USER MOD reduce.3.24.130724 H: found=0, std=0, add=860, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 864 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 62 ASN : amide:sc= 1.98 K(o=2.9,f=-7.3!) USER MOD Set 1.2: A 66 LYS NZ :NH3+ -179:sc= 0.954 (180deg=-0.0561) USER MOD Set 2.1: A 64 ASN : amide:sc= 1.2 K(o=2.1,f=-0.96) USER MOD Set 2.2: B 157 THR OG1 : rot -83:sc= 0.867 USER MOD Set 3.1: A 51 SER OG : rot 123:sc= 0.804 USER MOD Set 3.2: A 52 HIS : no HD1:sc= 0.478 K(o=1.3,f=-1.8) USER MOD Set 4.1: A 28 THR OG1 : rot 171:sc= 1.38 USER MOD Set 4.2: A 98 SER OG : rot 46:sc= -0.0433 USER MOD Single : A 3 GLN : amide:sc= 1.2 K(o=1.2,f=0) USER MOD Single : A 7 THR OG1 : rot 78:sc= 1.07 USER MOD Single : A 10 SER OG : rot 126:sc= -0.32 USER MOD Single : A 11 LYS NZ :NH3+ 166:sc= -0.0143 (180deg=-0.208) USER MOD Single : A 14 LYS NZ :NH3+ 174:sc= 1.02 (180deg=0.965) USER MOD Single : A 16 TYR OH : rot 147:sc= 1.22 USER MOD Single : A 19 SER OG : rot 180:sc= 0.0927 USER MOD Single : A 21 SER OG : rot 180:sc= 0.00816 USER MOD Single : A 24 MET CE :methyl 175:sc= 0 (180deg=-0.032) USER MOD Single : A 26 SER OG : rot 32:sc= 1.04 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 87:sc= 0.709 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 153:sc= 0.731 (180deg=0.0122) USER MOD Single : A 48 GLN : amide:sc= 0.39 K(o=0.39,f=-8.2!) USER MOD Single : A 56 LYS NZ :NH3+ 172:sc= 0.197 (180deg=0.175) USER MOD Single : A 60 TYR OH : rot 4:sc= 0.736 USER MOD Single : A 63 TYR OH : rot 15:sc= 1.38 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -76:sc= 1.08 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.51 USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 86:sc= 1.15 USER MOD Single : A 96 TYR OH : rot 134:sc= 0.0551 USER MOD Single : B 159 LYS NZ :NH3+ 157:sc= 0.927 (180deg=0.596) USER MOD Single : B 162 CYS SG : rot 140:sc= -0.0977 USER MOD Single : B 164 GLN : amide:sc= 0.612 K(o=0.61,f=0) USER MOD Single : B 168 SER OG : rot 79:sc= 2.23 USER MOD Single : B 171 LYS NZ :NH3+ 171:sc=-0.00441 (180deg=-0.0883) USER MOD ----------------------------------------------------------------- ATOM 31 N GLN A 3 3.813 4.448 4.788 1.00 0.00 N ATOM 32 CA GLN A 3 5.102 3.856 4.465 1.00 0.00 C ATOM 33 C GLN A 3 5.678 3.156 5.699 1.00 0.00 C ATOM 34 O GLN A 3 5.183 3.339 6.812 1.00 0.00 O ATOM 35 CB GLN A 3 6.064 4.911 3.878 1.00 0.00 C ATOM 36 CG GLN A 3 5.904 6.320 4.470 1.00 0.00 C ATOM 37 CD GLN A 3 7.052 7.227 4.033 1.00 0.00 C ATOM 38 OE1 GLN A 3 7.054 7.749 2.925 1.00 0.00 O ATOM 39 NE2 GLN A 3 8.047 7.409 4.891 1.00 0.00 N ATOM 0 HA GLN A 3 4.967 3.100 3.692 1.00 0.00 H new ATOM 0 HB2 GLN A 3 7.089 4.578 4.038 1.00 0.00 H new ATOM 0 HB3 GLN A 3 5.911 4.964 2.800 1.00 0.00 H new ATOM 0 HG2 GLN A 3 4.954 6.748 4.149 1.00 0.00 H new ATOM 0 HG3 GLN A 3 5.876 6.261 5.558 1.00 0.00 H new ATOM 0 HE21 GLN A 3 8.019 6.962 5.807 1.00 0.00 H new ATOM 0 HE22 GLN A 3 8.841 7.996 4.635 1.00 0.00 H new ATOM 48 N ASP A 4 6.727 2.355 5.486 1.00 0.00 N ATOM 49 CA ASP A 4 7.425 1.541 6.483 1.00 0.00 C ATOM 50 C ASP A 4 8.317 2.364 7.419 1.00 0.00 C ATOM 51 O ASP A 4 8.948 1.785 8.301 1.00 0.00 O ATOM 52 CB ASP A 4 8.260 0.476 5.760 1.00 0.00 C ATOM 53 CG ASP A 4 9.364 1.106 4.916 1.00 0.00 C ATOM 54 OD1 ASP A 4 8.998 1.756 3.912 1.00 0.00 O ATOM 55 OD2 ASP A 4 10.543 0.953 5.301 1.00 0.00 O ATOM 0 H ASP A 4 7.135 2.252 4.557 1.00 0.00 H new ATOM 0 HA ASP A 4 6.668 1.076 7.114 1.00 0.00 H new ATOM 0 HB2 ASP A 4 8.702 -0.200 6.492 1.00 0.00 H new ATOM 0 HB3 ASP A 4 7.611 -0.125 5.122 1.00 0.00 H new ATOM 60 N PHE A 5 8.377 3.687 7.265 1.00 0.00 N ATOM 61 CA PHE A 5 9.089 4.565 8.177 1.00 0.00 C ATOM 62 C PHE A 5 8.356 5.896 8.265 1.00 0.00 C ATOM 63 O PHE A 5 7.572 6.224 7.377 1.00 0.00 O ATOM 64 CB PHE A 5 10.548 4.750 7.737 1.00 0.00 C ATOM 65 CG PHE A 5 10.732 5.501 6.431 1.00 0.00 C ATOM 66 CD1 PHE A 5 10.608 4.819 5.207 1.00 0.00 C ATOM 67 CD2 PHE A 5 11.075 6.867 6.437 1.00 0.00 C ATOM 68 CE1 PHE A 5 10.832 5.495 3.995 1.00 0.00 C ATOM 69 CE2 PHE A 5 11.338 7.532 5.226 1.00 0.00 C ATOM 70 CZ PHE A 5 11.211 6.847 4.004 1.00 0.00 C ATOM 0 H PHE A 5 7.926 4.179 6.493 1.00 0.00 H new ATOM 0 HA PHE A 5 9.114 4.113 9.169 1.00 0.00 H new ATOM 0 HB2 PHE A 5 11.085 5.281 8.523 1.00 0.00 H new ATOM 0 HB3 PHE A 5 11.011 3.768 7.643 1.00 0.00 H new ATOM 0 HD1 PHE A 5 10.340 3.773 5.198 1.00 0.00 H new ATOM 0 HD2 PHE A 5 11.136 7.404 7.372 1.00 0.00 H new ATOM 0 HE1 PHE A 5 10.713 4.974 3.056 1.00 0.00 H new ATOM 0 HE2 PHE A 5 11.638 8.570 5.234 1.00 0.00 H new ATOM 0 HZ PHE A 5 11.405 7.360 3.074 1.00 0.00 H new ATOM 80 N VAL A 6 8.623 6.652 9.325 1.00 0.00 N ATOM 81 CA VAL A 6 8.210 8.029 9.516 1.00 0.00 C ATOM 82 C VAL A 6 9.512 8.764 9.814 1.00 0.00 C ATOM 83 O VAL A 6 10.396 8.183 10.436 1.00 0.00 O ATOM 84 CB VAL A 6 7.223 8.123 10.692 1.00 0.00 C ATOM 85 CG1 VAL A 6 6.693 9.555 10.826 1.00 0.00 C ATOM 86 CG2 VAL A 6 6.040 7.165 10.515 1.00 0.00 C ATOM 0 H VAL A 6 9.163 6.297 10.114 1.00 0.00 H new ATOM 0 HA VAL A 6 7.693 8.452 8.654 1.00 0.00 H new ATOM 0 HB VAL A 6 7.765 7.841 11.595 1.00 0.00 H new ATOM 0 HG11 VAL A 6 5.995 9.608 11.662 1.00 0.00 H new ATOM 0 HG12 VAL A 6 7.525 10.236 11.004 1.00 0.00 H new ATOM 0 HG13 VAL A 6 6.181 9.841 9.907 1.00 0.00 H new ATOM 0 HG21 VAL A 6 5.365 7.260 11.365 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.506 7.412 9.598 1.00 0.00 H new ATOM 0 HG23 VAL A 6 6.407 6.140 10.456 1.00 0.00 H new ATOM 96 N THR A 7 9.680 9.989 9.331 1.00 0.00 N ATOM 97 CA THR A 7 10.952 10.694 9.404 1.00 0.00 C ATOM 98 C THR A 7 10.841 11.859 10.382 1.00 0.00 C ATOM 99 O THR A 7 9.841 12.568 10.364 1.00 0.00 O ATOM 100 CB THR A 7 11.324 11.180 7.996 1.00 0.00 C ATOM 101 OG1 THR A 7 10.962 10.216 7.027 1.00 0.00 O ATOM 102 CG2 THR A 7 12.815 11.467 7.852 1.00 0.00 C ATOM 0 H THR A 7 8.937 10.521 8.878 1.00 0.00 H new ATOM 0 HA THR A 7 11.736 10.030 9.767 1.00 0.00 H new ATOM 0 HB THR A 7 10.775 12.108 7.839 1.00 0.00 H new ATOM 0 HG1 THR A 7 9.997 10.265 6.861 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.024 11.807 6.838 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.107 12.241 8.562 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.382 10.558 8.053 1.00 0.00 H new ATOM 110 N LEU A 8 11.848 12.074 11.229 1.00 0.00 N ATOM 111 CA LEU A 8 11.949 13.287 12.039 1.00 0.00 C ATOM 112 C LEU A 8 13.069 14.124 11.429 1.00 0.00 C ATOM 113 O LEU A 8 14.172 13.611 11.229 1.00 0.00 O ATOM 114 CB LEU A 8 12.204 12.968 13.522 1.00 0.00 C ATOM 115 CG LEU A 8 10.901 12.663 14.279 1.00 0.00 C ATOM 116 CD1 LEU A 8 11.201 11.935 15.594 1.00 0.00 C ATOM 117 CD2 LEU A 8 10.158 13.961 14.629 1.00 0.00 C ATOM 0 H LEU A 8 12.613 11.415 11.372 1.00 0.00 H new ATOM 0 HA LEU A 8 11.009 13.839 12.027 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.876 12.113 13.598 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.707 13.812 13.993 1.00 0.00 H new ATOM 0 HG LEU A 8 10.288 12.040 13.628 1.00 0.00 H new ATOM 0 HD11 LEU A 8 10.267 11.727 16.116 1.00 0.00 H new ATOM 0 HD12 LEU A 8 11.714 10.997 15.382 1.00 0.00 H new ATOM 0 HD13 LEU A 8 11.835 12.562 16.221 1.00 0.00 H new ATOM 0 HD21 LEU A 8 9.239 13.721 15.164 1.00 0.00 H new ATOM 0 HD22 LEU A 8 10.792 14.585 15.259 1.00 0.00 H new ATOM 0 HD23 LEU A 8 9.914 14.499 13.713 1.00 0.00 H new ATOM 129 N VAL A 9 12.774 15.379 11.068 1.00 0.00 N ATOM 130 CA VAL A 9 13.713 16.213 10.320 1.00 0.00 C ATOM 131 C VAL A 9 14.216 17.369 11.185 1.00 0.00 C ATOM 132 O VAL A 9 13.449 18.275 11.501 1.00 0.00 O ATOM 133 CB VAL A 9 13.076 16.694 9.008 1.00 0.00 C ATOM 134 CG1 VAL A 9 14.091 17.480 8.172 1.00 0.00 C ATOM 135 CG2 VAL A 9 12.523 15.512 8.204 1.00 0.00 C ATOM 0 H VAL A 9 11.889 15.837 11.284 1.00 0.00 H new ATOM 0 HA VAL A 9 14.585 15.616 10.053 1.00 0.00 H new ATOM 0 HB VAL A 9 12.246 17.355 9.258 1.00 0.00 H new ATOM 0 HG11 VAL A 9 13.621 17.812 7.247 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.434 18.347 8.737 1.00 0.00 H new ATOM 0 HG13 VAL A 9 14.942 16.841 7.937 1.00 0.00 H new ATOM 0 HG21 VAL A 9 12.077 15.878 7.279 1.00 0.00 H new ATOM 0 HG22 VAL A 9 13.333 14.822 7.968 1.00 0.00 H new ATOM 0 HG23 VAL A 9 11.765 14.995 8.792 1.00 0.00 H new ATOM 145 N SER A 10 15.500 17.330 11.546 1.00 0.00 N ATOM 146 CA SER A 10 16.190 18.377 12.290 1.00 0.00 C ATOM 147 C SER A 10 16.566 19.560 11.393 1.00 0.00 C ATOM 148 O SER A 10 16.749 19.392 10.187 1.00 0.00 O ATOM 149 CB SER A 10 17.457 17.811 12.957 1.00 0.00 C ATOM 150 OG SER A 10 17.762 16.490 12.539 1.00 0.00 O ATOM 0 H SER A 10 16.105 16.541 11.319 1.00 0.00 H new ATOM 0 HA SER A 10 15.503 18.739 13.055 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.302 18.462 12.730 1.00 0.00 H new ATOM 0 HB3 SER A 10 17.327 17.823 14.039 1.00 0.00 H new ATOM 0 HG SER A 10 18.683 16.457 12.207 1.00 0.00 H new ATOM 156 N LYS A 11 16.761 20.718 12.037 1.00 0.00 N ATOM 157 CA LYS A 11 17.279 21.980 11.519 1.00 0.00 C ATOM 158 C LYS A 11 17.056 22.190 10.012 1.00 0.00 C ATOM 159 O LYS A 11 15.954 21.983 9.505 1.00 0.00 O ATOM 160 CB LYS A 11 18.737 22.144 11.993 1.00 0.00 C ATOM 161 CG LYS A 11 19.082 23.614 12.256 1.00 0.00 C ATOM 162 CD LYS A 11 20.532 23.738 12.739 1.00 0.00 C ATOM 163 CE LYS A 11 20.868 25.176 13.151 1.00 0.00 C ATOM 164 NZ LYS A 11 20.089 25.609 14.326 1.00 0.00 N ATOM 0 H LYS A 11 16.537 20.797 13.029 1.00 0.00 H new ATOM 0 HA LYS A 11 16.693 22.798 11.937 1.00 0.00 H new ATOM 0 HB2 LYS A 11 18.892 21.565 12.903 1.00 0.00 H new ATOM 0 HB3 LYS A 11 19.413 21.740 11.239 1.00 0.00 H new ATOM 0 HG2 LYS A 11 18.943 24.197 11.345 1.00 0.00 H new ATOM 0 HG3 LYS A 11 18.405 24.026 13.004 1.00 0.00 H new ATOM 0 HD2 LYS A 11 20.693 23.069 13.585 1.00 0.00 H new ATOM 0 HD3 LYS A 11 21.209 23.418 11.947 1.00 0.00 H new ATOM 0 HE2 LYS A 11 21.932 25.250 13.374 1.00 0.00 H new ATOM 0 HE3 LYS A 11 20.670 25.848 12.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 20.504 26.479 14.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 19.105 25.791 14.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 20.108 24.862 15.050 1.00 0.00 H new ATOM 178 N ASP A 12 18.084 22.622 9.277 1.00 0.00 N ATOM 179 CA ASP A 12 18.013 22.789 7.833 1.00 0.00 C ATOM 180 C ASP A 12 18.108 21.425 7.143 1.00 0.00 C ATOM 181 O ASP A 12 19.102 21.109 6.496 1.00 0.00 O ATOM 182 CB ASP A 12 19.052 23.811 7.337 1.00 0.00 C ATOM 183 CG ASP A 12 20.476 23.527 7.806 1.00 0.00 C ATOM 184 OD1 ASP A 12 20.681 23.604 9.038 1.00 0.00 O ATOM 185 OD2 ASP A 12 21.333 23.258 6.937 1.00 0.00 O ATOM 0 H ASP A 12 18.991 22.866 9.674 1.00 0.00 H new ATOM 0 HA ASP A 12 17.045 23.210 7.562 1.00 0.00 H new ATOM 0 HB2 ASP A 12 19.036 23.830 6.247 1.00 0.00 H new ATOM 0 HB3 ASP A 12 18.760 24.805 7.677 1.00 0.00 H new ATOM 190 N ASP A 13 17.043 20.634 7.286 1.00 0.00 N ATOM 191 CA ASP A 13 16.792 19.392 6.564 1.00 0.00 C ATOM 192 C ASP A 13 17.810 18.280 6.850 1.00 0.00 C ATOM 193 O ASP A 13 18.434 17.751 5.933 1.00 0.00 O ATOM 194 CB ASP A 13 16.623 19.668 5.058 1.00 0.00 C ATOM 195 CG ASP A 13 16.130 18.445 4.282 1.00 0.00 C ATOM 196 OD1 ASP A 13 15.325 17.682 4.862 1.00 0.00 O ATOM 197 OD2 ASP A 13 16.545 18.308 3.111 1.00 0.00 O ATOM 0 H ASP A 13 16.296 20.857 7.943 1.00 0.00 H new ATOM 0 HA ASP A 13 15.852 18.995 6.948 1.00 0.00 H new ATOM 0 HB2 ASP A 13 15.918 20.488 4.921 1.00 0.00 H new ATOM 0 HB3 ASP A 13 17.577 19.995 4.644 1.00 0.00 H new ATOM 202 N LYS A 14 17.942 17.889 8.121 1.00 0.00 N ATOM 203 CA LYS A 14 18.695 16.708 8.526 1.00 0.00 C ATOM 204 C LYS A 14 17.680 15.636 8.905 1.00 0.00 C ATOM 205 O LYS A 14 17.139 15.652 10.010 1.00 0.00 O ATOM 206 CB LYS A 14 19.654 17.001 9.684 1.00 0.00 C ATOM 207 CG LYS A 14 20.825 17.887 9.244 1.00 0.00 C ATOM 208 CD LYS A 14 20.492 19.361 9.477 1.00 0.00 C ATOM 209 CE LYS A 14 21.629 20.258 8.978 1.00 0.00 C ATOM 210 NZ LYS A 14 21.678 20.303 7.505 1.00 0.00 N ATOM 0 H LYS A 14 17.523 18.392 8.903 1.00 0.00 H new ATOM 0 HA LYS A 14 19.325 16.371 7.703 1.00 0.00 H new ATOM 0 HB2 LYS A 14 19.110 17.492 10.491 1.00 0.00 H new ATOM 0 HB3 LYS A 14 20.038 16.063 10.084 1.00 0.00 H new ATOM 0 HG2 LYS A 14 21.723 17.618 9.800 1.00 0.00 H new ATOM 0 HG3 LYS A 14 21.041 17.718 8.189 1.00 0.00 H new ATOM 0 HD2 LYS A 14 19.567 19.616 8.960 1.00 0.00 H new ATOM 0 HD3 LYS A 14 20.322 19.537 10.539 1.00 0.00 H new ATOM 0 HE2 LYS A 14 21.496 21.267 9.369 1.00 0.00 H new ATOM 0 HE3 LYS A 14 22.580 19.890 9.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 22.392 20.996 7.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 21.930 19.363 7.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 20.747 20.581 7.135 1.00 0.00 H new ATOM 224 N GLU A 15 17.409 14.737 7.961 1.00 0.00 N ATOM 225 CA GLU A 15 16.333 13.761 8.033 1.00 0.00 C ATOM 226 C GLU A 15 16.792 12.476 8.724 1.00 0.00 C ATOM 227 O GLU A 15 17.598 11.740 8.160 1.00 0.00 O ATOM 228 CB GLU A 15 15.855 13.427 6.614 1.00 0.00 C ATOM 229 CG GLU A 15 15.458 14.657 5.789 1.00 0.00 C ATOM 230 CD GLU A 15 14.728 14.245 4.516 1.00 0.00 C ATOM 231 OE1 GLU A 15 15.427 14.021 3.504 1.00 0.00 O ATOM 232 OE2 GLU A 15 13.485 14.132 4.589 1.00 0.00 O ATOM 0 H GLU A 15 17.951 14.669 7.100 1.00 0.00 H new ATOM 0 HA GLU A 15 15.520 14.193 8.617 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.647 12.890 6.091 1.00 0.00 H new ATOM 0 HB3 GLU A 15 15.001 12.753 6.678 1.00 0.00 H new ATOM 0 HG2 GLU A 15 14.819 15.309 6.385 1.00 0.00 H new ATOM 0 HG3 GLU A 15 16.348 15.231 5.533 1.00 0.00 H new ATOM 239 N TYR A 16 16.252 12.175 9.908 1.00 0.00 N ATOM 240 CA TYR A 16 16.460 10.894 10.574 1.00 0.00 C ATOM 241 C TYR A 16 15.202 10.039 10.405 1.00 0.00 C ATOM 242 O TYR A 16 14.120 10.447 10.823 1.00 0.00 O ATOM 243 CB TYR A 16 16.797 11.132 12.046 1.00 0.00 C ATOM 244 CG TYR A 16 18.174 11.735 12.251 1.00 0.00 C ATOM 245 CD1 TYR A 16 18.350 13.131 12.257 1.00 0.00 C ATOM 246 CD2 TYR A 16 19.298 10.892 12.307 1.00 0.00 C ATOM 247 CE1 TYR A 16 19.641 13.676 12.370 1.00 0.00 C ATOM 248 CE2 TYR A 16 20.588 11.439 12.399 1.00 0.00 C ATOM 249 CZ TYR A 16 20.759 12.832 12.467 1.00 0.00 C ATOM 250 OH TYR A 16 22.004 13.362 12.639 1.00 0.00 O ATOM 0 H TYR A 16 15.657 12.818 10.430 1.00 0.00 H new ATOM 0 HA TYR A 16 17.298 10.359 10.128 1.00 0.00 H new ATOM 0 HB2 TYR A 16 16.048 11.794 12.482 1.00 0.00 H new ATOM 0 HB3 TYR A 16 16.737 10.186 12.584 1.00 0.00 H new ATOM 0 HD1 TYR A 16 17.493 13.784 12.175 1.00 0.00 H new ATOM 0 HD2 TYR A 16 19.169 9.820 12.279 1.00 0.00 H new ATOM 0 HE1 TYR A 16 19.773 14.748 12.382 1.00 0.00 H new ATOM 0 HE2 TYR A 16 21.450 10.788 12.418 1.00 0.00 H new ATOM 0 HH TYR A 16 22.545 12.756 13.188 1.00 0.00 H new ATOM 260 N GLU A 17 15.334 8.864 9.779 1.00 0.00 N ATOM 261 CA GLU A 17 14.210 7.975 9.514 1.00 0.00 C ATOM 262 C GLU A 17 13.990 7.017 10.687 1.00 0.00 C ATOM 263 O GLU A 17 14.936 6.432 11.208 1.00 0.00 O ATOM 264 CB GLU A 17 14.394 7.235 8.180 1.00 0.00 C ATOM 265 CG GLU A 17 15.610 6.300 8.130 1.00 0.00 C ATOM 266 CD GLU A 17 15.682 5.577 6.790 1.00 0.00 C ATOM 267 OE1 GLU A 17 14.990 4.544 6.667 1.00 0.00 O ATOM 268 OE2 GLU A 17 16.419 6.078 5.912 1.00 0.00 O ATOM 0 H GLU A 17 16.228 8.507 9.443 1.00 0.00 H new ATOM 0 HA GLU A 17 13.306 8.577 9.417 1.00 0.00 H new ATOM 0 HB2 GLU A 17 13.496 6.652 7.976 1.00 0.00 H new ATOM 0 HB3 GLU A 17 14.485 7.971 7.381 1.00 0.00 H new ATOM 0 HG2 GLU A 17 16.523 6.874 8.288 1.00 0.00 H new ATOM 0 HG3 GLU A 17 15.548 5.572 8.938 1.00 0.00 H new ATOM 275 N ILE A 18 12.733 6.869 11.099 1.00 0.00 N ATOM 276 CA ILE A 18 12.284 5.968 12.146 1.00 0.00 C ATOM 277 C ILE A 18 11.401 4.911 11.491 1.00 0.00 C ATOM 278 O ILE A 18 10.316 5.234 11.015 1.00 0.00 O ATOM 279 CB ILE A 18 11.490 6.763 13.198 1.00 0.00 C ATOM 280 CG1 ILE A 18 12.337 7.900 13.778 1.00 0.00 C ATOM 281 CG2 ILE A 18 11.008 5.874 14.340 1.00 0.00 C ATOM 282 CD1 ILE A 18 11.954 9.221 13.122 1.00 0.00 C ATOM 0 H ILE A 18 11.966 7.402 10.689 1.00 0.00 H new ATOM 0 HA ILE A 18 13.127 5.492 12.647 1.00 0.00 H new ATOM 0 HB ILE A 18 10.621 7.175 12.686 1.00 0.00 H new ATOM 0 HG12 ILE A 18 12.187 7.963 14.856 1.00 0.00 H new ATOM 0 HG13 ILE A 18 13.395 7.696 13.614 1.00 0.00 H new ATOM 0 HG21 ILE A 18 10.452 6.475 15.060 1.00 0.00 H new ATOM 0 HG22 ILE A 18 10.360 5.092 13.944 1.00 0.00 H new ATOM 0 HG23 ILE A 18 11.866 5.419 14.834 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.561 10.024 13.540 1.00 0.00 H new ATOM 0 HD12 ILE A 18 12.127 9.157 12.048 1.00 0.00 H new ATOM 0 HD13 ILE A 18 10.900 9.428 13.308 1.00 0.00 H new ATOM 294 N SER A 19 11.839 3.652 11.462 1.00 0.00 N ATOM 295 CA SER A 19 11.013 2.528 11.052 1.00 0.00 C ATOM 296 C SER A 19 9.645 2.609 11.739 1.00 0.00 C ATOM 297 O SER A 19 9.585 2.870 12.941 1.00 0.00 O ATOM 298 CB SER A 19 11.746 1.242 11.446 1.00 0.00 C ATOM 299 OG SER A 19 13.137 1.411 11.229 1.00 0.00 O ATOM 0 H SER A 19 12.788 3.387 11.726 1.00 0.00 H new ATOM 0 HA SER A 19 10.845 2.543 9.975 1.00 0.00 H new ATOM 0 HB2 SER A 19 11.555 1.007 12.493 1.00 0.00 H new ATOM 0 HB3 SER A 19 11.374 0.403 10.858 1.00 0.00 H new ATOM 0 HG SER A 19 13.610 0.591 11.482 1.00 0.00 H new ATOM 305 N ARG A 20 8.543 2.397 11.014 1.00 0.00 N ATOM 306 CA ARG A 20 7.217 2.580 11.592 1.00 0.00 C ATOM 307 C ARG A 20 7.030 1.673 12.813 1.00 0.00 C ATOM 308 O ARG A 20 6.392 2.040 13.795 1.00 0.00 O ATOM 309 CB ARG A 20 6.103 2.405 10.552 1.00 0.00 C ATOM 310 CG ARG A 20 5.875 0.957 10.083 1.00 0.00 C ATOM 311 CD ARG A 20 4.655 0.838 9.159 1.00 0.00 C ATOM 312 NE ARG A 20 3.431 1.305 9.825 1.00 0.00 N ATOM 313 CZ ARG A 20 2.905 2.538 9.749 1.00 0.00 C ATOM 314 NH1 ARG A 20 3.368 3.451 8.884 1.00 0.00 N ATOM 315 NH2 ARG A 20 1.908 2.854 10.580 1.00 0.00 N ATOM 0 H ARG A 20 8.546 2.102 10.038 1.00 0.00 H new ATOM 0 HA ARG A 20 7.141 3.611 11.936 1.00 0.00 H new ATOM 0 HB2 ARG A 20 5.172 2.787 10.971 1.00 0.00 H new ATOM 0 HB3 ARG A 20 6.337 3.020 9.683 1.00 0.00 H new ATOM 0 HG2 ARG A 20 6.762 0.601 9.560 1.00 0.00 H new ATOM 0 HG3 ARG A 20 5.737 0.312 10.951 1.00 0.00 H new ATOM 0 HD2 ARG A 20 4.824 1.421 8.254 1.00 0.00 H new ATOM 0 HD3 ARG A 20 4.530 -0.200 8.851 1.00 0.00 H new ATOM 0 HE ARG A 20 2.933 0.627 10.401 1.00 0.00 H new ATOM 0 HH11 ARG A 20 4.140 3.217 8.260 1.00 0.00 H new ATOM 0 HH12 ARG A 20 2.948 4.380 8.849 1.00 0.00 H new ATOM 0 HH21 ARG A 20 1.565 2.166 11.250 1.00 0.00 H new ATOM 0 HH22 ARG A 20 1.490 3.784 10.544 1.00 0.00 H new ATOM 329 N SER A 21 7.652 0.497 12.746 1.00 0.00 N ATOM 330 CA SER A 21 7.778 -0.478 13.808 1.00 0.00 C ATOM 331 C SER A 21 8.314 0.148 15.106 1.00 0.00 C ATOM 332 O SER A 21 7.868 -0.213 16.191 1.00 0.00 O ATOM 333 CB SER A 21 8.691 -1.571 13.250 1.00 0.00 C ATOM 334 OG SER A 21 9.835 -0.977 12.656 1.00 0.00 O ATOM 0 H SER A 21 8.109 0.187 11.888 1.00 0.00 H new ATOM 0 HA SER A 21 6.811 -0.891 14.095 1.00 0.00 H new ATOM 0 HB2 SER A 21 8.994 -2.249 14.048 1.00 0.00 H new ATOM 0 HB3 SER A 21 8.153 -2.167 12.512 1.00 0.00 H new ATOM 0 HG SER A 21 10.420 -1.678 12.300 1.00 0.00 H new ATOM 340 N ALA A 22 9.252 1.094 14.996 1.00 0.00 N ATOM 341 CA ALA A 22 9.702 1.920 16.107 1.00 0.00 C ATOM 342 C ALA A 22 8.666 3.009 16.386 1.00 0.00 C ATOM 343 O ALA A 22 8.230 3.150 17.527 1.00 0.00 O ATOM 344 CB ALA A 22 11.087 2.510 15.806 1.00 0.00 C ATOM 0 H ALA A 22 9.724 1.306 14.117 1.00 0.00 H new ATOM 0 HA ALA A 22 9.800 1.309 17.004 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.411 3.125 16.645 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.801 1.701 15.652 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.034 3.123 14.906 1.00 0.00 H new ATOM 350 N ALA A 23 8.263 3.765 15.353 1.00 0.00 N ATOM 351 CA ALA A 23 7.340 4.900 15.473 1.00 0.00 C ATOM 352 C ALA A 23 6.133 4.569 16.354 1.00 0.00 C ATOM 353 O ALA A 23 5.709 5.394 17.163 1.00 0.00 O ATOM 354 CB ALA A 23 6.878 5.383 14.095 1.00 0.00 C ATOM 0 H ALA A 23 8.575 3.601 14.396 1.00 0.00 H new ATOM 0 HA ALA A 23 7.891 5.706 15.958 1.00 0.00 H new ATOM 0 HB1 ALA A 23 6.195 6.224 14.214 1.00 0.00 H new ATOM 0 HB2 ALA A 23 7.743 5.698 13.511 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.367 4.571 13.578 1.00 0.00 H new ATOM 360 N MET A 24 5.612 3.346 16.206 1.00 0.00 N ATOM 361 CA MET A 24 4.567 2.766 17.037 1.00 0.00 C ATOM 362 C MET A 24 4.676 3.164 18.514 1.00 0.00 C ATOM 363 O MET A 24 3.673 3.550 19.112 1.00 0.00 O ATOM 364 CB MET A 24 4.606 1.237 16.909 1.00 0.00 C ATOM 365 CG MET A 24 4.234 0.753 15.500 1.00 0.00 C ATOM 366 SD MET A 24 2.757 -0.284 15.371 1.00 0.00 S ATOM 367 CE MET A 24 1.505 0.874 15.959 1.00 0.00 C ATOM 0 H MET A 24 5.925 2.712 15.471 1.00 0.00 H new ATOM 0 HA MET A 24 3.617 3.161 16.677 1.00 0.00 H new ATOM 0 HB2 MET A 24 5.605 0.880 17.160 1.00 0.00 H new ATOM 0 HB3 MET A 24 3.920 0.798 17.633 1.00 0.00 H new ATOM 0 HG2 MET A 24 4.095 1.627 14.864 1.00 0.00 H new ATOM 0 HG3 MET A 24 5.079 0.196 15.096 1.00 0.00 H new ATOM 0 HE1 MET A 24 0.517 0.423 15.860 1.00 0.00 H new ATOM 0 HE2 MET A 24 1.692 1.112 17.006 1.00 0.00 H new ATOM 0 HE3 MET A 24 1.548 1.788 15.366 1.00 0.00 H new ATOM 377 N ILE A 25 5.866 3.047 19.117 1.00 0.00 N ATOM 378 CA ILE A 25 6.005 3.243 20.558 1.00 0.00 C ATOM 379 C ILE A 25 5.982 4.726 20.956 1.00 0.00 C ATOM 380 O ILE A 25 5.895 5.028 22.143 1.00 0.00 O ATOM 381 CB ILE A 25 7.195 2.453 21.142 1.00 0.00 C ATOM 382 CG1 ILE A 25 8.535 3.171 20.954 1.00 0.00 C ATOM 383 CG2 ILE A 25 7.216 1.023 20.578 1.00 0.00 C ATOM 384 CD1 ILE A 25 9.733 2.341 21.424 1.00 0.00 C ATOM 0 H ILE A 25 6.735 2.820 18.633 1.00 0.00 H new ATOM 0 HA ILE A 25 5.119 2.814 21.026 1.00 0.00 H new ATOM 0 HB ILE A 25 7.049 2.390 22.220 1.00 0.00 H new ATOM 0 HG12 ILE A 25 8.663 3.418 19.900 1.00 0.00 H new ATOM 0 HG13 ILE A 25 8.516 4.113 21.502 1.00 0.00 H new ATOM 0 HG21 ILE A 25 8.061 0.478 20.999 1.00 0.00 H new ATOM 0 HG22 ILE A 25 6.289 0.514 20.841 1.00 0.00 H new ATOM 0 HG23 ILE A 25 7.313 1.061 19.493 1.00 0.00 H new ATOM 0 HD11 ILE A 25 10.652 2.905 21.264 1.00 0.00 H new ATOM 0 HD12 ILE A 25 9.626 2.116 22.485 1.00 0.00 H new ATOM 0 HD13 ILE A 25 9.775 1.410 20.858 1.00 0.00 H new ATOM 396 N SER A 26 6.041 5.653 19.990 1.00 0.00 N ATOM 397 CA SER A 26 5.824 7.078 20.214 1.00 0.00 C ATOM 398 C SER A 26 4.416 7.445 19.717 1.00 0.00 C ATOM 399 O SER A 26 4.252 7.719 18.526 1.00 0.00 O ATOM 400 CB SER A 26 6.906 7.896 19.498 1.00 0.00 C ATOM 401 OG SER A 26 7.232 7.337 18.240 1.00 0.00 O ATOM 0 H SER A 26 6.245 5.424 19.017 1.00 0.00 H new ATOM 0 HA SER A 26 5.893 7.309 21.277 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.559 8.921 19.363 1.00 0.00 H new ATOM 0 HB3 SER A 26 7.800 7.941 20.120 1.00 0.00 H new ATOM 0 HG SER A 26 6.437 6.914 17.854 1.00 0.00 H new ATOM 407 N PRO A 27 3.391 7.456 20.589 1.00 0.00 N ATOM 408 CA PRO A 27 2.004 7.643 20.182 1.00 0.00 C ATOM 409 C PRO A 27 1.774 9.003 19.519 1.00 0.00 C ATOM 410 O PRO A 27 0.919 9.127 18.649 1.00 0.00 O ATOM 411 CB PRO A 27 1.164 7.464 21.449 1.00 0.00 C ATOM 412 CG PRO A 27 2.138 7.806 22.574 1.00 0.00 C ATOM 413 CD PRO A 27 3.473 7.298 22.032 1.00 0.00 C ATOM 0 HA PRO A 27 1.719 6.916 19.421 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.298 8.126 21.453 1.00 0.00 H new ATOM 0 HB3 PRO A 27 0.787 6.445 21.540 1.00 0.00 H new ATOM 0 HG2 PRO A 27 2.164 8.877 22.775 1.00 0.00 H new ATOM 0 HG3 PRO A 27 1.867 7.313 23.508 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.306 7.868 22.443 1.00 0.00 H new ATOM 0 HD3 PRO A 27 3.636 6.255 22.304 1.00 0.00 H new ATOM 421 N THR A 28 2.540 10.020 19.907 1.00 0.00 N ATOM 422 CA THR A 28 2.555 11.323 19.273 1.00 0.00 C ATOM 423 C THR A 28 2.960 11.190 17.806 1.00 0.00 C ATOM 424 O THR A 28 2.209 11.575 16.916 1.00 0.00 O ATOM 425 CB THR A 28 3.576 12.166 20.039 1.00 0.00 C ATOM 426 OG1 THR A 28 4.683 11.324 20.306 1.00 0.00 O ATOM 427 CG2 THR A 28 2.973 12.660 21.357 1.00 0.00 C ATOM 0 H THR A 28 3.184 9.951 20.695 1.00 0.00 H new ATOM 0 HA THR A 28 1.569 11.788 19.297 1.00 0.00 H new ATOM 0 HB THR A 28 3.873 13.039 19.457 1.00 0.00 H new ATOM 0 HG1 THR A 28 5.422 11.859 20.665 1.00 0.00 H new ATOM 0 HG21 THR A 28 3.710 13.259 21.892 1.00 0.00 H new ATOM 0 HG22 THR A 28 2.093 13.269 21.149 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.686 11.805 21.969 1.00 0.00 H new ATOM 435 N LEU A 29 4.157 10.655 17.551 1.00 0.00 N ATOM 436 CA LEU A 29 4.670 10.473 16.198 1.00 0.00 C ATOM 437 C LEU A 29 3.685 9.633 15.377 1.00 0.00 C ATOM 438 O LEU A 29 3.340 10.004 14.258 1.00 0.00 O ATOM 439 CB LEU A 29 6.073 9.845 16.236 1.00 0.00 C ATOM 440 CG LEU A 29 6.804 9.840 14.879 1.00 0.00 C ATOM 441 CD1 LEU A 29 7.146 11.258 14.410 1.00 0.00 C ATOM 442 CD2 LEU A 29 8.102 9.036 15.012 1.00 0.00 C ATOM 0 H LEU A 29 4.795 10.337 18.280 1.00 0.00 H new ATOM 0 HA LEU A 29 4.766 11.444 15.711 1.00 0.00 H new ATOM 0 HB2 LEU A 29 6.681 10.387 16.961 1.00 0.00 H new ATOM 0 HB3 LEU A 29 5.989 8.819 16.594 1.00 0.00 H new ATOM 0 HG LEU A 29 6.140 9.389 14.142 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.660 11.210 13.450 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.229 11.836 14.301 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.793 11.738 15.144 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.625 9.028 14.056 1.00 0.00 H new ATOM 0 HD22 LEU A 29 8.738 9.494 15.769 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.868 8.013 15.306 1.00 0.00 H new ATOM 454 N LYS A 30 3.207 8.523 15.954 1.00 0.00 N ATOM 455 CA LYS A 30 2.171 7.692 15.352 1.00 0.00 C ATOM 456 C LYS A 30 0.961 8.552 14.967 1.00 0.00 C ATOM 457 O LYS A 30 0.510 8.520 13.825 1.00 0.00 O ATOM 458 CB LYS A 30 1.768 6.586 16.337 1.00 0.00 C ATOM 459 CG LYS A 30 0.817 5.551 15.717 1.00 0.00 C ATOM 460 CD LYS A 30 -0.047 4.872 16.789 1.00 0.00 C ATOM 461 CE LYS A 30 0.797 4.153 17.846 1.00 0.00 C ATOM 462 NZ LYS A 30 -0.046 3.481 18.849 1.00 0.00 N ATOM 0 H LYS A 30 3.534 8.179 16.857 1.00 0.00 H new ATOM 0 HA LYS A 30 2.556 7.229 14.444 1.00 0.00 H new ATOM 0 HB2 LYS A 30 2.665 6.080 16.694 1.00 0.00 H new ATOM 0 HB3 LYS A 30 1.289 7.037 17.206 1.00 0.00 H new ATOM 0 HG2 LYS A 30 0.174 6.038 14.984 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.395 4.797 15.182 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -0.674 5.620 17.275 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.717 4.156 16.313 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.441 3.419 17.361 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.450 4.872 18.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 0.559 3.005 19.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.642 4.185 19.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.651 2.778 18.379 1.00 0.00 H new ATOM 476 N ALA A 31 0.427 9.322 15.917 1.00 0.00 N ATOM 477 CA ALA A 31 -0.712 10.185 15.665 1.00 0.00 C ATOM 478 C ALA A 31 -0.408 11.139 14.513 1.00 0.00 C ATOM 479 O ALA A 31 -1.231 11.282 13.615 1.00 0.00 O ATOM 480 CB ALA A 31 -1.116 10.939 16.936 1.00 0.00 C ATOM 0 H ALA A 31 0.775 9.360 16.875 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.562 9.569 15.372 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.972 11.580 16.723 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.383 10.224 17.714 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -0.281 11.551 17.277 1.00 0.00 H new ATOM 486 N MET A 32 0.767 11.777 14.513 1.00 0.00 N ATOM 487 CA MET A 32 1.137 12.737 13.482 1.00 0.00 C ATOM 488 C MET A 32 0.914 12.163 12.080 1.00 0.00 C ATOM 489 O MET A 32 0.156 12.742 11.304 1.00 0.00 O ATOM 490 CB MET A 32 2.574 13.249 13.672 1.00 0.00 C ATOM 491 CG MET A 32 2.681 14.207 14.862 1.00 0.00 C ATOM 492 SD MET A 32 1.923 15.829 14.593 1.00 0.00 S ATOM 493 CE MET A 32 2.156 16.549 16.233 1.00 0.00 C ATOM 0 H MET A 32 1.482 11.639 15.227 1.00 0.00 H new ATOM 0 HA MET A 32 0.479 13.599 13.586 1.00 0.00 H new ATOM 0 HB2 MET A 32 3.245 12.403 13.824 1.00 0.00 H new ATOM 0 HB3 MET A 32 2.902 13.757 12.765 1.00 0.00 H new ATOM 0 HG2 MET A 32 2.214 13.741 15.730 1.00 0.00 H new ATOM 0 HG3 MET A 32 3.734 14.348 15.105 1.00 0.00 H new ATOM 0 HE1 MET A 32 1.744 17.558 16.249 1.00 0.00 H new ATOM 0 HE2 MET A 32 1.645 15.936 16.975 1.00 0.00 H new ATOM 0 HE3 MET A 32 3.220 16.588 16.465 1.00 0.00 H new ATOM 503 N ILE A 33 1.531 11.017 11.762 1.00 0.00 N ATOM 504 CA ILE A 33 1.425 10.384 10.439 1.00 0.00 C ATOM 505 C ILE A 33 -0.022 10.115 10.000 1.00 0.00 C ATOM 506 O ILE A 33 -0.294 10.034 8.804 1.00 0.00 O ATOM 507 CB ILE A 33 2.401 9.191 10.297 1.00 0.00 C ATOM 508 CG1 ILE A 33 2.290 8.393 8.985 1.00 0.00 C ATOM 509 CG2 ILE A 33 2.379 8.206 11.471 1.00 0.00 C ATOM 510 CD1 ILE A 33 1.353 7.180 9.031 1.00 0.00 C ATOM 0 H ILE A 33 2.119 10.501 12.416 1.00 0.00 H new ATOM 0 HA ILE A 33 1.763 11.112 9.702 1.00 0.00 H new ATOM 0 HB ILE A 33 3.358 9.712 10.290 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.948 9.065 8.198 1.00 0.00 H new ATOM 0 HG13 ILE A 33 3.286 8.051 8.702 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.093 7.403 11.286 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.650 8.728 12.389 1.00 0.00 H new ATOM 0 HG23 ILE A 33 1.379 7.785 11.574 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.346 6.688 8.058 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.702 6.479 9.790 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.344 7.509 9.278 1.00 0.00 H new ATOM 522 N GLU A 34 -0.956 10.035 10.949 1.00 0.00 N ATOM 523 CA GLU A 34 -2.377 9.851 10.693 1.00 0.00 C ATOM 524 C GLU A 34 -3.095 11.204 10.605 1.00 0.00 C ATOM 525 O GLU A 34 -3.964 11.392 9.759 1.00 0.00 O ATOM 526 CB GLU A 34 -2.985 8.994 11.813 1.00 0.00 C ATOM 527 CG GLU A 34 -2.317 7.615 11.909 1.00 0.00 C ATOM 528 CD GLU A 34 -2.865 6.809 13.082 1.00 0.00 C ATOM 529 OE1 GLU A 34 -2.322 6.977 14.197 1.00 0.00 O ATOM 530 OE2 GLU A 34 -3.813 6.031 12.844 1.00 0.00 O ATOM 0 H GLU A 34 -0.734 10.099 11.943 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.504 9.343 9.737 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -2.881 9.514 12.765 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.053 8.868 11.634 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.479 7.066 10.982 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -1.240 7.738 12.022 1.00 0.00 H new ATOM 537 N GLY A 35 -2.754 12.128 11.507 1.00 0.00 N ATOM 538 CA GLY A 35 -3.462 13.382 11.725 1.00 0.00 C ATOM 539 C GLY A 35 -3.066 14.426 10.681 1.00 0.00 C ATOM 540 O GLY A 35 -3.665 14.446 9.608 1.00 0.00 O ATOM 0 H GLY A 35 -1.950 12.015 12.124 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.537 13.209 11.681 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.241 13.759 12.723 1.00 0.00 H new ATOM 544 N PRO A 36 -2.068 15.295 10.928 1.00 0.00 N ATOM 545 CA PRO A 36 -1.498 16.169 9.905 1.00 0.00 C ATOM 546 C PRO A 36 -0.710 15.383 8.840 1.00 0.00 C ATOM 547 O PRO A 36 0.448 15.696 8.547 1.00 0.00 O ATOM 548 CB PRO A 36 -0.612 17.172 10.664 1.00 0.00 C ATOM 549 CG PRO A 36 -1.161 17.140 12.088 1.00 0.00 C ATOM 550 CD PRO A 36 -1.571 15.677 12.239 1.00 0.00 C ATOM 0 HA PRO A 36 -2.279 16.680 9.343 1.00 0.00 H new ATOM 0 HB2 PRO A 36 0.438 16.881 10.634 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.678 18.171 10.232 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -0.409 17.430 12.822 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.007 17.816 12.214 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -0.725 15.058 12.538 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.339 15.558 13.004 1.00 0.00 H new ATOM 558 N PHE A 37 -1.325 14.357 8.239 1.00 0.00 N ATOM 559 CA PHE A 37 -0.672 13.462 7.300 1.00 0.00 C ATOM 560 C PHE A 37 -0.222 14.216 6.065 1.00 0.00 C ATOM 561 O PHE A 37 0.822 13.893 5.511 1.00 0.00 O ATOM 562 CB PHE A 37 -1.560 12.252 6.976 1.00 0.00 C ATOM 563 CG PHE A 37 -2.710 12.534 6.025 1.00 0.00 C ATOM 564 CD1 PHE A 37 -3.928 13.047 6.508 1.00 0.00 C ATOM 565 CD2 PHE A 37 -2.569 12.262 4.651 1.00 0.00 C ATOM 566 CE1 PHE A 37 -4.961 13.374 5.614 1.00 0.00 C ATOM 567 CE2 PHE A 37 -3.607 12.579 3.756 1.00 0.00 C ATOM 568 CZ PHE A 37 -4.799 13.148 4.236 1.00 0.00 C ATOM 0 H PHE A 37 -2.306 14.129 8.400 1.00 0.00 H new ATOM 0 HA PHE A 37 0.228 13.061 7.767 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.937 11.468 6.546 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.967 11.860 7.908 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.069 13.190 7.569 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.661 11.808 4.283 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -5.881 13.800 5.986 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.488 12.385 2.700 1.00 0.00 H new ATOM 0 HZ PHE A 37 -5.589 13.411 3.548 1.00 0.00 H new ATOM 578 N ARG A 38 -0.942 15.283 5.714 1.00 0.00 N ATOM 579 CA ARG A 38 -0.553 16.251 4.698 1.00 0.00 C ATOM 580 C ARG A 38 0.937 16.619 4.770 1.00 0.00 C ATOM 581 O ARG A 38 1.510 16.975 3.744 1.00 0.00 O ATOM 582 CB ARG A 38 -1.425 17.509 4.816 1.00 0.00 C ATOM 583 CG ARG A 38 -2.939 17.237 4.774 1.00 0.00 C ATOM 584 CD ARG A 38 -3.368 16.390 3.569 1.00 0.00 C ATOM 585 NE ARG A 38 -2.879 16.951 2.300 1.00 0.00 N ATOM 586 CZ ARG A 38 -3.425 17.988 1.649 1.00 0.00 C ATOM 587 NH1 ARG A 38 -4.504 18.607 2.138 1.00 0.00 N ATOM 588 NH2 ARG A 38 -2.879 18.404 0.501 1.00 0.00 N ATOM 0 H ARG A 38 -1.840 15.500 6.146 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.712 15.784 3.726 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -1.185 18.017 5.750 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -1.168 18.192 4.006 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.236 16.729 5.691 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -3.472 18.188 4.750 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -2.990 15.375 3.686 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -4.456 16.324 3.541 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.057 16.515 1.881 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.920 18.291 3.014 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -4.912 19.395 1.635 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -2.055 17.933 0.128 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -3.287 19.192 -0.002 1.00 0.00 H new ATOM 602 N GLU A 39 1.561 16.518 5.953 1.00 0.00 N ATOM 603 CA GLU A 39 3.009 16.629 6.100 1.00 0.00 C ATOM 604 C GLU A 39 3.536 15.278 6.583 1.00 0.00 C ATOM 605 O GLU A 39 4.381 14.638 5.954 1.00 0.00 O ATOM 606 CB GLU A 39 3.334 17.746 7.110 1.00 0.00 C ATOM 607 CG GLU A 39 4.843 18.025 7.207 1.00 0.00 C ATOM 608 CD GLU A 39 5.204 18.862 8.434 1.00 0.00 C ATOM 609 OE1 GLU A 39 4.462 19.832 8.697 1.00 0.00 O ATOM 610 OE2 GLU A 39 6.216 18.518 9.089 1.00 0.00 O ATOM 0 H GLU A 39 1.070 16.357 6.832 1.00 0.00 H new ATOM 0 HA GLU A 39 3.484 16.885 5.153 1.00 0.00 H new ATOM 0 HB2 GLU A 39 2.816 18.659 6.817 1.00 0.00 H new ATOM 0 HB3 GLU A 39 2.955 17.466 8.093 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.383 17.079 7.245 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.172 18.544 6.307 1.00 0.00 H new ATOM 617 N SER A 40 2.973 14.841 7.705 1.00 0.00 N ATOM 618 CA SER A 40 3.421 13.725 8.508 1.00 0.00 C ATOM 619 C SER A 40 3.358 12.355 7.836 1.00 0.00 C ATOM 620 O SER A 40 3.917 11.411 8.386 1.00 0.00 O ATOM 621 CB SER A 40 2.614 13.734 9.799 1.00 0.00 C ATOM 622 OG SER A 40 2.486 15.047 10.313 1.00 0.00 O ATOM 0 H SER A 40 2.143 15.288 8.095 1.00 0.00 H new ATOM 0 HA SER A 40 4.487 13.869 8.686 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.625 13.314 9.616 1.00 0.00 H new ATOM 0 HB3 SER A 40 3.099 13.097 10.539 1.00 0.00 H new ATOM 0 HG SER A 40 1.711 15.485 9.903 1.00 0.00 H new ATOM 628 N LYS A 41 2.716 12.221 6.667 1.00 0.00 N ATOM 629 CA LYS A 41 2.639 10.959 5.931 1.00 0.00 C ATOM 630 C LYS A 41 4.014 10.316 5.718 1.00 0.00 C ATOM 631 O LYS A 41 4.106 9.107 5.518 1.00 0.00 O ATOM 632 CB LYS A 41 1.911 11.143 4.592 1.00 0.00 C ATOM 633 CG LYS A 41 2.656 12.075 3.623 1.00 0.00 C ATOM 634 CD LYS A 41 1.839 12.348 2.352 1.00 0.00 C ATOM 635 CE LYS A 41 0.723 13.364 2.617 1.00 0.00 C ATOM 636 NZ LYS A 41 -0.051 13.653 1.397 1.00 0.00 N ATOM 0 H LYS A 41 2.234 12.992 6.206 1.00 0.00 H new ATOM 0 HA LYS A 41 2.060 10.273 6.550 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.779 10.169 4.120 1.00 0.00 H new ATOM 0 HB3 LYS A 41 0.915 11.544 4.779 1.00 0.00 H new ATOM 0 HG2 LYS A 41 2.876 13.018 4.123 1.00 0.00 H new ATOM 0 HG3 LYS A 41 3.612 11.628 3.351 1.00 0.00 H new ATOM 0 HD2 LYS A 41 2.497 12.723 1.568 1.00 0.00 H new ATOM 0 HD3 LYS A 41 1.407 11.416 1.987 1.00 0.00 H new ATOM 0 HE2 LYS A 41 0.056 12.979 3.389 1.00 0.00 H new ATOM 0 HE3 LYS A 41 1.155 14.288 3.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -0.797 14.344 1.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 0.581 14.043 0.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -0.484 12.776 1.045 1.00 0.00 H new ATOM 650 N GLY A 42 5.061 11.144 5.725 1.00 0.00 N ATOM 651 CA GLY A 42 6.440 10.748 5.516 1.00 0.00 C ATOM 652 C GLY A 42 7.356 11.390 6.553 1.00 0.00 C ATOM 653 O GLY A 42 8.238 10.707 7.077 1.00 0.00 O ATOM 0 H GLY A 42 4.959 12.146 5.883 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.523 9.663 5.574 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.758 11.039 4.515 1.00 0.00 H new ATOM 657 N ARG A 43 7.184 12.688 6.851 1.00 0.00 N ATOM 658 CA ARG A 43 8.125 13.420 7.695 1.00 0.00 C ATOM 659 C ARG A 43 7.460 14.443 8.618 1.00 0.00 C ATOM 660 O ARG A 43 6.526 15.124 8.211 1.00 0.00 O ATOM 661 CB ARG A 43 9.227 14.064 6.833 1.00 0.00 C ATOM 662 CG ARG A 43 8.884 15.395 6.141 1.00 0.00 C ATOM 663 CD ARG A 43 7.708 15.308 5.163 1.00 0.00 C ATOM 664 NE ARG A 43 7.935 14.277 4.142 1.00 0.00 N ATOM 665 CZ ARG A 43 6.988 13.659 3.423 1.00 0.00 C ATOM 666 NH1 ARG A 43 5.685 13.840 3.679 1.00 0.00 N ATOM 667 NH2 ARG A 43 7.360 12.842 2.432 1.00 0.00 N ATOM 0 H ARG A 43 6.399 13.247 6.517 1.00 0.00 H new ATOM 0 HA ARG A 43 8.579 12.688 8.363 1.00 0.00 H new ATOM 0 HB2 ARG A 43 10.100 14.226 7.465 1.00 0.00 H new ATOM 0 HB3 ARG A 43 9.518 13.348 6.065 1.00 0.00 H new ATOM 0 HG2 ARG A 43 8.654 16.139 6.903 1.00 0.00 H new ATOM 0 HG3 ARG A 43 9.764 15.750 5.604 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.793 15.084 5.711 1.00 0.00 H new ATOM 0 HD3 ARG A 43 7.562 16.274 4.680 1.00 0.00 H new ATOM 0 HE ARG A 43 8.902 14.007 3.964 1.00 0.00 H new ATOM 0 HH11 ARG A 43 5.395 14.460 4.436 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.983 13.358 3.117 1.00 0.00 H new ATOM 0 HH21 ARG A 43 8.350 12.698 2.234 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.654 12.363 1.874 1.00 0.00 H new ATOM 681 N ILE A 44 7.965 14.566 9.850 1.00 0.00 N ATOM 682 CA ILE A 44 7.624 15.614 10.800 1.00 0.00 C ATOM 683 C ILE A 44 8.844 16.545 10.866 1.00 0.00 C ATOM 684 O ILE A 44 9.958 16.108 11.185 1.00 0.00 O ATOM 685 CB ILE A 44 7.265 15.012 12.173 1.00 0.00 C ATOM 686 CG1 ILE A 44 5.930 14.238 12.165 1.00 0.00 C ATOM 687 CG2 ILE A 44 7.146 16.123 13.230 1.00 0.00 C ATOM 688 CD1 ILE A 44 5.988 12.897 11.430 1.00 0.00 C ATOM 0 H ILE A 44 8.650 13.908 10.221 1.00 0.00 H new ATOM 0 HA ILE A 44 6.742 16.174 10.489 1.00 0.00 H new ATOM 0 HB ILE A 44 8.071 14.318 12.410 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.618 14.062 13.195 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.164 14.861 11.702 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.892 15.682 14.194 1.00 0.00 H new ATOM 0 HG22 ILE A 44 8.096 16.651 13.311 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.365 16.824 12.935 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.010 12.417 11.471 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.267 13.064 10.390 1.00 0.00 H new ATOM 0 HD13 ILE A 44 6.728 12.253 11.905 1.00 0.00 H new ATOM 700 N GLU A 45 8.641 17.819 10.519 1.00 0.00 N ATOM 701 CA GLU A 45 9.714 18.793 10.425 1.00 0.00 C ATOM 702 C GLU A 45 9.904 19.552 11.743 1.00 0.00 C ATOM 703 O GLU A 45 9.038 20.327 12.142 1.00 0.00 O ATOM 704 CB GLU A 45 9.445 19.738 9.244 1.00 0.00 C ATOM 705 CG GLU A 45 10.760 20.362 8.753 1.00 0.00 C ATOM 706 CD GLU A 45 10.532 21.462 7.719 1.00 0.00 C ATOM 707 OE1 GLU A 45 9.634 22.296 7.960 1.00 0.00 O ATOM 708 OE2 GLU A 45 11.275 21.464 6.713 1.00 0.00 O ATOM 0 H GLU A 45 7.721 18.198 10.296 1.00 0.00 H new ATOM 0 HA GLU A 45 10.653 18.271 10.240 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.969 19.190 8.431 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.753 20.523 9.548 1.00 0.00 H new ATOM 0 HG2 GLU A 45 11.303 20.774 9.603 1.00 0.00 H new ATOM 0 HG3 GLU A 45 11.388 19.584 8.319 1.00 0.00 H new ATOM 715 N LEU A 46 11.053 19.357 12.395 1.00 0.00 N ATOM 716 CA LEU A 46 11.511 20.138 13.534 1.00 0.00 C ATOM 717 C LEU A 46 12.665 20.999 13.017 1.00 0.00 C ATOM 718 O LEU A 46 13.836 20.727 13.287 1.00 0.00 O ATOM 719 CB LEU A 46 11.938 19.212 14.687 1.00 0.00 C ATOM 720 CG LEU A 46 10.783 18.387 15.282 1.00 0.00 C ATOM 721 CD1 LEU A 46 11.322 17.481 16.393 1.00 0.00 C ATOM 722 CD2 LEU A 46 9.671 19.270 15.863 1.00 0.00 C ATOM 0 H LEU A 46 11.710 18.623 12.130 1.00 0.00 H new ATOM 0 HA LEU A 46 10.723 20.771 13.943 1.00 0.00 H new ATOM 0 HB2 LEU A 46 12.710 18.532 14.327 1.00 0.00 H new ATOM 0 HB3 LEU A 46 12.387 19.814 15.477 1.00 0.00 H new ATOM 0 HG LEU A 46 10.356 17.799 14.470 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.504 16.897 16.815 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.074 16.808 15.981 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.772 18.093 17.175 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.881 18.639 16.270 1.00 0.00 H new ATOM 0 HD22 LEU A 46 10.080 19.896 16.656 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.261 19.903 15.076 1.00 0.00 H new ATOM 734 N LYS A 47 12.318 22.035 12.243 1.00 0.00 N ATOM 735 CA LYS A 47 13.246 22.858 11.475 1.00 0.00 C ATOM 736 C LYS A 47 14.017 23.853 12.356 1.00 0.00 C ATOM 737 O LYS A 47 14.090 25.044 12.061 1.00 0.00 O ATOM 738 CB LYS A 47 12.453 23.569 10.364 1.00 0.00 C ATOM 739 CG LYS A 47 13.329 23.826 9.134 1.00 0.00 C ATOM 740 CD LYS A 47 12.530 24.596 8.077 1.00 0.00 C ATOM 741 CE LYS A 47 13.283 24.674 6.746 1.00 0.00 C ATOM 742 NZ LYS A 47 13.494 23.341 6.151 1.00 0.00 N ATOM 0 H LYS A 47 11.347 22.329 12.134 1.00 0.00 H new ATOM 0 HA LYS A 47 14.008 22.218 11.031 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.594 22.961 10.081 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.064 24.515 10.740 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.214 24.395 9.419 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.678 22.880 8.721 1.00 0.00 H new ATOM 0 HD2 LYS A 47 11.567 24.110 7.923 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.324 25.603 8.439 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.723 25.298 6.049 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.247 25.158 6.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.569 23.430 5.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 14.371 22.927 6.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.691 22.724 6.388 1.00 0.00 H new ATOM 756 N GLN A 48 14.590 23.363 13.453 1.00 0.00 N ATOM 757 CA GLN A 48 15.312 24.138 14.447 1.00 0.00 C ATOM 758 C GLN A 48 16.122 23.209 15.356 1.00 0.00 C ATOM 759 O GLN A 48 17.263 23.525 15.686 1.00 0.00 O ATOM 760 CB GLN A 48 14.390 25.105 15.226 1.00 0.00 C ATOM 761 CG GLN A 48 12.899 24.739 15.346 1.00 0.00 C ATOM 762 CD GLN A 48 12.649 23.460 16.134 1.00 0.00 C ATOM 763 OE1 GLN A 48 12.804 22.362 15.613 1.00 0.00 O ATOM 764 NE2 GLN A 48 12.260 23.575 17.398 1.00 0.00 N ATOM 0 H GLN A 48 14.560 22.369 13.679 1.00 0.00 H new ATOM 0 HA GLN A 48 16.020 24.784 13.929 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.791 25.210 16.234 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.457 26.085 14.753 1.00 0.00 H new ATOM 0 HG2 GLN A 48 12.369 25.562 15.826 1.00 0.00 H new ATOM 0 HG3 GLN A 48 12.479 24.629 14.346 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.137 24.499 17.812 1.00 0.00 H new ATOM 0 HE22 GLN A 48 12.084 22.739 17.955 1.00 0.00 H new ATOM 773 N PHE A 49 15.558 22.058 15.746 1.00 0.00 N ATOM 774 CA PHE A 49 16.256 21.099 16.591 1.00 0.00 C ATOM 775 C PHE A 49 17.524 20.591 15.910 1.00 0.00 C ATOM 776 O PHE A 49 17.537 20.340 14.704 1.00 0.00 O ATOM 777 CB PHE A 49 15.344 19.922 16.971 1.00 0.00 C ATOM 778 CG PHE A 49 14.404 20.128 18.148 1.00 0.00 C ATOM 779 CD1 PHE A 49 14.145 21.408 18.680 1.00 0.00 C ATOM 780 CD2 PHE A 49 13.871 18.994 18.789 1.00 0.00 C ATOM 781 CE1 PHE A 49 13.354 21.549 19.832 1.00 0.00 C ATOM 782 CE2 PHE A 49 13.068 19.137 19.932 1.00 0.00 C ATOM 783 CZ PHE A 49 12.802 20.415 20.448 1.00 0.00 C ATOM 0 H PHE A 49 14.614 21.774 15.484 1.00 0.00 H new ATOM 0 HA PHE A 49 16.541 21.617 17.507 1.00 0.00 H new ATOM 0 HB2 PHE A 49 14.743 19.664 16.099 1.00 0.00 H new ATOM 0 HB3 PHE A 49 15.976 19.061 17.189 1.00 0.00 H new ATOM 0 HD1 PHE A 49 14.557 22.283 18.200 1.00 0.00 H new ATOM 0 HD2 PHE A 49 14.081 18.009 18.400 1.00 0.00 H new ATOM 0 HE1 PHE A 49 13.170 22.530 20.244 1.00 0.00 H new ATOM 0 HE2 PHE A 49 12.655 18.263 20.414 1.00 0.00 H new ATOM 0 HZ PHE A 49 12.173 20.526 21.319 1.00 0.00 H new ATOM 793 N ASP A 50 18.584 20.436 16.708 1.00 0.00 N ATOM 794 CA ASP A 50 19.915 20.080 16.246 1.00 0.00 C ATOM 795 C ASP A 50 19.965 18.624 15.773 1.00 0.00 C ATOM 796 O ASP A 50 19.304 17.754 16.338 1.00 0.00 O ATOM 797 CB ASP A 50 20.911 20.352 17.380 1.00 0.00 C ATOM 798 CG ASP A 50 22.268 19.706 17.137 1.00 0.00 C ATOM 799 OD1 ASP A 50 23.084 20.323 16.420 1.00 0.00 O ATOM 800 OD2 ASP A 50 22.461 18.589 17.663 1.00 0.00 O ATOM 0 H ASP A 50 18.532 20.559 17.719 1.00 0.00 H new ATOM 0 HA ASP A 50 20.185 20.689 15.383 1.00 0.00 H new ATOM 0 HB2 ASP A 50 21.041 21.428 17.494 1.00 0.00 H new ATOM 0 HB3 ASP A 50 20.498 19.980 18.318 1.00 0.00 H new ATOM 805 N SER A 51 20.786 18.361 14.754 1.00 0.00 N ATOM 806 CA SER A 51 21.014 17.047 14.174 1.00 0.00 C ATOM 807 C SER A 51 21.328 16.002 15.239 1.00 0.00 C ATOM 808 O SER A 51 20.716 14.942 15.278 1.00 0.00 O ATOM 809 CB SER A 51 22.189 17.169 13.198 1.00 0.00 C ATOM 810 OG SER A 51 23.149 18.058 13.751 1.00 0.00 O ATOM 0 H SER A 51 21.330 19.092 14.295 1.00 0.00 H new ATOM 0 HA SER A 51 20.109 16.717 13.664 1.00 0.00 H new ATOM 0 HB2 SER A 51 22.637 16.191 13.022 1.00 0.00 H new ATOM 0 HB3 SER A 51 21.842 17.540 12.233 1.00 0.00 H new ATOM 0 HG SER A 51 24.014 17.603 13.821 1.00 0.00 H new ATOM 816 N HIS A 52 22.311 16.288 16.086 1.00 0.00 N ATOM 817 CA HIS A 52 22.849 15.339 17.053 1.00 0.00 C ATOM 818 C HIS A 52 21.807 15.036 18.134 1.00 0.00 C ATOM 819 O HIS A 52 21.608 13.878 18.511 1.00 0.00 O ATOM 820 CB HIS A 52 24.166 15.881 17.633 1.00 0.00 C ATOM 821 CG HIS A 52 25.002 16.612 16.610 1.00 0.00 C ATOM 822 ND1 HIS A 52 25.240 17.969 16.604 1.00 0.00 N ATOM 823 CD2 HIS A 52 25.331 16.135 15.367 1.00 0.00 C ATOM 824 CE1 HIS A 52 25.720 18.296 15.393 1.00 0.00 C ATOM 825 NE2 HIS A 52 25.762 17.217 14.593 1.00 0.00 N ATOM 0 H HIS A 52 22.764 17.201 16.120 1.00 0.00 H new ATOM 0 HA HIS A 52 23.075 14.393 16.560 1.00 0.00 H new ATOM 0 HB2 HIS A 52 23.943 16.554 18.460 1.00 0.00 H new ATOM 0 HB3 HIS A 52 24.744 15.053 18.043 1.00 0.00 H new ATOM 0 HD2 HIS A 52 25.268 15.107 15.043 1.00 0.00 H new ATOM 0 HE1 HIS A 52 26.030 19.289 15.102 1.00 0.00 H new ATOM 0 HE2 HIS A 52 26.051 17.192 13.615 1.00 0.00 H new ATOM 833 N ILE A 53 21.118 16.080 18.607 1.00 0.00 N ATOM 834 CA ILE A 53 19.970 15.922 19.493 1.00 0.00 C ATOM 835 C ILE A 53 18.972 14.961 18.845 1.00 0.00 C ATOM 836 O ILE A 53 18.609 13.941 19.433 1.00 0.00 O ATOM 837 CB ILE A 53 19.295 17.281 19.774 1.00 0.00 C ATOM 838 CG1 ILE A 53 20.219 18.295 20.470 1.00 0.00 C ATOM 839 CG2 ILE A 53 18.008 17.067 20.582 1.00 0.00 C ATOM 840 CD1 ILE A 53 20.472 18.010 21.945 1.00 0.00 C ATOM 0 H ILE A 53 21.342 17.050 18.386 1.00 0.00 H new ATOM 0 HA ILE A 53 20.310 15.517 20.446 1.00 0.00 H new ATOM 0 HB ILE A 53 19.053 17.719 18.806 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.175 18.314 19.947 1.00 0.00 H new ATOM 0 HG13 ILE A 53 19.783 19.290 20.375 1.00 0.00 H new ATOM 0 HG21 ILE A 53 17.536 18.030 20.777 1.00 0.00 H new ATOM 0 HG22 ILE A 53 17.323 16.436 20.015 1.00 0.00 H new ATOM 0 HG23 ILE A 53 18.249 16.583 21.528 1.00 0.00 H new ATOM 0 HD11 ILE A 53 21.133 18.774 22.355 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.525 18.021 22.485 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.939 17.031 22.052 1.00 0.00 H new ATOM 852 N LEU A 54 18.526 15.307 17.633 1.00 0.00 N ATOM 853 CA LEU A 54 17.544 14.535 16.886 1.00 0.00 C ATOM 854 C LEU A 54 18.019 13.081 16.781 1.00 0.00 C ATOM 855 O LEU A 54 17.262 12.156 17.063 1.00 0.00 O ATOM 856 CB LEU A 54 17.327 15.199 15.512 1.00 0.00 C ATOM 857 CG LEU A 54 15.969 14.944 14.833 1.00 0.00 C ATOM 858 CD1 LEU A 54 15.610 13.464 14.816 1.00 0.00 C ATOM 859 CD2 LEU A 54 14.847 15.771 15.472 1.00 0.00 C ATOM 0 H LEU A 54 18.845 16.143 17.142 1.00 0.00 H new ATOM 0 HA LEU A 54 16.581 14.520 17.396 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.453 16.275 15.629 1.00 0.00 H new ATOM 0 HB3 LEU A 54 18.114 14.857 14.840 1.00 0.00 H new ATOM 0 HG LEU A 54 16.073 15.270 13.798 1.00 0.00 H new ATOM 0 HD11 LEU A 54 14.645 13.329 14.328 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.373 12.911 14.269 1.00 0.00 H new ATOM 0 HD13 LEU A 54 15.555 13.091 15.839 1.00 0.00 H new ATOM 0 HD21 LEU A 54 13.906 15.562 14.964 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.756 15.508 16.526 1.00 0.00 H new ATOM 0 HD23 LEU A 54 15.080 16.832 15.381 1.00 0.00 H new ATOM 871 N GLU A 55 19.289 12.886 16.420 1.00 0.00 N ATOM 872 CA GLU A 55 19.922 11.587 16.281 1.00 0.00 C ATOM 873 C GLU A 55 19.703 10.740 17.532 1.00 0.00 C ATOM 874 O GLU A 55 19.121 9.658 17.449 1.00 0.00 O ATOM 875 CB GLU A 55 21.410 11.768 15.951 1.00 0.00 C ATOM 876 CG GLU A 55 22.078 10.468 15.489 1.00 0.00 C ATOM 877 CD GLU A 55 23.467 10.756 14.927 1.00 0.00 C ATOM 878 OE1 GLU A 55 23.521 11.421 13.867 1.00 0.00 O ATOM 879 OE2 GLU A 55 24.445 10.327 15.575 1.00 0.00 O ATOM 0 H GLU A 55 19.921 13.659 16.211 1.00 0.00 H new ATOM 0 HA GLU A 55 19.462 11.046 15.454 1.00 0.00 H new ATOM 0 HB2 GLU A 55 21.515 12.522 15.171 1.00 0.00 H new ATOM 0 HB3 GLU A 55 21.930 12.145 16.832 1.00 0.00 H new ATOM 0 HG2 GLU A 55 22.154 9.773 16.325 1.00 0.00 H new ATOM 0 HG3 GLU A 55 21.464 9.986 14.729 1.00 0.00 H new ATOM 886 N LYS A 56 20.155 11.223 18.694 1.00 0.00 N ATOM 887 CA LYS A 56 19.989 10.462 19.925 1.00 0.00 C ATOM 888 C LYS A 56 18.506 10.256 20.242 1.00 0.00 C ATOM 889 O LYS A 56 18.108 9.156 20.620 1.00 0.00 O ATOM 890 CB LYS A 56 20.735 11.116 21.093 1.00 0.00 C ATOM 891 CG LYS A 56 22.252 11.113 20.854 1.00 0.00 C ATOM 892 CD LYS A 56 23.048 11.315 22.156 1.00 0.00 C ATOM 893 CE LYS A 56 23.050 10.094 23.092 1.00 0.00 C ATOM 894 NZ LYS A 56 23.622 8.898 22.448 1.00 0.00 N ATOM 0 H LYS A 56 20.629 12.120 18.803 1.00 0.00 H new ATOM 0 HA LYS A 56 20.434 9.478 19.775 1.00 0.00 H new ATOM 0 HB2 LYS A 56 20.387 12.141 21.222 1.00 0.00 H new ATOM 0 HB3 LYS A 56 20.509 10.583 22.017 1.00 0.00 H new ATOM 0 HG2 LYS A 56 22.544 10.168 20.395 1.00 0.00 H new ATOM 0 HG3 LYS A 56 22.508 11.903 20.148 1.00 0.00 H new ATOM 0 HD2 LYS A 56 24.078 11.566 21.903 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.634 12.169 22.692 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.621 10.328 23.991 1.00 0.00 H new ATOM 0 HE3 LYS A 56 22.029 9.880 23.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 23.728 8.141 23.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 22.989 8.577 21.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.553 9.131 22.048 1.00 0.00 H new ATOM 908 N ALA A 57 17.686 11.297 20.070 1.00 0.00 N ATOM 909 CA ALA A 57 16.250 11.213 20.308 1.00 0.00 C ATOM 910 C ALA A 57 15.593 10.122 19.454 1.00 0.00 C ATOM 911 O ALA A 57 14.713 9.413 19.930 1.00 0.00 O ATOM 912 CB ALA A 57 15.599 12.574 20.063 1.00 0.00 C ATOM 0 H ALA A 57 18.002 12.217 19.763 1.00 0.00 H new ATOM 0 HA ALA A 57 16.096 10.933 21.350 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.526 12.502 20.243 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.032 13.311 20.739 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.774 12.881 19.032 1.00 0.00 H new ATOM 918 N VAL A 58 16.005 9.968 18.198 1.00 0.00 N ATOM 919 CA VAL A 58 15.527 8.885 17.350 1.00 0.00 C ATOM 920 C VAL A 58 16.089 7.553 17.846 1.00 0.00 C ATOM 921 O VAL A 58 15.332 6.595 18.027 1.00 0.00 O ATOM 922 CB VAL A 58 15.854 9.188 15.877 1.00 0.00 C ATOM 923 CG1 VAL A 58 15.837 7.925 15.006 1.00 0.00 C ATOM 924 CG2 VAL A 58 14.812 10.182 15.364 1.00 0.00 C ATOM 0 H VAL A 58 16.676 10.588 17.744 1.00 0.00 H new ATOM 0 HA VAL A 58 14.442 8.802 17.410 1.00 0.00 H new ATOM 0 HB VAL A 58 16.861 9.600 15.817 1.00 0.00 H new ATOM 0 HG11 VAL A 58 16.074 8.190 13.976 1.00 0.00 H new ATOM 0 HG12 VAL A 58 16.578 7.217 15.377 1.00 0.00 H new ATOM 0 HG13 VAL A 58 14.848 7.469 15.045 1.00 0.00 H new ATOM 0 HG21 VAL A 58 15.017 10.417 14.320 1.00 0.00 H new ATOM 0 HG22 VAL A 58 13.818 9.743 15.449 1.00 0.00 H new ATOM 0 HG23 VAL A 58 14.857 11.095 15.957 1.00 0.00 H new ATOM 934 N GLU A 59 17.406 7.485 18.075 1.00 0.00 N ATOM 935 CA GLU A 59 18.066 6.261 18.510 1.00 0.00 C ATOM 936 C GLU A 59 17.348 5.694 19.738 1.00 0.00 C ATOM 937 O GLU A 59 17.059 4.505 19.775 1.00 0.00 O ATOM 938 CB GLU A 59 19.564 6.513 18.762 1.00 0.00 C ATOM 939 CG GLU A 59 20.426 5.280 18.449 1.00 0.00 C ATOM 940 CD GLU A 59 20.094 4.069 19.316 1.00 0.00 C ATOM 941 OE1 GLU A 59 20.442 4.125 20.515 1.00 0.00 O ATOM 942 OE2 GLU A 59 19.504 3.113 18.768 1.00 0.00 O ATOM 0 H GLU A 59 18.038 8.278 17.963 1.00 0.00 H new ATOM 0 HA GLU A 59 18.006 5.512 17.721 1.00 0.00 H new ATOM 0 HB2 GLU A 59 19.897 7.351 18.149 1.00 0.00 H new ATOM 0 HB3 GLU A 59 19.711 6.801 19.803 1.00 0.00 H new ATOM 0 HG2 GLU A 59 20.296 5.013 17.400 1.00 0.00 H new ATOM 0 HG3 GLU A 59 21.477 5.537 18.585 1.00 0.00 H new ATOM 949 N TYR A 60 17.006 6.555 20.699 1.00 0.00 N ATOM 950 CA TYR A 60 16.207 6.240 21.882 1.00 0.00 C ATOM 951 C TYR A 60 15.015 5.323 21.569 1.00 0.00 C ATOM 952 O TYR A 60 14.710 4.415 22.339 1.00 0.00 O ATOM 953 CB TYR A 60 15.720 7.562 22.488 1.00 0.00 C ATOM 954 CG TYR A 60 14.918 7.532 23.776 1.00 0.00 C ATOM 955 CD1 TYR A 60 15.051 6.486 24.706 1.00 0.00 C ATOM 956 CD2 TYR A 60 14.096 8.635 24.087 1.00 0.00 C ATOM 957 CE1 TYR A 60 14.386 6.562 25.939 1.00 0.00 C ATOM 958 CE2 TYR A 60 13.446 8.711 25.331 1.00 0.00 C ATOM 959 CZ TYR A 60 13.630 7.689 26.276 1.00 0.00 C ATOM 960 OH TYR A 60 13.070 7.766 27.515 1.00 0.00 O ATOM 0 H TYR A 60 17.292 7.534 20.671 1.00 0.00 H new ATOM 0 HA TYR A 60 16.831 5.691 22.587 1.00 0.00 H new ATOM 0 HB2 TYR A 60 16.596 8.187 22.661 1.00 0.00 H new ATOM 0 HB3 TYR A 60 15.114 8.065 21.735 1.00 0.00 H new ATOM 0 HD1 TYR A 60 15.663 5.627 24.472 1.00 0.00 H new ATOM 0 HD2 TYR A 60 13.965 9.427 23.364 1.00 0.00 H new ATOM 0 HE1 TYR A 60 14.459 5.740 26.636 1.00 0.00 H new ATOM 0 HE2 TYR A 60 12.808 9.552 25.559 1.00 0.00 H new ATOM 0 HH TYR A 60 13.347 6.992 28.048 1.00 0.00 H new ATOM 970 N LEU A 61 14.318 5.551 20.454 1.00 0.00 N ATOM 971 CA LEU A 61 13.130 4.783 20.115 1.00 0.00 C ATOM 972 C LEU A 61 13.514 3.348 19.735 1.00 0.00 C ATOM 973 O LEU A 61 12.983 2.385 20.288 1.00 0.00 O ATOM 974 CB LEU A 61 12.363 5.509 19.001 1.00 0.00 C ATOM 975 CG LEU A 61 10.854 5.228 19.049 1.00 0.00 C ATOM 976 CD1 LEU A 61 10.191 5.942 20.234 1.00 0.00 C ATOM 977 CD2 LEU A 61 10.205 5.760 17.776 1.00 0.00 C ATOM 0 H LEU A 61 14.562 6.267 19.770 1.00 0.00 H new ATOM 0 HA LEU A 61 12.469 4.707 20.978 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.533 6.582 19.087 1.00 0.00 H new ATOM 0 HB3 LEU A 61 12.756 5.201 18.032 1.00 0.00 H new ATOM 0 HG LEU A 61 10.719 4.151 19.150 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.123 5.723 20.240 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.638 5.594 21.165 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.340 7.018 20.140 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.133 5.563 17.804 1.00 0.00 H new ATOM 0 HD22 LEU A 61 10.375 6.834 17.702 1.00 0.00 H new ATOM 0 HD23 LEU A 61 10.642 5.263 16.910 1.00 0.00 H new ATOM 989 N ASN A 62 14.474 3.201 18.817 1.00 0.00 N ATOM 990 CA ASN A 62 15.031 1.900 18.448 1.00 0.00 C ATOM 991 C ASN A 62 15.569 1.185 19.689 1.00 0.00 C ATOM 992 O ASN A 62 15.251 0.029 19.959 1.00 0.00 O ATOM 993 CB ASN A 62 16.143 2.097 17.409 1.00 0.00 C ATOM 994 CG ASN A 62 16.987 0.835 17.246 1.00 0.00 C ATOM 995 OD1 ASN A 62 16.537 -0.151 16.674 1.00 0.00 O ATOM 996 ND2 ASN A 62 18.215 0.847 17.757 1.00 0.00 N ATOM 0 H ASN A 62 14.886 3.984 18.309 1.00 0.00 H new ATOM 0 HA ASN A 62 14.248 1.280 18.013 1.00 0.00 H new ATOM 0 HB2 ASN A 62 15.702 2.367 16.450 1.00 0.00 H new ATOM 0 HB3 ASN A 62 16.782 2.927 17.711 1.00 0.00 H new ATOM 0 HD21 ASN A 62 18.808 0.021 17.678 1.00 0.00 H new ATOM 0 HD22 ASN A 62 18.563 1.682 18.228 1.00 0.00 H new ATOM 1003 N TYR A 63 16.384 1.905 20.453 1.00 0.00 N ATOM 1004 CA TYR A 63 16.976 1.471 21.702 1.00 0.00 C ATOM 1005 C TYR A 63 15.906 0.909 22.638 1.00 0.00 C ATOM 1006 O TYR A 63 16.034 -0.212 23.119 1.00 0.00 O ATOM 1007 CB TYR A 63 17.692 2.673 22.318 1.00 0.00 C ATOM 1008 CG TYR A 63 18.544 2.354 23.516 1.00 0.00 C ATOM 1009 CD1 TYR A 63 19.835 1.839 23.318 1.00 0.00 C ATOM 1010 CD2 TYR A 63 18.102 2.680 24.811 1.00 0.00 C ATOM 1011 CE1 TYR A 63 20.700 1.683 24.410 1.00 0.00 C ATOM 1012 CE2 TYR A 63 18.966 2.509 25.905 1.00 0.00 C ATOM 1013 CZ TYR A 63 20.264 2.022 25.700 1.00 0.00 C ATOM 1014 OH TYR A 63 21.111 1.895 26.757 1.00 0.00 O ATOM 0 H TYR A 63 16.660 2.854 20.200 1.00 0.00 H new ATOM 0 HA TYR A 63 17.692 0.667 21.531 1.00 0.00 H new ATOM 0 HB2 TYR A 63 18.320 3.134 21.556 1.00 0.00 H new ATOM 0 HB3 TYR A 63 16.946 3.413 22.607 1.00 0.00 H new ATOM 0 HD1 TYR A 63 20.161 1.563 22.326 1.00 0.00 H new ATOM 0 HD2 TYR A 63 17.103 3.060 24.963 1.00 0.00 H new ATOM 0 HE1 TYR A 63 21.700 1.303 24.259 1.00 0.00 H new ATOM 0 HE2 TYR A 63 18.631 2.752 26.902 1.00 0.00 H new ATOM 0 HH TYR A 63 22.029 1.791 26.430 1.00 0.00 H new ATOM 1024 N ASN A 64 14.840 1.676 22.883 1.00 0.00 N ATOM 1025 CA ASN A 64 13.721 1.244 23.712 1.00 0.00 C ATOM 1026 C ASN A 64 13.066 -0.008 23.130 1.00 0.00 C ATOM 1027 O ASN A 64 12.777 -0.949 23.867 1.00 0.00 O ATOM 1028 CB ASN A 64 12.670 2.353 23.839 1.00 0.00 C ATOM 1029 CG ASN A 64 13.050 3.471 24.803 1.00 0.00 C ATOM 1030 OD1 ASN A 64 13.924 3.334 25.661 1.00 0.00 O ATOM 1031 ND2 ASN A 64 12.349 4.594 24.688 1.00 0.00 N ATOM 0 H ASN A 64 14.732 2.618 22.508 1.00 0.00 H new ATOM 0 HA ASN A 64 14.117 1.015 24.701 1.00 0.00 H new ATOM 0 HB2 ASN A 64 12.493 2.784 22.854 1.00 0.00 H new ATOM 0 HB3 ASN A 64 11.730 1.910 24.167 1.00 0.00 H new ATOM 0 HD21 ASN A 64 12.528 5.374 25.321 1.00 0.00 H new ATOM 0 HD22 ASN A 64 11.632 4.676 23.967 1.00 0.00 H new ATOM 1038 N LEU A 65 12.807 -0.026 21.818 1.00 0.00 N ATOM 1039 CA LEU A 65 12.207 -1.181 21.159 1.00 0.00 C ATOM 1040 C LEU A 65 13.032 -2.439 21.462 1.00 0.00 C ATOM 1041 O LEU A 65 12.509 -3.433 21.965 1.00 0.00 O ATOM 1042 CB LEU A 65 12.077 -0.915 19.650 1.00 0.00 C ATOM 1043 CG LEU A 65 11.282 -1.993 18.892 1.00 0.00 C ATOM 1044 CD1 LEU A 65 9.787 -1.943 19.235 1.00 0.00 C ATOM 1045 CD2 LEU A 65 11.455 -1.777 17.384 1.00 0.00 C ATOM 0 H LEU A 65 13.007 0.754 21.192 1.00 0.00 H new ATOM 0 HA LEU A 65 11.202 -1.350 21.545 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.593 0.050 19.502 1.00 0.00 H new ATOM 0 HB3 LEU A 65 13.075 -0.842 19.217 1.00 0.00 H new ATOM 0 HG LEU A 65 11.667 -2.968 19.191 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.260 -2.719 18.680 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.653 -2.107 20.304 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.384 -0.967 18.965 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.894 -2.538 16.841 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.083 -0.789 17.113 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.511 -1.851 17.125 1.00 0.00 H new ATOM 1057 N LYS A 66 14.341 -2.385 21.207 1.00 0.00 N ATOM 1058 CA LYS A 66 15.242 -3.491 21.506 1.00 0.00 C ATOM 1059 C LYS A 66 15.219 -3.819 23.002 1.00 0.00 C ATOM 1060 O LYS A 66 15.017 -4.971 23.372 1.00 0.00 O ATOM 1061 CB LYS A 66 16.657 -3.174 20.996 1.00 0.00 C ATOM 1062 CG LYS A 66 16.883 -3.623 19.542 1.00 0.00 C ATOM 1063 CD LYS A 66 15.864 -3.044 18.549 1.00 0.00 C ATOM 1064 CE LYS A 66 16.149 -3.490 17.109 1.00 0.00 C ATOM 1065 NZ LYS A 66 17.379 -2.876 16.578 1.00 0.00 N ATOM 0 H LYS A 66 14.801 -1.576 20.789 1.00 0.00 H new ATOM 0 HA LYS A 66 14.900 -4.384 20.983 1.00 0.00 H new ATOM 0 HB2 LYS A 66 16.833 -2.101 21.071 1.00 0.00 H new ATOM 0 HB3 LYS A 66 17.388 -3.663 21.640 1.00 0.00 H new ATOM 0 HG2 LYS A 66 17.886 -3.329 19.232 1.00 0.00 H new ATOM 0 HG3 LYS A 66 16.842 -4.711 19.497 1.00 0.00 H new ATOM 0 HD2 LYS A 66 14.860 -3.359 18.834 1.00 0.00 H new ATOM 0 HD3 LYS A 66 15.884 -1.955 18.602 1.00 0.00 H new ATOM 0 HE2 LYS A 66 16.242 -4.576 17.077 1.00 0.00 H new ATOM 0 HE3 LYS A 66 15.306 -3.223 16.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 17.528 -3.189 15.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 17.288 -1.840 16.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 18.191 -3.165 17.160 1.00 0.00 H new ATOM 1079 N TYR A 67 15.406 -2.824 23.869 1.00 0.00 N ATOM 1080 CA TYR A 67 15.432 -2.985 25.320 1.00 0.00 C ATOM 1081 C TYR A 67 14.181 -3.706 25.834 1.00 0.00 C ATOM 1082 O TYR A 67 14.269 -4.618 26.655 1.00 0.00 O ATOM 1083 CB TYR A 67 15.605 -1.601 25.966 1.00 0.00 C ATOM 1084 CG TYR A 67 15.696 -1.592 27.479 1.00 0.00 C ATOM 1085 CD1 TYR A 67 16.779 -2.219 28.119 1.00 0.00 C ATOM 1086 CD2 TYR A 67 14.738 -0.902 28.247 1.00 0.00 C ATOM 1087 CE1 TYR A 67 16.863 -2.222 29.520 1.00 0.00 C ATOM 1088 CE2 TYR A 67 14.849 -0.870 29.647 1.00 0.00 C ATOM 1089 CZ TYR A 67 15.899 -1.549 30.287 1.00 0.00 C ATOM 1090 OH TYR A 67 15.888 -1.692 31.641 1.00 0.00 O ATOM 0 H TYR A 67 15.547 -1.858 23.572 1.00 0.00 H new ATOM 0 HA TYR A 67 16.276 -3.617 25.598 1.00 0.00 H new ATOM 0 HB2 TYR A 67 16.508 -1.142 25.563 1.00 0.00 H new ATOM 0 HB3 TYR A 67 14.766 -0.972 25.666 1.00 0.00 H new ATOM 0 HD1 TYR A 67 17.548 -2.699 27.532 1.00 0.00 H new ATOM 0 HD2 TYR A 67 13.917 -0.397 27.759 1.00 0.00 H new ATOM 0 HE1 TYR A 67 17.672 -2.744 30.010 1.00 0.00 H new ATOM 0 HE2 TYR A 67 14.125 -0.322 30.233 1.00 0.00 H new ATOM 0 HH TYR A 67 15.158 -1.159 32.020 1.00 0.00 H new ATOM 1100 N SER A 68 13.012 -3.302 25.343 1.00 0.00 N ATOM 1101 CA SER A 68 11.734 -3.886 25.721 1.00 0.00 C ATOM 1102 C SER A 68 11.622 -5.311 25.177 1.00 0.00 C ATOM 1103 O SER A 68 11.227 -6.213 25.912 1.00 0.00 O ATOM 1104 CB SER A 68 10.568 -2.985 25.299 1.00 0.00 C ATOM 1105 OG SER A 68 10.609 -2.682 23.922 1.00 0.00 O ATOM 0 H SER A 68 12.928 -2.548 24.661 1.00 0.00 H new ATOM 0 HA SER A 68 11.680 -3.956 26.807 1.00 0.00 H new ATOM 0 HB2 SER A 68 9.625 -3.478 25.534 1.00 0.00 H new ATOM 0 HB3 SER A 68 10.597 -2.060 25.875 1.00 0.00 H new ATOM 0 HG SER A 68 11.304 -2.012 23.755 1.00 0.00 H new ATOM 1111 N GLY A 69 12.019 -5.537 23.920 1.00 0.00 N ATOM 1112 CA GLY A 69 12.161 -6.885 23.374 1.00 0.00 C ATOM 1113 C GLY A 69 13.020 -7.753 24.301 1.00 0.00 C ATOM 1114 O GLY A 69 12.662 -8.879 24.639 1.00 0.00 O ATOM 0 H GLY A 69 12.249 -4.795 23.259 1.00 0.00 H new ATOM 0 HA2 GLY A 69 11.178 -7.339 23.250 1.00 0.00 H new ATOM 0 HA3 GLY A 69 12.617 -6.837 22.385 1.00 0.00 H new ATOM 1118 N VAL A 70 14.123 -7.181 24.786 1.00 0.00 N ATOM 1119 CA VAL A 70 15.047 -7.758 25.756 1.00 0.00 C ATOM 1120 C VAL A 70 14.457 -7.735 27.184 1.00 0.00 C ATOM 1121 O VAL A 70 15.181 -7.862 28.169 1.00 0.00 O ATOM 1122 CB VAL A 70 16.403 -7.025 25.583 1.00 0.00 C ATOM 1123 CG1 VAL A 70 17.481 -7.364 26.625 1.00 0.00 C ATOM 1124 CG2 VAL A 70 16.996 -7.400 24.214 1.00 0.00 C ATOM 0 H VAL A 70 14.410 -6.247 24.493 1.00 0.00 H new ATOM 0 HA VAL A 70 15.217 -8.820 25.579 1.00 0.00 H new ATOM 0 HB VAL A 70 16.163 -5.968 25.696 1.00 0.00 H new ATOM 0 HG11 VAL A 70 18.386 -6.797 26.410 1.00 0.00 H new ATOM 0 HG12 VAL A 70 17.119 -7.106 27.620 1.00 0.00 H new ATOM 0 HG13 VAL A 70 17.703 -8.430 26.585 1.00 0.00 H new ATOM 0 HG21 VAL A 70 17.950 -6.891 24.079 1.00 0.00 H new ATOM 0 HG22 VAL A 70 17.150 -8.478 24.167 1.00 0.00 H new ATOM 0 HG23 VAL A 70 16.308 -7.097 23.424 1.00 0.00 H new ATOM 1244 N GLU A 79 24.642 0.920 27.661 1.00 0.00 N ATOM 1245 CA GLU A 79 24.048 1.875 28.589 1.00 0.00 C ATOM 1246 C GLU A 79 24.695 3.258 28.448 1.00 0.00 C ATOM 1247 O GLU A 79 25.357 3.738 29.367 1.00 0.00 O ATOM 1248 CB GLU A 79 24.143 1.326 30.020 1.00 0.00 C ATOM 1249 CG GLU A 79 23.374 0.001 30.142 1.00 0.00 C ATOM 1250 CD GLU A 79 23.357 -0.534 31.571 1.00 0.00 C ATOM 1251 OE1 GLU A 79 24.441 -0.535 32.193 1.00 0.00 O ATOM 1252 OE2 GLU A 79 22.259 -0.934 32.014 1.00 0.00 O ATOM 0 HA GLU A 79 22.993 2.006 28.348 1.00 0.00 H new ATOM 0 HB2 GLU A 79 25.188 1.172 30.288 1.00 0.00 H new ATOM 0 HB3 GLU A 79 23.738 2.054 30.723 1.00 0.00 H new ATOM 0 HG2 GLU A 79 22.349 0.146 29.799 1.00 0.00 H new ATOM 0 HG3 GLU A 79 23.828 -0.741 29.485 1.00 0.00 H new ATOM 1259 N PHE A 80 24.520 3.899 27.289 1.00 0.00 N ATOM 1260 CA PHE A 80 25.088 5.214 27.032 1.00 0.00 C ATOM 1261 C PHE A 80 24.376 6.298 27.843 1.00 0.00 C ATOM 1262 O PHE A 80 23.153 6.286 27.982 1.00 0.00 O ATOM 1263 CB PHE A 80 25.078 5.536 25.530 1.00 0.00 C ATOM 1264 CG PHE A 80 23.722 5.507 24.845 1.00 0.00 C ATOM 1265 CD1 PHE A 80 22.866 6.624 24.915 1.00 0.00 C ATOM 1266 CD2 PHE A 80 23.379 4.422 24.017 1.00 0.00 C ATOM 1267 CE1 PHE A 80 21.678 6.654 24.162 1.00 0.00 C ATOM 1268 CE2 PHE A 80 22.203 4.464 23.249 1.00 0.00 C ATOM 1269 CZ PHE A 80 21.350 5.578 23.323 1.00 0.00 C ATOM 0 H PHE A 80 23.983 3.519 26.510 1.00 0.00 H new ATOM 0 HA PHE A 80 26.128 5.196 27.359 1.00 0.00 H new ATOM 0 HB2 PHE A 80 25.511 6.526 25.389 1.00 0.00 H new ATOM 0 HB3 PHE A 80 25.733 4.827 25.024 1.00 0.00 H new ATOM 0 HD1 PHE A 80 23.123 7.460 25.549 1.00 0.00 H new ATOM 0 HD2 PHE A 80 24.021 3.555 23.972 1.00 0.00 H new ATOM 0 HE1 PHE A 80 21.018 7.506 24.230 1.00 0.00 H new ATOM 0 HE2 PHE A 80 21.954 3.637 22.600 1.00 0.00 H new ATOM 0 HZ PHE A 80 20.444 5.606 22.736 1.00 0.00 H new ATOM 1279 N GLU A 81 25.152 7.255 28.354 1.00 0.00 N ATOM 1280 CA GLU A 81 24.635 8.469 28.963 1.00 0.00 C ATOM 1281 C GLU A 81 24.452 9.544 27.898 1.00 0.00 C ATOM 1282 O GLU A 81 24.708 9.326 26.713 1.00 0.00 O ATOM 1283 CB GLU A 81 25.606 8.961 30.044 1.00 0.00 C ATOM 1284 CG GLU A 81 25.536 8.084 31.305 1.00 0.00 C ATOM 1285 CD GLU A 81 24.203 8.194 32.051 1.00 0.00 C ATOM 1286 OE1 GLU A 81 23.510 9.218 31.852 1.00 0.00 O ATOM 1287 OE2 GLU A 81 23.899 7.259 32.823 1.00 0.00 O ATOM 0 H GLU A 81 26.171 7.202 28.354 1.00 0.00 H new ATOM 0 HA GLU A 81 23.669 8.257 29.422 1.00 0.00 H new ATOM 0 HB2 GLU A 81 26.623 8.955 29.651 1.00 0.00 H new ATOM 0 HB3 GLU A 81 25.371 9.993 30.304 1.00 0.00 H new ATOM 0 HG2 GLU A 81 25.702 7.044 31.024 1.00 0.00 H new ATOM 0 HG3 GLU A 81 26.345 8.365 31.979 1.00 0.00 H new ATOM 1294 N ILE A 82 24.019 10.721 28.351 1.00 0.00 N ATOM 1295 CA ILE A 82 23.746 11.869 27.518 1.00 0.00 C ATOM 1296 C ILE A 82 24.913 12.859 27.615 1.00 0.00 C ATOM 1297 O ILE A 82 25.293 13.214 28.732 1.00 0.00 O ATOM 1298 CB ILE A 82 22.421 12.493 27.987 1.00 0.00 C ATOM 1299 CG1 ILE A 82 21.260 11.526 27.711 1.00 0.00 C ATOM 1300 CG2 ILE A 82 22.154 13.823 27.282 1.00 0.00 C ATOM 1301 CD1 ILE A 82 20.096 11.804 28.656 1.00 0.00 C ATOM 0 H ILE A 82 23.846 10.896 29.341 1.00 0.00 H new ATOM 0 HA ILE A 82 23.648 11.585 26.470 1.00 0.00 H new ATOM 0 HB ILE A 82 22.499 12.680 29.058 1.00 0.00 H new ATOM 0 HG12 ILE A 82 20.930 11.631 26.678 1.00 0.00 H new ATOM 0 HG13 ILE A 82 21.599 10.497 27.835 1.00 0.00 H new ATOM 0 HG21 ILE A 82 21.210 14.239 27.635 1.00 0.00 H new ATOM 0 HG22 ILE A 82 22.963 14.520 27.502 1.00 0.00 H new ATOM 0 HG23 ILE A 82 22.098 13.660 26.206 1.00 0.00 H new ATOM 0 HD11 ILE A 82 19.283 11.109 28.446 1.00 0.00 H new ATOM 0 HD12 ILE A 82 20.426 11.675 29.687 1.00 0.00 H new ATOM 0 HD13 ILE A 82 19.746 12.826 28.512 1.00 0.00 H new ATOM 1313 N PRO A 83 25.488 13.318 26.487 1.00 0.00 N ATOM 1314 CA PRO A 83 26.480 14.391 26.461 1.00 0.00 C ATOM 1315 C PRO A 83 25.970 15.732 27.021 1.00 0.00 C ATOM 1316 O PRO A 83 25.721 16.677 26.273 1.00 0.00 O ATOM 1317 CB PRO A 83 27.011 14.472 25.023 1.00 0.00 C ATOM 1318 CG PRO A 83 26.689 13.096 24.443 1.00 0.00 C ATOM 1319 CD PRO A 83 25.444 12.635 25.203 1.00 0.00 C ATOM 0 HA PRO A 83 27.297 14.158 27.144 1.00 0.00 H new ATOM 0 HB2 PRO A 83 26.524 15.268 24.460 1.00 0.00 H new ATOM 0 HB3 PRO A 83 28.082 14.675 25.002 1.00 0.00 H new ATOM 0 HG2 PRO A 83 26.500 13.153 23.371 1.00 0.00 H new ATOM 0 HG3 PRO A 83 27.518 12.403 24.584 1.00 0.00 H new ATOM 0 HD2 PRO A 83 24.536 12.889 24.656 1.00 0.00 H new ATOM 0 HD3 PRO A 83 25.445 11.553 25.335 1.00 0.00 H new ATOM 1327 N THR A 84 25.861 15.806 28.353 1.00 0.00 N ATOM 1328 CA THR A 84 25.511 16.960 29.179 1.00 0.00 C ATOM 1329 C THR A 84 24.514 17.912 28.511 1.00 0.00 C ATOM 1330 O THR A 84 23.305 17.705 28.614 1.00 0.00 O ATOM 1331 CB THR A 84 26.786 17.676 29.661 1.00 0.00 C ATOM 1332 OG1 THR A 84 27.562 18.102 28.558 1.00 0.00 O ATOM 1333 CG2 THR A 84 27.639 16.765 30.550 1.00 0.00 C ATOM 0 H THR A 84 26.032 14.982 28.929 1.00 0.00 H new ATOM 0 HA THR A 84 24.981 16.582 30.054 1.00 0.00 H new ATOM 0 HB THR A 84 26.470 18.540 30.245 1.00 0.00 H new ATOM 0 HG1 THR A 84 28.368 18.556 28.881 1.00 0.00 H new ATOM 0 HG21 THR A 84 28.531 17.302 30.872 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.061 16.465 31.424 1.00 0.00 H new ATOM 0 HG23 THR A 84 27.933 15.879 29.987 1.00 0.00 H new ATOM 1341 N GLU A 85 25.031 18.944 27.838 1.00 0.00 N ATOM 1342 CA GLU A 85 24.278 19.983 27.144 1.00 0.00 C ATOM 1343 C GLU A 85 23.117 19.399 26.336 1.00 0.00 C ATOM 1344 O GLU A 85 22.022 19.964 26.341 1.00 0.00 O ATOM 1345 CB GLU A 85 25.222 20.785 26.237 1.00 0.00 C ATOM 1346 CG GLU A 85 26.334 21.487 27.031 1.00 0.00 C ATOM 1347 CD GLU A 85 27.199 22.352 26.120 1.00 0.00 C ATOM 1348 OE1 GLU A 85 28.115 21.777 25.493 1.00 0.00 O ATOM 1349 OE2 GLU A 85 26.919 23.569 26.058 1.00 0.00 O ATOM 0 H GLU A 85 26.039 19.081 27.761 1.00 0.00 H new ATOM 0 HA GLU A 85 23.845 20.647 27.892 1.00 0.00 H new ATOM 0 HB2 GLU A 85 25.670 20.117 25.501 1.00 0.00 H new ATOM 0 HB3 GLU A 85 24.647 21.529 25.685 1.00 0.00 H new ATOM 0 HG2 GLU A 85 25.892 22.106 27.812 1.00 0.00 H new ATOM 0 HG3 GLU A 85 26.956 20.742 27.528 1.00 0.00 H new ATOM 1356 N MET A 86 23.356 18.255 25.676 1.00 0.00 N ATOM 1357 CA MET A 86 22.342 17.474 24.974 1.00 0.00 C ATOM 1358 C MET A 86 20.991 17.515 25.696 1.00 0.00 C ATOM 1359 O MET A 86 19.962 17.805 25.084 1.00 0.00 O ATOM 1360 CB MET A 86 22.810 16.019 24.868 1.00 0.00 C ATOM 1361 CG MET A 86 23.723 15.723 23.675 1.00 0.00 C ATOM 1362 SD MET A 86 22.830 15.023 22.256 1.00 0.00 S ATOM 1363 CE MET A 86 24.159 14.669 21.087 1.00 0.00 C ATOM 0 H MET A 86 24.287 17.842 25.618 1.00 0.00 H new ATOM 0 HA MET A 86 22.209 17.909 23.984 1.00 0.00 H new ATOM 0 HB2 MET A 86 23.336 15.754 25.785 1.00 0.00 H new ATOM 0 HB3 MET A 86 21.934 15.374 24.806 1.00 0.00 H new ATOM 0 HG2 MET A 86 24.219 16.643 23.367 1.00 0.00 H new ATOM 0 HG3 MET A 86 24.503 15.028 23.985 1.00 0.00 H new ATOM 0 HE1 MET A 86 23.739 14.237 20.179 1.00 0.00 H new ATOM 0 HE2 MET A 86 24.683 15.593 20.841 1.00 0.00 H new ATOM 0 HE3 MET A 86 24.859 13.963 21.534 1.00 0.00 H new ATOM 1373 N SER A 87 21.013 17.225 27.001 1.00 0.00 N ATOM 1374 CA SER A 87 19.843 17.113 27.856 1.00 0.00 C ATOM 1375 C SER A 87 18.817 18.220 27.603 1.00 0.00 C ATOM 1376 O SER A 87 17.624 17.938 27.544 1.00 0.00 O ATOM 1377 CB SER A 87 20.279 17.107 29.325 1.00 0.00 C ATOM 1378 OG SER A 87 21.280 16.132 29.534 1.00 0.00 O ATOM 0 H SER A 87 21.885 17.057 27.503 1.00 0.00 H new ATOM 0 HA SER A 87 19.348 16.173 27.614 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.656 18.091 29.604 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.421 16.901 29.965 1.00 0.00 H new ATOM 0 HG SER A 87 22.159 16.517 29.333 1.00 0.00 H new ATOM 1384 N LEU A 88 19.271 19.471 27.460 1.00 0.00 N ATOM 1385 CA LEU A 88 18.384 20.628 27.389 1.00 0.00 C ATOM 1386 C LEU A 88 17.315 20.437 26.309 1.00 0.00 C ATOM 1387 O LEU A 88 16.123 20.540 26.589 1.00 0.00 O ATOM 1388 CB LEU A 88 19.196 21.909 27.144 1.00 0.00 C ATOM 1389 CG LEU A 88 19.778 22.527 28.428 1.00 0.00 C ATOM 1390 CD1 LEU A 88 20.696 21.580 29.209 1.00 0.00 C ATOM 1391 CD2 LEU A 88 20.560 23.793 28.061 1.00 0.00 C ATOM 0 H LEU A 88 20.261 19.705 27.391 1.00 0.00 H new ATOM 0 HA LEU A 88 17.870 20.726 28.345 1.00 0.00 H new ATOM 0 HB2 LEU A 88 20.012 21.686 26.457 1.00 0.00 H new ATOM 0 HB3 LEU A 88 18.558 22.645 26.654 1.00 0.00 H new ATOM 0 HG LEU A 88 18.933 22.750 29.080 1.00 0.00 H new ATOM 0 HD11 LEU A 88 21.067 22.086 30.100 1.00 0.00 H new ATOM 0 HD12 LEU A 88 20.137 20.691 29.502 1.00 0.00 H new ATOM 0 HD13 LEU A 88 21.537 21.288 28.580 1.00 0.00 H new ATOM 0 HD21 LEU A 88 20.976 24.238 28.965 1.00 0.00 H new ATOM 0 HD22 LEU A 88 21.369 23.536 27.377 1.00 0.00 H new ATOM 0 HD23 LEU A 88 19.892 24.507 27.580 1.00 0.00 H new ATOM 1403 N GLU A 89 17.741 20.155 25.074 1.00 0.00 N ATOM 1404 CA GLU A 89 16.821 19.974 23.958 1.00 0.00 C ATOM 1405 C GLU A 89 16.390 18.509 23.852 1.00 0.00 C ATOM 1406 O GLU A 89 15.239 18.217 23.522 1.00 0.00 O ATOM 1407 CB GLU A 89 17.459 20.507 22.670 1.00 0.00 C ATOM 1408 CG GLU A 89 16.433 20.545 21.533 1.00 0.00 C ATOM 1409 CD GLU A 89 17.047 21.103 20.252 1.00 0.00 C ATOM 1410 OE1 GLU A 89 16.983 22.339 20.087 1.00 0.00 O ATOM 1411 OE2 GLU A 89 17.588 20.295 19.464 1.00 0.00 O ATOM 0 H GLU A 89 18.724 20.048 24.826 1.00 0.00 H new ATOM 0 HA GLU A 89 15.912 20.550 24.129 1.00 0.00 H new ATOM 0 HB2 GLU A 89 17.856 21.508 22.842 1.00 0.00 H new ATOM 0 HB3 GLU A 89 18.300 19.875 22.386 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.053 19.540 21.349 1.00 0.00 H new ATOM 0 HG3 GLU A 89 15.582 21.159 21.828 1.00 0.00 H new ATOM 1418 N LEU A 90 17.301 17.575 24.149 1.00 0.00 N ATOM 1419 CA LEU A 90 16.995 16.151 24.128 1.00 0.00 C ATOM 1420 C LEU A 90 15.793 15.847 25.021 1.00 0.00 C ATOM 1421 O LEU A 90 14.978 14.996 24.676 1.00 0.00 O ATOM 1422 CB LEU A 90 18.241 15.340 24.511 1.00 0.00 C ATOM 1423 CG LEU A 90 18.062 13.824 24.313 1.00 0.00 C ATOM 1424 CD1 LEU A 90 19.379 13.222 23.811 1.00 0.00 C ATOM 1425 CD2 LEU A 90 17.649 13.121 25.613 1.00 0.00 C ATOM 0 H LEU A 90 18.264 17.789 24.408 1.00 0.00 H new ATOM 0 HA LEU A 90 16.715 15.853 23.118 1.00 0.00 H new ATOM 0 HB2 LEU A 90 19.086 15.681 23.913 1.00 0.00 H new ATOM 0 HB3 LEU A 90 18.488 15.537 25.554 1.00 0.00 H new ATOM 0 HG LEU A 90 17.267 13.673 23.583 1.00 0.00 H new ATOM 0 HD11 LEU A 90 19.257 12.148 23.669 1.00 0.00 H new ATOM 0 HD12 LEU A 90 19.652 13.685 22.863 1.00 0.00 H new ATOM 0 HD13 LEU A 90 20.165 13.405 24.544 1.00 0.00 H new ATOM 0 HD21 LEU A 90 17.534 12.053 25.428 1.00 0.00 H new ATOM 0 HD22 LEU A 90 18.417 13.277 26.371 1.00 0.00 H new ATOM 0 HD23 LEU A 90 16.703 13.533 25.965 1.00 0.00 H new ATOM 1437 N LEU A 91 15.647 16.564 26.137 1.00 0.00 N ATOM 1438 CA LEU A 91 14.493 16.410 27.011 1.00 0.00 C ATOM 1439 C LEU A 91 13.212 16.726 26.238 1.00 0.00 C ATOM 1440 O LEU A 91 12.268 15.939 26.241 1.00 0.00 O ATOM 1441 CB LEU A 91 14.648 17.310 28.246 1.00 0.00 C ATOM 1442 CG LEU A 91 13.444 17.274 29.203 1.00 0.00 C ATOM 1443 CD1 LEU A 91 13.134 15.856 29.700 1.00 0.00 C ATOM 1444 CD2 LEU A 91 13.740 18.179 30.404 1.00 0.00 C ATOM 0 H LEU A 91 16.321 17.260 26.454 1.00 0.00 H new ATOM 0 HA LEU A 91 14.429 15.379 27.358 1.00 0.00 H new ATOM 0 HB2 LEU A 91 15.542 17.009 28.792 1.00 0.00 H new ATOM 0 HB3 LEU A 91 14.806 18.337 27.917 1.00 0.00 H new ATOM 0 HG LEU A 91 12.570 17.625 28.654 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.276 15.885 30.372 1.00 0.00 H new ATOM 0 HD12 LEU A 91 12.907 15.214 28.849 1.00 0.00 H new ATOM 0 HD13 LEU A 91 13.999 15.460 30.232 1.00 0.00 H new ATOM 0 HD21 LEU A 91 12.893 18.162 31.090 1.00 0.00 H new ATOM 0 HD22 LEU A 91 14.631 17.820 30.919 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.906 19.199 30.058 1.00 0.00 H new ATOM 1456 N LEU A 92 13.188 17.870 25.550 1.00 0.00 N ATOM 1457 CA LEU A 92 12.040 18.271 24.753 1.00 0.00 C ATOM 1458 C LEU A 92 11.750 17.203 23.700 1.00 0.00 C ATOM 1459 O LEU A 92 10.614 16.760 23.566 1.00 0.00 O ATOM 1460 CB LEU A 92 12.272 19.641 24.100 1.00 0.00 C ATOM 1461 CG LEU A 92 12.642 20.758 25.088 1.00 0.00 C ATOM 1462 CD1 LEU A 92 12.857 22.059 24.306 1.00 0.00 C ATOM 1463 CD2 LEU A 92 11.554 20.974 26.147 1.00 0.00 C ATOM 0 H LEU A 92 13.961 18.536 25.533 1.00 0.00 H new ATOM 0 HA LEU A 92 11.173 18.366 25.407 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.067 19.548 23.361 1.00 0.00 H new ATOM 0 HB3 LEU A 92 11.369 19.932 23.562 1.00 0.00 H new ATOM 0 HG LEU A 92 13.553 20.463 25.608 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.120 22.860 24.997 1.00 0.00 H new ATOM 0 HD12 LEU A 92 13.663 21.922 23.586 1.00 0.00 H new ATOM 0 HD13 LEU A 92 11.940 22.322 23.778 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.858 21.773 26.824 1.00 0.00 H new ATOM 0 HD22 LEU A 92 10.620 21.249 25.658 1.00 0.00 H new ATOM 0 HD23 LEU A 92 11.410 20.054 26.713 1.00 0.00 H new ATOM 1475 N ALA A 93 12.776 16.760 22.968 1.00 0.00 N ATOM 1476 CA ALA A 93 12.615 15.714 21.962 1.00 0.00 C ATOM 1477 C ALA A 93 12.014 14.439 22.571 1.00 0.00 C ATOM 1478 O ALA A 93 11.049 13.882 22.048 1.00 0.00 O ATOM 1479 CB ALA A 93 13.958 15.443 21.281 1.00 0.00 C ATOM 0 H ALA A 93 13.729 17.113 23.056 1.00 0.00 H new ATOM 0 HA ALA A 93 11.910 16.058 21.205 1.00 0.00 H new ATOM 0 HB1 ALA A 93 13.834 14.662 20.531 1.00 0.00 H new ATOM 0 HB2 ALA A 93 14.313 16.355 20.801 1.00 0.00 H new ATOM 0 HB3 ALA A 93 14.685 15.119 22.026 1.00 0.00 H new ATOM 1485 N ALA A 94 12.566 13.983 23.699 1.00 0.00 N ATOM 1486 CA ALA A 94 12.056 12.835 24.435 1.00 0.00 C ATOM 1487 C ALA A 94 10.584 13.040 24.803 1.00 0.00 C ATOM 1488 O ALA A 94 9.772 12.133 24.626 1.00 0.00 O ATOM 1489 CB ALA A 94 12.923 12.582 25.675 1.00 0.00 C ATOM 0 H ALA A 94 13.388 14.409 24.127 1.00 0.00 H new ATOM 0 HA ALA A 94 12.110 11.950 23.801 1.00 0.00 H new ATOM 0 HB1 ALA A 94 12.535 11.722 26.221 1.00 0.00 H new ATOM 0 HB2 ALA A 94 13.950 12.384 25.367 1.00 0.00 H new ATOM 0 HB3 ALA A 94 12.901 13.461 26.320 1.00 0.00 H new ATOM 1495 N ASP A 95 10.227 14.229 25.293 1.00 0.00 N ATOM 1496 CA ASP A 95 8.848 14.565 25.632 1.00 0.00 C ATOM 1497 C ASP A 95 7.959 14.563 24.387 1.00 0.00 C ATOM 1498 O ASP A 95 6.827 14.098 24.455 1.00 0.00 O ATOM 1499 CB ASP A 95 8.780 15.920 26.353 1.00 0.00 C ATOM 1500 CG ASP A 95 9.556 15.957 27.668 1.00 0.00 C ATOM 1501 OD1 ASP A 95 9.684 14.883 28.297 1.00 0.00 O ATOM 1502 OD2 ASP A 95 9.990 17.070 28.035 1.00 0.00 O ATOM 0 H ASP A 95 10.889 14.985 25.465 1.00 0.00 H new ATOM 0 HA ASP A 95 8.472 13.800 26.311 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.168 16.694 25.691 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.736 16.164 26.551 1.00 0.00 H new ATOM 1507 N TYR A 96 8.452 15.067 23.253 1.00 0.00 N ATOM 1508 CA TYR A 96 7.705 15.046 22.002 1.00 0.00 C ATOM 1509 C TYR A 96 7.430 13.599 21.597 1.00 0.00 C ATOM 1510 O TYR A 96 6.310 13.266 21.226 1.00 0.00 O ATOM 1511 CB TYR A 96 8.457 15.776 20.878 1.00 0.00 C ATOM 1512 CG TYR A 96 8.720 17.266 21.023 1.00 0.00 C ATOM 1513 CD1 TYR A 96 8.247 18.017 22.120 1.00 0.00 C ATOM 1514 CD2 TYR A 96 9.431 17.916 19.998 1.00 0.00 C ATOM 1515 CE1 TYR A 96 8.531 19.390 22.209 1.00 0.00 C ATOM 1516 CE2 TYR A 96 9.673 19.298 20.065 1.00 0.00 C ATOM 1517 CZ TYR A 96 9.241 20.031 21.181 1.00 0.00 C ATOM 1518 OH TYR A 96 9.549 21.353 21.293 1.00 0.00 O ATOM 0 H TYR A 96 9.374 15.497 23.180 1.00 0.00 H new ATOM 0 HA TYR A 96 6.763 15.571 22.160 1.00 0.00 H new ATOM 0 HB2 TYR A 96 9.420 15.282 20.749 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.897 15.628 19.955 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.666 17.536 22.892 1.00 0.00 H new ATOM 0 HD2 TYR A 96 9.793 17.348 19.154 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.203 19.954 23.070 1.00 0.00 H new ATOM 0 HE2 TYR A 96 10.191 19.796 19.259 1.00 0.00 H new ATOM 0 HH TYR A 96 10.485 21.493 21.040 1.00 0.00 H new ATOM 1528 N LEU A 97 8.450 12.737 21.652 1.00 0.00 N ATOM 1529 CA LEU A 97 8.298 11.317 21.349 1.00 0.00 C ATOM 1530 C LEU A 97 7.342 10.650 22.341 1.00 0.00 C ATOM 1531 O LEU A 97 6.518 9.824 21.948 1.00 0.00 O ATOM 1532 CB LEU A 97 9.666 10.625 21.371 1.00 0.00 C ATOM 1533 CG LEU A 97 10.540 11.018 20.170 1.00 0.00 C ATOM 1534 CD1 LEU A 97 11.998 10.663 20.465 1.00 0.00 C ATOM 1535 CD2 LEU A 97 10.099 10.286 18.895 1.00 0.00 C ATOM 0 H LEU A 97 9.400 13.006 21.907 1.00 0.00 H new ATOM 0 HA LEU A 97 7.871 11.219 20.351 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.185 10.882 22.294 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.524 9.544 21.375 1.00 0.00 H new ATOM 0 HG LEU A 97 10.432 12.091 20.010 1.00 0.00 H new ATOM 0 HD11 LEU A 97 12.620 10.941 19.614 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.332 11.204 21.350 1.00 0.00 H new ATOM 0 HD13 LEU A 97 12.083 9.591 20.641 1.00 0.00 H new ATOM 0 HD21 LEU A 97 10.737 10.586 18.064 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.182 9.210 19.046 1.00 0.00 H new ATOM 0 HD23 LEU A 97 9.064 10.542 18.668 1.00 0.00 H new ATOM 1547 N SER A 98 7.459 10.999 23.625 1.00 0.00 N ATOM 1548 CA SER A 98 6.648 10.486 24.722 1.00 0.00 C ATOM 1549 C SER A 98 6.569 8.959 24.673 1.00 0.00 C ATOM 1550 O SER A 98 5.487 8.386 24.585 1.00 0.00 O ATOM 1551 CB SER A 98 5.269 11.161 24.740 1.00 0.00 C ATOM 1552 OG SER A 98 4.622 11.084 23.483 1.00 0.00 O ATOM 0 H SER A 98 8.154 11.677 23.937 1.00 0.00 H new ATOM 0 HA SER A 98 7.129 10.739 25.667 1.00 0.00 H new ATOM 0 HB2 SER A 98 4.644 10.689 25.498 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.381 12.207 25.026 1.00 0.00 H new ATOM 0 HG SER A 98 4.701 10.173 23.130 1.00 0.00 H new ATOM 1558 N ILE A 99 7.735 8.313 24.706 1.00 0.00 N ATOM 1559 CA ILE A 99 7.866 6.868 24.556 1.00 0.00 C ATOM 1560 C ILE A 99 7.027 6.090 25.579 1.00 0.00 C ATOM 1561 O ILE A 99 6.732 4.911 25.289 1.00 0.00 O ATOM 1562 CB ILE A 99 9.355 6.474 24.590 1.00 0.00 C ATOM 1563 CG1 ILE A 99 10.040 6.724 25.947 1.00 0.00 C ATOM 1564 CG2 ILE A 99 10.115 7.257 23.506 1.00 0.00 C ATOM 1565 CD1 ILE A 99 9.929 5.555 26.932 1.00 0.00 C ATOM 1566 OXT ILE A 99 6.736 6.667 26.650 1.00 0.00 O ATOM 0 H ILE A 99 8.627 8.789 24.840 1.00 0.00 H new ATOM 0 HA ILE A 99 7.461 6.588 23.584 1.00 0.00 H new ATOM 0 HB ILE A 99 9.387 5.399 24.411 1.00 0.00 H new ATOM 0 HG12 ILE A 99 11.094 6.940 25.775 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.603 7.612 26.404 1.00 0.00 H new ATOM 0 HG21 ILE A 99 11.169 6.980 23.528 1.00 0.00 H new ATOM 0 HG22 ILE A 99 9.698 7.021 22.527 1.00 0.00 H new ATOM 0 HG23 ILE A 99 10.017 8.326 23.694 1.00 0.00 H new ATOM 0 HD11 ILE A 99 10.437 5.813 27.861 1.00 0.00 H new ATOM 0 HD12 ILE A 99 8.878 5.351 27.137 1.00 0.00 H new ATOM 0 HD13 ILE A 99 10.393 4.669 26.499 1.00 0.00 H new ATOM 1579 N THR B 157 14.206 4.659 29.260 1.00 0.00 N ATOM 1580 CA THR B 157 15.646 4.672 29.574 1.00 0.00 C ATOM 1581 C THR B 157 16.206 6.103 29.531 1.00 0.00 C ATOM 1582 O THR B 157 16.439 6.735 30.565 1.00 0.00 O ATOM 1583 CB THR B 157 16.410 3.733 28.621 1.00 0.00 C ATOM 1584 OG1 THR B 157 16.147 4.077 27.271 1.00 0.00 O ATOM 1585 CG2 THR B 157 16.033 2.265 28.840 1.00 0.00 C ATOM 0 HA THR B 157 15.784 4.303 30.590 1.00 0.00 H new ATOM 0 HB THR B 157 17.471 3.855 28.839 1.00 0.00 H new ATOM 0 HG1 THR B 157 15.301 3.670 26.989 1.00 0.00 H new ATOM 0 HG21 THR B 157 16.595 1.638 28.148 1.00 0.00 H new ATOM 0 HG22 THR B 157 16.270 1.977 29.864 1.00 0.00 H new ATOM 0 HG23 THR B 157 14.965 2.133 28.664 1.00 0.00 H new ATOM 1595 N LEU B 158 16.426 6.608 28.317 1.00 0.00 N ATOM 1596 CA LEU B 158 17.117 7.862 28.074 1.00 0.00 C ATOM 1597 C LEU B 158 16.484 9.033 28.827 1.00 0.00 C ATOM 1598 O LEU B 158 17.211 9.891 29.310 1.00 0.00 O ATOM 1599 CB LEU B 158 17.227 8.135 26.567 1.00 0.00 C ATOM 1600 CG LEU B 158 18.321 9.141 26.176 1.00 0.00 C ATOM 1601 CD1 LEU B 158 19.713 8.641 26.586 1.00 0.00 C ATOM 1602 CD2 LEU B 158 18.296 9.320 24.655 1.00 0.00 C ATOM 0 H LEU B 158 16.120 6.143 27.462 1.00 0.00 H new ATOM 0 HA LEU B 158 18.127 7.763 28.471 1.00 0.00 H new ATOM 0 HB2 LEU B 158 17.418 7.193 26.054 1.00 0.00 H new ATOM 0 HB3 LEU B 158 16.267 8.505 26.207 1.00 0.00 H new ATOM 0 HG LEU B 158 18.126 10.082 26.690 1.00 0.00 H new ATOM 0 HD11 LEU B 158 20.464 9.376 26.295 1.00 0.00 H new ATOM 0 HD12 LEU B 158 19.745 8.498 27.666 1.00 0.00 H new ATOM 0 HD13 LEU B 158 19.920 7.694 26.088 1.00 0.00 H new ATOM 0 HD21 LEU B 158 19.067 10.032 24.360 1.00 0.00 H new ATOM 0 HD22 LEU B 158 18.484 8.361 24.173 1.00 0.00 H new ATOM 0 HD23 LEU B 158 17.319 9.695 24.349 1.00 0.00 H new ATOM 1614 N LYS B 159 15.154 9.091 28.967 1.00 0.00 N ATOM 1615 CA LYS B 159 14.544 10.158 29.756 1.00 0.00 C ATOM 1616 C LYS B 159 14.974 10.058 31.224 1.00 0.00 C ATOM 1617 O LYS B 159 15.354 11.058 31.830 1.00 0.00 O ATOM 1618 CB LYS B 159 13.019 10.176 29.588 1.00 0.00 C ATOM 1619 CG LYS B 159 12.398 11.335 30.382 1.00 0.00 C ATOM 1620 CD LYS B 159 10.945 11.582 29.957 1.00 0.00 C ATOM 1621 CE LYS B 159 10.319 12.664 30.843 1.00 0.00 C ATOM 1622 NZ LYS B 159 8.969 13.026 30.376 1.00 0.00 N ATOM 0 H LYS B 159 14.497 8.428 28.555 1.00 0.00 H new ATOM 0 HA LYS B 159 14.905 11.115 29.380 1.00 0.00 H new ATOM 0 HB2 LYS B 159 12.766 10.275 28.532 1.00 0.00 H new ATOM 0 HB3 LYS B 159 12.600 9.229 29.929 1.00 0.00 H new ATOM 0 HG2 LYS B 159 12.435 11.110 31.448 1.00 0.00 H new ATOM 0 HG3 LYS B 159 12.984 12.241 30.227 1.00 0.00 H new ATOM 0 HD2 LYS B 159 10.910 11.890 28.912 1.00 0.00 H new ATOM 0 HD3 LYS B 159 10.372 10.658 30.036 1.00 0.00 H new ATOM 0 HE2 LYS B 159 10.267 12.309 31.872 1.00 0.00 H new ATOM 0 HE3 LYS B 159 10.955 13.549 30.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 159 8.428 13.438 31.163 1.00 0.00 H new ATOM 0 HZ2 LYS B 159 9.043 13.721 29.606 1.00 0.00 H new ATOM 0 HZ3 LYS B 159 8.482 12.175 30.029 1.00 0.00 H new ATOM 1636 N GLU B 160 14.948 8.859 31.807 1.00 0.00 N ATOM 1637 CA GLU B 160 15.435 8.655 33.165 1.00 0.00 C ATOM 1638 C GLU B 160 16.902 9.083 33.257 1.00 0.00 C ATOM 1639 O GLU B 160 17.289 9.795 34.185 1.00 0.00 O ATOM 1640 CB GLU B 160 15.239 7.201 33.619 1.00 0.00 C ATOM 1641 CG GLU B 160 13.781 6.727 33.502 1.00 0.00 C ATOM 1642 CD GLU B 160 13.504 6.006 32.185 1.00 0.00 C ATOM 1643 OE1 GLU B 160 13.387 6.704 31.153 1.00 0.00 O ATOM 1644 OE2 GLU B 160 13.434 4.758 32.225 1.00 0.00 O ATOM 0 H GLU B 160 14.594 8.015 31.356 1.00 0.00 H new ATOM 0 HA GLU B 160 14.850 9.276 33.844 1.00 0.00 H new ATOM 0 HB2 GLU B 160 15.876 6.550 33.020 1.00 0.00 H new ATOM 0 HB3 GLU B 160 15.566 7.102 34.654 1.00 0.00 H new ATOM 0 HG2 GLU B 160 13.552 6.060 34.333 1.00 0.00 H new ATOM 0 HG3 GLU B 160 13.115 7.586 33.589 1.00 0.00 H new ATOM 1651 N ARG B 161 17.714 8.684 32.273 1.00 0.00 N ATOM 1652 CA ARG B 161 19.105 9.124 32.214 1.00 0.00 C ATOM 1653 C ARG B 161 19.196 10.657 32.130 1.00 0.00 C ATOM 1654 O ARG B 161 20.036 11.260 32.792 1.00 0.00 O ATOM 1655 CB ARG B 161 19.864 8.429 31.076 1.00 0.00 C ATOM 1656 CG ARG B 161 19.888 6.907 31.282 1.00 0.00 C ATOM 1657 CD ARG B 161 20.646 6.190 30.160 1.00 0.00 C ATOM 1658 NE ARG B 161 20.437 4.737 30.237 1.00 0.00 N ATOM 1659 CZ ARG B 161 20.686 3.889 29.228 1.00 0.00 C ATOM 1660 NH1 ARG B 161 21.306 4.304 28.123 1.00 0.00 N ATOM 1661 NH2 ARG B 161 20.313 2.609 29.309 1.00 0.00 N ATOM 0 H ARG B 161 17.432 8.063 31.515 1.00 0.00 H new ATOM 0 HA ARG B 161 19.594 8.827 33.141 1.00 0.00 H new ATOM 0 HB2 ARG B 161 19.391 8.663 30.122 1.00 0.00 H new ATOM 0 HB3 ARG B 161 20.884 8.810 31.028 1.00 0.00 H new ATOM 0 HG2 ARG B 161 20.355 6.678 32.240 1.00 0.00 H new ATOM 0 HG3 ARG B 161 18.866 6.531 31.328 1.00 0.00 H new ATOM 0 HD2 ARG B 161 20.308 6.560 29.192 1.00 0.00 H new ATOM 0 HD3 ARG B 161 21.710 6.414 30.233 1.00 0.00 H new ATOM 0 HE ARG B 161 20.081 4.350 31.111 1.00 0.00 H new ATOM 0 HH11 ARG B 161 21.598 5.278 28.037 1.00 0.00 H new ATOM 0 HH12 ARG B 161 21.489 3.648 27.364 1.00 0.00 H new ATOM 0 HH21 ARG B 161 19.835 2.269 30.143 1.00 0.00 H new ATOM 0 HH22 ARG B 161 20.507 1.972 28.537 1.00 0.00 H new ATOM 1675 N CYS B 162 18.321 11.308 31.358 1.00 0.00 N ATOM 1676 CA CYS B 162 18.261 12.767 31.285 1.00 0.00 C ATOM 1677 C CYS B 162 17.974 13.348 32.664 1.00 0.00 C ATOM 1678 O CYS B 162 18.682 14.244 33.118 1.00 0.00 O ATOM 1679 CB CYS B 162 17.212 13.234 30.267 1.00 0.00 C ATOM 1680 SG CYS B 162 17.234 15.042 30.178 1.00 0.00 S ATOM 0 H CYS B 162 17.636 10.837 30.767 1.00 0.00 H new ATOM 0 HA CYS B 162 19.230 13.131 30.945 1.00 0.00 H new ATOM 0 HB2 CYS B 162 17.424 12.807 29.287 1.00 0.00 H new ATOM 0 HB3 CYS B 162 16.222 12.884 30.560 1.00 0.00 H new ATOM 0 HG CYS B 162 17.098 15.417 28.941 1.00 0.00 H new ATOM 1686 N LEU B 163 16.944 12.841 33.345 1.00 0.00 N ATOM 1687 CA LEU B 163 16.614 13.293 34.691 1.00 0.00 C ATOM 1688 C LEU B 163 17.820 13.129 35.621 1.00 0.00 C ATOM 1689 O LEU B 163 18.200 14.081 36.299 1.00 0.00 O ATOM 1690 CB LEU B 163 15.377 12.559 35.229 1.00 0.00 C ATOM 1691 CG LEU B 163 14.082 12.881 34.459 1.00 0.00 C ATOM 1692 CD1 LEU B 163 12.965 11.950 34.942 1.00 0.00 C ATOM 1693 CD2 LEU B 163 13.637 14.337 34.652 1.00 0.00 C ATOM 0 H LEU B 163 16.325 12.116 32.982 1.00 0.00 H new ATOM 0 HA LEU B 163 16.367 14.354 34.651 1.00 0.00 H new ATOM 0 HB2 LEU B 163 15.556 11.485 35.187 1.00 0.00 H new ATOM 0 HB3 LEU B 163 15.239 12.819 36.279 1.00 0.00 H new ATOM 0 HG LEU B 163 14.283 12.732 33.398 1.00 0.00 H new ATOM 0 HD11 LEU B 163 12.046 12.173 34.401 1.00 0.00 H new ATOM 0 HD12 LEU B 163 13.251 10.914 34.760 1.00 0.00 H new ATOM 0 HD13 LEU B 163 12.803 12.100 36.009 1.00 0.00 H new ATOM 0 HD21 LEU B 163 12.720 14.515 34.090 1.00 0.00 H new ATOM 0 HD22 LEU B 163 13.456 14.525 35.710 1.00 0.00 H new ATOM 0 HD23 LEU B 163 14.418 15.007 34.293 1.00 0.00 H new ATOM 1705 N GLN B 164 18.440 11.944 35.632 1.00 0.00 N ATOM 1706 CA GLN B 164 19.662 11.677 36.387 1.00 0.00 C ATOM 1707 C GLN B 164 20.722 12.748 36.096 1.00 0.00 C ATOM 1708 O GLN B 164 21.244 13.378 37.016 1.00 0.00 O ATOM 1709 CB GLN B 164 20.169 10.270 36.034 1.00 0.00 C ATOM 1710 CG GLN B 164 21.505 9.900 36.695 1.00 0.00 C ATOM 1711 CD GLN B 164 22.092 8.626 36.094 1.00 0.00 C ATOM 1712 OE1 GLN B 164 22.248 7.624 36.782 1.00 0.00 O ATOM 1713 NE2 GLN B 164 22.428 8.659 34.805 1.00 0.00 N ATOM 0 H GLN B 164 18.101 11.136 35.110 1.00 0.00 H new ATOM 0 HA GLN B 164 19.452 11.717 37.456 1.00 0.00 H new ATOM 0 HB2 GLN B 164 19.416 9.540 36.329 1.00 0.00 H new ATOM 0 HB3 GLN B 164 20.279 10.196 34.952 1.00 0.00 H new ATOM 0 HG2 GLN B 164 22.212 10.720 36.573 1.00 0.00 H new ATOM 0 HG3 GLN B 164 21.357 9.764 37.766 1.00 0.00 H new ATOM 0 HE21 GLN B 164 22.284 9.510 34.262 1.00 0.00 H new ATOM 0 HE22 GLN B 164 22.829 7.833 34.361 1.00 0.00 H new ATOM 1722 N VAL B 165 21.069 12.926 34.819 1.00 0.00 N ATOM 1723 CA VAL B 165 22.105 13.859 34.395 1.00 0.00 C ATOM 1724 C VAL B 165 21.768 15.271 34.878 1.00 0.00 C ATOM 1725 O VAL B 165 22.587 15.894 35.550 1.00 0.00 O ATOM 1726 CB VAL B 165 22.314 13.772 32.870 1.00 0.00 C ATOM 1727 CG1 VAL B 165 23.150 14.937 32.322 1.00 0.00 C ATOM 1728 CG2 VAL B 165 23.039 12.464 32.522 1.00 0.00 C ATOM 0 H VAL B 165 20.633 12.421 34.048 1.00 0.00 H new ATOM 0 HA VAL B 165 23.057 13.588 34.852 1.00 0.00 H new ATOM 0 HB VAL B 165 21.325 13.813 32.415 1.00 0.00 H new ATOM 0 HG11 VAL B 165 23.266 14.826 31.244 1.00 0.00 H new ATOM 0 HG12 VAL B 165 22.646 15.879 32.537 1.00 0.00 H new ATOM 0 HG13 VAL B 165 24.132 14.934 32.795 1.00 0.00 H new ATOM 0 HG21 VAL B 165 23.185 12.405 31.443 1.00 0.00 H new ATOM 0 HG22 VAL B 165 24.008 12.441 33.022 1.00 0.00 H new ATOM 0 HG23 VAL B 165 22.439 11.616 32.854 1.00 0.00 H new ATOM 1738 N VAL B 166 20.573 15.774 34.557 1.00 0.00 N ATOM 1739 CA VAL B 166 20.145 17.107 34.967 1.00 0.00 C ATOM 1740 C VAL B 166 20.238 17.248 36.490 1.00 0.00 C ATOM 1741 O VAL B 166 20.866 18.183 36.983 1.00 0.00 O ATOM 1742 CB VAL B 166 18.735 17.402 34.424 1.00 0.00 C ATOM 1743 CG1 VAL B 166 18.165 18.707 34.998 1.00 0.00 C ATOM 1744 CG2 VAL B 166 18.774 17.529 32.894 1.00 0.00 C ATOM 0 H VAL B 166 19.879 15.267 34.007 1.00 0.00 H new ATOM 0 HA VAL B 166 20.812 17.855 34.539 1.00 0.00 H new ATOM 0 HB VAL B 166 18.096 16.572 34.726 1.00 0.00 H new ATOM 0 HG11 VAL B 166 17.169 18.879 34.590 1.00 0.00 H new ATOM 0 HG12 VAL B 166 18.105 18.631 36.084 1.00 0.00 H new ATOM 0 HG13 VAL B 166 18.816 19.538 34.728 1.00 0.00 H new ATOM 0 HG21 VAL B 166 17.771 17.738 32.521 1.00 0.00 H new ATOM 0 HG22 VAL B 166 19.442 18.343 32.613 1.00 0.00 H new ATOM 0 HG23 VAL B 166 19.136 16.597 32.461 1.00 0.00 H new ATOM 1754 N ARG B 167 19.638 16.313 37.232 1.00 0.00 N ATOM 1755 CA ARG B 167 19.683 16.280 38.689 1.00 0.00 C ATOM 1756 C ARG B 167 21.128 16.420 39.166 1.00 0.00 C ATOM 1757 O ARG B 167 21.440 17.318 39.947 1.00 0.00 O ATOM 1758 CB ARG B 167 19.012 14.984 39.177 1.00 0.00 C ATOM 1759 CG ARG B 167 18.872 14.822 40.700 1.00 0.00 C ATOM 1760 CD ARG B 167 20.171 14.516 41.463 1.00 0.00 C ATOM 1761 NE ARG B 167 21.014 13.520 40.787 1.00 0.00 N ATOM 1762 CZ ARG B 167 20.823 12.195 40.766 1.00 0.00 C ATOM 1763 NH1 ARG B 167 19.760 11.644 41.361 1.00 0.00 N ATOM 1764 NH2 ARG B 167 21.722 11.429 40.140 1.00 0.00 N ATOM 0 H ARG B 167 19.100 15.547 36.827 1.00 0.00 H new ATOM 0 HA ARG B 167 19.132 17.118 39.115 1.00 0.00 H new ATOM 0 HB2 ARG B 167 18.018 14.925 38.734 1.00 0.00 H new ATOM 0 HB3 ARG B 167 19.582 14.138 38.794 1.00 0.00 H new ATOM 0 HG2 ARG B 167 18.442 15.738 41.106 1.00 0.00 H new ATOM 0 HG3 ARG B 167 18.160 14.021 40.897 1.00 0.00 H new ATOM 0 HD2 ARG B 167 20.738 15.438 41.588 1.00 0.00 H new ATOM 0 HD3 ARG B 167 19.923 14.156 42.462 1.00 0.00 H new ATOM 0 HE ARG B 167 21.827 13.874 40.283 1.00 0.00 H new ATOM 0 HH11 ARG B 167 19.080 12.235 41.840 1.00 0.00 H new ATOM 0 HH12 ARG B 167 19.629 10.633 41.336 1.00 0.00 H new ATOM 0 HH21 ARG B 167 22.532 11.856 39.692 1.00 0.00 H new ATOM 0 HH22 ARG B 167 21.598 10.417 40.111 1.00 0.00 H new ATOM 1778 N SER B 168 22.012 15.546 38.684 1.00 0.00 N ATOM 1779 CA SER B 168 23.402 15.522 39.117 1.00 0.00 C ATOM 1780 C SER B 168 24.111 16.834 38.769 1.00 0.00 C ATOM 1781 O SER B 168 24.844 17.381 39.587 1.00 0.00 O ATOM 1782 CB SER B 168 24.115 14.314 38.499 1.00 0.00 C ATOM 1783 OG SER B 168 23.372 13.133 38.744 1.00 0.00 O ATOM 0 H SER B 168 21.782 14.839 37.985 1.00 0.00 H new ATOM 0 HA SER B 168 23.433 15.422 40.202 1.00 0.00 H new ATOM 0 HB2 SER B 168 24.234 14.462 37.426 1.00 0.00 H new ATOM 0 HB3 SER B 168 25.116 14.218 38.920 1.00 0.00 H new ATOM 0 HG SER B 168 22.622 13.082 38.116 1.00 0.00 H new ATOM 1789 N LEU B 169 23.896 17.334 37.551 1.00 0.00 N ATOM 1790 CA LEU B 169 24.511 18.558 37.058 1.00 0.00 C ATOM 1791 C LEU B 169 24.081 19.755 37.910 1.00 0.00 C ATOM 1792 O LEU B 169 24.910 20.581 38.280 1.00 0.00 O ATOM 1793 CB LEU B 169 24.141 18.735 35.577 1.00 0.00 C ATOM 1794 CG LEU B 169 24.749 19.978 34.907 1.00 0.00 C ATOM 1795 CD1 LEU B 169 26.282 19.954 34.929 1.00 0.00 C ATOM 1796 CD2 LEU B 169 24.266 20.041 33.453 1.00 0.00 C ATOM 0 H LEU B 169 23.279 16.889 36.872 1.00 0.00 H new ATOM 0 HA LEU B 169 25.596 18.493 37.137 1.00 0.00 H new ATOM 0 HB2 LEU B 169 24.462 17.850 35.028 1.00 0.00 H new ATOM 0 HB3 LEU B 169 23.056 18.787 35.491 1.00 0.00 H new ATOM 0 HG LEU B 169 24.425 20.856 35.465 1.00 0.00 H new ATOM 0 HD11 LEU B 169 26.667 20.852 34.445 1.00 0.00 H new ATOM 0 HD12 LEU B 169 26.631 19.921 35.961 1.00 0.00 H new ATOM 0 HD13 LEU B 169 26.640 19.073 34.397 1.00 0.00 H new ATOM 0 HD21 LEU B 169 24.691 20.919 32.966 1.00 0.00 H new ATOM 0 HD22 LEU B 169 24.585 19.143 32.924 1.00 0.00 H new ATOM 0 HD23 LEU B 169 23.178 20.106 33.433 1.00 0.00 H new ATOM 1808 N VAL B 170 22.783 19.854 38.212 1.00 0.00 N ATOM 1809 CA VAL B 170 22.250 20.908 39.064 1.00 0.00 C ATOM 1810 C VAL B 170 22.796 20.763 40.489 1.00 0.00 C ATOM 1811 O VAL B 170 23.192 21.754 41.098 1.00 0.00 O ATOM 1812 CB VAL B 170 20.710 20.885 39.016 1.00 0.00 C ATOM 1813 CG1 VAL B 170 20.084 21.820 40.062 1.00 0.00 C ATOM 1814 CG2 VAL B 170 20.218 21.323 37.629 1.00 0.00 C ATOM 0 H VAL B 170 22.076 19.203 37.870 1.00 0.00 H new ATOM 0 HA VAL B 170 22.574 21.882 38.698 1.00 0.00 H new ATOM 0 HB VAL B 170 20.404 19.861 39.232 1.00 0.00 H new ATOM 0 HG11 VAL B 170 18.997 21.770 39.990 1.00 0.00 H new ATOM 0 HG12 VAL B 170 20.396 21.511 41.060 1.00 0.00 H new ATOM 0 HG13 VAL B 170 20.413 22.843 39.879 1.00 0.00 H new ATOM 0 HG21 VAL B 170 19.128 21.303 37.606 1.00 0.00 H new ATOM 0 HG22 VAL B 170 20.567 22.335 37.422 1.00 0.00 H new ATOM 0 HG23 VAL B 170 20.609 20.643 36.873 1.00 0.00 H new ATOM 1824 N LYS B 171 22.774 19.542 41.032 1.00 0.00 N ATOM 1825 CA LYS B 171 23.200 19.257 42.396 1.00 0.00 C ATOM 1826 C LYS B 171 24.651 18.757 42.402 1.00 0.00 C ATOM 1827 O LYS B 171 25.534 19.573 42.061 1.00 0.00 O ATOM 1828 CB LYS B 171 22.216 18.269 43.045 1.00 0.00 C ATOM 1829 CG LYS B 171 20.781 18.811 42.992 1.00 0.00 C ATOM 1830 CD LYS B 171 19.827 17.901 43.776 1.00 0.00 C ATOM 1831 CE LYS B 171 18.401 18.467 43.802 1.00 0.00 C ATOM 1832 NZ LYS B 171 17.823 18.578 42.450 1.00 0.00 N ATOM 1833 OXT LYS B 171 24.859 17.583 42.782 1.00 0.00 O ATOM 0 H LYS B 171 22.455 18.716 40.526 1.00 0.00 H new ATOM 0 HA LYS B 171 23.184 20.166 42.997 1.00 0.00 H new ATOM 0 HB2 LYS B 171 22.266 17.309 42.531 1.00 0.00 H new ATOM 0 HB3 LYS B 171 22.504 18.091 44.081 1.00 0.00 H new ATOM 0 HG2 LYS B 171 20.752 19.819 43.406 1.00 0.00 H new ATOM 0 HG3 LYS B 171 20.452 18.883 41.955 1.00 0.00 H new ATOM 0 HD2 LYS B 171 19.817 16.909 43.325 1.00 0.00 H new ATOM 0 HD3 LYS B 171 20.191 17.784 44.797 1.00 0.00 H new ATOM 0 HE2 LYS B 171 17.768 17.825 44.415 1.00 0.00 H new ATOM 0 HE3 LYS B 171 18.410 19.450 44.274 1.00 0.00 H new ATOM 0 HZ1 LYS B 171 16.814 18.818 42.523 1.00 0.00 H new ATOM 0 HZ2 LYS B 171 18.319 19.323 41.921 1.00 0.00 H new ATOM 0 HZ3 LYS B 171 17.928 17.671 41.952 1.00 0.00 H new