ATOM 0 HB3 LEU A 76 20.330 3.182 -16.930 1.00 0.00 H new ATOM 0 HG LEU A 76 18.035 1.439 -17.871 1.00 0.00 H new ATOM 0 HD11 LEU A 76 19.466 1.200 -19.928 1.00 0.00 H new ATOM 0 HD12 LEU A 76 19.029 2.898 -19.625 1.00 0.00 H new ATOM 0 HD13 LEU A 76 20.655 2.309 -19.205 1.00 0.00 H new ATOM 0 HD21 LEU A 76 19.664 -0.401 -18.098 1.00 0.00 H new ATOM 0 HD22 LEU A 76 20.902 0.611 -17.316 1.00 0.00 H new ATOM 0 HD23 LEU A 76 19.457 0.110 -16.406 1.00 0.00 H new ATOM 1290 N SER A 77 18.302 4.642 -14.186 1.00 0.00 N ATOM 1291 CA SER A 77 18.509 5.639 -13.144 1.00 0.00 C ATOM 1292 C SER A 77 18.726 4.939 -11.806 1.00 0.00 C ATOM 1293 O SER A 77 19.753 5.170 -11.164 1.00 0.00 O ATOM 1294 CB SER A 77 17.348 6.638 -13.099 1.00 0.00 C ATOM 1295 OG SER A 77 17.122 7.203 -14.384 1.00 0.00 O ATOM 0 H SER A 77 17.391 4.696 -14.642 1.00 0.00 H new ATOM 0 HA SER A 77 19.404 6.219 -13.370 1.00 0.00 H new ATOM 0 HB2 SER A 77 16.444 6.137 -12.752 1.00 0.00 H new ATOM 0 HB3 SER A 77 17.569 7.429 -12.382 1.00 0.00 H new ATOM 0 HG SER A 77 16.376 7.837 -14.336 1.00 0.00 H new ATOM 1301 N VAL A 78 17.817 4.036 -11.409 1.00 0.00 N ATOM 1302 CA VAL A 78 17.913 3.425 -10.084 1.00 0.00 C ATOM 1303 C VAL A 78 19.202 2.611 -9.958 1.00 0.00 C ATOM 1304 O VAL A 78 19.885 2.723 -8.934 1.00 0.00 O ATOM 1305 CB VAL A 78 16.643 2.654 -9.657 1.00 0.00 C ATOM 1306 CG1 VAL A 78 15.367 3.382 -10.103 1.00 0.00 C ATOM 1307 CG2 VAL A 78 16.563 1.186 -10.087 1.00 0.00 C ATOM 0 H VAL A 78 17.028 3.722 -11.973 1.00 0.00 H new ATOM 0 HA VAL A 78 17.972 4.237 -9.359 1.00 0.00 H new ATOM 0 HB VAL A 78 16.722 2.635 -8.570 1.00 0.00 H new ATOM 0 HG11 VAL A 78 14.493 2.812 -9.786 1.00 0.00 H new ATOM 0 HG12 VAL A 78 15.337 4.373 -9.651 1.00 0.00 H new ATOM 0 HG13 VAL A 78 15.363 3.478 -11.189 1.00 0.00 H new ATOM 0 HG21 VAL A 78 15.629 0.753 -9.730 1.00 0.00 H new ATOM 0 HG22 VAL A 78 16.600 1.123 -11.175 1.00 0.00 H new ATOM 0 HG23 VAL A 78 17.403 0.636 -9.663 1.00 0.00 H new ATOM 1317 N VAL A 79 19.583 1.841 -10.989 1.00 0.00 N ATOM 1318 CA VAL A 79 20.817 1.097 -10.918 1.00 0.00 C ATOM 1319 C VAL A 79 22.013 2.038 -10.946 1.00 0.00 C ATOM 1320 O VAL A 79 22.922 1.781 -10.176 1.00 0.00 O ATOM 1321 CB VAL A 79 20.925 -0.049 -11.938 1.00 0.00 C ATOM 1322 CG1 VAL A 79 19.864 -1.125 -11.680 1.00 0.00 C ATOM 1323 CG2 VAL A 79 20.934 0.330 -13.420 1.00 0.00 C ATOM 0 H VAL A 79 19.058 1.728 -11.856 1.00 0.00 H new ATOM 0 HA VAL A 79 20.816 0.585 -9.956 1.00 0.00 H new ATOM 0 HB VAL A 79 21.928 -0.435 -11.756 1.00 0.00 H new ATOM 0 HG11 VAL A 79 19.966 -1.921 -12.417 1.00 0.00 H new ATOM 0 HG12 VAL A 79 19.999 -1.537 -10.680 1.00 0.00 H new ATOM 0 HG13 VAL A 79 18.871 -0.683 -11.759 1.00 0.00 H new ATOM 0 HG21 VAL A 79 21.014 -0.573 -14.026 1.00 0.00 H new ATOM 0 HG22 VAL A 79 20.010 0.852 -13.668 1.00 0.00 H new ATOM 0 HG23 VAL A 79 21.784 0.981 -13.624 1.00 0.00 H new ATOM 1333 N LYS A 80 22.055 3.127 -11.732 1.00 0.00 N ATOM 1334 CA LYS A 80 23.224 4.021 -11.749 1.00 0.00 C ATOM 1335 C LYS A 80 23.515 4.565 -10.357 1.00 0.00 C ATOM 1336 O LYS A 80 24.681 4.640 -9.968 1.00 0.00 O ATOM 1337 CB LYS A 80 23.034 5.174 -12.752 1.00 0.00 C ATOM 1338 CG LYS A 80 23.355 4.777 -14.203 1.00 0.00 C ATOM 1339 CD LYS A 80 24.864 4.684 -14.479 1.00 0.00 C ATOM 1340 CE LYS A 80 25.099 4.343 -15.957 1.00 0.00 C ATOM 1341 NZ LYS A 80 26.543 4.280 -16.300 1.00 0.00 N ATOM 0 H LYS A 80 21.300 3.407 -12.358 1.00 0.00 H new ATOM 0 HA LYS A 80 24.082 3.432 -12.073 1.00 0.00 H new ATOM 0 HB2 LYS A 80 22.004 5.527 -12.699 1.00 0.00 H new ATOM 0 HB3 LYS A 80 23.672 6.008 -12.461 1.00 0.00 H new ATOM 0 HG2 LYS A 80 22.891 3.815 -14.422 1.00 0.00 H new ATOM 0 HG3 LYS A 80 22.911 5.507 -14.880 1.00 0.00 H new ATOM 0 HD2 LYS A 80 25.348 5.629 -14.232 1.00 0.00 H new ATOM 0 HD3 LYS A 80 25.313 3.921 -13.844 1.00 0.00 H new ATOM 0 HE2 LYS A 80 24.632 3.385 -16.185 1.00 0.00 H new ATOM 0 HE3 LYS A 80 24.612 5.092 -16.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 26.651 4.047 -17.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 26.986 5.201 -16.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 27.005 3.548 -15.724 1.00 0.00 H new ATOM 1355 N TYR A 81 22.469 4.901 -9.601 1.00 0.00 N ATOM 1356 CA TYR A 81 22.622 5.418 -8.249 1.00 0.00 C ATOM 1357 C TYR A 81 23.300 4.356 -7.377 1.00 0.00 C ATOM 1358 O TYR A 81 24.362 4.621 -6.808 1.00 0.00 O ATOM 1359 CB TYR A 81 21.260 5.851 -7.671 1.00 0.00 C ATOM 1360 CG TYR A 81 20.444 6.842 -8.495 1.00 0.00 C ATOM 1361 CD1 TYR A 81 21.061 7.837 -9.287 1.00 0.00 C ATOM 1362 CD2 TYR A 81 19.037 6.755 -8.474 1.00 0.00 C ATOM 1363 CE1 TYR A 81 20.287 8.704 -10.077 1.00 0.00 C ATOM 1364 CE2 TYR A 81 18.255 7.612 -9.270 1.00 0.00 C ATOM 1365 CZ TYR A 81 18.878 8.584 -10.084 1.00 0.00 C ATOM 1366 OH TYR A 81 18.109 9.403 -10.855 1.00 0.00 O ATOM 0 H TYR A 81 21.500 4.822 -9.910 1.00 0.00 H new ATOM 0 HA TYR A 81 23.254 6.306 -8.267 1.00 0.00 H new ATOM 0 HB2 TYR A 81 20.656 4.956 -7.520 1.00 0.00 H new ATOM 0 HB3 TYR A 81 21.432 6.288 -6.688 1.00 0.00 H new ATOM 0 HD1 TYR A 81 22.137 7.932 -9.285 1.00 0.00 H new ATOM 0 HD2 TYR A 81 18.555 6.024 -7.841 1.00 0.00 H new ATOM 0 HE1 TYR A 81 20.768 9.461 -10.678 1.00 0.00 H new ATOM 0 HE2 TYR A 81 17.178 7.527 -9.259 1.00 0.00 H new ATOM 0 HH TYR A 81 17.164 9.175 -10.733 1.00 0.00 H new ATOM 1376 N LEU A 82 22.710 3.155 -7.329 1.00 0.00 N ATOM 1377 CA LEU A 82 23.218 2.031 -6.543 1.00 0.00 C ATOM 1378 C LEU A 82 24.629 1.642 -6.986 1.00 0.00 C ATOM 1379 O LEU A 82 25.494 1.444 -6.139 1.00 0.00 O ATOM 1380 CB LEU A 82 22.247 0.845 -6.680 1.00 0.00 C ATOM 1381 CG LEU A 82 22.726 -0.463 -6.016 1.00 0.00 C ATOM 1382 CD1 LEU A 82 22.990 -0.318 -4.515 1.00 0.00 C ATOM 1383 CD2 LEU A 82 21.674 -1.551 -6.249 1.00 0.00 C ATOM 0 H LEU A 82 21.856 2.937 -7.842 1.00 0.00 H new ATOM 0 HA LEU A 82 23.282 2.324 -5.495 1.00 0.00 H new ATOM 0 HB2 LEU A 82 21.288 1.127 -6.245 1.00 0.00 H new ATOM 0 HB3 LEU A 82 22.074 0.656 -7.739 1.00 0.00 H new ATOM 0 HG LEU A 82 23.678 -0.730 -6.475 1.00 0.00 H new ATOM 0 HD11 LEU A 82 23.324 -1.273 -4.110 1.00 0.00 H new ATOM 0 HD12 LEU A 82 23.762 0.434 -4.352 1.00 0.00 H new ATOM 0 HD13 LEU A 82 22.073 -0.012 -4.012 1.00 0.00 H new ATOM 0 HD21 LEU A 82 22.002 -2.480 -5.784 1.00 0.00 H new ATOM 0 HD22 LEU A 82 20.726 -1.241 -5.810 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.544 -1.708 -7.320 1.00 0.00 H new ATOM 1395 N LEU A 83 24.858 1.543 -8.299 1.00 0.00 N ATOM 1396 CA LEU A 83 26.121 1.167 -8.920 1.00 0.00 C ATOM 1397 C LEU A 83 27.235 2.020 -8.335 1.00 0.00 C ATOM 1398 O LEU A 83 28.146 1.463 -7.737 1.00 0.00 O ATOM 1399 CB LEU A 83 26.051 1.323 -10.459 1.00 0.00 C ATOM 1400 CG LEU A 83 25.365 0.149 -11.199 1.00 0.00 C ATOM 1401 CD1 LEU A 83 24.820 0.566 -12.578 1.00 0.00 C ATOM 1402 CD2 LEU A 83 26.348 -1.012 -11.389 1.00 0.00 C ATOM 0 H LEU A 83 24.129 1.733 -8.987 1.00 0.00 H new ATOM 0 HA LEU A 83 26.326 0.117 -8.711 1.00 0.00 H new ATOM 0 HB2 LEU A 83 25.517 2.244 -10.693 1.00 0.00 H new ATOM 0 HB3 LEU A 83 27.064 1.435 -10.845 1.00 0.00 H new ATOM 0 HG LEU A 83 24.526 -0.163 -10.577 1.00 0.00 H new ATOM 0 HD11 LEU A 83 24.348 -0.292 -13.057 1.00 0.00 H new ATOM 0 HD12 LEU A 83 24.085 1.362 -12.453 1.00 0.00 H new ATOM 0 HD13 LEU A 83 25.640 0.924 -13.200 1.00 0.00 H new ATOM 0 HD21 LEU A 83 25.850 -1.829 -11.911 1.00 0.00 H new ATOM 0 HD22 LEU A 83 27.202 -0.674 -11.976 1.00 0.00 H new ATOM 0 HD23 LEU A 83 26.693 -1.360 -10.415 1.00 0.00 H new ATOM 1414 N ALA A 84 27.152 3.352 -8.431 1.00 0.00 N ATOM 1415 CA ALA A 84 28.218 4.196 -7.902 1.00 0.00 C ATOM 1416 C ALA A 84 28.428 3.951 -6.412 1.00 0.00 C ATOM 1417 O ALA A 84 29.572 3.800 -5.986 1.00 0.00 O ATOM 1418 CB ALA A 84 27.930 5.676 -8.153 1.00 0.00 C ATOM 0 H ALA A 84 26.375 3.855 -8.860 1.00 0.00 H new ATOM 0 HA ALA A 84 29.133 3.928 -8.430 1.00 0.00 H new ATOM 0 HB1 ALA A 84 28.743 6.279 -7.747 1.00 0.00 H new ATOM 0 HB2 ALA A 84 27.847 5.854 -9.225 1.00 0.00 H new ATOM 0 HB3 ALA A 84 26.995 5.952 -7.666 1.00 0.00 H new ATOM 1424 N SER A 85 27.351 3.892 -5.626 1.00 0.00 N ATOM 1425 CA SER A 85 27.455 3.686 -4.186 1.00 0.00 C ATOM 1426 C SER A 85 28.176 2.376 -3.840 1.00 0.00 C ATOM 1427 O SER A 85 29.076 2.345 -2.995 1.00 0.00 O ATOM 1428 CB SER A 85 26.045 3.684 -3.591 1.00 0.00 C ATOM 1429 OG SER A 85 25.338 4.845 -3.974 1.00 0.00 O ATOM 0 H SER A 85 26.394 3.985 -5.968 1.00 0.00 H new ATOM 0 HA SER A 85 28.049 4.496 -3.762 1.00 0.00 H new ATOM 0 HB2 SER A 85 25.506 2.798 -3.925 1.00 0.00 H new ATOM 0 HB3 SER A 85 26.104 3.631 -2.504 1.00 0.00 H new ATOM 0 HG SER A 85 25.700 5.621 -3.497 1.00 0.00 H new ATOM 1435 N LEU A 86 27.798 1.285 -4.502 1.00 0.00 N ATOM 1436 CA LEU A 86 28.228 -0.055 -4.133 1.00 0.00 C ATOM 1437 C LEU A 86 29.583 -0.412 -4.750 1.00 0.00 C ATOM 1438 O LEU A 86 30.383 -1.093 -4.108 1.00 0.00 O ATOM 1439 CB LEU A 86 27.109 -1.025 -4.532 1.00 0.00 C ATOM 1440 CG LEU A 86 27.217 -2.432 -3.921 1.00 0.00 C ATOM 1441 CD1 LEU A 86 27.458 -2.438 -2.405 1.00 0.00 C ATOM 1442 CD2 LEU A 86 25.898 -3.157 -4.201 1.00 0.00 C ATOM 0 H LEU A 86 27.181 1.309 -5.314 1.00 0.00 H new ATOM 0 HA LEU A 86 28.392 -0.120 -3.057 1.00 0.00 H new ATOM 0 HB2 LEU A 86 26.152 -0.592 -4.240 1.00 0.00 H new ATOM 0 HB3 LEU A 86 27.099 -1.117 -5.618 1.00 0.00 H new ATOM 0 HG LEU A 86 28.080 -2.919 -4.375 1.00 0.00 H new ATOM 0 HD11 LEU A 86 27.522 -3.467 -2.051 1.00 0.00 H new ATOM 0 HD12 LEU A 86 28.390 -1.919 -2.183 1.00 0.00 H new ATOM 0 HD13 LEU A 86 26.633 -1.933 -1.903 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.939 -4.162 -3.780 1.00 0.00 H new ATOM 0 HD22 LEU A 86 25.076 -2.606 -3.745 1.00 0.00 H new ATOM 0 HD23 LEU A 86 25.739 -3.220 -5.277 1.00 0.00 H new ATOM 1454 N LYS A 87 29.892 0.124 -5.937 1.00 0.00 N ATOM 1455 CA LYS A 87 31.230 0.029 -6.518 1.00 0.00 C ATOM 1456 C LYS A 87 32.206 0.800 -5.632 1.00 0.00 C ATOM 1457 O LYS A 87 33.271 0.284 -5.294 1.00 0.00 O ATOM 1458 CB LYS A 87 31.255 0.605 -7.944 1.00 0.00 C ATOM 1459 CG LYS A 87 30.358 -0.108 -8.975 1.00 0.00 C ATOM 1460 CD LYS A 87 31.008 -1.264 -9.742 1.00 0.00 C ATOM 1461 CE LYS A 87 30.077 -1.576 -10.925 1.00 0.00 C ATOM 1462 NZ LYS A 87 30.640 -2.548 -11.887 1.00 0.00 N ATOM 0 H LYS A 87 29.224 0.632 -6.516 1.00 0.00 H new ATOM 0 HA LYS A 87 31.519 -1.021 -6.574 1.00 0.00 H new ATOM 0 HB2 LYS A 87 30.959 1.653 -7.897 1.00 0.00 H new ATOM 0 HB3 LYS A 87 32.283 0.580 -8.307 1.00 0.00 H new ATOM 0 HG2 LYS A 87 29.477 -0.490 -8.459 1.00 0.00 H new ATOM 0 HG3 LYS A 87 30.009 0.631 -9.697 1.00 0.00 H new ATOM 0 HD2 LYS A 87 32.002 -0.987 -10.092 1.00 0.00 H new ATOM 0 HD3 LYS A 87 31.128 -2.137 -9.101 1.00 0.00 H new ATOM 0 HE2 LYS A 87 29.134 -1.964 -10.541 1.00 0.00 H new ATOM 0 HE3 LYS A 87 29.849 -0.649 -11.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 30.495 -2.201 -12.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 31.658 -2.663 -11.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 30.163 -3.465 -11.773 1.00 0.00 H new ATOM 1476 N ASP A 88 31.841 2.020 -5.221 1.00 0.00 N ATOM 1477 CA ASP A 88 32.697 2.868 -4.387 1.00 0.00 C ATOM 1478 C ASP A 88 32.916 2.273 -2.999 1.00 0.00 C ATOM 1479 O ASP A 88 33.950 2.533 -2.392 1.00 0.00 O ATOM 1480 CB ASP A 88 32.115 4.275 -4.249 1.00 0.00 C ATOM 1481 CG ASP A 88 33.009 5.172 -3.375 1.00 0.00 C ATOM 1482 OD1 ASP A 88 34.157 5.462 -3.781 1.00 0.00 O ATOM 1483 OD2 ASP A 88 32.558 5.610 -2.294 1.00 0.00 O ATOM 0 H ASP A 88 30.945 2.446 -5.457 1.00 0.00 H new ATOM 0 HA ASP A 88 33.661 2.925 -4.893 1.00 0.00 H new ATOM 0 HB2 ASP A 88 32.004 4.722 -5.237 1.00 0.00 H new ATOM 0 HB3 ASP A 88 31.118 4.216 -3.812 1.00 0.00 H new ATOM 1488 N SER A 89 32.007 1.417 -2.526 1.00 0.00 N ATOM 1489 CA SER A 89 32.186 0.630 -1.304 1.00 0.00 C ATOM 1490 C SER A 89 33.305 -0.439 -1.412 1.00 0.00 C ATOM 1491 O SER A 89 33.480 -1.234 -0.486 1.00 0.00 O ATOM 1492 CB SER A 89 30.838 0.015 -0.900 1.00 0.00 C ATOM 1493 OG SER A 89 29.848 1.016 -0.705 1.00 0.00 O ATOM 0 H SER A 89 31.113 1.249 -2.988 1.00 0.00 H new ATOM 0 HA SER A 89 32.527 1.306 -0.520 1.00 0.00 H new ATOM 0 HB2 SER A 89 30.508 -0.680 -1.672 1.00 0.00 H new ATOM 0 HB3 SER A 89 30.960 -0.562 0.017 1.00 0.00 H new ATOM 0 HG SER A 89 29.565 1.370 -1.574 1.00 0.00 H new ATOM 1499 N LYS A 90 34.086 -0.450 -2.504 1.00 0.00 N ATOM 1500 CA LYS A 90 35.196 -1.365 -2.789 1.00 0.00 C ATOM 1501 C LYS A 90 34.785 -2.837 -2.658 1.00 0.00 C ATOM 1502 O LYS A 90 35.564 -3.651 -2.155 1.00 0.00 O ATOM 1503 CB LYS A 90 36.484 -1.040 -1.997 1.00 0.00 C ATOM 1504 CG LYS A 90 37.024 0.390 -2.161 1.00 0.00 C ATOM 1505 CD LYS A 90 36.593 1.271 -0.985 1.00 0.00 C ATOM 1506 CE LYS A 90 37.118 2.714 -1.066 1.00 0.00 C ATOM 1507 NZ LYS A 90 36.574 3.463 -2.225 1.00 0.00 N ATOM 0 H LYS A 90 33.948 0.224 -3.257 1.00 0.00 H new ATOM 0 HA LYS A 90 35.450 -1.199 -3.836 1.00 0.00 H new ATOM 0 HB2 LYS A 90 36.292 -1.217 -0.939 1.00 0.00 H new ATOM 0 HB3 LYS A 90 37.262 -1.740 -2.302 1.00 0.00 H new ATOM 0 HG2 LYS A 90 38.112 0.368 -2.225 1.00 0.00 H new ATOM 0 HG3 LYS A 90 36.658 0.817 -3.095 1.00 0.00 H new ATOM 0 HD2 LYS A 90 35.504 1.292 -0.939 1.00 0.00 H new ATOM 0 HD3 LYS A 90 36.942 0.819 -0.057 1.00 0.00 H new ATOM 0 HE2 LYS A 90 36.861 3.241 -0.147 1.00 0.00 H new ATOM 0 HE3 LYS A 90 38.206 2.696 -1.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 36.627 4.484 -2.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 37.130 3.240 -3.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 35.582 3.191 -2.379 1.00 0.00 H new ATOM 1521 N ASP A 91 33.570 -3.196 -3.081 1.00 0.00 N ATOM 1522 CA ASP A 91 33.072 -4.563 -2.950 1.00 0.00 C ATOM 1523 C ASP A 91 32.347 -4.978 -4.225 1.00 0.00 C ATOM 1524 O ASP A 91 31.121 -4.898 -4.346 1.00 0.00 O ATOM 1525 CB ASP A 91 32.233 -4.748 -1.679 1.00 0.00 C ATOM 1526 CG ASP A 91 32.089 -6.239 -1.329 1.00 0.00 C ATOM 1527 OD1 ASP A 91 32.160 -7.098 -2.236 1.00 0.00 O ATOM 1528 OD2 ASP A 91 31.943 -6.550 -0.124 1.00 0.00 O ATOM 0 H ASP A 91 32.911 -2.552 -3.519 1.00 0.00 H new ATOM 0 HA ASP A 91 33.919 -5.238 -2.829 1.00 0.00 H new ATOM 0 HB2 ASP A 91 32.701 -4.219 -0.849 1.00 0.00 H new ATOM 0 HB3 ASP A 91 31.247 -4.307 -1.822 1.00 0.00 H new ATOM 1533 N PHE A 92 33.136 -5.371 -5.225 1.00 0.00 N ATOM 1534 CA PHE A 92 32.626 -5.818 -6.515 1.00 0.00 C ATOM 1535 C PHE A 92 31.853 -7.138 -6.399 1.00 0.00 C ATOM 1536 O PHE A 92 31.020 -7.426 -7.255 1.00 0.00 O ATOM 1537 CB PHE A 92 33.785 -5.938 -7.514 1.00 0.00 C ATOM 1538 CG PHE A 92 34.577 -4.652 -7.688 1.00 0.00 C ATOM 1539 CD1 PHE A 92 33.953 -3.510 -8.225 1.00 0.00 C ATOM 1540 CD2 PHE A 92 35.922 -4.580 -7.275 1.00 0.00 C ATOM 1541 CE1 PHE A 92 34.663 -2.302 -8.339 1.00 0.00 C ATOM 1542 CE2 PHE A 92 36.632 -3.372 -7.391 1.00 0.00 C ATOM 1543 CZ PHE A 92 36.003 -2.232 -7.922 1.00 0.00 C ATOM 0 H PHE A 92 34.154 -5.387 -5.159 1.00 0.00 H new ATOM 0 HA PHE A 92 31.918 -5.074 -6.880 1.00 0.00 H new ATOM 0 HB2 PHE A 92 34.459 -6.727 -7.182 1.00 0.00 H new ATOM 0 HB3 PHE A 92 33.388 -6.244 -8.482 1.00 0.00 H new ATOM 0 HD1 PHE A 92 32.925 -3.562 -8.551 1.00 0.00 H new ATOM 0 HD2 PHE A 92 36.409 -5.454 -6.869 1.00 0.00 H new ATOM 0 HE1 PHE A 92 34.178 -1.427 -8.747 1.00 0.00 H new ATOM 0 HE2 PHE A 92 37.662 -3.320 -7.072 1.00 0.00 H new ATOM 0 HZ PHE A 92 36.549 -1.304 -8.009 1.00 0.00 H new ATOM 1553 N ASP A 93 32.088 -7.940 -5.357 1.00 0.00 N ATOM 1554 CA ASP A 93 31.352 -9.187 -5.150 1.00 0.00 C ATOM 1555 C ASP A 93 29.955 -8.896 -4.602 1.00 0.00 C ATOM 1556 O ASP A 93 28.970 -9.457 -5.081 1.00 0.00 O ATOM 1557 CB ASP A 93 32.123 -10.113 -4.209 1.00 0.00 C ATOM 1558 CG ASP A 93 31.423 -11.473 -4.104 1.00 0.00 C ATOM 1559 OD1 ASP A 93 31.514 -12.253 -5.079 1.00 0.00 O ATOM 1560 OD2 ASP A 93 30.837 -11.778 -3.043 1.00 0.00 O ATOM 0 H ASP A 93 32.787 -7.745 -4.640 1.00 0.00 H new ATOM 0 HA ASP A 93 31.244 -9.691 -6.110 1.00 0.00 H new ATOM 0 HB2 ASP A 93 33.141 -10.248 -4.575 1.00 0.00 H new ATOM 0 HB3 ASP A 93 32.197 -9.658 -3.221 1.00 0.00 H new ATOM 1565 N GLU A 94 29.841 -7.953 -3.667 1.00 0.00 N ATOM 1566 CA GLU A 94 28.549 -7.457 -3.214 1.00 0.00 C ATOM 1567 C GLU A 94 27.838 -6.727 -4.361 1.00 0.00 C ATOM 1568 O GLU A 94 26.629 -6.879 -4.515 1.00 0.00 O ATOM 1569 CB GLU A 94 28.740 -6.548 -1.991 1.00 0.00 C ATOM 1570 CG GLU A 94 27.442 -6.254 -1.227 1.00 0.00 C ATOM 1571 CD GLU A 94 26.978 -7.450 -0.372 1.00 0.00 C ATOM 1572 OE1 GLU A 94 26.468 -8.448 -0.925 1.00 0.00 O ATOM 1573 OE2 GLU A 94 27.118 -7.392 0.872 1.00 0.00 O ATOM 0 H GLU A 94 30.639 -7.516 -3.207 1.00 0.00 H new ATOM 0 HA GLU A 94 27.918 -8.293 -2.912 1.00 0.00 H new ATOM 0 HB2 GLU A 94 29.453 -7.015 -1.311 1.00 0.00 H new ATOM 0 HB3 GLU A 94 29.180 -5.605 -2.316 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.591 -5.387 -0.583 1.00 0.00 H new ATOM 0 HG3 GLU A 94 26.657 -5.993 -1.937 1.00 0.00 H new ATOM 1580 N SER A 95 28.580 -6.001 -5.208 1.00 0.00 N ATOM 1581 CA SER A 95 28.020 -5.361 -6.396 1.00 0.00 C ATOM 1582 C SER A 95 27.415 -6.410 -7.338 1.00 0.00 C ATOM 1583 O SER A 95 26.283 -6.244 -7.795 1.00 0.00 O ATOM 1584 CB SER A 95 29.084 -4.532 -7.128 1.00 0.00 C ATOM 1585 OG SER A 95 29.697 -3.575 -6.284 1.00 0.00 O ATOM 0 H SER A 95 29.580 -5.844 -5.086 1.00 0.00 H new ATOM 0 HA SER A 95 27.228 -4.686 -6.073 1.00 0.00 H new ATOM 0 HB2 SER A 95 29.847 -5.199 -7.531 1.00 0.00 H new ATOM 0 HB3 SER A 95 28.625 -4.024 -7.976 1.00 0.00 H new ATOM 0 HG SER A 95 30.221 -4.034 -5.595 1.00 0.00 H new ATOM 1591 N LEU A 96 28.135 -7.509 -7.594 1.00 0.00 N ATOM 1592 CA LEU A 96 27.671 -8.617 -8.404 1.00 0.00 C ATOM 1593 C LEU A 96 26.360 -9.167 -7.839 1.00 0.00 C ATOM 1594 O LEU A 96 25.378 -9.289 -8.573 1.00 0.00 O ATOM 1595 CB LEU A 96 28.811 -9.643 -8.487 1.00 0.00 C ATOM 1596 CG LEU A 96 28.536 -10.909 -9.304 1.00 0.00 C ATOM 1597 CD1 LEU A 96 27.786 -11.976 -8.503 1.00 0.00 C ATOM 1598 CD2 LEU A 96 27.849 -10.629 -10.634 1.00 0.00 C ATOM 0 H LEU A 96 29.078 -7.645 -7.230 1.00 0.00 H new ATOM 0 HA LEU A 96 27.432 -8.311 -9.422 1.00 0.00 H new ATOM 0 HB2 LEU A 96 29.685 -9.148 -8.910 1.00 0.00 H new ATOM 0 HB3 LEU A 96 29.074 -9.943 -7.473 1.00 0.00 H new ATOM 0 HG LEU A 96 29.520 -11.314 -9.541 1.00 0.00 H new ATOM 0 HD11 LEU A 96 27.618 -12.851 -9.131 1.00 0.00 H new ATOM 0 HD12 LEU A 96 28.378 -12.262 -7.634 1.00 0.00 H new ATOM 0 HD13 LEU A 96 26.827 -11.576 -8.173 1.00 0.00 H new ATOM 0 HD21 LEU A 96 27.683 -11.568 -11.163 1.00 0.00 H new ATOM 0 HD22 LEU A 96 26.892 -10.140 -10.453 1.00 0.00 H new ATOM 0 HD23 LEU A 96 28.480 -9.978 -11.239 1.00 0.00 H new ATOM 1610 N LYS A 97 26.315 -9.450 -6.534 1.00 0.00 N ATOM 1611 CA LYS A 97 25.117 -9.992 -5.897 1.00 0.00 C ATOM 1612 C LYS A 97 23.951 -9.010 -6.006 1.00 0.00 C ATOM 1613 O LYS A 97 22.878 -9.394 -6.471 1.00 0.00 O ATOM 1614 CB LYS A 97 25.424 -10.338 -4.433 1.00 0.00 C ATOM 1615 CG LYS A 97 26.329 -11.576 -4.325 1.00 0.00 C ATOM 1616 CD LYS A 97 26.869 -11.728 -2.898 1.00 0.00 C ATOM 1617 CE LYS A 97 27.769 -12.963 -2.743 1.00 0.00 C ATOM 1618 NZ LYS A 97 27.024 -14.245 -2.827 1.00 0.00 N ATOM 0 H LYS A 97 27.100 -9.311 -5.898 1.00 0.00 H new ATOM 0 HA LYS A 97 24.819 -10.905 -6.414 1.00 0.00 H new ATOM 0 HB2 LYS A 97 25.908 -9.489 -3.951 1.00 0.00 H new ATOM 0 HB3 LYS A 97 24.492 -10.519 -3.898 1.00 0.00 H new ATOM 0 HG2 LYS A 97 25.768 -12.468 -4.604 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.159 -11.489 -5.026 1.00 0.00 H new ATOM 0 HD2 LYS A 97 27.432 -10.835 -2.628 1.00 0.00 H new ATOM 0 HD3 LYS A 97 26.034 -11.800 -2.202 1.00 0.00 H new ATOM 0 HE2 LYS A 97 28.536 -12.945 -3.517 1.00 0.00 H new ATOM 0 HE3 LYS A 97 28.283 -12.911 -1.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 27.686 -15.039 -2.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 26.309 -14.281 -2.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 26.554 -14.314 -3.752 1.00 0.00 H new ATOM 1632 N TYR A 98 24.149 -7.754 -5.602 1.00 0.00 N ATOM 1633 CA TYR A 98 23.085 -6.761 -5.537 1.00 0.00 C ATOM 1634 C TYR A 98 22.493 -6.480 -6.907 1.00 0.00 C ATOM 1635 O TYR A 98 21.269 -6.437 -7.022 1.00 0.00 O ATOM 1636 CB TYR A 98 23.585 -5.455 -4.913 1.00 0.00 C ATOM 1637 CG TYR A 98 23.408 -5.349 -3.404 1.00 0.00 C ATOM 1638 CD1 TYR A 98 23.911 -6.345 -2.544 1.00 0.00 C ATOM 1639 CD2 TYR A 98 22.727 -4.243 -2.857 1.00 0.00 C ATOM 1640 CE1 TYR A 98 23.720 -6.246 -1.154 1.00 0.00 C ATOM 1641 CE2 TYR A 98 22.542 -4.130 -1.468 1.00 0.00 C ATOM 1642 CZ TYR A 98 23.037 -5.136 -0.607 1.00 0.00 C ATOM 1643 OH TYR A 98 22.866 -5.051 0.742 1.00 0.00 O ATOM 0 H TYR A 98 25.059 -7.399 -5.310 1.00 0.00 H new ATOM 0 HA TYR A 98 22.302 -7.179 -4.904 1.00 0.00 H new ATOM 0 HB2 TYR A 98 24.643 -5.340 -5.148 1.00 0.00 H new ATOM 0 HB3 TYR A 98 23.062 -4.622 -5.384 1.00 0.00 H new ATOM 0 HD1 TYR A 98 24.446 -7.189 -2.954 1.00 0.00 H new ATOM 0 HD2 TYR A 98 22.343 -3.474 -3.512 1.00 0.00 H new ATOM 0 HE1 TYR A 98 24.096 -7.021 -0.502 1.00 0.00 H new ATOM 0 HE2 TYR A 98 22.022 -3.276 -1.059 1.00 0.00 H new ATOM 0 HH TYR A 98 22.379 -4.229 0.959 1.00 0.00 H new ATOM 1653 N LEU A 99 23.311 -6.267 -7.942 1.00 0.00 N ATOM 1654 CA LEU A 99 22.774 -5.780 -9.203 1.00 0.00 C ATOM 1655 C LEU A 99 22.171 -6.935 -9.987 1.00 0.00 C ATOM 1656 O LEU A 99 21.195 -6.709 -10.695 1.00 0.00 O ATOM 1657 CB LEU A 99 23.821 -4.977 -10.000 1.00 0.00 C ATOM 1658 CG LEU A 99 23.950 -3.489 -9.619 1.00 0.00 C ATOM 1659 CD1 LEU A 99 22.676 -2.692 -9.924 1.00 0.00 C ATOM 1660 CD2 LEU A 99 24.356 -3.280 -8.156 1.00 0.00 C ATOM 0 H LEU A 99 24.319 -6.421 -7.929 1.00 0.00 H new ATOM 0 HA LEU A 99 21.970 -5.073 -8.999 1.00 0.00 H new ATOM 0 HB2 LEU A 99 24.793 -5.452 -9.870 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.573 -5.042 -11.059 1.00 0.00 H new ATOM 0 HG LEU A 99 24.754 -3.106 -10.248 1.00 0.00 H new ATOM 0 HD11 LEU A 99 22.821 -1.651 -9.637 1.00 0.00 H new ATOM 0 HD12 LEU A 99 22.459 -2.747 -10.991 1.00 0.00 H new ATOM 0 HD13 LEU A 99 21.841 -3.111 -9.362 1.00 0.00 H new ATOM 0 HD21 LEU A 99 24.431 -2.213 -7.948 1.00 0.00 H new ATOM 0 HD22 LEU A 99 23.605 -3.725 -7.503 1.00 0.00 H new ATOM 0 HD23 LEU A 99 25.321 -3.753 -7.975 1.00 0.00 H new ATOM 1672 N ASP A 100 22.662 -8.168 -9.825 1.00 0.00 N ATOM 1673 CA ASP A 100 22.029 -9.323 -10.457 1.00 0.00 C ATOM 1674 C ASP A 100 20.710 -9.670 -9.764 1.00 0.00 C ATOM 1675 O ASP A 100 19.734 -9.996 -10.435 1.00 0.00 O ATOM 1676 CB ASP A 100 22.950 -10.542 -10.485 1.00 0.00 C ATOM 1677 CG ASP A 100 22.303 -11.658 -11.322 1.00 0.00 C ATOM 1678 OD1 ASP A 100 22.073 -11.444 -12.535 1.00 0.00 O ATOM 1679 OD2 ASP A 100 22.050 -12.756 -10.776 1.00 0.00 O ATOM 0 H ASP A 100 23.487 -8.388 -9.267 1.00 0.00 H new ATOM 0 HA ASP A 100 21.822 -9.044 -11.490 1.00 0.00 H new ATOM 0 HB2 ASP A 100 23.917 -10.270 -10.908 1.00 0.00 H new ATOM 0 HB3 ASP A 100 23.134 -10.895 -9.470 1.00 0.00 H new ATOM 1684 N ASP A 101 20.633 -9.540 -8.435 1.00 0.00 N ATOM 1685 CA ASP A 101 19.382 -9.734 -7.698 1.00 0.00 C ATOM 1686 C ASP A 101 18.362 -8.648 -8.054 1.00 0.00 C ATOM 1687 O ASP A 101 17.193 -8.946 -8.298 1.00 0.00 O ATOM 1688 CB ASP A 101 19.639 -9.725 -6.188 1.00 0.00 C ATOM 1689 CG ASP A 101 18.320 -9.862 -5.410 1.00 0.00 C ATOM 1690 OD1 ASP A 101 17.766 -10.983 -5.351 1.00 0.00 O ATOM 1691 OD2 ASP A 101 17.852 -8.862 -4.822 1.00 0.00 O ATOM 0 H ASP A 101 21.430 -9.299 -7.845 1.00 0.00 H new ATOM 0 HA ASP A 101 18.975 -10.704 -7.984 1.00 0.00 H new ATOM 0 HB2 ASP A 101 20.309 -10.543 -5.924 1.00 0.00 H new ATOM 0 HB3 ASP A 101 20.139 -8.799 -5.905 1.00 0.00 H new ATOM 1696 N LEU A 102 18.802 -7.391 -8.146 1.00 0.00 N ATOM 1697 CA LEU A 102 17.947 -6.279 -8.539 1.00 0.00 C ATOM 1698 C LEU A 102 17.472 -6.453 -9.988 1.00 0.00 C ATOM 1699 O LEU A 102 16.286 -6.280 -10.274 1.00 0.00 O ATOM 1700 CB LEU A 102 18.702 -4.957 -8.313 1.00 0.00 C ATOM 1701 CG LEU A 102 17.887 -3.705 -8.688 1.00 0.00 C ATOM 1702 CD1 LEU A 102 16.506 -3.640 -8.021 1.00 0.00 C ATOM 1703 CD2 LEU A 102 18.697 -2.471 -8.285 1.00 0.00 C ATOM 0 H LEU A 102 19.765 -7.119 -7.948 1.00 0.00 H new ATOM 0 HA LEU A 102 17.049 -6.258 -7.922 1.00 0.00 H new ATOM 0 HB2 LEU A 102 18.992 -4.890 -7.265 1.00 0.00 H new ATOM 0 HB3 LEU A 102 19.621 -4.970 -8.898 1.00 0.00 H new ATOM 0 HG LEU A 102 17.706 -3.746 -9.762 1.00 0.00 H new ATOM 0 HD11 LEU A 102 15.993 -2.731 -8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 102 15.918 -4.509 -8.317 1.00 0.00 H new ATOM 0 HD13 LEU A 102 16.625 -3.635 -6.938 1.00 0.00 H new ATOM 0 HD21 LEU A 102 18.139 -1.570 -8.541 1.00 0.00 H new ATOM 0 HD22 LEU A 102 18.880 -2.491 -7.211 1.00 0.00 H new ATOM 0 HD23 LEU A 102 19.649 -2.471 -8.816 1.00 0.00 H new ATOM 1715 N LYS A 103 18.360 -6.885 -10.893 1.00 0.00 N ATOM 1716 CA LYS A 103 18.000 -7.239 -12.264 1.00 0.00 C ATOM 1717 C LYS A 103 16.938 -8.338 -12.261 1.00 0.00 C ATOM 1718 O LYS A 103 15.976 -8.252 -13.021 1.00 0.00 O ATOM 1719 CB LYS A 103 19.253 -7.720 -13.014 1.00 0.00 C ATOM 1720 CG LYS A 103 19.031 -7.908 -14.521 1.00 0.00 C ATOM 1721 CD LYS A 103 20.020 -8.901 -15.131 1.00 0.00 C ATOM 1722 CE LYS A 103 19.562 -10.345 -14.866 1.00 0.00 C ATOM 1723 NZ LYS A 103 20.675 -11.326 -14.938 1.00 0.00 N ATOM 0 H LYS A 103 19.353 -6.998 -10.689 1.00 0.00 H new ATOM 0 HA LYS A 103 17.593 -6.362 -12.767 1.00 0.00 H new ATOM 0 HB2 LYS A 103 20.057 -7.000 -12.860 1.00 0.00 H new ATOM 0 HB3 LYS A 103 19.584 -8.665 -12.583 1.00 0.00 H new ATOM 0 HG2 LYS A 103 18.013 -8.258 -14.696 1.00 0.00 H new ATOM 0 HG3 LYS A 103 19.128 -6.946 -15.024 1.00 0.00 H new ATOM 0 HD2 LYS A 103 20.102 -8.730 -16.204 1.00 0.00 H new ATOM 0 HD3 LYS A 103 21.012 -8.744 -14.707 1.00 0.00 H new ATOM 0 HE2 LYS A 103 19.100 -10.399 -13.880 1.00 0.00 H new ATOM 0 HE3 LYS A 103 18.797 -10.617 -15.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 20.294 -12.268 -15.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 21.343 -11.040 -15.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 21.169 -11.358 -14.023 1.00 0.00 H new ATOM 1737 N ALA A 104 17.105 -9.361 -11.418 1.00 0.00 N ATOM 1738 CA ALA A 104 16.148 -10.452 -11.317 1.00 0.00 C ATOM 1739 C ALA A 104 14.791 -9.926 -10.846 1.00 0.00 C ATOM 1740 O ALA A 104 13.770 -10.376 -11.352 1.00 0.00 O ATOM 1741 CB ALA A 104 16.672 -11.564 -10.401 1.00 0.00 C ATOM 0 H ALA A 104 17.905 -9.451 -10.792 1.00 0.00 H new ATOM 0 HA ALA A 104 16.015 -10.888 -12.307 1.00 0.00 H new ATOM 0 HB1 ALA A 104 15.936 -12.366 -10.344 1.00 0.00 H new ATOM 0 HB2 ALA A 104 17.606 -11.957 -10.803 1.00 0.00 H new ATOM 0 HB3 ALA A 104 16.847 -11.161 -9.403 1.00 0.00 H new ATOM 1747 N GLN A 105 14.748 -8.950 -9.935 1.00 0.00 N ATOM 1748 CA GLN A 105 13.491 -8.340 -9.513 1.00 0.00 C ATOM 1749 C GLN A 105 12.784 -7.665 -10.698 1.00 0.00 C ATOM 1750 O GLN A 105 11.579 -7.846 -10.879 1.00 0.00 O ATOM 1751 CB GLN A 105 13.740 -7.364 -8.344 1.00 0.00 C ATOM 1752 CG GLN A 105 12.857 -7.695 -7.133 1.00 0.00 C ATOM 1753 CD GLN A 105 11.379 -7.386 -7.381 1.00 0.00 C ATOM 1754 OE1 GLN A 105 10.952 -6.237 -7.285 1.00 0.00 O ATOM 1755 NE2 GLN A 105 10.570 -8.385 -7.691 1.00 0.00 N ATOM 0 H GLN A 105 15.574 -8.566 -9.476 1.00 0.00 H new ATOM 0 HA GLN A 105 12.820 -9.120 -9.152 1.00 0.00 H new ATOM 0 HB2 GLN A 105 14.789 -7.406 -8.052 1.00 0.00 H new ATOM 0 HB3 GLN A 105 13.541 -6.344 -8.672 1.00 0.00 H new ATOM 0 HG2 GLN A 105 12.967 -8.751 -6.885 1.00 0.00 H new ATOM 0 HG3 GLN A 105 13.203 -7.127 -6.269 1.00 0.00 H new ATOM 0 HE21 GLN A 105 10.937 -9.334 -7.767 1.00 0.00 H new ATOM 0 HE22 GLN A 105 9.579 -8.207 -7.854 1.00 0.00 H new ATOM 1764 N PHE A 106 13.516 -6.947 -11.553 1.00 0.00 N ATOM 1765 CA PHE A 106 12.944 -6.392 -12.781 1.00 0.00 C ATOM 1766 C PHE A 106 12.477 -7.510 -13.713 1.00 0.00 C ATOM 1767 O PHE A 106 11.388 -7.414 -14.268 1.00 0.00 O ATOM 1768 CB PHE A 106 13.938 -5.450 -13.467 1.00 0.00 C ATOM 1769 CG PHE A 106 14.483 -4.305 -12.626 1.00 0.00 C ATOM 1770 CD1 PHE A 106 13.670 -3.625 -11.693 1.00 0.00 C ATOM 1771 CD2 PHE A 106 15.823 -3.908 -12.790 1.00 0.00 C ATOM 1772 CE1 PHE A 106 14.208 -2.583 -10.918 1.00 0.00 C ATOM 1773 CE2 PHE A 106 16.357 -2.864 -12.020 1.00 0.00 C ATOM 1774 CZ PHE A 106 15.550 -2.206 -11.078 1.00 0.00 C ATOM 0 H PHE A 106 14.505 -6.737 -11.417 1.00 0.00 H new ATOM 0 HA PHE A 106 12.067 -5.800 -12.520 1.00 0.00 H new ATOM 0 HB2 PHE A 106 14.781 -6.043 -13.822 1.00 0.00 H new ATOM 0 HB3 PHE A 106 13.454 -5.026 -14.347 1.00 0.00 H new ATOM 0 HD1 PHE A 106 12.634 -3.906 -11.575 1.00 0.00 H new ATOM 0 HD2 PHE A 106 16.446 -4.411 -13.515 1.00 0.00 H new ATOM 0 HE1 PHE A 106 13.587 -2.071 -10.198 1.00 0.00 H new ATOM 0 HE2 PHE A 106 17.387 -2.567 -12.152 1.00 0.00 H new ATOM 0 HZ PHE A 106 15.962 -1.409 -10.476 1.00 0.00 H new ATOM 1784 N GLN A 107 13.255 -8.586 -13.844 1.00 0.00 N ATOM 1785 CA GLN A 107 12.873 -9.757 -14.632 1.00 0.00 C ATOM 1786 C GLN A 107 11.557 -10.387 -14.125 1.00 0.00 C ATOM 1787 O GLN A 107 10.792 -10.920 -14.930 1.00 0.00 O ATOM 1788 CB GLN A 107 14.042 -10.759 -14.643 1.00 0.00 C ATOM 1789 CG GLN A 107 13.939 -11.845 -15.725 1.00 0.00 C ATOM 1790 CD GLN A 107 15.183 -12.741 -15.711 1.00 0.00 C ATOM 1791 OE1 GLN A 107 15.558 -13.303 -14.685 1.00 0.00 O ATOM 1792 NE2 GLN A 107 15.878 -12.868 -16.830 1.00 0.00 N ATOM 0 H GLN A 107 14.172 -8.669 -13.404 1.00 0.00 H new ATOM 0 HA GLN A 107 12.672 -9.449 -15.658 1.00 0.00 H new ATOM 0 HB2 GLN A 107 14.973 -10.210 -14.784 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.101 -11.241 -13.667 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.047 -12.449 -15.558 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.830 -11.380 -16.705 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.565 -12.401 -17.681 1.00 0.00 H new ATOM 0 HE22 GLN A 107 16.727 -13.433 -16.842 1.00 0.00 H new ATOM 1801 N GLU A 108 11.243 -10.300 -12.826 1.00 0.00 N ATOM 1802 CA GLU A 108 9.991 -10.813 -12.272 1.00 0.00 C ATOM 1803 C GLU A 108 8.855 -9.857 -12.627 1.00 0.00 C ATOM 1804 O GLU A 108 7.811 -10.297 -13.105 1.00 0.00 O ATOM 1805 CB GLU A 108 10.055 -10.940 -10.739 1.00 0.00 C ATOM 1806 CG GLU A 108 10.985 -12.048 -10.231 1.00 0.00 C ATOM 1807 CD GLU A 108 11.031 -12.080 -8.691 1.00 0.00 C ATOM 1808 OE1 GLU A 108 11.374 -11.051 -8.062 1.00 0.00 O ATOM 1809 OE2 GLU A 108 10.731 -13.143 -8.098 1.00 0.00 O ATOM 0 H GLU A 108 11.854 -9.870 -12.131 1.00 0.00 H new ATOM 0 HA GLU A 108 9.821 -11.802 -12.697 1.00 0.00 H new ATOM 0 HB2 GLU A 108 10.383 -9.988 -10.322 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.050 -11.125 -10.360 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.644 -13.013 -10.607 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.990 -11.891 -10.624 1.00 0.00 H new ATOM 1816 N LEU A 109 9.056 -8.550 -12.430 1.00 0.00 N ATOM 1817 CA LEU A 109 8.052 -7.541 -12.764 1.00 0.00 C ATOM 1818 C LEU A 109 7.752 -7.578 -14.262 1.00 0.00 C ATOM 1819 O LEU A 109 6.597 -7.460 -14.662 1.00 0.00 O ATOM 1820 CB LEU A 109 8.528 -6.138 -12.346 1.00 0.00 C ATOM 1821 CG LEU A 109 8.612 -5.909 -10.823 1.00 0.00 C ATOM 1822 CD1 LEU A 109 9.230 -4.533 -10.548 1.00 0.00 C ATOM 1823 CD2 LEU A 109 7.238 -5.987 -10.143 1.00 0.00 C ATOM 0 H LEU A 109 9.915 -8.166 -12.037 1.00 0.00 H new ATOM 0 HA LEU A 109 7.138 -7.766 -12.215 1.00 0.00 H new ATOM 0 HB2 LEU A 109 9.511 -5.959 -12.781 1.00 0.00 H new ATOM 0 HB3 LEU A 109 7.851 -5.398 -12.773 1.00 0.00 H new ATOM 0 HG LEU A 109 9.233 -6.703 -10.408 1.00 0.00 H new ATOM 0 HD11 LEU A 109 9.290 -4.370 -9.472 1.00 0.00 H new ATOM 0 HD12 LEU A 109 10.231 -4.491 -10.978 1.00 0.00 H new ATOM 0 HD13 LEU A 109 8.609 -3.759 -10.998 1.00 0.00 H new ATOM 0 HD21 LEU A 109 7.352 -5.819 -9.072 1.00 0.00 H new ATOM 0 HD22 LEU A 109 6.581 -5.225 -10.562 1.00 0.00 H new ATOM 0 HD23 LEU A 109 6.804 -6.973 -10.311 1.00 0.00 H new ATOM 1835 N ASP A 110 8.768 -7.784 -15.097 1.00 0.00 N ATOM 1836 CA ASP A 110 8.600 -7.942 -16.534 1.00 0.00 C ATOM 1837 C ASP A 110 7.839 -9.223 -16.857 1.00 0.00 C ATOM 1838 O ASP A 110 6.996 -9.226 -17.753 1.00 0.00 O ATOM 1839 CB ASP A 110 9.947 -7.941 -17.258 1.00 0.00 C ATOM 1840 CG ASP A 110 9.732 -8.075 -18.773 1.00 0.00 C ATOM 1841 OD1 ASP A 110 9.121 -7.161 -19.374 1.00 0.00 O ATOM 1842 OD2 ASP A 110 10.206 -9.070 -19.364 1.00 0.00 O ATOM 0 H ASP A 110 9.739 -7.846 -14.789 1.00 0.00 H new ATOM 0 HA ASP A 110 8.020 -7.089 -16.886 1.00 0.00 H new ATOM 0 HB2 ASP A 110 10.485 -7.019 -17.039 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.564 -8.764 -16.896 1.00 0.00 H new ATOM 2059 N GLY A 125 17.262 -2.609 -21.109 1.00 0.00 N ATOM 2060 CA GLY A 125 17.248 -2.202 -19.713 1.00 0.00 C ATOM 2061 C GLY A 125 17.996 -3.265 -18.927 1.00 0.00 C ATOM 2062 O GLY A 125 19.201 -3.132 -18.712 1.00 0.00 O ATOM 0 HA2 GLY A 125 17.723 -1.228 -19.591 1.00 0.00 H new ATOM 0 HA3 GLY A 125 16.224 -2.105 -19.351 1.00 0.00 H new ATOM 2066 N ILE A 126 17.334 -4.375 -18.584 1.00 0.00 N ATOM 2067 CA ILE A 126 18.014 -5.474 -17.902 1.00 0.00 C ATOM 2068 C ILE A 126 19.091 -6.139 -18.764 1.00 0.00 C ATOM 2069 O ILE A 126 20.035 -6.674 -18.194 1.00 0.00 O ATOM 2070 CB ILE A 126 17.055 -6.473 -17.215 1.00 0.00 C ATOM 2071 CG1 ILE A 126 15.804 -6.896 -18.012 1.00 0.00 C ATOM 2072 CG2 ILE A 126 16.636 -5.890 -15.859 1.00 0.00 C ATOM 2073 CD1 ILE A 126 14.985 -7.974 -17.273 1.00 0.00 C ATOM 0 H ILE A 126 16.343 -4.533 -18.765 1.00 0.00 H new ATOM 0 HA ILE A 126 18.554 -5.011 -17.076 1.00 0.00 H new ATOM 0 HB ILE A 126 17.625 -7.397 -17.120 1.00 0.00 H new ATOM 0 HG12 ILE A 126 15.176 -6.023 -18.191 1.00 0.00 H new ATOM 0 HG13 ILE A 126 16.107 -7.276 -18.987 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.958 -6.582 -15.359 1.00 0.00 H new ATOM 0 HG22 ILE A 126 17.520 -5.737 -15.240 1.00 0.00 H new ATOM 0 HG23 ILE A 126 16.132 -4.936 -16.013 1.00 0.00 H new ATOM 0 HD11 ILE A 126 14.113 -8.242 -17.870 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.604 -8.858 -17.117 1.00 0.00 H new ATOM 0 HD13 ILE A 126 14.658 -7.585 -16.309 1.00 0.00 H new ATOM 2085 N LEU A 127 19.041 -6.048 -20.095 1.00 0.00 N ATOM 2086 CA LEU A 127 20.146 -6.465 -20.965 1.00 0.00 C ATOM 2087 C LEU A 127 21.427 -5.669 -20.659 1.00 0.00 C ATOM 2088 O LEU A 127 22.522 -6.236 -20.632 1.00 0.00 O ATOM 2089 CB LEU A 127 19.707 -6.273 -22.430 1.00 0.00 C ATOM 2090 CG LEU A 127 20.804 -6.514 -23.486 1.00 0.00 C ATOM 2091 CD1 LEU A 127 21.361 -7.941 -23.450 1.00 0.00 C ATOM 2092 CD2 LEU A 127 20.230 -6.240 -24.881 1.00 0.00 C ATOM 0 H LEU A 127 18.234 -5.683 -20.601 1.00 0.00 H new ATOM 0 HA LEU A 127 20.379 -7.515 -20.785 1.00 0.00 H new ATOM 0 HB2 LEU A 127 18.876 -6.948 -22.634 1.00 0.00 H new ATOM 0 HB3 LEU A 127 19.329 -5.257 -22.548 1.00 0.00 H new ATOM 0 HG LEU A 127 21.626 -5.836 -23.257 1.00 0.00 H new ATOM 0 HD11 LEU A 127 22.129 -8.051 -24.215 1.00 0.00 H new ATOM 0 HD12 LEU A 127 21.795 -8.138 -22.470 1.00 0.00 H new ATOM 0 HD13 LEU A 127 20.556 -8.651 -23.640 1.00 0.00 H new ATOM 0 HD21 LEU A 127 21.002 -6.409 -25.632 1.00 0.00 H new ATOM 0 HD22 LEU A 127 19.390 -6.910 -25.067 1.00 0.00 H new ATOM 0 HD23 LEU A 127 19.889 -5.206 -24.938 1.00 0.00 H new ATOM 2104 N LEU A 128 21.293 -4.361 -20.404 1.00 0.00 N ATOM 2105 CA LEU A 128 22.435 -3.529 -20.023 1.00 0.00 C ATOM 2106 C LEU A 128 22.901 -3.938 -18.634 1.00 0.00 C ATOM 2107 O LEU A 128 24.095 -4.146 -18.440 1.00 0.00 O ATOM 2108 CB LEU A 128 22.100 -2.026 -20.090 1.00 0.00 C ATOM 2109 CG LEU A 128 23.253 -1.042 -19.764 1.00 0.00 C ATOM 2110 CD1 LEU A 128 23.574 -0.892 -18.267 1.00 0.00 C ATOM 2111 CD2 LEU A 128 24.551 -1.358 -20.520 1.00 0.00 C ATOM 0 H LEU A 128 20.406 -3.860 -20.455 1.00 0.00 H new ATOM 0 HA LEU A 128 23.244 -3.690 -20.736 1.00 0.00 H new ATOM 0 HB2 LEU A 128 21.735 -1.803 -21.093 1.00 0.00 H new ATOM 0 HB3 LEU A 128 21.279 -1.829 -19.401 1.00 0.00 H new ATOM 0 HG LEU A 128 22.854 -0.089 -20.111 1.00 0.00 H new ATOM 0 HD11 LEU A 128 24.393 -0.184 -18.140 1.00 0.00 H new ATOM 0 HD12 LEU A 128 22.692 -0.526 -17.741 1.00 0.00 H new ATOM 0 HD13 LEU A 128 23.864 -1.860 -17.858 1.00 0.00 H new ATOM 0 HD21 LEU A 128 25.317 -0.632 -20.247 1.00 0.00 H new ATOM 0 HD22 LEU A 128 24.890 -2.360 -20.257 1.00 0.00 H new ATOM 0 HD23 LEU A 128 24.369 -1.306 -21.593 1.00 0.00 H new ATOM 2123 N ILE A 129 21.979 -4.100 -17.681 1.00 0.00 N ATOM 2124 CA ILE A 129 22.340 -4.457 -16.310 1.00 0.00 C ATOM 2125 C ILE A 129 23.038 -5.826 -16.310 1.00 0.00 C ATOM 2126 O ILE A 129 24.018 -5.997 -15.593 1.00 0.00 O ATOM 2127 CB ILE A 129 21.108 -4.391 -15.372 1.00 0.00 C ATOM 2128 CG1 ILE A 129 20.471 -2.978 -15.380 1.00 0.00 C ATOM 2129 CG2 ILE A 129 21.514 -4.748 -13.925 1.00 0.00 C ATOM 2130 CD1 ILE A 129 19.051 -2.918 -14.804 1.00 0.00 C ATOM 0 H ILE A 129 20.977 -3.989 -17.836 1.00 0.00 H new ATOM 0 HA ILE A 129 23.047 -3.730 -15.910 1.00 0.00 H new ATOM 0 HB ILE A 129 20.378 -5.111 -15.741 1.00 0.00 H new ATOM 0 HG12 ILE A 129 21.109 -2.302 -14.811 1.00 0.00 H new ATOM 0 HG13 ILE A 129 20.450 -2.609 -16.405 1.00 0.00 H new ATOM 0 HG21 ILE A 129 20.638 -4.697 -13.278 1.00 0.00 H new ATOM 0 HG22 ILE A 129 21.925 -5.757 -13.901 1.00 0.00 H new ATOM 0 HG23 ILE A 129 22.266 -4.042 -13.573 1.00 0.00 H new ATOM 0 HD11 ILE A 129 18.683 -1.893 -14.849 1.00 0.00 H new ATOM 0 HD12 ILE A 129 18.395 -3.565 -15.386 1.00 0.00 H new ATOM 0 HD13 ILE A 129 19.065 -3.254 -13.767 1.00 0.00 H new ATOM 2142 N ASP A 130 22.604 -6.781 -17.138 1.00 0.00 N ATOM 2143 CA ASP A 130 23.238 -8.093 -17.263 1.00 0.00 C ATOM 2144 C ASP A 130 24.659 -7.964 -17.809 1.00 0.00 C ATOM 2145 O ASP A 130 25.577 -8.607 -17.305 1.00 0.00 O ATOM 2146 CB ASP A 130 22.432 -9.014 -18.187 1.00 0.00 C ATOM 2147 CG ASP A 130 22.919 -10.460 -18.027 1.00 0.00 C ATOM 2148 OD1 ASP A 130 22.438 -11.127 -17.081 1.00 0.00 O ATOM 2149 OD2 ASP A 130 23.769 -10.924 -18.821 1.00 0.00 O ATOM 0 H ASP A 130 21.794 -6.662 -17.746 1.00 0.00 H new ATOM 0 HA ASP A 130 23.271 -8.528 -16.264 1.00 0.00 H new ATOM 0 HB2 ASP A 130 21.371 -8.949 -17.946 1.00 0.00 H new ATOM 0 HB3 ASP A 130 22.544 -8.695 -19.223 1.00 0.00 H new ATOM 2154 N SER A 131 24.851 -7.093 -18.804 1.00 0.00 N ATOM 2155 CA SER A 131 26.161 -6.822 -19.385 1.00 0.00 C ATOM 2156 C SER A 131 27.082 -6.131 -18.367 1.00 0.00 C ATOM 2157 O SER A 131 28.268 -6.449 -18.288 1.00 0.00 O ATOM 2158 CB SER A 131 25.987 -5.964 -20.648 1.00 0.00 C ATOM 2159 OG SER A 131 25.086 -6.565 -21.567 1.00 0.00 O ATOM 0 H SER A 131 24.095 -6.555 -19.228 1.00 0.00 H new ATOM 0 HA SER A 131 26.634 -7.765 -19.659 1.00 0.00 H new ATOM 0 HB2 SER A 131 25.619 -4.976 -20.370 1.00 0.00 H new ATOM 0 HB3 SER A 131 26.955 -5.820 -21.128 1.00 0.00 H new ATOM 0 HG SER A 131 24.164 -6.373 -21.294 1.00 0.00 H new ATOM 2165 N GLU A 132 26.541 -5.223 -17.551 1.00 0.00 N ATOM 2166 CA GLU A 132 27.289 -4.557 -16.494 1.00 0.00 C ATOM 2167 C GLU A 132 27.651 -5.566 -15.395 1.00 0.00 C ATOM 2168 O GLU A 132 28.751 -5.527 -14.842 1.00 0.00 O ATOM 2169 CB GLU A 132 26.476 -3.368 -15.954 1.00 0.00 C ATOM 2170 CG GLU A 132 27.168 -2.595 -14.818 1.00 0.00 C ATOM 2171 CD GLU A 132 28.583 -2.085 -15.142 1.00 0.00 C ATOM 2172 OE1 GLU A 132 28.962 -1.920 -16.322 1.00 0.00 O ATOM 2173 OE2 GLU A 132 29.351 -1.821 -14.190 1.00 0.00 O ATOM 0 H GLU A 132 25.565 -4.931 -17.609 1.00 0.00 H new ATOM 0 HA GLU A 132 28.224 -4.161 -16.889 1.00 0.00 H new ATOM 0 HB2 GLU A 132 26.271 -2.680 -16.774 1.00 0.00 H new ATOM 0 HB3 GLU A 132 25.513 -3.733 -15.596 1.00 0.00 H new ATOM 0 HG2 GLU A 132 26.545 -1.743 -14.547 1.00 0.00 H new ATOM 0 HG3 GLU A 132 27.223 -3.241 -13.941 1.00 0.00 H new ATOM 2180 N ILE A 133 26.750 -6.502 -15.098 1.00 0.00 N ATOM 2181 CA ILE A 133 27.000 -7.596 -14.173 1.00 0.00 C ATOM 2182 C ILE A 133 28.099 -8.514 -14.711 1.00 0.00 C ATOM 2183 O ILE A 133 28.999 -8.865 -13.947 1.00 0.00 O ATOM 2184 CB ILE A 133 25.657 -8.301 -13.836 1.00 0.00 C ATOM 2185 CG1 ILE A 133 24.944 -7.596 -12.661 1.00 0.00 C ATOM 2186 CG2 ILE A 133 25.761 -9.800 -13.521 1.00 0.00 C ATOM 2187 CD1 ILE A 133 25.807 -7.434 -11.405 1.00 0.00 C ATOM 0 H ILE A 133 25.813 -6.518 -15.502 1.00 0.00 H new ATOM 0 HA ILE A 133 27.391 -7.225 -13.225 1.00 0.00 H new ATOM 0 HB ILE A 133 25.079 -8.220 -14.756 1.00 0.00 H new ATOM 0 HG12 ILE A 133 24.614 -6.611 -12.990 1.00 0.00 H new ATOM 0 HG13 ILE A 133 24.049 -8.162 -12.402 1.00 0.00 H new ATOM 0 HG21 ILE A 133 24.769 -10.195 -13.300 1.00 0.00 H new ATOM 0 HG22 ILE A 133 26.177 -10.325 -14.381 1.00 0.00 H new ATOM 0 HG23 ILE A 133 26.411 -9.946 -12.658 1.00 0.00 H new ATOM 0 HD11 ILE A 133 25.230 -6.930 -10.630 1.00 0.00 H new ATOM 0 HD12 ILE A 133 26.116 -8.416 -11.047 1.00 0.00 H new ATOM 0 HD13 ILE A 133 26.690 -6.841 -11.644 1.00 0.00 H new ATOM 2199 N ALA A 134 28.102 -8.846 -16.006 1.00 0.00 N ATOM 2200 CA ALA A 134 29.191 -9.608 -16.608 1.00 0.00 C ATOM 2201 C ALA A 134 30.514 -8.846 -16.469 1.00 0.00 C ATOM 2202 O ALA A 134 31.520 -9.435 -16.079 1.00 0.00 O ATOM 2203 CB ALA A 134 28.874 -9.920 -18.076 1.00 0.00 C ATOM 0 H ALA A 134 27.357 -8.596 -16.656 1.00 0.00 H new ATOM 0 HA ALA A 134 29.296 -10.556 -16.081 1.00 0.00 H new ATOM 0 HB1 ALA A 134 29.695 -10.489 -18.513 1.00 0.00 H new ATOM 0 HB2 ALA A 134 27.956 -10.505 -18.134 1.00 0.00 H new ATOM 0 HB3 ALA A 134 28.745 -8.988 -18.626 1.00 0.00 H new ATOM 2209 N ARG A 135 30.514 -7.530 -16.719 1.00 0.00 N ATOM 2210 CA ARG A 135 31.699 -6.691 -16.533 1.00 0.00 C ATOM 2211 C ARG A 135 32.170 -6.732 -15.078 1.00 0.00 C ATOM 2212 O ARG A 135 33.368 -6.852 -14.832 1.00 0.00 O ATOM 2213 CB ARG A 135 31.392 -5.257 -17.003 1.00 0.00 C ATOM 2214 CG ARG A 135 32.667 -4.427 -17.217 1.00 0.00 C ATOM 2215 CD ARG A 135 32.339 -3.013 -17.718 1.00 0.00 C ATOM 2216 NE ARG A 135 31.755 -2.170 -16.658 1.00 0.00 N ATOM 2217 CZ ARG A 135 32.410 -1.313 -15.865 1.00 0.00 C ATOM 2218 NH1 ARG A 135 33.718 -1.108 -16.000 1.00 0.00 N ATOM 2219 NH2 ARG A 135 31.733 -0.666 -14.926 1.00 0.00 N ATOM 0 H ARG A 135 29.696 -7.022 -17.054 1.00 0.00 H new ATOM 0 HA ARG A 135 32.518 -7.078 -17.139 1.00 0.00 H new ATOM 0 HB2 ARG A 135 30.826 -5.296 -17.934 1.00 0.00 H new ATOM 0 HB3 ARG A 135 30.759 -4.763 -16.265 1.00 0.00 H new ATOM 0 HG2 ARG A 135 33.222 -4.363 -16.281 1.00 0.00 H new ATOM 0 HG3 ARG A 135 33.313 -4.929 -17.937 1.00 0.00 H new ATOM 0 HD2 ARG A 135 33.247 -2.543 -18.095 1.00 0.00 H new ATOM 0 HD3 ARG A 135 31.643 -3.078 -18.554 1.00 0.00 H new ATOM 0 HE ARG A 135 30.748 -2.248 -16.514 1.00 0.00 H new ATOM 0 HH11 ARG A 135 34.241 -1.608 -16.719 1.00 0.00 H new ATOM 0 HH12 ARG A 135 34.197 -0.450 -15.385 1.00 0.00 H new ATOM 0 HH21 ARG A 135 30.731 -0.826 -14.818 1.00 0.00 H new ATOM 0 HH22 ARG A 135 32.214 -0.009 -14.312 1.00 0.00 H new ATOM 2233 N THR A 136 31.252 -6.680 -14.115 1.00 0.00 N ATOM 2234 CA THR A 136 31.570 -6.737 -12.691 1.00 0.00 C ATOM 2235 C THR A 136 32.167 -8.104 -12.326 1.00 0.00 C ATOM 2236 O THR A 136 33.172 -8.162 -11.616 1.00 0.00 O ATOM 2237 CB THR A 136 30.302 -6.411 -11.881 1.00 0.00 C ATOM 2238 OG1 THR A 136 29.777 -5.166 -12.305 1.00 0.00 O ATOM 2239 CG2 THR A 136 30.575 -6.279 -10.381 1.00 0.00 C ATOM 0 H THR A 136 30.253 -6.596 -14.305 1.00 0.00 H new ATOM 0 HA THR A 136 32.329 -5.994 -12.445 1.00 0.00 H new ATOM 0 HB THR A 136 29.611 -7.236 -12.050 1.00 0.00 H new ATOM 0 HG1 THR A 136 29.334 -5.276 -13.172 1.00 0.00 H new ATOM 0 HG21 THR A 136 29.645 -6.049 -9.861 1.00 0.00 H new ATOM 0 HG22 THR A 136 30.981 -7.217 -10.001 1.00 0.00 H new ATOM 0 HG23 THR A 136 31.294 -5.477 -10.211 1.00 0.00 H new ATOM 2247 N TYR A 137 31.598 -9.202 -12.835 1.00 0.00 N ATOM 2248 CA TYR A 137 32.107 -10.544 -12.584 1.00 0.00 C ATOM 2249 C TYR A 137 33.510 -10.704 -13.180 1.00 0.00 C ATOM 2250 O TYR A 137 34.403 -11.242 -12.525 1.00 0.00 O ATOM 2251 CB TYR A 137 31.132 -11.580 -13.164 1.00 0.00 C ATOM 2252 CG TYR A 137 31.475 -13.013 -12.801 1.00 0.00 C ATOM 2253 CD1 TYR A 137 32.394 -13.743 -13.580 1.00 0.00 C ATOM 2254 CD2 TYR A 137 30.879 -13.617 -11.676 1.00 0.00 C ATOM 2255 CE1 TYR A 137 32.730 -15.063 -13.230 1.00 0.00 C ATOM 2256 CE2 TYR A 137 31.206 -14.938 -11.321 1.00 0.00 C ATOM 2257 CZ TYR A 137 32.138 -15.668 -12.098 1.00 0.00 C ATOM 2258 OH TYR A 137 32.467 -16.950 -11.770 1.00 0.00 O ATOM 0 H TYR A 137 30.771 -9.180 -13.432 1.00 0.00 H new ATOM 0 HA TYR A 137 32.186 -10.707 -11.509 1.00 0.00 H new ATOM 0 HB2 TYR A 137 30.126 -11.356 -12.810 1.00 0.00 H new ATOM 0 HB3 TYR A 137 31.117 -11.483 -14.250 1.00 0.00 H new ATOM 0 HD1 TYR A 137 32.843 -13.287 -14.450 1.00 0.00 H new ATOM 0 HD2 TYR A 137 30.167 -13.062 -11.083 1.00 0.00 H new ATOM 0 HE1 TYR A 137 33.441 -15.615 -13.827 1.00 0.00 H new ATOM 0 HE2 TYR A 137 30.747 -15.395 -10.457 1.00 0.00 H new ATOM 0 HH TYR A 137 31.975 -17.218 -10.966 1.00 0.00 H new ATOM 2268 N LEU A 138 33.722 -10.194 -14.398 1.00 0.00 N ATOM 2269 CA LEU A 138 35.028 -10.214 -15.044 1.00 0.00 C ATOM 2270 C LEU A 138 36.029 -9.420 -14.209 1.00 0.00 C ATOM 2271 O LEU A 138 37.117 -9.923 -13.931 1.00 0.00 O ATOM 2272 CB LEU A 138 34.914 -9.658 -16.476 1.00 0.00 C ATOM 2273 CG LEU A 138 36.259 -9.560 -17.224 1.00 0.00 C ATOM 2274 CD1 LEU A 138 36.962 -10.918 -17.361 1.00 0.00 C ATOM 2275 CD2 LEU A 138 36.018 -8.974 -18.620 1.00 0.00 C ATOM 0 H LEU A 138 32.990 -9.757 -14.959 1.00 0.00 H new ATOM 0 HA LEU A 138 35.389 -11.240 -15.114 1.00 0.00 H new ATOM 0 HB2 LEU A 138 34.238 -10.294 -17.048 1.00 0.00 H new ATOM 0 HB3 LEU A 138 34.461 -8.667 -16.434 1.00 0.00 H new ATOM 0 HG LEU A 138 36.911 -8.914 -16.636 1.00 0.00 H new ATOM 0 HD11 LEU A 138 37.903 -10.788 -17.895 1.00 0.00 H new ATOM 0 HD12 LEU A 138 37.161 -11.326 -16.370 1.00 0.00 H new ATOM 0 HD13 LEU A 138 36.322 -11.605 -17.915 1.00 0.00 H new ATOM 0 HD21 LEU A 138 36.966 -8.903 -19.153 1.00 0.00 H new ATOM 0 HD22 LEU A 138 35.338 -9.621 -19.174 1.00 0.00 H new ATOM 0 HD23 LEU A 138 35.578 -7.981 -18.527 1.00 0.00 H new