USER MOD reduce.3.24.130724 H: found=0, std=0, add=860, rem=0, adj=29 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 60 TYR OH : rot 18:sc= 1 USER MOD Set 1.2: B 157 THR OG1 : rot -179:sc= 2.35 USER MOD Set 2.1: A 56 LYS NZ :NH3+ -173:sc= 0.303 (180deg=0.255) USER MOD Set 2.2: A 86 MET CE :methyl 177:sc= -0.292 (180deg=-0.35) USER MOD Set 3.1: A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 96 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 28 THR OG1 : rot 170:sc= 1.32 USER MOD Set 4.2: A 98 SER OG : rot -17:sc= 1.14 USER MOD Set 5.1: A 19 SER OG : rot 112:sc= 1.04 USER MOD Set 5.2: A 21 SER OG : rot 180:sc= 0.907 USER MOD Set 6.1: A 10 SER OG : rot -120:sc= 0.552 USER MOD Set 6.2: A 51 SER OG : rot -52:sc= 1.07 USER MOD Single : A 3 GLN : amide:sc= -0.0424 K(o=-0.042,f=-1.1) USER MOD Single : A 7 THR OG1 : rot -56:sc= 1.06 USER MOD Single : A 11 LYS NZ :NH3+ 152:sc= 0.278 (180deg=-0.132) USER MOD Single : A 14 LYS NZ :NH3+ 171:sc= 1.07 (180deg=0.951) USER MOD Single : A 16 TYR OH : rot 166:sc= 1.24 USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 31:sc= 1.23 USER MOD Single : A 30 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0296) USER MOD Single : A 40 SER OG : rot 86:sc= 0.781 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 HIS : no HE2:sc= 0.628 K(o=0.63,f=-2.9!) USER MOD Single : A 62 ASN : amide:sc= 0.95 K(o=0.95,f=0) USER MOD Single : A 63 TYR OH : rot 161:sc= 1.31 USER MOD Single : A 64 ASN : amide:sc= -0.162 X(o=-0.16,f=-0.3) USER MOD Single : A 66 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0454) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 73:sc= 0.797 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -64:sc= 1.25 USER MOD Single : B 159 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0415) USER MOD Single : B 162 CYS SG : rot 161:sc= -0.0298 USER MOD Single : B 164 GLN : amide:sc= 0.271 X(o=0.27,f=0) USER MOD Single : B 168 SER OG : rot 82:sc= 2.21 USER MOD Single : B 171 LYS NZ :NH3+ 163:sc= 1.05 (180deg=0.603) USER MOD ----------------------------------------------------------------- ATOM 31 N GLN A 3 4.324 3.995 4.223 1.00 0.00 N ATOM 32 CA GLN A 3 5.523 3.174 4.212 1.00 0.00 C ATOM 33 C GLN A 3 5.863 2.796 5.651 1.00 0.00 C ATOM 34 O GLN A 3 5.431 3.477 6.580 1.00 0.00 O ATOM 35 CB GLN A 3 6.684 3.917 3.523 1.00 0.00 C ATOM 36 CG GLN A 3 7.172 5.188 4.243 1.00 0.00 C ATOM 37 CD GLN A 3 6.111 6.281 4.324 1.00 0.00 C ATOM 38 OE1 GLN A 3 5.620 6.758 3.305 1.00 0.00 O ATOM 39 NE2 GLN A 3 5.715 6.679 5.530 1.00 0.00 N ATOM 0 HA GLN A 3 5.351 2.263 3.639 1.00 0.00 H new ATOM 0 HB2 GLN A 3 7.525 3.230 3.423 1.00 0.00 H new ATOM 0 HB3 GLN A 3 6.372 4.188 2.514 1.00 0.00 H new ATOM 0 HG2 GLN A 3 7.491 4.926 5.252 1.00 0.00 H new ATOM 0 HG3 GLN A 3 8.047 5.578 3.723 1.00 0.00 H new ATOM 0 HE21 GLN A 3 6.135 6.271 6.365 1.00 0.00 H new ATOM 0 HE22 GLN A 3 4.991 7.392 5.620 1.00 0.00 H new ATOM 48 N ASP A 4 6.668 1.748 5.844 1.00 0.00 N ATOM 49 CA ASP A 4 7.070 1.250 7.159 1.00 0.00 C ATOM 50 C ASP A 4 8.135 2.136 7.815 1.00 0.00 C ATOM 51 O ASP A 4 9.014 1.624 8.504 1.00 0.00 O ATOM 52 CB ASP A 4 7.542 -0.209 7.036 1.00 0.00 C ATOM 53 CG ASP A 4 8.845 -0.350 6.249 1.00 0.00 C ATOM 54 OD1 ASP A 4 8.867 0.155 5.104 1.00 0.00 O ATOM 55 OD2 ASP A 4 9.781 -0.971 6.794 1.00 0.00 O ATOM 0 H ASP A 4 7.066 1.212 5.073 1.00 0.00 H new ATOM 0 HA ASP A 4 6.202 1.286 7.817 1.00 0.00 H new ATOM 0 HB2 ASP A 4 7.679 -0.626 8.034 1.00 0.00 H new ATOM 0 HB3 ASP A 4 6.764 -0.797 6.549 1.00 0.00 H new ATOM 60 N PHE A 5 8.033 3.460 7.660 1.00 0.00 N ATOM 61 CA PHE A 5 8.960 4.439 8.208 1.00 0.00 C ATOM 62 C PHE A 5 8.216 5.741 8.485 1.00 0.00 C ATOM 63 O PHE A 5 7.221 6.027 7.817 1.00 0.00 O ATOM 64 CB PHE A 5 10.113 4.703 7.229 1.00 0.00 C ATOM 65 CG PHE A 5 11.120 3.577 7.103 1.00 0.00 C ATOM 66 CD1 PHE A 5 12.221 3.523 7.978 1.00 0.00 C ATOM 67 CD2 PHE A 5 10.958 2.581 6.122 1.00 0.00 C ATOM 68 CE1 PHE A 5 13.130 2.454 7.903 1.00 0.00 C ATOM 69 CE2 PHE A 5 11.866 1.511 6.050 1.00 0.00 C ATOM 70 CZ PHE A 5 12.949 1.443 6.942 1.00 0.00 C ATOM 0 H PHE A 5 7.274 3.888 7.130 1.00 0.00 H new ATOM 0 HA PHE A 5 9.377 4.046 9.135 1.00 0.00 H new ATOM 0 HB2 PHE A 5 9.693 4.906 6.244 1.00 0.00 H new ATOM 0 HB3 PHE A 5 10.637 5.605 7.544 1.00 0.00 H new ATOM 0 HD1 PHE A 5 12.368 4.305 8.709 1.00 0.00 H new ATOM 0 HD2 PHE A 5 10.136 2.639 5.424 1.00 0.00 H new ATOM 0 HE1 PHE A 5 13.968 2.409 8.583 1.00 0.00 H new ATOM 0 HE2 PHE A 5 11.731 0.739 5.307 1.00 0.00 H new ATOM 0 HZ PHE A 5 13.641 0.616 6.890 1.00 0.00 H new ATOM 80 N VAL A 6 8.712 6.523 9.445 1.00 0.00 N ATOM 81 CA VAL A 6 8.297 7.887 9.727 1.00 0.00 C ATOM 82 C VAL A 6 9.596 8.681 9.876 1.00 0.00 C ATOM 83 O VAL A 6 10.616 8.104 10.253 1.00 0.00 O ATOM 84 CB VAL A 6 7.428 7.946 10.996 1.00 0.00 C ATOM 85 CG1 VAL A 6 6.894 9.369 11.206 1.00 0.00 C ATOM 86 CG2 VAL A 6 6.243 6.974 10.911 1.00 0.00 C ATOM 0 H VAL A 6 9.448 6.202 10.073 1.00 0.00 H new ATOM 0 HA VAL A 6 7.676 8.302 8.934 1.00 0.00 H new ATOM 0 HB VAL A 6 8.057 7.656 11.838 1.00 0.00 H new ATOM 0 HG11 VAL A 6 6.281 9.398 12.107 1.00 0.00 H new ATOM 0 HG12 VAL A 6 7.731 10.059 11.314 1.00 0.00 H new ATOM 0 HG13 VAL A 6 6.291 9.662 10.347 1.00 0.00 H new ATOM 0 HG21 VAL A 6 5.651 7.042 11.824 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.621 7.233 10.054 1.00 0.00 H new ATOM 0 HG23 VAL A 6 6.615 5.956 10.795 1.00 0.00 H new ATOM 96 N THR A 7 9.582 9.971 9.550 1.00 0.00 N ATOM 97 CA THR A 7 10.777 10.787 9.436 1.00 0.00 C ATOM 98 C THR A 7 10.733 11.935 10.447 1.00 0.00 C ATOM 99 O THR A 7 9.885 12.822 10.341 1.00 0.00 O ATOM 100 CB THR A 7 10.868 11.305 7.994 1.00 0.00 C ATOM 101 OG1 THR A 7 10.450 10.312 7.074 1.00 0.00 O ATOM 102 CG2 THR A 7 12.294 11.739 7.659 1.00 0.00 C ATOM 0 H THR A 7 8.722 10.483 9.355 1.00 0.00 H new ATOM 0 HA THR A 7 11.666 10.198 9.661 1.00 0.00 H new ATOM 0 HB THR A 7 10.206 12.167 7.913 1.00 0.00 H new ATOM 0 HG1 THR A 7 10.978 9.498 7.209 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.332 12.102 6.632 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.601 12.536 8.337 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.968 10.890 7.769 1.00 0.00 H new ATOM 110 N LEU A 8 11.654 11.941 11.414 1.00 0.00 N ATOM 111 CA LEU A 8 11.846 13.094 12.293 1.00 0.00 C ATOM 112 C LEU A 8 12.981 13.921 11.698 1.00 0.00 C ATOM 113 O LEU A 8 14.008 13.362 11.321 1.00 0.00 O ATOM 114 CB LEU A 8 12.182 12.667 13.730 1.00 0.00 C ATOM 115 CG LEU A 8 10.956 12.235 14.552 1.00 0.00 C ATOM 116 CD1 LEU A 8 11.395 11.440 15.788 1.00 0.00 C ATOM 117 CD2 LEU A 8 10.192 13.466 15.055 1.00 0.00 C ATOM 0 H LEU A 8 12.279 11.158 11.607 1.00 0.00 H new ATOM 0 HA LEU A 8 10.925 13.674 12.355 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.894 11.843 13.697 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.676 13.495 14.239 1.00 0.00 H new ATOM 0 HG LEU A 8 10.325 11.625 13.906 1.00 0.00 H new ATOM 0 HD11 LEU A 8 10.516 11.141 16.360 1.00 0.00 H new ATOM 0 HD12 LEU A 8 11.943 10.552 15.474 1.00 0.00 H new ATOM 0 HD13 LEU A 8 12.039 12.061 16.411 1.00 0.00 H new ATOM 0 HD21 LEU A 8 9.327 13.145 15.635 1.00 0.00 H new ATOM 0 HD22 LEU A 8 10.847 14.069 15.684 1.00 0.00 H new ATOM 0 HD23 LEU A 8 9.858 14.060 14.204 1.00 0.00 H new ATOM 129 N VAL A 9 12.806 15.238 11.583 1.00 0.00 N ATOM 130 CA VAL A 9 13.742 16.099 10.872 1.00 0.00 C ATOM 131 C VAL A 9 14.262 17.187 11.810 1.00 0.00 C ATOM 132 O VAL A 9 13.480 17.762 12.568 1.00 0.00 O ATOM 133 CB VAL A 9 13.067 16.682 9.621 1.00 0.00 C ATOM 134 CG1 VAL A 9 14.068 17.455 8.762 1.00 0.00 C ATOM 135 CG2 VAL A 9 12.369 15.600 8.787 1.00 0.00 C ATOM 0 H VAL A 9 12.009 15.735 11.982 1.00 0.00 H new ATOM 0 HA VAL A 9 14.602 15.518 10.538 1.00 0.00 H new ATOM 0 HB VAL A 9 12.302 17.375 9.970 1.00 0.00 H new ATOM 0 HG11 VAL A 9 13.561 17.856 7.884 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.489 18.275 9.343 1.00 0.00 H new ATOM 0 HG13 VAL A 9 14.868 16.786 8.445 1.00 0.00 H new ATOM 0 HG21 VAL A 9 11.906 16.057 7.913 1.00 0.00 H new ATOM 0 HG22 VAL A 9 13.102 14.860 8.464 1.00 0.00 H new ATOM 0 HG23 VAL A 9 11.603 15.113 9.391 1.00 0.00 H new ATOM 145 N SER A 10 15.575 17.445 11.754 1.00 0.00 N ATOM 146 CA SER A 10 16.296 18.388 12.605 1.00 0.00 C ATOM 147 C SER A 10 16.855 19.554 11.786 1.00 0.00 C ATOM 148 O SER A 10 17.081 19.405 10.584 1.00 0.00 O ATOM 149 CB SER A 10 17.415 17.651 13.352 1.00 0.00 C ATOM 150 OG SER A 10 18.130 16.754 12.518 1.00 0.00 O ATOM 0 H SER A 10 16.186 16.979 11.083 1.00 0.00 H new ATOM 0 HA SER A 10 15.602 18.808 13.333 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.107 18.380 13.772 1.00 0.00 H new ATOM 0 HB3 SER A 10 16.986 17.100 14.189 1.00 0.00 H new ATOM 0 HG SER A 10 18.052 15.844 12.874 1.00 0.00 H new ATOM 156 N LYS A 11 17.087 20.691 12.461 1.00 0.00 N ATOM 157 CA LYS A 11 17.549 21.969 11.905 1.00 0.00 C ATOM 158 C LYS A 11 17.158 22.164 10.429 1.00 0.00 C ATOM 159 O LYS A 11 15.985 22.047 10.068 1.00 0.00 O ATOM 160 CB LYS A 11 19.064 22.145 12.141 1.00 0.00 C ATOM 161 CG LYS A 11 19.503 22.099 13.605 1.00 0.00 C ATOM 162 CD LYS A 11 19.139 23.384 14.363 1.00 0.00 C ATOM 163 CE LYS A 11 19.655 23.376 15.808 1.00 0.00 C ATOM 164 NZ LYS A 11 21.125 23.275 15.883 1.00 0.00 N ATOM 0 H LYS A 11 16.948 20.744 13.470 1.00 0.00 H new ATOM 0 HA LYS A 11 17.029 22.762 12.443 1.00 0.00 H new ATOM 0 HB2 LYS A 11 19.594 21.365 11.594 1.00 0.00 H new ATOM 0 HB3 LYS A 11 19.374 23.099 11.715 1.00 0.00 H new ATOM 0 HG2 LYS A 11 19.035 21.245 14.096 1.00 0.00 H new ATOM 0 HG3 LYS A 11 20.581 21.944 13.654 1.00 0.00 H new ATOM 0 HD2 LYS A 11 19.554 24.243 13.836 1.00 0.00 H new ATOM 0 HD3 LYS A 11 18.056 23.506 14.367 1.00 0.00 H new ATOM 0 HE2 LYS A 11 19.331 24.287 16.311 1.00 0.00 H new ATOM 0 HE3 LYS A 11 19.209 22.539 16.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 21.460 23.730 16.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 21.404 22.273 15.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 21.548 23.750 15.060 1.00 0.00 H new ATOM 178 N ASP A 12 18.135 22.467 9.567 1.00 0.00 N ATOM 179 CA ASP A 12 17.917 22.723 8.154 1.00 0.00 C ATOM 180 C ASP A 12 17.798 21.397 7.405 1.00 0.00 C ATOM 181 O ASP A 12 18.680 21.031 6.632 1.00 0.00 O ATOM 182 CB ASP A 12 19.051 23.604 7.609 1.00 0.00 C ATOM 183 CG ASP A 12 18.882 23.915 6.122 1.00 0.00 C ATOM 184 OD1 ASP A 12 17.717 24.077 5.699 1.00 0.00 O ATOM 185 OD2 ASP A 12 19.927 24.004 5.442 1.00 0.00 O ATOM 0 H ASP A 12 19.114 22.540 9.845 1.00 0.00 H new ATOM 0 HA ASP A 12 16.983 23.265 8.007 1.00 0.00 H new ATOM 0 HB2 ASP A 12 19.085 24.537 8.171 1.00 0.00 H new ATOM 0 HB3 ASP A 12 20.006 23.102 7.766 1.00 0.00 H new ATOM 190 N ASP A 13 16.703 20.677 7.651 1.00 0.00 N ATOM 191 CA ASP A 13 16.311 19.503 6.876 1.00 0.00 C ATOM 192 C ASP A 13 17.300 18.332 6.996 1.00 0.00 C ATOM 193 O ASP A 13 17.668 17.714 5.999 1.00 0.00 O ATOM 194 CB ASP A 13 16.046 19.898 5.409 1.00 0.00 C ATOM 195 CG ASP A 13 15.432 18.765 4.591 1.00 0.00 C ATOM 196 OD1 ASP A 13 14.677 17.972 5.196 1.00 0.00 O ATOM 197 OD2 ASP A 13 15.697 18.729 3.370 1.00 0.00 O ATOM 0 H ASP A 13 16.054 20.898 8.407 1.00 0.00 H new ATOM 0 HA ASP A 13 15.382 19.128 7.306 1.00 0.00 H new ATOM 0 HB2 ASP A 13 15.379 20.760 5.385 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.983 20.207 4.946 1.00 0.00 H new ATOM 202 N LYS A 14 17.693 17.982 8.222 1.00 0.00 N ATOM 203 CA LYS A 14 18.458 16.773 8.503 1.00 0.00 C ATOM 204 C LYS A 14 17.478 15.693 8.953 1.00 0.00 C ATOM 205 O LYS A 14 17.047 15.678 10.110 1.00 0.00 O ATOM 206 CB LYS A 14 19.526 17.021 9.567 1.00 0.00 C ATOM 207 CG LYS A 14 20.656 17.936 9.079 1.00 0.00 C ATOM 208 CD LYS A 14 20.334 19.399 9.407 1.00 0.00 C ATOM 209 CE LYS A 14 21.396 20.355 8.855 1.00 0.00 C ATOM 210 NZ LYS A 14 21.373 20.402 7.381 1.00 0.00 N ATOM 0 H LYS A 14 17.486 18.537 9.053 1.00 0.00 H new ATOM 0 HA LYS A 14 18.985 16.453 7.604 1.00 0.00 H new ATOM 0 HB2 LYS A 14 19.059 17.466 10.446 1.00 0.00 H new ATOM 0 HB3 LYS A 14 19.948 16.066 9.880 1.00 0.00 H new ATOM 0 HG2 LYS A 14 21.596 17.649 9.551 1.00 0.00 H new ATOM 0 HG3 LYS A 14 20.790 17.818 8.004 1.00 0.00 H new ATOM 0 HD2 LYS A 14 19.360 19.659 8.991 1.00 0.00 H new ATOM 0 HD3 LYS A 14 20.262 19.521 10.488 1.00 0.00 H new ATOM 0 HE2 LYS A 14 21.228 21.355 9.254 1.00 0.00 H new ATOM 0 HE3 LYS A 14 22.382 20.038 9.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 21.995 21.166 7.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 21.706 19.494 6.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 20.402 20.579 7.054 1.00 0.00 H new ATOM 224 N GLU A 15 17.108 14.830 8.004 1.00 0.00 N ATOM 225 CA GLU A 15 16.040 13.853 8.136 1.00 0.00 C ATOM 226 C GLU A 15 16.541 12.528 8.711 1.00 0.00 C ATOM 227 O GLU A 15 17.300 11.820 8.054 1.00 0.00 O ATOM 228 CB GLU A 15 15.403 13.585 6.765 1.00 0.00 C ATOM 229 CG GLU A 15 14.892 14.846 6.059 1.00 0.00 C ATOM 230 CD GLU A 15 14.021 14.482 4.861 1.00 0.00 C ATOM 231 OE1 GLU A 15 14.598 14.313 3.767 1.00 0.00 O ATOM 232 OE2 GLU A 15 12.791 14.375 5.067 1.00 0.00 O ATOM 0 H GLU A 15 17.564 14.796 7.092 1.00 0.00 H new ATOM 0 HA GLU A 15 15.306 14.271 8.825 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.136 13.094 6.125 1.00 0.00 H new ATOM 0 HB3 GLU A 15 14.573 12.890 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 15 14.319 15.453 6.760 1.00 0.00 H new ATOM 0 HG3 GLU A 15 15.737 15.451 5.730 1.00 0.00 H new ATOM 239 N TYR A 16 16.079 12.175 9.909 1.00 0.00 N ATOM 240 CA TYR A 16 16.271 10.863 10.505 1.00 0.00 C ATOM 241 C TYR A 16 15.023 10.013 10.247 1.00 0.00 C ATOM 242 O TYR A 16 13.917 10.387 10.644 1.00 0.00 O ATOM 243 CB TYR A 16 16.535 10.999 12.006 1.00 0.00 C ATOM 244 CG TYR A 16 17.910 11.550 12.333 1.00 0.00 C ATOM 245 CD1 TYR A 16 18.143 12.936 12.296 1.00 0.00 C ATOM 246 CD2 TYR A 16 18.982 10.669 12.568 1.00 0.00 C ATOM 247 CE1 TYR A 16 19.435 13.439 12.531 1.00 0.00 C ATOM 248 CE2 TYR A 16 20.274 11.173 12.795 1.00 0.00 C ATOM 249 CZ TYR A 16 20.500 12.559 12.790 1.00 0.00 C ATOM 250 OH TYR A 16 21.755 13.051 12.998 1.00 0.00 O ATOM 0 H TYR A 16 15.548 12.812 10.503 1.00 0.00 H new ATOM 0 HA TYR A 16 17.136 10.375 10.055 1.00 0.00 H new ATOM 0 HB2 TYR A 16 15.778 11.651 12.442 1.00 0.00 H new ATOM 0 HB3 TYR A 16 16.423 10.022 12.476 1.00 0.00 H new ATOM 0 HD1 TYR A 16 17.329 13.615 12.087 1.00 0.00 H new ATOM 0 HD2 TYR A 16 18.811 9.603 12.574 1.00 0.00 H new ATOM 0 HE1 TYR A 16 19.609 14.505 12.512 1.00 0.00 H new ATOM 0 HE2 TYR A 16 21.094 10.494 12.974 1.00 0.00 H new ATOM 0 HH TYR A 16 22.322 12.350 13.382 1.00 0.00 H new ATOM 260 N GLU A 17 15.209 8.863 9.590 1.00 0.00 N ATOM 261 CA GLU A 17 14.162 7.884 9.343 1.00 0.00 C ATOM 262 C GLU A 17 14.108 6.905 10.513 1.00 0.00 C ATOM 263 O GLU A 17 15.126 6.321 10.876 1.00 0.00 O ATOM 264 CB GLU A 17 14.458 7.107 8.053 1.00 0.00 C ATOM 265 CG GLU A 17 14.448 7.976 6.787 1.00 0.00 C ATOM 266 CD GLU A 17 13.067 8.492 6.392 1.00 0.00 C ATOM 267 OE1 GLU A 17 12.073 8.090 7.037 1.00 0.00 O ATOM 268 OE2 GLU A 17 13.029 9.300 5.439 1.00 0.00 O ATOM 0 H GLU A 17 16.114 8.587 9.210 1.00 0.00 H new ATOM 0 HA GLU A 17 13.208 8.400 9.239 1.00 0.00 H new ATOM 0 HB2 GLU A 17 15.432 6.627 8.145 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.721 6.312 7.942 1.00 0.00 H new ATOM 0 HG2 GLU A 17 15.112 8.827 6.939 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.857 7.397 5.959 1.00 0.00 H new ATOM 275 N ILE A 18 12.920 6.714 11.081 1.00 0.00 N ATOM 276 CA ILE A 18 12.630 5.737 12.116 1.00 0.00 C ATOM 277 C ILE A 18 11.673 4.730 11.491 1.00 0.00 C ATOM 278 O ILE A 18 10.735 5.143 10.813 1.00 0.00 O ATOM 279 CB ILE A 18 11.974 6.450 13.311 1.00 0.00 C ATOM 280 CG1 ILE A 18 12.843 7.609 13.813 1.00 0.00 C ATOM 281 CG2 ILE A 18 11.730 5.471 14.456 1.00 0.00 C ATOM 282 CD1 ILE A 18 12.346 8.933 13.236 1.00 0.00 C ATOM 0 H ILE A 18 12.101 7.262 10.818 1.00 0.00 H new ATOM 0 HA ILE A 18 13.528 5.238 12.480 1.00 0.00 H new ATOM 0 HB ILE A 18 11.020 6.849 12.967 1.00 0.00 H new ATOM 0 HG12 ILE A 18 12.817 7.647 14.902 1.00 0.00 H new ATOM 0 HG13 ILE A 18 13.881 7.446 13.524 1.00 0.00 H new ATOM 0 HG21 ILE A 18 11.266 5.996 15.291 1.00 0.00 H new ATOM 0 HG22 ILE A 18 11.070 4.672 14.117 1.00 0.00 H new ATOM 0 HG23 ILE A 18 12.680 5.045 14.779 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.972 9.747 13.601 1.00 0.00 H new ATOM 0 HD12 ILE A 18 12.395 8.897 12.148 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.315 9.101 13.547 1.00 0.00 H new ATOM 294 N SER A 19 11.887 3.426 11.674 1.00 0.00 N ATOM 295 CA SER A 19 10.944 2.444 11.162 1.00 0.00 C ATOM 296 C SER A 19 9.598 2.633 11.862 1.00 0.00 C ATOM 297 O SER A 19 9.563 2.952 13.048 1.00 0.00 O ATOM 298 CB SER A 19 11.506 1.034 11.358 1.00 0.00 C ATOM 299 OG SER A 19 11.783 0.798 12.725 1.00 0.00 O ATOM 0 H SER A 19 12.691 3.035 12.165 1.00 0.00 H new ATOM 0 HA SER A 19 10.790 2.584 10.092 1.00 0.00 H new ATOM 0 HB2 SER A 19 10.791 0.297 10.993 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.416 0.914 10.770 1.00 0.00 H new ATOM 0 HG SER A 19 11.166 0.121 13.072 1.00 0.00 H new ATOM 305 N ARG A 20 8.489 2.416 11.153 1.00 0.00 N ATOM 306 CA ARG A 20 7.131 2.509 11.687 1.00 0.00 C ATOM 307 C ARG A 20 7.033 1.759 13.019 1.00 0.00 C ATOM 308 O ARG A 20 6.429 2.233 13.981 1.00 0.00 O ATOM 309 CB ARG A 20 6.162 1.930 10.646 1.00 0.00 C ATOM 310 CG ARG A 20 4.694 1.812 11.080 1.00 0.00 C ATOM 311 CD ARG A 20 4.004 3.169 11.239 1.00 0.00 C ATOM 312 NE ARG A 20 4.327 3.813 12.518 1.00 0.00 N ATOM 313 CZ ARG A 20 3.825 4.997 12.895 1.00 0.00 C ATOM 314 NH1 ARG A 20 3.030 5.687 12.071 1.00 0.00 N ATOM 315 NH2 ARG A 20 4.118 5.481 14.103 1.00 0.00 N ATOM 0 H ARG A 20 8.512 2.164 10.165 1.00 0.00 H new ATOM 0 HA ARG A 20 6.870 3.549 11.881 1.00 0.00 H new ATOM 0 HB2 ARG A 20 6.206 2.553 9.753 1.00 0.00 H new ATOM 0 HB3 ARG A 20 6.516 0.939 10.362 1.00 0.00 H new ATOM 0 HG2 ARG A 20 4.151 1.219 10.345 1.00 0.00 H new ATOM 0 HG3 ARG A 20 4.643 1.272 12.026 1.00 0.00 H new ATOM 0 HD2 ARG A 20 4.302 3.824 10.420 1.00 0.00 H new ATOM 0 HD3 ARG A 20 2.925 3.036 11.164 1.00 0.00 H new ATOM 0 HE ARG A 20 4.967 3.335 13.153 1.00 0.00 H new ATOM 0 HH11 ARG A 20 2.802 5.313 11.150 1.00 0.00 H new ATOM 0 HH12 ARG A 20 2.651 6.588 12.364 1.00 0.00 H new ATOM 0 HH21 ARG A 20 4.720 4.951 14.733 1.00 0.00 H new ATOM 0 HH22 ARG A 20 3.740 6.381 14.397 1.00 0.00 H new ATOM 329 N SER A 21 7.663 0.584 13.050 1.00 0.00 N ATOM 330 CA SER A 21 7.751 -0.321 14.176 1.00 0.00 C ATOM 331 C SER A 21 8.368 0.330 15.420 1.00 0.00 C ATOM 332 O SER A 21 7.983 -0.013 16.534 1.00 0.00 O ATOM 333 CB SER A 21 8.564 -1.523 13.694 1.00 0.00 C ATOM 334 OG SER A 21 9.774 -1.080 13.102 1.00 0.00 O ATOM 0 H SER A 21 8.154 0.224 12.232 1.00 0.00 H new ATOM 0 HA SER A 21 6.754 -0.622 14.498 1.00 0.00 H new ATOM 0 HB2 SER A 21 8.780 -2.187 14.531 1.00 0.00 H new ATOM 0 HB3 SER A 21 7.985 -2.099 12.972 1.00 0.00 H new ATOM 0 HG SER A 21 10.291 -1.854 12.797 1.00 0.00 H new ATOM 340 N ALA A 22 9.312 1.259 15.245 1.00 0.00 N ATOM 341 CA ALA A 22 9.885 2.045 16.329 1.00 0.00 C ATOM 342 C ALA A 22 9.044 3.304 16.541 1.00 0.00 C ATOM 343 O ALA A 22 8.668 3.607 17.666 1.00 0.00 O ATOM 344 CB ALA A 22 11.347 2.375 16.015 1.00 0.00 C ATOM 0 H ALA A 22 9.702 1.486 14.330 1.00 0.00 H new ATOM 0 HA ALA A 22 9.872 1.473 17.257 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.770 2.963 16.829 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.913 1.450 15.903 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.400 2.947 15.089 1.00 0.00 H new ATOM 350 N ALA A 23 8.714 4.028 15.469 1.00 0.00 N ATOM 351 CA ALA A 23 7.933 5.256 15.530 1.00 0.00 C ATOM 352 C ALA A 23 6.658 5.075 16.355 1.00 0.00 C ATOM 353 O ALA A 23 6.286 5.953 17.130 1.00 0.00 O ATOM 354 CB ALA A 23 7.603 5.722 14.111 1.00 0.00 C ATOM 0 H ALA A 23 8.988 3.770 14.521 1.00 0.00 H new ATOM 0 HA ALA A 23 8.529 6.019 16.030 1.00 0.00 H new ATOM 0 HB1 ALA A 23 7.019 6.641 14.157 1.00 0.00 H new ATOM 0 HB2 ALA A 23 8.528 5.907 13.564 1.00 0.00 H new ATOM 0 HB3 ALA A 23 7.027 4.951 13.599 1.00 0.00 H new ATOM 360 N MET A 24 5.976 3.935 16.203 1.00 0.00 N ATOM 361 CA MET A 24 4.746 3.657 16.938 1.00 0.00 C ATOM 362 C MET A 24 4.957 3.680 18.457 1.00 0.00 C ATOM 363 O MET A 24 4.021 3.972 19.198 1.00 0.00 O ATOM 364 CB MET A 24 4.105 2.358 16.428 1.00 0.00 C ATOM 365 CG MET A 24 4.843 1.091 16.873 1.00 0.00 C ATOM 366 SD MET A 24 4.392 0.486 18.522 1.00 0.00 S ATOM 367 CE MET A 24 5.452 -0.967 18.647 1.00 0.00 C ATOM 0 H MET A 24 6.261 3.187 15.571 1.00 0.00 H new ATOM 0 HA MET A 24 4.038 4.463 16.743 1.00 0.00 H new ATOM 0 HB2 MET A 24 3.074 2.310 16.779 1.00 0.00 H new ATOM 0 HB3 MET A 24 4.070 2.384 15.339 1.00 0.00 H new ATOM 0 HG2 MET A 24 4.650 0.301 16.147 1.00 0.00 H new ATOM 0 HG3 MET A 24 5.915 1.287 16.854 1.00 0.00 H new ATOM 0 HE1 MET A 24 5.292 -1.453 19.610 1.00 0.00 H new ATOM 0 HE2 MET A 24 5.210 -1.664 17.844 1.00 0.00 H new ATOM 0 HE3 MET A 24 6.496 -0.664 18.563 1.00 0.00 H new ATOM 377 N ILE A 25 6.182 3.399 18.918 1.00 0.00 N ATOM 378 CA ILE A 25 6.529 3.427 20.330 1.00 0.00 C ATOM 379 C ILE A 25 6.408 4.861 20.863 1.00 0.00 C ATOM 380 O ILE A 25 6.141 5.043 22.048 1.00 0.00 O ATOM 381 CB ILE A 25 7.923 2.799 20.560 1.00 0.00 C ATOM 382 CG1 ILE A 25 7.974 1.378 19.965 1.00 0.00 C ATOM 383 CG2 ILE A 25 8.282 2.738 22.049 1.00 0.00 C ATOM 384 CD1 ILE A 25 9.343 0.705 20.104 1.00 0.00 C ATOM 0 H ILE A 25 6.961 3.145 18.311 1.00 0.00 H new ATOM 0 HA ILE A 25 5.828 2.816 20.900 1.00 0.00 H new ATOM 0 HB ILE A 25 8.651 3.437 20.059 1.00 0.00 H new ATOM 0 HG12 ILE A 25 7.223 0.760 20.457 1.00 0.00 H new ATOM 0 HG13 ILE A 25 7.707 1.425 18.909 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.269 2.290 22.167 1.00 0.00 H new ATOM 0 HG22 ILE A 25 8.289 3.746 22.463 1.00 0.00 H new ATOM 0 HG23 ILE A 25 7.544 2.134 22.577 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.305 -0.291 19.664 1.00 0.00 H new ATOM 0 HD12 ILE A 25 10.096 1.301 19.588 1.00 0.00 H new ATOM 0 HD13 ILE A 25 9.604 0.626 21.159 1.00 0.00 H new ATOM 396 N SER A 26 6.573 5.881 20.009 1.00 0.00 N ATOM 397 CA SER A 26 6.269 7.263 20.359 1.00 0.00 C ATOM 398 C SER A 26 4.832 7.586 19.912 1.00 0.00 C ATOM 399 O SER A 26 4.634 7.958 18.751 1.00 0.00 O ATOM 400 CB SER A 26 7.297 8.213 19.729 1.00 0.00 C ATOM 401 OG SER A 26 7.643 7.839 18.414 1.00 0.00 O ATOM 0 H SER A 26 6.921 5.764 19.058 1.00 0.00 H new ATOM 0 HA SER A 26 6.332 7.400 21.439 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.894 9.226 19.721 1.00 0.00 H new ATOM 0 HB3 SER A 26 8.195 8.232 20.346 1.00 0.00 H new ATOM 0 HG SER A 26 6.877 7.403 17.985 1.00 0.00 H new ATOM 407 N PRO A 27 3.817 7.467 20.790 1.00 0.00 N ATOM 408 CA PRO A 27 2.428 7.704 20.417 1.00 0.00 C ATOM 409 C PRO A 27 2.209 9.120 19.882 1.00 0.00 C ATOM 410 O PRO A 27 1.348 9.325 19.034 1.00 0.00 O ATOM 411 CB PRO A 27 1.593 7.427 21.671 1.00 0.00 C ATOM 412 CG PRO A 27 2.589 7.613 22.813 1.00 0.00 C ATOM 413 CD PRO A 27 3.889 7.101 22.198 1.00 0.00 C ATOM 0 HA PRO A 27 2.130 7.047 19.600 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.754 8.117 21.754 1.00 0.00 H new ATOM 0 HB3 PRO A 27 1.177 6.419 21.662 1.00 0.00 H new ATOM 0 HG2 PRO A 27 2.667 8.656 23.119 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.305 7.042 23.697 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.757 7.553 22.678 1.00 0.00 H new ATOM 0 HD3 PRO A 27 3.984 6.022 22.320 1.00 0.00 H new ATOM 421 N THR A 28 2.992 10.091 20.349 1.00 0.00 N ATOM 422 CA THR A 28 3.036 11.442 19.820 1.00 0.00 C ATOM 423 C THR A 28 3.305 11.424 18.313 1.00 0.00 C ATOM 424 O THR A 28 2.500 11.920 17.532 1.00 0.00 O ATOM 425 CB THR A 28 4.168 12.162 20.554 1.00 0.00 C ATOM 426 OG1 THR A 28 5.248 11.251 20.646 1.00 0.00 O ATOM 427 CG2 THR A 28 3.732 12.573 21.963 1.00 0.00 C ATOM 0 H THR A 28 3.631 9.949 21.131 1.00 0.00 H new ATOM 0 HA THR A 28 2.083 11.949 19.971 1.00 0.00 H new ATOM 0 HB THR A 28 4.448 13.066 20.014 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.048 11.723 20.959 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.555 13.083 22.464 1.00 0.00 H new ATOM 0 HG22 THR A 28 2.875 13.244 21.898 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.455 11.685 22.532 1.00 0.00 H new ATOM 435 N LEU A 29 4.444 10.860 17.906 1.00 0.00 N ATOM 436 CA LEU A 29 4.852 10.782 16.507 1.00 0.00 C ATOM 437 C LEU A 29 3.752 10.110 15.683 1.00 0.00 C ATOM 438 O LEU A 29 3.333 10.634 14.651 1.00 0.00 O ATOM 439 CB LEU A 29 6.194 10.037 16.400 1.00 0.00 C ATOM 440 CG LEU A 29 6.785 9.944 14.980 1.00 0.00 C ATOM 441 CD1 LEU A 29 6.889 11.322 14.329 1.00 0.00 C ATOM 442 CD2 LEU A 29 8.174 9.302 15.056 1.00 0.00 C ATOM 0 H LEU A 29 5.115 10.440 18.549 1.00 0.00 H new ATOM 0 HA LEU A 29 4.998 11.784 16.103 1.00 0.00 H new ATOM 0 HB2 LEU A 29 6.919 10.533 17.045 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.062 9.027 16.787 1.00 0.00 H new ATOM 0 HG LEU A 29 6.121 9.334 14.368 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.310 11.221 13.329 1.00 0.00 H new ATOM 0 HD12 LEU A 29 5.897 11.769 14.262 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.535 11.961 14.931 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.598 9.233 14.054 1.00 0.00 H new ATOM 0 HD22 LEU A 29 8.823 9.912 15.684 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.090 8.303 15.484 1.00 0.00 H new ATOM 454 N LYS A 30 3.269 8.958 16.163 1.00 0.00 N ATOM 455 CA LYS A 30 2.181 8.225 15.531 1.00 0.00 C ATOM 456 C LYS A 30 0.927 9.097 15.392 1.00 0.00 C ATOM 457 O LYS A 30 0.303 9.121 14.334 1.00 0.00 O ATOM 458 CB LYS A 30 1.909 6.953 16.340 1.00 0.00 C ATOM 459 CG LYS A 30 0.860 6.049 15.679 1.00 0.00 C ATOM 460 CD LYS A 30 0.857 4.634 16.275 1.00 0.00 C ATOM 461 CE LYS A 30 0.736 4.641 17.805 1.00 0.00 C ATOM 462 NZ LYS A 30 0.628 3.275 18.345 1.00 0.00 N ATOM 0 H LYS A 30 3.629 8.511 17.006 1.00 0.00 H new ATOM 0 HA LYS A 30 2.469 7.944 14.518 1.00 0.00 H new ATOM 0 HB2 LYS A 30 2.839 6.397 16.460 1.00 0.00 H new ATOM 0 HB3 LYS A 30 1.570 7.227 17.339 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.128 6.494 15.798 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.056 5.990 14.608 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.029 4.066 15.851 1.00 0.00 H new ATOM 0 HD3 LYS A 30 1.775 4.121 15.989 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.605 5.136 18.237 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -0.140 5.220 18.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 0.379 3.319 19.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.110 2.755 17.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 1.539 2.785 18.234 1.00 0.00 H new ATOM 476 N ALA A 31 0.545 9.810 16.450 1.00 0.00 N ATOM 477 CA ALA A 31 -0.600 10.704 16.407 1.00 0.00 C ATOM 478 C ALA A 31 -0.376 11.781 15.348 1.00 0.00 C ATOM 479 O ALA A 31 -1.253 12.017 14.521 1.00 0.00 O ATOM 480 CB ALA A 31 -0.859 11.314 17.787 1.00 0.00 C ATOM 0 H ALA A 31 1.019 9.782 17.353 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.489 10.137 16.131 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.720 11.980 17.734 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.059 10.518 18.505 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.017 11.878 18.106 1.00 0.00 H new ATOM 486 N MET A 32 0.796 12.422 15.357 1.00 0.00 N ATOM 487 CA MET A 32 1.134 13.488 14.426 1.00 0.00 C ATOM 488 C MET A 32 0.899 13.039 12.980 1.00 0.00 C ATOM 489 O MET A 32 0.106 13.655 12.269 1.00 0.00 O ATOM 490 CB MET A 32 2.573 13.971 14.658 1.00 0.00 C ATOM 491 CG MET A 32 2.699 14.774 15.959 1.00 0.00 C ATOM 492 SD MET A 32 2.008 16.446 15.894 1.00 0.00 S ATOM 493 CE MET A 32 2.372 16.998 17.574 1.00 0.00 C ATOM 0 H MET A 32 1.541 12.209 16.020 1.00 0.00 H new ATOM 0 HA MET A 32 0.475 14.337 14.608 1.00 0.00 H new ATOM 0 HB2 MET A 32 3.244 13.113 14.694 1.00 0.00 H new ATOM 0 HB3 MET A 32 2.890 14.588 13.817 1.00 0.00 H new ATOM 0 HG2 MET A 32 2.204 14.223 16.758 1.00 0.00 H new ATOM 0 HG3 MET A 32 3.754 14.843 16.226 1.00 0.00 H new ATOM 0 HE1 MET A 32 2.011 18.018 17.708 1.00 0.00 H new ATOM 0 HE2 MET A 32 1.876 16.341 18.288 1.00 0.00 H new ATOM 0 HE3 MET A 32 3.449 16.969 17.741 1.00 0.00 H new ATOM 503 N ILE A 33 1.562 11.963 12.543 1.00 0.00 N ATOM 504 CA ILE A 33 1.483 11.506 11.149 1.00 0.00 C ATOM 505 C ILE A 33 0.055 11.270 10.657 1.00 0.00 C ATOM 506 O ILE A 33 -0.225 11.489 9.480 1.00 0.00 O ATOM 507 CB ILE A 33 2.423 10.317 10.872 1.00 0.00 C ATOM 508 CG1 ILE A 33 2.286 9.779 9.438 1.00 0.00 C ATOM 509 CG2 ILE A 33 2.257 9.149 11.847 1.00 0.00 C ATOM 510 CD1 ILE A 33 3.348 8.734 9.091 1.00 0.00 C ATOM 0 H ILE A 33 2.162 11.390 13.136 1.00 0.00 H new ATOM 0 HA ILE A 33 1.848 12.337 10.545 1.00 0.00 H new ATOM 0 HB ILE A 33 3.418 10.738 11.015 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.296 9.339 9.313 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.357 10.609 8.735 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.954 8.353 11.584 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.462 9.490 12.862 1.00 0.00 H new ATOM 0 HG23 ILE A 33 1.236 8.770 11.791 1.00 0.00 H new ATOM 0 HD11 ILE A 33 3.200 8.391 8.067 1.00 0.00 H new ATOM 0 HD12 ILE A 33 4.339 9.177 9.186 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.262 7.888 9.773 1.00 0.00 H new ATOM 522 N GLU A 34 -0.840 10.829 11.540 1.00 0.00 N ATOM 523 CA GLU A 34 -2.221 10.531 11.188 1.00 0.00 C ATOM 524 C GLU A 34 -3.109 11.772 11.324 1.00 0.00 C ATOM 525 O GLU A 34 -3.994 11.985 10.502 1.00 0.00 O ATOM 526 CB GLU A 34 -2.745 9.382 12.060 1.00 0.00 C ATOM 527 CG GLU A 34 -1.900 8.103 11.938 1.00 0.00 C ATOM 528 CD GLU A 34 -1.757 7.616 10.499 1.00 0.00 C ATOM 529 OE1 GLU A 34 -2.813 7.370 9.877 1.00 0.00 O ATOM 530 OE2 GLU A 34 -0.598 7.498 10.048 1.00 0.00 O ATOM 0 H GLU A 34 -0.623 10.669 12.524 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.253 10.222 10.143 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -2.762 9.702 13.102 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.774 9.159 11.778 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.909 8.288 12.353 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.355 7.315 12.539 1.00 0.00 H new ATOM 537 N GLY A 35 -2.903 12.561 12.380 1.00 0.00 N ATOM 538 CA GLY A 35 -3.791 13.658 12.748 1.00 0.00 C ATOM 539 C GLY A 35 -3.511 14.879 11.874 1.00 0.00 C ATOM 540 O GLY A 35 -4.112 15.018 10.810 1.00 0.00 O ATOM 0 H GLY A 35 -2.106 12.453 13.008 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.830 13.349 12.632 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.650 13.913 13.798 1.00 0.00 H new ATOM 544 N PRO A 36 -2.588 15.771 12.268 1.00 0.00 N ATOM 545 CA PRO A 36 -2.110 16.858 11.423 1.00 0.00 C ATOM 546 C PRO A 36 -1.199 16.310 10.312 1.00 0.00 C ATOM 547 O PRO A 36 -0.053 16.740 10.152 1.00 0.00 O ATOM 548 CB PRO A 36 -1.384 17.806 12.385 1.00 0.00 C ATOM 549 CG PRO A 36 -0.848 16.861 13.461 1.00 0.00 C ATOM 550 CD PRO A 36 -1.959 15.817 13.577 1.00 0.00 C ATOM 0 HA PRO A 36 -2.909 17.382 10.898 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.580 18.348 11.887 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.060 18.552 12.803 1.00 0.00 H new ATOM 0 HG2 PRO A 36 0.101 16.411 13.169 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -0.678 17.378 14.405 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -1.555 14.843 13.852 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.678 16.093 14.348 1.00 0.00 H new ATOM 558 N PHE A 37 -1.715 15.365 9.518 1.00 0.00 N ATOM 559 CA PHE A 37 -0.967 14.699 8.463 1.00 0.00 C ATOM 560 C PHE A 37 -0.604 15.695 7.372 1.00 0.00 C ATOM 561 O PHE A 37 0.483 15.631 6.805 1.00 0.00 O ATOM 562 CB PHE A 37 -1.767 13.512 7.905 1.00 0.00 C ATOM 563 CG PHE A 37 -2.965 13.892 7.051 1.00 0.00 C ATOM 564 CD1 PHE A 37 -2.794 14.172 5.681 1.00 0.00 C ATOM 565 CD2 PHE A 37 -4.238 14.022 7.633 1.00 0.00 C ATOM 566 CE1 PHE A 37 -3.879 14.628 4.913 1.00 0.00 C ATOM 567 CE2 PHE A 37 -5.322 14.481 6.866 1.00 0.00 C ATOM 568 CZ PHE A 37 -5.143 14.791 5.507 1.00 0.00 C ATOM 0 H PHE A 37 -2.679 15.042 9.597 1.00 0.00 H new ATOM 0 HA PHE A 37 -0.040 14.303 8.877 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.098 12.890 7.310 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.113 12.902 8.739 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.827 14.036 5.220 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -4.383 13.768 8.673 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.742 14.853 3.866 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.294 14.596 7.322 1.00 0.00 H new ATOM 0 HZ PHE A 37 -5.974 15.154 4.920 1.00 0.00 H new ATOM 578 N ARG A 38 -1.491 16.673 7.157 1.00 0.00 N ATOM 579 CA ARG A 38 -1.275 17.848 6.327 1.00 0.00 C ATOM 580 C ARG A 38 0.101 18.493 6.528 1.00 0.00 C ATOM 581 O ARG A 38 0.526 19.268 5.674 1.00 0.00 O ATOM 582 CB ARG A 38 -2.374 18.878 6.617 1.00 0.00 C ATOM 583 CG ARG A 38 -2.491 19.225 8.113 1.00 0.00 C ATOM 584 CD ARG A 38 -2.456 20.736 8.350 1.00 0.00 C ATOM 585 NE ARG A 38 -1.145 21.303 7.995 1.00 0.00 N ATOM 586 CZ ARG A 38 -0.765 22.558 8.267 1.00 0.00 C ATOM 587 NH1 ARG A 38 -1.616 23.403 8.859 1.00 0.00 N ATOM 588 NH2 ARG A 38 0.466 22.970 7.946 1.00 0.00 N ATOM 0 H ARG A 38 -2.419 16.660 7.579 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.313 17.517 5.289 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -2.170 19.788 6.053 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -3.330 18.491 6.263 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.421 18.816 8.509 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -1.676 18.752 8.661 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.235 21.217 7.758 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -2.675 20.947 9.397 1.00 0.00 H new ATOM 0 HE ARG A 38 -0.481 20.700 7.509 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -2.556 23.092 9.104 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -1.325 24.359 9.066 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.117 22.328 7.493 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.754 23.926 8.154 1.00 0.00 H new ATOM 602 N GLU A 39 0.772 18.219 7.652 1.00 0.00 N ATOM 603 CA GLU A 39 2.141 18.647 7.882 1.00 0.00 C ATOM 604 C GLU A 39 2.999 17.409 8.134 1.00 0.00 C ATOM 605 O GLU A 39 4.039 17.216 7.513 1.00 0.00 O ATOM 606 CB GLU A 39 2.145 19.610 9.081 1.00 0.00 C ATOM 607 CG GLU A 39 3.490 20.329 9.269 1.00 0.00 C ATOM 608 CD GLU A 39 3.836 21.300 8.138 1.00 0.00 C ATOM 609 OE1 GLU A 39 2.893 21.734 7.439 1.00 0.00 O ATOM 610 OE2 GLU A 39 5.039 21.608 8.010 1.00 0.00 O ATOM 0 H GLU A 39 0.371 17.691 8.427 1.00 0.00 H new ATOM 0 HA GLU A 39 2.555 19.172 7.021 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.358 20.352 8.946 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.907 19.054 9.988 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.470 20.876 10.211 1.00 0.00 H new ATOM 0 HG3 GLU A 39 4.281 19.584 9.350 1.00 0.00 H new ATOM 617 N SER A 40 2.529 16.563 9.048 1.00 0.00 N ATOM 618 CA SER A 40 3.258 15.448 9.619 1.00 0.00 C ATOM 619 C SER A 40 3.283 14.173 8.772 1.00 0.00 C ATOM 620 O SER A 40 3.758 13.153 9.267 1.00 0.00 O ATOM 621 CB SER A 40 2.594 15.130 10.958 1.00 0.00 C ATOM 622 OG SER A 40 2.277 16.311 11.671 1.00 0.00 O ATOM 0 H SER A 40 1.584 16.646 9.424 1.00 0.00 H new ATOM 0 HA SER A 40 4.301 15.755 9.699 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.686 14.552 10.787 1.00 0.00 H new ATOM 0 HB3 SER A 40 3.260 14.509 11.557 1.00 0.00 H new ATOM 0 HG SER A 40 1.401 16.642 11.383 1.00 0.00 H new ATOM 628 N LYS A 41 2.731 14.165 7.554 1.00 0.00 N ATOM 629 CA LYS A 41 2.671 12.955 6.742 1.00 0.00 C ATOM 630 C LYS A 41 4.091 12.472 6.421 1.00 0.00 C ATOM 631 O LYS A 41 4.714 12.893 5.448 1.00 0.00 O ATOM 632 CB LYS A 41 1.813 13.193 5.488 1.00 0.00 C ATOM 633 CG LYS A 41 1.661 11.994 4.540 1.00 0.00 C ATOM 634 CD LYS A 41 0.540 11.009 4.920 1.00 0.00 C ATOM 635 CE LYS A 41 0.837 10.174 6.170 1.00 0.00 C ATOM 636 NZ LYS A 41 0.046 8.931 6.184 1.00 0.00 N ATOM 0 H LYS A 41 2.320 14.987 7.112 1.00 0.00 H new ATOM 0 HA LYS A 41 2.183 12.156 7.300 1.00 0.00 H new ATOM 0 HB2 LYS A 41 0.819 13.508 5.806 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.246 14.022 4.928 1.00 0.00 H new ATOM 0 HG2 LYS A 41 1.472 12.366 3.533 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.606 11.452 4.508 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -0.381 11.569 5.081 1.00 0.00 H new ATOM 0 HD3 LYS A 41 0.362 10.336 4.081 1.00 0.00 H new ATOM 0 HE2 LYS A 41 1.899 9.932 6.204 1.00 0.00 H new ATOM 0 HE3 LYS A 41 0.614 10.759 7.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 0.269 8.387 7.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -0.967 9.164 6.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 0.277 8.363 5.344 1.00 0.00 H new ATOM 650 N GLY A 42 4.626 11.610 7.283 1.00 0.00 N ATOM 651 CA GLY A 42 5.988 11.119 7.206 1.00 0.00 C ATOM 652 C GLY A 42 6.943 12.140 7.816 1.00 0.00 C ATOM 653 O GLY A 42 7.678 11.814 8.742 1.00 0.00 O ATOM 0 H GLY A 42 4.106 11.228 8.072 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.072 10.169 7.734 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.258 10.931 6.167 1.00 0.00 H new ATOM 657 N ARG A 43 6.922 13.369 7.300 1.00 0.00 N ATOM 658 CA ARG A 43 7.898 14.405 7.602 1.00 0.00 C ATOM 659 C ARG A 43 7.497 15.239 8.825 1.00 0.00 C ATOM 660 O ARG A 43 6.806 16.245 8.685 1.00 0.00 O ATOM 661 CB ARG A 43 8.038 15.272 6.341 1.00 0.00 C ATOM 662 CG ARG A 43 9.167 16.297 6.458 1.00 0.00 C ATOM 663 CD ARG A 43 9.187 17.196 5.217 1.00 0.00 C ATOM 664 NE ARG A 43 10.091 18.336 5.400 1.00 0.00 N ATOM 665 CZ ARG A 43 11.428 18.272 5.421 1.00 0.00 C ATOM 666 NH1 ARG A 43 12.067 17.130 5.156 1.00 0.00 N ATOM 667 NH2 ARG A 43 12.138 19.362 5.717 1.00 0.00 N ATOM 0 H ARG A 43 6.204 13.675 6.643 1.00 0.00 H new ATOM 0 HA ARG A 43 8.855 13.954 7.865 1.00 0.00 H new ATOM 0 HB2 ARG A 43 8.223 14.629 5.481 1.00 0.00 H new ATOM 0 HB3 ARG A 43 7.098 15.791 6.155 1.00 0.00 H new ATOM 0 HG2 ARG A 43 9.029 16.902 7.354 1.00 0.00 H new ATOM 0 HG3 ARG A 43 10.124 15.786 6.563 1.00 0.00 H new ATOM 0 HD2 ARG A 43 9.501 16.615 4.350 1.00 0.00 H new ATOM 0 HD3 ARG A 43 8.180 17.557 5.011 1.00 0.00 H new ATOM 0 HE ARG A 43 9.665 19.255 5.521 1.00 0.00 H new ATOM 0 HH11 ARG A 43 11.536 16.288 4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 43 13.086 17.099 5.176 1.00 0.00 H new ATOM 0 HH21 ARG A 43 11.662 20.240 5.926 1.00 0.00 H new ATOM 0 HH22 ARG A 43 13.157 19.318 5.734 1.00 0.00 H new ATOM 681 N ILE A 44 7.969 14.877 10.024 1.00 0.00 N ATOM 682 CA ILE A 44 7.821 15.724 11.204 1.00 0.00 C ATOM 683 C ILE A 44 9.038 16.656 11.291 1.00 0.00 C ATOM 684 O ILE A 44 10.152 16.227 11.606 1.00 0.00 O ATOM 685 CB ILE A 44 7.599 14.876 12.470 1.00 0.00 C ATOM 686 CG1 ILE A 44 6.201 14.229 12.484 1.00 0.00 C ATOM 687 CG2 ILE A 44 7.688 15.747 13.733 1.00 0.00 C ATOM 688 CD1 ILE A 44 6.031 13.085 11.481 1.00 0.00 C ATOM 0 H ILE A 44 8.458 13.999 10.198 1.00 0.00 H new ATOM 0 HA ILE A 44 6.930 16.346 11.120 1.00 0.00 H new ATOM 0 HB ILE A 44 8.374 14.110 12.460 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.997 13.852 13.486 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.455 14.996 12.274 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.528 15.127 14.615 1.00 0.00 H new ATOM 0 HG22 ILE A 44 8.674 16.208 13.788 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.925 16.525 13.693 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.020 12.684 11.554 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.201 13.458 10.471 1.00 0.00 H new ATOM 0 HD13 ILE A 44 6.751 12.297 11.702 1.00 0.00 H new ATOM 700 N GLU A 45 8.813 17.946 11.019 1.00 0.00 N ATOM 701 CA GLU A 45 9.855 18.959 10.966 1.00 0.00 C ATOM 702 C GLU A 45 10.103 19.586 12.335 1.00 0.00 C ATOM 703 O GLU A 45 9.523 20.623 12.648 1.00 0.00 O ATOM 704 CB GLU A 45 9.496 20.052 9.949 1.00 0.00 C ATOM 705 CG GLU A 45 9.375 19.520 8.518 1.00 0.00 C ATOM 706 CD GLU A 45 9.334 20.671 7.517 1.00 0.00 C ATOM 707 OE1 GLU A 45 8.214 21.146 7.234 1.00 0.00 O ATOM 708 OE2 GLU A 45 10.428 21.073 7.063 1.00 0.00 O ATOM 0 H GLU A 45 7.882 18.315 10.827 1.00 0.00 H new ATOM 0 HA GLU A 45 10.773 18.463 10.650 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.553 20.516 10.240 1.00 0.00 H new ATOM 0 HB3 GLU A 45 10.257 20.832 9.978 1.00 0.00 H new ATOM 0 HG2 GLU A 45 10.219 18.867 8.295 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.472 18.917 8.424 1.00 0.00 H new ATOM 715 N LEU A 46 11.046 19.046 13.112 1.00 0.00 N ATOM 716 CA LEU A 46 11.498 19.709 14.330 1.00 0.00 C ATOM 717 C LEU A 46 12.637 20.645 13.924 1.00 0.00 C ATOM 718 O LEU A 46 13.766 20.521 14.403 1.00 0.00 O ATOM 719 CB LEU A 46 11.915 18.680 15.393 1.00 0.00 C ATOM 720 CG LEU A 46 10.827 17.634 15.690 1.00 0.00 C ATOM 721 CD1 LEU A 46 11.272 16.752 16.860 1.00 0.00 C ATOM 722 CD2 LEU A 46 9.477 18.273 16.042 1.00 0.00 C ATOM 0 H LEU A 46 11.507 18.157 12.918 1.00 0.00 H new ATOM 0 HA LEU A 46 10.699 20.288 14.793 1.00 0.00 H new ATOM 0 HB2 LEU A 46 12.818 18.169 15.059 1.00 0.00 H new ATOM 0 HB3 LEU A 46 12.167 19.203 16.315 1.00 0.00 H new ATOM 0 HG LEU A 46 10.693 17.044 14.783 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.501 16.011 17.071 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.202 16.245 16.601 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.431 17.371 17.743 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.745 17.490 16.242 1.00 0.00 H new ATOM 0 HD22 LEU A 46 9.590 18.899 16.927 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.135 18.884 15.207 1.00 0.00 H new ATOM 734 N LYS A 47 12.304 21.584 13.025 1.00 0.00 N ATOM 735 CA LYS A 47 13.202 22.544 12.387 1.00 0.00 C ATOM 736 C LYS A 47 13.692 23.576 13.409 1.00 0.00 C ATOM 737 O LYS A 47 13.378 24.762 13.341 1.00 0.00 O ATOM 738 CB LYS A 47 12.509 23.167 11.159 1.00 0.00 C ATOM 739 CG LYS A 47 11.125 23.789 11.439 1.00 0.00 C ATOM 740 CD LYS A 47 10.603 24.596 10.240 1.00 0.00 C ATOM 741 CE LYS A 47 10.223 23.692 9.062 1.00 0.00 C ATOM 742 NZ LYS A 47 9.665 24.464 7.939 1.00 0.00 N ATOM 0 H LYS A 47 11.341 21.695 12.709 1.00 0.00 H new ATOM 0 HA LYS A 47 14.095 22.040 12.019 1.00 0.00 H new ATOM 0 HB2 LYS A 47 13.160 23.937 10.745 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.398 22.398 10.394 1.00 0.00 H new ATOM 0 HG2 LYS A 47 10.415 22.998 11.681 1.00 0.00 H new ATOM 0 HG3 LYS A 47 11.189 24.438 12.312 1.00 0.00 H new ATOM 0 HD2 LYS A 47 9.734 25.178 10.546 1.00 0.00 H new ATOM 0 HD3 LYS A 47 11.366 25.306 9.921 1.00 0.00 H new ATOM 0 HE2 LYS A 47 11.103 23.145 8.725 1.00 0.00 H new ATOM 0 HE3 LYS A 47 9.494 22.952 9.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.420 23.818 7.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 8.811 24.967 8.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 10.370 25.153 7.607 1.00 0.00 H new ATOM 756 N GLN A 48 14.466 23.084 14.371 1.00 0.00 N ATOM 757 CA GLN A 48 14.888 23.777 15.577 1.00 0.00 C ATOM 758 C GLN A 48 15.765 22.832 16.394 1.00 0.00 C ATOM 759 O GLN A 48 16.807 23.239 16.899 1.00 0.00 O ATOM 760 CB GLN A 48 13.655 24.191 16.404 1.00 0.00 C ATOM 761 CG GLN A 48 14.034 24.926 17.697 1.00 0.00 C ATOM 762 CD GLN A 48 12.795 25.263 18.518 1.00 0.00 C ATOM 763 OE1 GLN A 48 12.545 24.653 19.552 1.00 0.00 O ATOM 764 NE2 GLN A 48 12.002 26.227 18.061 1.00 0.00 N ATOM 0 H GLN A 48 14.836 22.135 14.324 1.00 0.00 H new ATOM 0 HA GLN A 48 15.448 24.675 15.314 1.00 0.00 H new ATOM 0 HB2 GLN A 48 13.015 24.833 15.799 1.00 0.00 H new ATOM 0 HB3 GLN A 48 13.073 23.303 16.652 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.708 24.306 18.288 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.574 25.841 17.454 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.238 26.715 17.197 1.00 0.00 H new ATOM 0 HE22 GLN A 48 11.157 26.478 18.574 1.00 0.00 H new ATOM 773 N PHE A 49 15.332 21.575 16.551 1.00 0.00 N ATOM 774 CA PHE A 49 16.078 20.603 17.335 1.00 0.00 C ATOM 775 C PHE A 49 17.316 20.182 16.549 1.00 0.00 C ATOM 776 O PHE A 49 17.280 20.097 15.319 1.00 0.00 O ATOM 777 CB PHE A 49 15.203 19.394 17.699 1.00 0.00 C ATOM 778 CG PHE A 49 14.118 19.603 18.750 1.00 0.00 C ATOM 779 CD1 PHE A 49 13.783 20.883 19.240 1.00 0.00 C ATOM 780 CD2 PHE A 49 13.450 18.475 19.263 1.00 0.00 C ATOM 781 CE1 PHE A 49 12.779 21.030 20.213 1.00 0.00 C ATOM 782 CE2 PHE A 49 12.439 18.624 20.230 1.00 0.00 C ATOM 783 CZ PHE A 49 12.107 19.900 20.710 1.00 0.00 C ATOM 0 H PHE A 49 14.469 21.215 16.143 1.00 0.00 H new ATOM 0 HA PHE A 49 16.390 21.057 18.275 1.00 0.00 H new ATOM 0 HB2 PHE A 49 14.724 19.038 16.787 1.00 0.00 H new ATOM 0 HB3 PHE A 49 15.859 18.596 18.047 1.00 0.00 H new ATOM 0 HD1 PHE A 49 14.300 21.754 18.866 1.00 0.00 H new ATOM 0 HD2 PHE A 49 13.715 17.489 18.912 1.00 0.00 H new ATOM 0 HE1 PHE A 49 12.524 22.013 20.579 1.00 0.00 H new ATOM 0 HE2 PHE A 49 11.918 17.755 20.603 1.00 0.00 H new ATOM 0 HZ PHE A 49 11.337 20.014 21.459 1.00 0.00 H new ATOM 793 N ASP A 50 18.417 19.948 17.268 1.00 0.00 N ATOM 794 CA ASP A 50 19.734 19.704 16.707 1.00 0.00 C ATOM 795 C ASP A 50 19.908 18.235 16.337 1.00 0.00 C ATOM 796 O ASP A 50 19.575 17.349 17.121 1.00 0.00 O ATOM 797 CB ASP A 50 20.807 20.156 17.700 1.00 0.00 C ATOM 798 CG ASP A 50 22.205 19.951 17.128 1.00 0.00 C ATOM 799 OD1 ASP A 50 22.432 20.436 15.999 1.00 0.00 O ATOM 800 OD2 ASP A 50 23.016 19.291 17.812 1.00 0.00 O ATOM 0 H ASP A 50 18.408 19.924 18.288 1.00 0.00 H new ATOM 0 HA ASP A 50 19.840 20.283 15.789 1.00 0.00 H new ATOM 0 HB2 ASP A 50 20.661 21.208 17.944 1.00 0.00 H new ATOM 0 HB3 ASP A 50 20.705 19.596 18.630 1.00 0.00 H new ATOM 805 N SER A 51 20.460 17.974 15.151 1.00 0.00 N ATOM 806 CA SER A 51 20.647 16.639 14.613 1.00 0.00 C ATOM 807 C SER A 51 21.321 15.699 15.604 1.00 0.00 C ATOM 808 O SER A 51 20.846 14.588 15.807 1.00 0.00 O ATOM 809 CB SER A 51 21.426 16.765 13.304 1.00 0.00 C ATOM 810 OG SER A 51 20.751 17.725 12.515 1.00 0.00 O ATOM 0 H SER A 51 20.796 18.708 14.528 1.00 0.00 H new ATOM 0 HA SER A 51 19.676 16.185 14.418 1.00 0.00 H new ATOM 0 HB2 SER A 51 22.453 17.075 13.494 1.00 0.00 H new ATOM 0 HB3 SER A 51 21.473 15.806 12.789 1.00 0.00 H new ATOM 0 HG SER A 51 19.801 17.491 12.457 1.00 0.00 H new ATOM 816 N HIS A 52 22.393 16.147 16.257 1.00 0.00 N ATOM 817 CA HIS A 52 23.110 15.331 17.231 1.00 0.00 C ATOM 818 C HIS A 52 22.190 14.900 18.380 1.00 0.00 C ATOM 819 O HIS A 52 22.312 13.793 18.899 1.00 0.00 O ATOM 820 CB HIS A 52 24.327 16.101 17.758 1.00 0.00 C ATOM 821 CG HIS A 52 25.112 16.790 16.669 1.00 0.00 C ATOM 822 ND1 HIS A 52 25.110 18.143 16.422 1.00 0.00 N ATOM 823 CD2 HIS A 52 25.785 16.183 15.643 1.00 0.00 C ATOM 824 CE1 HIS A 52 25.784 18.349 15.279 1.00 0.00 C ATOM 825 NE2 HIS A 52 26.208 17.184 14.763 1.00 0.00 N ATOM 0 H HIS A 52 22.785 17.079 16.126 1.00 0.00 H new ATOM 0 HA HIS A 52 23.456 14.423 16.736 1.00 0.00 H new ATOM 0 HB2 HIS A 52 23.993 16.844 18.482 1.00 0.00 H new ATOM 0 HB3 HIS A 52 24.983 15.411 18.289 1.00 0.00 H new ATOM 0 HD1 HIS A 52 24.675 18.860 17.002 1.00 0.00 H new ATOM 0 HD2 HIS A 52 25.958 15.123 15.533 1.00 0.00 H new ATOM 0 HE1 HIS A 52 25.961 19.318 14.836 1.00 0.00 H new ATOM 833 N ILE A 53 21.268 15.778 18.782 1.00 0.00 N ATOM 834 CA ILE A 53 20.310 15.492 19.835 1.00 0.00 C ATOM 835 C ILE A 53 19.286 14.501 19.281 1.00 0.00 C ATOM 836 O ILE A 53 19.117 13.404 19.817 1.00 0.00 O ATOM 837 CB ILE A 53 19.649 16.799 20.317 1.00 0.00 C ATOM 838 CG1 ILE A 53 20.672 17.852 20.782 1.00 0.00 C ATOM 839 CG2 ILE A 53 18.622 16.507 21.413 1.00 0.00 C ATOM 840 CD1 ILE A 53 21.329 17.554 22.128 1.00 0.00 C ATOM 0 H ILE A 53 21.170 16.710 18.380 1.00 0.00 H new ATOM 0 HA ILE A 53 20.801 15.049 20.702 1.00 0.00 H new ATOM 0 HB ILE A 53 19.136 17.231 19.458 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.451 17.941 20.025 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.174 18.820 20.843 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.165 17.441 21.742 1.00 0.00 H new ATOM 0 HG22 ILE A 53 17.851 15.844 21.022 1.00 0.00 H new ATOM 0 HG23 ILE A 53 19.117 16.028 22.258 1.00 0.00 H new ATOM 0 HD11 ILE A 53 22.033 18.349 22.373 1.00 0.00 H new ATOM 0 HD12 ILE A 53 20.563 17.496 22.902 1.00 0.00 H new ATOM 0 HD13 ILE A 53 21.860 16.604 22.071 1.00 0.00 H new ATOM 852 N LEU A 54 18.616 14.886 18.190 1.00 0.00 N ATOM 853 CA LEU A 54 17.580 14.077 17.564 1.00 0.00 C ATOM 854 C LEU A 54 18.089 12.651 17.332 1.00 0.00 C ATOM 855 O LEU A 54 17.382 11.687 17.617 1.00 0.00 O ATOM 856 CB LEU A 54 17.096 14.755 16.271 1.00 0.00 C ATOM 857 CG LEU A 54 15.860 14.087 15.639 1.00 0.00 C ATOM 858 CD1 LEU A 54 14.679 14.058 16.618 1.00 0.00 C ATOM 859 CD2 LEU A 54 15.456 14.846 14.373 1.00 0.00 C ATOM 0 H LEU A 54 18.783 15.775 17.718 1.00 0.00 H new ATOM 0 HA LEU A 54 16.719 14.000 18.228 1.00 0.00 H new ATOM 0 HB2 LEU A 54 16.863 15.798 16.485 1.00 0.00 H new ATOM 0 HB3 LEU A 54 17.909 14.752 15.545 1.00 0.00 H new ATOM 0 HG LEU A 54 16.121 13.059 15.389 1.00 0.00 H new ATOM 0 HD11 LEU A 54 13.823 13.580 16.141 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.959 13.496 17.509 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.415 15.077 16.900 1.00 0.00 H new ATOM 0 HD21 LEU A 54 14.581 14.372 13.928 1.00 0.00 H new ATOM 0 HD22 LEU A 54 15.218 15.879 14.628 1.00 0.00 H new ATOM 0 HD23 LEU A 54 16.280 14.829 13.660 1.00 0.00 H new ATOM 871 N GLU A 55 19.341 12.528 16.884 1.00 0.00 N ATOM 872 CA GLU A 55 20.048 11.273 16.705 1.00 0.00 C ATOM 873 C GLU A 55 19.923 10.360 17.925 1.00 0.00 C ATOM 874 O GLU A 55 19.563 9.193 17.776 1.00 0.00 O ATOM 875 CB GLU A 55 21.512 11.547 16.342 1.00 0.00 C ATOM 876 CG GLU A 55 22.255 10.281 15.897 1.00 0.00 C ATOM 877 CD GLU A 55 23.561 10.650 15.199 1.00 0.00 C ATOM 878 OE1 GLU A 55 23.462 11.160 14.059 1.00 0.00 O ATOM 879 OE2 GLU A 55 24.622 10.438 15.821 1.00 0.00 O ATOM 0 H GLU A 55 19.906 13.337 16.628 1.00 0.00 H new ATOM 0 HA GLU A 55 19.582 10.735 15.879 1.00 0.00 H new ATOM 0 HB2 GLU A 55 21.552 12.287 15.543 1.00 0.00 H new ATOM 0 HB3 GLU A 55 22.021 11.979 17.203 1.00 0.00 H new ATOM 0 HG2 GLU A 55 22.463 9.650 16.761 1.00 0.00 H new ATOM 0 HG3 GLU A 55 21.626 9.700 15.222 1.00 0.00 H new ATOM 886 N LYS A 56 20.211 10.861 19.130 1.00 0.00 N ATOM 887 CA LYS A 56 20.182 10.011 20.307 1.00 0.00 C ATOM 888 C LYS A 56 18.745 9.575 20.586 1.00 0.00 C ATOM 889 O LYS A 56 18.506 8.418 20.921 1.00 0.00 O ATOM 890 CB LYS A 56 20.826 10.733 21.495 1.00 0.00 C ATOM 891 CG LYS A 56 22.356 10.651 21.417 1.00 0.00 C ATOM 892 CD LYS A 56 22.987 11.292 22.659 1.00 0.00 C ATOM 893 CE LYS A 56 24.479 10.962 22.764 1.00 0.00 C ATOM 894 NZ LYS A 56 25.255 11.574 21.672 1.00 0.00 N ATOM 0 H LYS A 56 20.462 11.834 19.307 1.00 0.00 H new ATOM 0 HA LYS A 56 20.768 9.108 20.134 1.00 0.00 H new ATOM 0 HB2 LYS A 56 20.513 11.777 21.505 1.00 0.00 H new ATOM 0 HB3 LYS A 56 20.480 10.288 22.428 1.00 0.00 H new ATOM 0 HG2 LYS A 56 22.668 9.609 21.339 1.00 0.00 H new ATOM 0 HG3 LYS A 56 22.709 11.158 20.519 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.854 12.373 22.619 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.472 10.940 23.553 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.862 11.313 23.722 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.614 9.881 22.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.236 11.232 21.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 24.833 11.314 20.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.245 12.609 21.776 1.00 0.00 H new ATOM 908 N ALA A 57 17.785 10.488 20.417 1.00 0.00 N ATOM 909 CA ALA A 57 16.377 10.179 20.616 1.00 0.00 C ATOM 910 C ALA A 57 15.922 9.059 19.669 1.00 0.00 C ATOM 911 O ALA A 57 15.414 8.030 20.112 1.00 0.00 O ATOM 912 CB ALA A 57 15.541 11.452 20.453 1.00 0.00 C ATOM 0 H ALA A 57 17.965 11.453 20.141 1.00 0.00 H new ATOM 0 HA ALA A 57 16.229 9.808 21.630 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.487 11.217 20.603 1.00 0.00 H new ATOM 0 HB2 ALA A 57 15.856 12.191 21.190 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.684 11.855 19.450 1.00 0.00 H new ATOM 918 N VAL A 58 16.106 9.241 18.359 1.00 0.00 N ATOM 919 CA VAL A 58 15.654 8.253 17.382 1.00 0.00 C ATOM 920 C VAL A 58 16.407 6.930 17.553 1.00 0.00 C ATOM 921 O VAL A 58 15.795 5.859 17.544 1.00 0.00 O ATOM 922 CB VAL A 58 15.723 8.800 15.945 1.00 0.00 C ATOM 923 CG1 VAL A 58 14.888 10.079 15.814 1.00 0.00 C ATOM 924 CG2 VAL A 58 17.151 9.054 15.461 1.00 0.00 C ATOM 0 H VAL A 58 16.562 10.059 17.954 1.00 0.00 H new ATOM 0 HA VAL A 58 14.601 8.044 17.573 1.00 0.00 H new ATOM 0 HB VAL A 58 15.308 8.022 15.304 1.00 0.00 H new ATOM 0 HG11 VAL A 58 14.949 10.450 14.791 1.00 0.00 H new ATOM 0 HG12 VAL A 58 13.848 9.862 16.059 1.00 0.00 H new ATOM 0 HG13 VAL A 58 15.272 10.836 16.498 1.00 0.00 H new ATOM 0 HG21 VAL A 58 17.127 9.438 14.441 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.632 9.784 16.113 1.00 0.00 H new ATOM 0 HG23 VAL A 58 17.714 8.121 15.484 1.00 0.00 H new ATOM 934 N GLU A 59 17.731 6.993 17.740 1.00 0.00 N ATOM 935 CA GLU A 59 18.538 5.799 17.943 1.00 0.00 C ATOM 936 C GLU A 59 18.055 5.056 19.194 1.00 0.00 C ATOM 937 O GLU A 59 17.933 3.829 19.188 1.00 0.00 O ATOM 938 CB GLU A 59 20.023 6.176 18.015 1.00 0.00 C ATOM 939 CG GLU A 59 20.920 4.942 17.866 1.00 0.00 C ATOM 940 CD GLU A 59 22.397 5.306 17.992 1.00 0.00 C ATOM 941 OE1 GLU A 59 22.856 6.108 17.151 1.00 0.00 O ATOM 942 OE2 GLU A 59 23.039 4.771 18.922 1.00 0.00 O ATOM 0 H GLU A 59 18.261 7.864 17.754 1.00 0.00 H new ATOM 0 HA GLU A 59 18.423 5.120 17.098 1.00 0.00 H new ATOM 0 HB2 GLU A 59 20.256 6.895 17.229 1.00 0.00 H new ATOM 0 HB3 GLU A 59 20.230 6.666 18.966 1.00 0.00 H new ATOM 0 HG2 GLU A 59 20.659 4.207 18.627 1.00 0.00 H new ATOM 0 HG3 GLU A 59 20.741 4.475 16.898 1.00 0.00 H new ATOM 949 N TYR A 60 17.744 5.799 20.260 1.00 0.00 N ATOM 950 CA TYR A 60 17.139 5.221 21.443 1.00 0.00 C ATOM 951 C TYR A 60 15.797 4.575 21.122 1.00 0.00 C ATOM 952 O TYR A 60 15.543 3.471 21.586 1.00 0.00 O ATOM 953 CB TYR A 60 16.984 6.241 22.564 1.00 0.00 C ATOM 954 CG TYR A 60 16.421 5.613 23.820 1.00 0.00 C ATOM 955 CD1 TYR A 60 17.275 4.917 24.698 1.00 0.00 C ATOM 956 CD2 TYR A 60 15.028 5.573 24.017 1.00 0.00 C ATOM 957 CE1 TYR A 60 16.740 4.237 25.805 1.00 0.00 C ATOM 958 CE2 TYR A 60 14.494 4.867 25.107 1.00 0.00 C ATOM 959 CZ TYR A 60 15.349 4.211 26.002 1.00 0.00 C ATOM 960 OH TYR A 60 14.825 3.693 27.144 1.00 0.00 O ATOM 0 H TYR A 60 17.905 6.804 20.319 1.00 0.00 H new ATOM 0 HA TYR A 60 17.819 4.445 21.794 1.00 0.00 H new ATOM 0 HB2 TYR A 60 17.953 6.689 22.784 1.00 0.00 H new ATOM 0 HB3 TYR A 60 16.328 7.047 22.235 1.00 0.00 H new ATOM 0 HD1 TYR A 60 18.340 4.906 24.520 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.370 6.085 23.330 1.00 0.00 H new ATOM 0 HE1 TYR A 60 17.396 3.736 26.502 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.425 4.830 25.255 1.00 0.00 H new ATOM 0 HH TYR A 60 15.521 3.647 27.832 1.00 0.00 H new ATOM 970 N LEU A 61 14.922 5.232 20.357 1.00 0.00 N ATOM 971 CA LEU A 61 13.642 4.616 20.015 1.00 0.00 C ATOM 972 C LEU A 61 13.882 3.275 19.309 1.00 0.00 C ATOM 973 O LEU A 61 13.248 2.271 19.638 1.00 0.00 O ATOM 974 CB LEU A 61 12.764 5.584 19.211 1.00 0.00 C ATOM 975 CG LEU A 61 11.263 5.251 19.301 1.00 0.00 C ATOM 976 CD1 LEU A 61 10.728 5.323 20.741 1.00 0.00 C ATOM 977 CD2 LEU A 61 10.484 6.258 18.453 1.00 0.00 C ATOM 0 H LEU A 61 15.071 6.165 19.972 1.00 0.00 H new ATOM 0 HA LEU A 61 13.083 4.399 20.925 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.928 6.599 19.572 1.00 0.00 H new ATOM 0 HB3 LEU A 61 13.073 5.564 18.166 1.00 0.00 H new ATOM 0 HG LEU A 61 11.133 4.230 18.942 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.666 5.080 20.747 1.00 0.00 H new ATOM 0 HD12 LEU A 61 11.267 4.611 21.365 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.872 6.330 21.133 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.419 6.033 18.508 1.00 0.00 H new ATOM 0 HD22 LEU A 61 10.662 7.265 18.829 1.00 0.00 H new ATOM 0 HD23 LEU A 61 10.815 6.194 17.416 1.00 0.00 H new ATOM 989 N ASN A 62 14.858 3.233 18.393 1.00 0.00 N ATOM 990 CA ASN A 62 15.336 1.976 17.818 1.00 0.00 C ATOM 991 C ASN A 62 15.726 0.991 18.934 1.00 0.00 C ATOM 992 O ASN A 62 15.278 -0.155 18.943 1.00 0.00 O ATOM 993 CB ASN A 62 16.476 2.241 16.815 1.00 0.00 C ATOM 994 CG ASN A 62 17.618 1.228 16.907 1.00 0.00 C ATOM 995 OD1 ASN A 62 17.593 0.192 16.256 1.00 0.00 O ATOM 996 ND2 ASN A 62 18.628 1.523 17.720 1.00 0.00 N ATOM 0 H ASN A 62 15.332 4.062 18.035 1.00 0.00 H new ATOM 0 HA ASN A 62 14.532 1.504 17.254 1.00 0.00 H new ATOM 0 HB2 ASN A 62 16.070 2.228 15.804 1.00 0.00 H new ATOM 0 HB3 ASN A 62 16.874 3.241 16.985 1.00 0.00 H new ATOM 0 HD21 ASN A 62 19.412 0.877 17.815 1.00 0.00 H new ATOM 0 HD22 ASN A 62 18.619 2.395 18.249 1.00 0.00 H new ATOM 1003 N TYR A 63 16.530 1.428 19.905 1.00 0.00 N ATOM 1004 CA TYR A 63 16.883 0.576 21.034 1.00 0.00 C ATOM 1005 C TYR A 63 15.662 0.175 21.868 1.00 0.00 C ATOM 1006 O TYR A 63 15.672 -0.894 22.464 1.00 0.00 O ATOM 1007 CB TYR A 63 17.965 1.211 21.914 1.00 0.00 C ATOM 1008 CG TYR A 63 19.322 1.410 21.261 1.00 0.00 C ATOM 1009 CD1 TYR A 63 19.912 0.385 20.495 1.00 0.00 C ATOM 1010 CD2 TYR A 63 20.044 2.594 21.499 1.00 0.00 C ATOM 1011 CE1 TYR A 63 21.132 0.613 19.835 1.00 0.00 C ATOM 1012 CE2 TYR A 63 21.261 2.822 20.839 1.00 0.00 C ATOM 1013 CZ TYR A 63 21.780 1.849 19.968 1.00 0.00 C ATOM 1014 OH TYR A 63 22.925 2.091 19.274 1.00 0.00 O ATOM 0 H TYR A 63 16.944 2.360 19.930 1.00 0.00 H new ATOM 0 HA TYR A 63 17.296 -0.338 20.607 1.00 0.00 H new ATOM 0 HB2 TYR A 63 17.603 2.180 22.257 1.00 0.00 H new ATOM 0 HB3 TYR A 63 18.097 0.588 22.799 1.00 0.00 H new ATOM 0 HD1 TYR A 63 19.427 -0.576 20.415 1.00 0.00 H new ATOM 0 HD2 TYR A 63 19.661 3.329 22.191 1.00 0.00 H new ATOM 0 HE1 TYR A 63 21.570 -0.164 19.226 1.00 0.00 H new ATOM 0 HE2 TYR A 63 21.799 3.745 21.000 1.00 0.00 H new ATOM 0 HH TYR A 63 23.082 3.057 19.228 1.00 0.00 H new ATOM 1024 N ASN A 64 14.604 0.983 21.924 1.00 0.00 N ATOM 1025 CA ASN A 64 13.381 0.621 22.630 1.00 0.00 C ATOM 1026 C ASN A 64 12.641 -0.475 21.859 1.00 0.00 C ATOM 1027 O ASN A 64 12.058 -1.381 22.461 1.00 0.00 O ATOM 1028 CB ASN A 64 12.492 1.851 22.852 1.00 0.00 C ATOM 1029 CG ASN A 64 11.542 1.675 24.038 1.00 0.00 C ATOM 1030 OD1 ASN A 64 11.434 2.565 24.873 1.00 0.00 O ATOM 1031 ND2 ASN A 64 10.853 0.541 24.153 1.00 0.00 N ATOM 0 H ASN A 64 14.573 1.902 21.483 1.00 0.00 H new ATOM 0 HA ASN A 64 13.642 0.231 23.614 1.00 0.00 H new ATOM 0 HB2 ASN A 64 13.121 2.725 23.020 1.00 0.00 H new ATOM 0 HB3 ASN A 64 11.911 2.044 21.950 1.00 0.00 H new ATOM 0 HD21 ASN A 64 10.225 0.404 24.945 1.00 0.00 H new ATOM 0 HD22 ASN A 64 10.954 -0.191 23.449 1.00 0.00 H new ATOM 1038 N LEU A 65 12.657 -0.404 20.525 1.00 0.00 N ATOM 1039 CA LEU A 65 12.167 -1.500 19.700 1.00 0.00 C ATOM 1040 C LEU A 65 12.984 -2.757 20.009 1.00 0.00 C ATOM 1041 O LEU A 65 12.409 -3.809 20.281 1.00 0.00 O ATOM 1042 CB LEU A 65 12.180 -1.119 18.211 1.00 0.00 C ATOM 1043 CG LEU A 65 11.718 -2.246 17.272 1.00 0.00 C ATOM 1044 CD1 LEU A 65 10.287 -2.709 17.571 1.00 0.00 C ATOM 1045 CD2 LEU A 65 11.796 -1.752 15.822 1.00 0.00 C ATOM 0 H LEU A 65 13.003 0.399 20.000 1.00 0.00 H new ATOM 0 HA LEU A 65 11.125 -1.712 19.938 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.538 -0.251 18.063 1.00 0.00 H new ATOM 0 HB3 LEU A 65 13.190 -0.819 17.932 1.00 0.00 H new ATOM 0 HG LEU A 65 12.377 -3.099 17.430 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.010 -3.505 16.880 1.00 0.00 H new ATOM 0 HD12 LEU A 65 10.231 -3.081 18.594 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.601 -1.870 17.452 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.470 -2.545 15.149 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.150 -0.883 15.698 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.824 -1.476 15.586 1.00 0.00 H new ATOM 1057 N LYS A 66 14.316 -2.651 20.036 1.00 0.00 N ATOM 1058 CA LYS A 66 15.170 -3.766 20.432 1.00 0.00 C ATOM 1059 C LYS A 66 14.805 -4.278 21.825 1.00 0.00 C ATOM 1060 O LYS A 66 14.666 -5.478 22.006 1.00 0.00 O ATOM 1061 CB LYS A 66 16.653 -3.383 20.329 1.00 0.00 C ATOM 1062 CG LYS A 66 17.604 -4.557 20.611 1.00 0.00 C ATOM 1063 CD LYS A 66 17.424 -5.768 19.678 1.00 0.00 C ATOM 1064 CE LYS A 66 17.574 -5.417 18.190 1.00 0.00 C ATOM 1065 NZ LYS A 66 18.880 -4.801 17.896 1.00 0.00 N ATOM 0 H LYS A 66 14.823 -1.802 19.787 1.00 0.00 H new ATOM 0 HA LYS A 66 14.998 -4.588 19.738 1.00 0.00 H new ATOM 0 HB2 LYS A 66 16.852 -2.994 19.330 1.00 0.00 H new ATOM 0 HB3 LYS A 66 16.863 -2.577 21.032 1.00 0.00 H new ATOM 0 HG2 LYS A 66 18.631 -4.202 20.530 1.00 0.00 H new ATOM 0 HG3 LYS A 66 17.460 -4.884 21.641 1.00 0.00 H new ATOM 0 HD2 LYS A 66 18.157 -6.531 19.940 1.00 0.00 H new ATOM 0 HD3 LYS A 66 16.438 -6.202 19.844 1.00 0.00 H new ATOM 0 HE2 LYS A 66 17.456 -6.320 17.591 1.00 0.00 H new ATOM 0 HE3 LYS A 66 16.777 -4.734 17.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 18.959 -4.627 16.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 18.962 -3.900 18.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 19.642 -5.441 18.198 1.00 0.00 H new ATOM 1079 N TYR A 67 14.619 -3.396 22.806 1.00 0.00 N ATOM 1080 CA TYR A 67 14.217 -3.774 24.156 1.00 0.00 C ATOM 1081 C TYR A 67 12.911 -4.573 24.137 1.00 0.00 C ATOM 1082 O TYR A 67 12.700 -5.431 24.989 1.00 0.00 O ATOM 1083 CB TYR A 67 14.096 -2.524 25.037 1.00 0.00 C ATOM 1084 CG TYR A 67 13.809 -2.811 26.499 1.00 0.00 C ATOM 1085 CD1 TYR A 67 14.766 -3.479 27.285 1.00 0.00 C ATOM 1086 CD2 TYR A 67 12.591 -2.407 27.077 1.00 0.00 C ATOM 1087 CE1 TYR A 67 14.519 -3.725 28.646 1.00 0.00 C ATOM 1088 CE2 TYR A 67 12.344 -2.651 28.440 1.00 0.00 C ATOM 1089 CZ TYR A 67 13.307 -3.309 29.224 1.00 0.00 C ATOM 1090 OH TYR A 67 13.059 -3.544 30.544 1.00 0.00 O ATOM 0 H TYR A 67 14.745 -2.391 22.683 1.00 0.00 H new ATOM 0 HA TYR A 67 14.985 -4.420 24.582 1.00 0.00 H new ATOM 0 HB2 TYR A 67 15.022 -1.954 24.967 1.00 0.00 H new ATOM 0 HB3 TYR A 67 13.302 -1.891 24.641 1.00 0.00 H new ATOM 0 HD1 TYR A 67 15.695 -3.804 26.840 1.00 0.00 H new ATOM 0 HD2 TYR A 67 11.846 -1.910 26.474 1.00 0.00 H new ATOM 0 HE1 TYR A 67 15.259 -4.233 29.247 1.00 0.00 H new ATOM 0 HE2 TYR A 67 11.413 -2.332 28.885 1.00 0.00 H new ATOM 0 HH TYR A 67 12.176 -3.190 30.779 1.00 0.00 H new ATOM 1100 N SER A 68 12.044 -4.304 23.158 1.00 0.00 N ATOM 1101 CA SER A 68 10.860 -5.112 22.928 1.00 0.00 C ATOM 1102 C SER A 68 11.277 -6.457 22.311 1.00 0.00 C ATOM 1103 O SER A 68 11.160 -7.500 22.950 1.00 0.00 O ATOM 1104 CB SER A 68 9.850 -4.330 22.077 1.00 0.00 C ATOM 1105 OG SER A 68 9.722 -3.002 22.560 1.00 0.00 O ATOM 0 H SER A 68 12.148 -3.523 22.510 1.00 0.00 H new ATOM 0 HA SER A 68 10.355 -5.337 23.867 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.175 -4.316 21.037 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.881 -4.828 22.102 1.00 0.00 H new ATOM 0 HG SER A 68 10.529 -2.493 22.335 1.00 0.00 H new ATOM 1111 N GLY A 69 11.814 -6.452 21.086 1.00 0.00 N ATOM 1112 CA GLY A 69 12.257 -7.663 20.399 1.00 0.00 C ATOM 1113 C GLY A 69 13.656 -8.084 20.853 1.00 0.00 C ATOM 1114 O GLY A 69 14.524 -8.378 20.029 1.00 0.00 O ATOM 0 H GLY A 69 11.953 -5.600 20.543 1.00 0.00 H new ATOM 0 HA2 GLY A 69 11.552 -8.471 20.593 1.00 0.00 H new ATOM 0 HA3 GLY A 69 12.258 -7.492 19.322 1.00 0.00 H new ATOM 1118 N VAL A 70 13.875 -8.149 22.167 1.00 0.00 N ATOM 1119 CA VAL A 70 15.212 -8.310 22.734 1.00 0.00 C ATOM 1120 C VAL A 70 15.835 -9.666 22.402 1.00 0.00 C ATOM 1121 O VAL A 70 17.056 -9.808 22.412 1.00 0.00 O ATOM 1122 CB VAL A 70 15.185 -7.950 24.224 1.00 0.00 C ATOM 1123 CG1 VAL A 70 14.403 -8.975 25.054 1.00 0.00 C ATOM 1124 CG2 VAL A 70 16.598 -7.777 24.792 1.00 0.00 C ATOM 0 H VAL A 70 13.133 -8.092 22.865 1.00 0.00 H new ATOM 0 HA VAL A 70 15.894 -7.606 22.258 1.00 0.00 H new ATOM 0 HB VAL A 70 14.666 -6.994 24.297 1.00 0.00 H new ATOM 0 HG11 VAL A 70 14.412 -8.677 26.102 1.00 0.00 H new ATOM 0 HG12 VAL A 70 13.374 -9.022 24.699 1.00 0.00 H new ATOM 0 HG13 VAL A 70 14.867 -9.956 24.952 1.00 0.00 H new ATOM 0 HG21 VAL A 70 16.536 -7.522 25.850 1.00 0.00 H new ATOM 0 HG22 VAL A 70 17.154 -8.707 24.674 1.00 0.00 H new ATOM 0 HG23 VAL A 70 17.110 -6.978 24.256 1.00 0.00 H new ATOM 1244 N GLU A 79 22.817 2.008 26.482 1.00 0.00 N ATOM 1245 CA GLU A 79 22.248 3.201 27.095 1.00 0.00 C ATOM 1246 C GLU A 79 23.338 4.279 27.190 1.00 0.00 C ATOM 1247 O GLU A 79 23.917 4.513 28.247 1.00 0.00 O ATOM 1248 CB GLU A 79 21.638 2.849 28.458 1.00 0.00 C ATOM 1249 CG GLU A 79 20.625 1.705 28.317 1.00 0.00 C ATOM 1250 CD GLU A 79 19.820 1.517 29.599 1.00 0.00 C ATOM 1251 OE1 GLU A 79 20.348 0.846 30.510 1.00 0.00 O ATOM 1252 OE2 GLU A 79 18.694 2.064 29.649 1.00 0.00 O ATOM 0 HA GLU A 79 21.438 3.600 26.485 1.00 0.00 H new ATOM 0 HB2 GLU A 79 22.427 2.560 29.152 1.00 0.00 H new ATOM 0 HB3 GLU A 79 21.148 3.726 28.881 1.00 0.00 H new ATOM 0 HG2 GLU A 79 19.949 1.915 27.488 1.00 0.00 H new ATOM 0 HG3 GLU A 79 21.149 0.780 28.075 1.00 0.00 H new ATOM 1259 N PHE A 80 23.639 4.874 26.036 1.00 0.00 N ATOM 1260 CA PHE A 80 24.751 5.774 25.774 1.00 0.00 C ATOM 1261 C PHE A 80 24.886 6.902 26.798 1.00 0.00 C ATOM 1262 O PHE A 80 23.897 7.383 27.350 1.00 0.00 O ATOM 1263 CB PHE A 80 24.583 6.356 24.360 1.00 0.00 C ATOM 1264 CG PHE A 80 23.185 6.875 24.052 1.00 0.00 C ATOM 1265 CD1 PHE A 80 22.743 8.090 24.608 1.00 0.00 C ATOM 1266 CD2 PHE A 80 22.293 6.098 23.288 1.00 0.00 C ATOM 1267 CE1 PHE A 80 21.410 8.498 24.450 1.00 0.00 C ATOM 1268 CE2 PHE A 80 20.978 6.546 23.067 1.00 0.00 C ATOM 1269 CZ PHE A 80 20.533 7.740 23.659 1.00 0.00 C ATOM 0 H PHE A 80 23.069 4.726 25.203 1.00 0.00 H new ATOM 0 HA PHE A 80 25.670 5.193 25.855 1.00 0.00 H new ATOM 0 HB2 PHE A 80 25.296 7.170 24.229 1.00 0.00 H new ATOM 0 HB3 PHE A 80 24.840 5.587 23.632 1.00 0.00 H new ATOM 0 HD1 PHE A 80 23.433 8.711 25.159 1.00 0.00 H new ATOM 0 HD2 PHE A 80 22.619 5.157 22.871 1.00 0.00 H new ATOM 0 HE1 PHE A 80 21.059 9.396 24.937 1.00 0.00 H new ATOM 0 HE2 PHE A 80 20.310 5.972 22.442 1.00 0.00 H new ATOM 0 HZ PHE A 80 19.517 8.074 23.506 1.00 0.00 H new ATOM 1279 N GLU A 81 26.122 7.367 27.004 1.00 0.00 N ATOM 1280 CA GLU A 81 26.365 8.576 27.771 1.00 0.00 C ATOM 1281 C GLU A 81 25.702 9.752 27.063 1.00 0.00 C ATOM 1282 O GLU A 81 25.549 9.736 25.842 1.00 0.00 O ATOM 1283 CB GLU A 81 27.866 8.867 27.863 1.00 0.00 C ATOM 1284 CG GLU A 81 28.636 7.789 28.634 1.00 0.00 C ATOM 1285 CD GLU A 81 28.181 7.684 30.086 1.00 0.00 C ATOM 1286 OE1 GLU A 81 28.284 8.714 30.787 1.00 0.00 O ATOM 1287 OE2 GLU A 81 27.723 6.583 30.463 1.00 0.00 O ATOM 0 H GLU A 81 26.966 6.919 26.647 1.00 0.00 H new ATOM 0 HA GLU A 81 25.959 8.437 28.773 1.00 0.00 H new ATOM 0 HB2 GLU A 81 28.277 8.951 26.857 1.00 0.00 H new ATOM 0 HB3 GLU A 81 28.015 9.831 28.349 1.00 0.00 H new ATOM 0 HG2 GLU A 81 28.500 6.826 28.142 1.00 0.00 H new ATOM 0 HG3 GLU A 81 29.702 8.015 28.604 1.00 0.00 H new ATOM 1294 N ILE A 82 25.359 10.785 27.832 1.00 0.00 N ATOM 1295 CA ILE A 82 24.742 11.995 27.321 1.00 0.00 C ATOM 1296 C ILE A 82 25.700 13.160 27.610 1.00 0.00 C ATOM 1297 O ILE A 82 25.788 13.568 28.767 1.00 0.00 O ATOM 1298 CB ILE A 82 23.356 12.170 27.979 1.00 0.00 C ATOM 1299 CG1 ILE A 82 22.448 10.958 27.674 1.00 0.00 C ATOM 1300 CG2 ILE A 82 22.696 13.459 27.474 1.00 0.00 C ATOM 1301 CD1 ILE A 82 21.140 10.962 28.474 1.00 0.00 C ATOM 0 H ILE A 82 25.507 10.799 28.841 1.00 0.00 H new ATOM 0 HA ILE A 82 24.573 11.953 26.245 1.00 0.00 H new ATOM 0 HB ILE A 82 23.493 12.235 29.058 1.00 0.00 H new ATOM 0 HG12 ILE A 82 22.214 10.947 26.609 1.00 0.00 H new ATOM 0 HG13 ILE A 82 22.995 10.040 27.890 1.00 0.00 H new ATOM 0 HG21 ILE A 82 21.719 13.575 27.943 1.00 0.00 H new ATOM 0 HG22 ILE A 82 23.324 14.313 27.728 1.00 0.00 H new ATOM 0 HG23 ILE A 82 22.575 13.406 26.392 1.00 0.00 H new ATOM 0 HD11 ILE A 82 20.550 10.084 28.211 1.00 0.00 H new ATOM 0 HD12 ILE A 82 21.366 10.942 29.540 1.00 0.00 H new ATOM 0 HD13 ILE A 82 20.573 11.863 28.240 1.00 0.00 H new ATOM 1313 N PRO A 83 26.447 13.668 26.607 1.00 0.00 N ATOM 1314 CA PRO A 83 27.413 14.751 26.759 1.00 0.00 C ATOM 1315 C PRO A 83 26.863 16.069 27.325 1.00 0.00 C ATOM 1316 O PRO A 83 26.692 17.053 26.606 1.00 0.00 O ATOM 1317 CB PRO A 83 28.153 14.893 25.422 1.00 0.00 C ATOM 1318 CG PRO A 83 27.990 13.513 24.791 1.00 0.00 C ATOM 1319 CD PRO A 83 26.641 13.023 25.320 1.00 0.00 C ATOM 0 HA PRO A 83 28.113 14.480 27.549 1.00 0.00 H new ATOM 0 HB2 PRO A 83 27.717 15.675 24.800 1.00 0.00 H new ATOM 0 HB3 PRO A 83 29.203 15.149 25.567 1.00 0.00 H new ATOM 0 HG2 PRO A 83 27.996 13.568 23.702 1.00 0.00 H new ATOM 0 HG3 PRO A 83 28.800 12.843 25.081 1.00 0.00 H new ATOM 0 HD2 PRO A 83 25.837 13.281 24.631 1.00 0.00 H new ATOM 0 HD3 PRO A 83 26.636 11.938 25.424 1.00 0.00 H new ATOM 1327 N THR A 84 26.630 16.082 28.639 1.00 0.00 N ATOM 1328 CA THR A 84 26.318 17.237 29.466 1.00 0.00 C ATOM 1329 C THR A 84 25.218 18.108 28.847 1.00 0.00 C ATOM 1330 O THR A 84 24.037 17.850 29.079 1.00 0.00 O ATOM 1331 CB THR A 84 27.629 17.974 29.800 1.00 0.00 C ATOM 1332 OG1 THR A 84 28.584 17.042 30.269 1.00 0.00 O ATOM 1333 CG2 THR A 84 27.434 19.039 30.880 1.00 0.00 C ATOM 0 H THR A 84 26.658 15.222 29.187 1.00 0.00 H new ATOM 0 HA THR A 84 25.881 16.921 30.413 1.00 0.00 H new ATOM 0 HB THR A 84 27.966 18.464 28.887 1.00 0.00 H new ATOM 0 HG1 THR A 84 29.420 17.508 30.481 1.00 0.00 H new ATOM 0 HG21 THR A 84 28.385 19.531 31.082 1.00 0.00 H new ATOM 0 HG22 THR A 84 26.709 19.777 30.537 1.00 0.00 H new ATOM 0 HG23 THR A 84 27.068 18.569 31.793 1.00 0.00 H new ATOM 1341 N GLU A 85 25.594 19.109 28.041 1.00 0.00 N ATOM 1342 CA GLU A 85 24.678 19.975 27.313 1.00 0.00 C ATOM 1343 C GLU A 85 23.591 19.144 26.637 1.00 0.00 C ATOM 1344 O GLU A 85 22.421 19.520 26.686 1.00 0.00 O ATOM 1345 CB GLU A 85 25.476 20.809 26.294 1.00 0.00 C ATOM 1346 CG GLU A 85 24.639 21.878 25.566 1.00 0.00 C ATOM 1347 CD GLU A 85 23.666 21.317 24.527 1.00 0.00 C ATOM 1348 OE1 GLU A 85 24.079 20.392 23.795 1.00 0.00 O ATOM 1349 OE2 GLU A 85 22.525 21.827 24.483 1.00 0.00 O ATOM 0 H GLU A 85 26.574 19.340 27.877 1.00 0.00 H new ATOM 0 HA GLU A 85 24.181 20.657 28.003 1.00 0.00 H new ATOM 0 HB2 GLU A 85 26.303 21.298 26.809 1.00 0.00 H new ATOM 0 HB3 GLU A 85 25.913 20.139 25.554 1.00 0.00 H new ATOM 0 HG2 GLU A 85 24.075 22.446 26.305 1.00 0.00 H new ATOM 0 HG3 GLU A 85 25.314 22.578 25.074 1.00 0.00 H new ATOM 1356 N MET A 86 23.973 18.013 26.026 1.00 0.00 N ATOM 1357 CA MET A 86 23.032 17.207 25.261 1.00 0.00 C ATOM 1358 C MET A 86 21.764 16.908 26.063 1.00 0.00 C ATOM 1359 O MET A 86 20.675 16.924 25.498 1.00 0.00 O ATOM 1360 CB MET A 86 23.667 15.920 24.710 1.00 0.00 C ATOM 1361 CG MET A 86 24.883 16.215 23.822 1.00 0.00 C ATOM 1362 SD MET A 86 25.347 14.988 22.559 1.00 0.00 S ATOM 1363 CE MET A 86 23.943 14.989 21.421 1.00 0.00 C ATOM 0 H MET A 86 24.923 17.644 26.051 1.00 0.00 H new ATOM 0 HA MET A 86 22.744 17.806 24.397 1.00 0.00 H new ATOM 0 HB2 MET A 86 23.970 15.281 25.540 1.00 0.00 H new ATOM 0 HB3 MET A 86 22.924 15.366 24.136 1.00 0.00 H new ATOM 0 HG2 MET A 86 24.702 17.163 23.314 1.00 0.00 H new ATOM 0 HG3 MET A 86 25.744 16.362 24.475 1.00 0.00 H new ATOM 0 HE1 MET A 86 24.149 14.316 20.589 1.00 0.00 H new ATOM 0 HE2 MET A 86 23.049 14.654 21.946 1.00 0.00 H new ATOM 0 HE3 MET A 86 23.784 15.998 21.041 1.00 0.00 H new ATOM 1373 N SER A 87 21.885 16.680 27.376 1.00 0.00 N ATOM 1374 CA SER A 87 20.727 16.366 28.201 1.00 0.00 C ATOM 1375 C SER A 87 19.638 17.435 28.079 1.00 0.00 C ATOM 1376 O SER A 87 18.456 17.103 27.995 1.00 0.00 O ATOM 1377 CB SER A 87 21.151 16.123 29.655 1.00 0.00 C ATOM 1378 OG SER A 87 21.622 17.305 30.274 1.00 0.00 O ATOM 0 H SER A 87 22.770 16.708 27.882 1.00 0.00 H new ATOM 0 HA SER A 87 20.286 15.440 27.832 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.305 15.731 30.219 1.00 0.00 H new ATOM 0 HB3 SER A 87 21.932 15.363 29.683 1.00 0.00 H new ATOM 0 HG SER A 87 22.439 17.606 29.825 1.00 0.00 H new ATOM 1384 N LEU A 88 20.029 18.712 28.034 1.00 0.00 N ATOM 1385 CA LEU A 88 19.098 19.830 28.068 1.00 0.00 C ATOM 1386 C LEU A 88 18.055 19.683 26.961 1.00 0.00 C ATOM 1387 O LEU A 88 16.855 19.647 27.233 1.00 0.00 O ATOM 1388 CB LEU A 88 19.854 21.162 27.948 1.00 0.00 C ATOM 1389 CG LEU A 88 20.907 21.391 29.049 1.00 0.00 C ATOM 1390 CD1 LEU A 88 21.635 22.711 28.775 1.00 0.00 C ATOM 1391 CD2 LEU A 88 20.282 21.437 30.448 1.00 0.00 C ATOM 0 H LEU A 88 21.007 18.995 27.973 1.00 0.00 H new ATOM 0 HA LEU A 88 18.577 19.827 29.026 1.00 0.00 H new ATOM 0 HB2 LEU A 88 20.346 21.201 26.976 1.00 0.00 H new ATOM 0 HB3 LEU A 88 19.134 21.980 27.974 1.00 0.00 H new ATOM 0 HG LEU A 88 21.603 20.552 29.027 1.00 0.00 H new ATOM 0 HD11 LEU A 88 22.383 22.882 29.550 1.00 0.00 H new ATOM 0 HD12 LEU A 88 22.125 22.661 27.802 1.00 0.00 H new ATOM 0 HD13 LEU A 88 20.916 23.530 28.778 1.00 0.00 H new ATOM 0 HD21 LEU A 88 21.063 21.600 31.190 1.00 0.00 H new ATOM 0 HD22 LEU A 88 19.559 22.251 30.497 1.00 0.00 H new ATOM 0 HD23 LEU A 88 19.779 20.492 30.653 1.00 0.00 H new ATOM 1403 N GLU A 89 18.505 19.581 25.709 1.00 0.00 N ATOM 1404 CA GLU A 89 17.593 19.444 24.585 1.00 0.00 C ATOM 1405 C GLU A 89 17.122 17.993 24.446 1.00 0.00 C ATOM 1406 O GLU A 89 15.964 17.754 24.105 1.00 0.00 O ATOM 1407 CB GLU A 89 18.229 19.994 23.305 1.00 0.00 C ATOM 1408 CG GLU A 89 17.159 20.137 22.214 1.00 0.00 C ATOM 1409 CD GLU A 89 17.754 20.589 20.885 1.00 0.00 C ATOM 1410 OE1 GLU A 89 18.078 21.791 20.781 1.00 0.00 O ATOM 1411 OE2 GLU A 89 17.878 19.723 19.992 1.00 0.00 O ATOM 0 H GLU A 89 19.493 19.591 25.454 1.00 0.00 H new ATOM 0 HA GLU A 89 16.702 20.043 24.771 1.00 0.00 H new ATOM 0 HB2 GLU A 89 18.691 20.961 23.504 1.00 0.00 H new ATOM 0 HB3 GLU A 89 19.021 19.327 22.965 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.651 19.182 22.078 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.406 20.856 22.537 1.00 0.00 H new ATOM 1418 N LEU A 90 17.989 17.009 24.715 1.00 0.00 N ATOM 1419 CA LEU A 90 17.603 15.606 24.593 1.00 0.00 C ATOM 1420 C LEU A 90 16.421 15.284 25.507 1.00 0.00 C ATOM 1421 O LEU A 90 15.629 14.408 25.184 1.00 0.00 O ATOM 1422 CB LEU A 90 18.800 14.671 24.837 1.00 0.00 C ATOM 1423 CG LEU A 90 18.592 13.220 24.360 1.00 0.00 C ATOM 1424 CD1 LEU A 90 18.506 13.129 22.835 1.00 0.00 C ATOM 1425 CD2 LEU A 90 19.778 12.376 24.839 1.00 0.00 C ATOM 0 H LEU A 90 18.952 17.160 25.015 1.00 0.00 H new ATOM 0 HA LEU A 90 17.275 15.432 23.568 1.00 0.00 H new ATOM 0 HB2 LEU A 90 19.674 15.083 24.333 1.00 0.00 H new ATOM 0 HB3 LEU A 90 19.023 14.660 25.904 1.00 0.00 H new ATOM 0 HG LEU A 90 17.652 12.855 24.773 1.00 0.00 H new ATOM 0 HD11 LEU A 90 18.359 12.090 22.540 1.00 0.00 H new ATOM 0 HD12 LEU A 90 17.667 13.728 22.481 1.00 0.00 H new ATOM 0 HD13 LEU A 90 19.430 13.504 22.395 1.00 0.00 H new ATOM 0 HD21 LEU A 90 19.647 11.345 24.510 1.00 0.00 H new ATOM 0 HD22 LEU A 90 20.702 12.776 24.421 1.00 0.00 H new ATOM 0 HD23 LEU A 90 19.830 12.406 25.927 1.00 0.00 H new ATOM 1437 N LEU A 91 16.271 15.997 26.627 1.00 0.00 N ATOM 1438 CA LEU A 91 15.087 15.879 27.470 1.00 0.00 C ATOM 1439 C LEU A 91 13.843 16.297 26.679 1.00 0.00 C ATOM 1440 O LEU A 91 12.848 15.573 26.651 1.00 0.00 O ATOM 1441 CB LEU A 91 15.289 16.706 28.750 1.00 0.00 C ATOM 1442 CG LEU A 91 14.202 16.575 29.834 1.00 0.00 C ATOM 1443 CD1 LEU A 91 12.969 17.447 29.566 1.00 0.00 C ATOM 1444 CD2 LEU A 91 13.783 15.123 30.090 1.00 0.00 C ATOM 0 H LEU A 91 16.962 16.665 26.969 1.00 0.00 H new ATOM 0 HA LEU A 91 14.934 14.843 27.774 1.00 0.00 H new ATOM 0 HB2 LEU A 91 16.245 16.424 29.191 1.00 0.00 H new ATOM 0 HB3 LEU A 91 15.365 17.756 28.469 1.00 0.00 H new ATOM 0 HG LEU A 91 14.676 16.950 30.741 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.243 17.307 30.367 1.00 0.00 H new ATOM 0 HD12 LEU A 91 13.266 18.495 29.525 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.520 17.160 28.615 1.00 0.00 H new ATOM 0 HD21 LEU A 91 13.015 15.097 30.863 1.00 0.00 H new ATOM 0 HD22 LEU A 91 13.387 14.691 29.171 1.00 0.00 H new ATOM 0 HD23 LEU A 91 14.648 14.547 30.418 1.00 0.00 H new ATOM 1456 N LEU A 92 13.899 17.454 26.011 1.00 0.00 N ATOM 1457 CA LEU A 92 12.791 17.945 25.200 1.00 0.00 C ATOM 1458 C LEU A 92 12.473 16.943 24.090 1.00 0.00 C ATOM 1459 O LEU A 92 11.317 16.579 23.892 1.00 0.00 O ATOM 1460 CB LEU A 92 13.103 19.332 24.612 1.00 0.00 C ATOM 1461 CG LEU A 92 13.505 20.385 25.659 1.00 0.00 C ATOM 1462 CD1 LEU A 92 13.819 21.704 24.944 1.00 0.00 C ATOM 1463 CD2 LEU A 92 12.399 20.621 26.693 1.00 0.00 C ATOM 0 H LEU A 92 14.712 18.070 26.020 1.00 0.00 H new ATOM 0 HA LEU A 92 11.915 18.050 25.841 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.909 19.233 23.885 1.00 0.00 H new ATOM 0 HB3 LEU A 92 12.227 19.690 24.071 1.00 0.00 H new ATOM 0 HG LEU A 92 14.381 20.013 26.191 1.00 0.00 H new ATOM 0 HD11 LEU A 92 14.105 22.457 25.678 1.00 0.00 H new ATOM 0 HD12 LEU A 92 14.639 21.551 24.243 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.936 22.043 24.402 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.727 21.372 27.412 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.498 20.971 26.189 1.00 0.00 H new ATOM 0 HD23 LEU A 92 12.184 19.689 27.215 1.00 0.00 H new ATOM 1475 N ALA A 93 13.503 16.469 23.382 1.00 0.00 N ATOM 1476 CA ALA A 93 13.335 15.439 22.363 1.00 0.00 C ATOM 1477 C ALA A 93 12.661 14.198 22.955 1.00 0.00 C ATOM 1478 O ALA A 93 11.657 13.721 22.430 1.00 0.00 O ATOM 1479 CB ALA A 93 14.685 15.102 21.728 1.00 0.00 C ATOM 0 H ALA A 93 14.465 16.787 23.500 1.00 0.00 H new ATOM 0 HA ALA A 93 12.682 15.819 21.578 1.00 0.00 H new ATOM 0 HB1 ALA A 93 14.548 14.332 20.969 1.00 0.00 H new ATOM 0 HB2 ALA A 93 15.103 15.996 21.266 1.00 0.00 H new ATOM 0 HB3 ALA A 93 15.367 14.737 22.496 1.00 0.00 H new ATOM 1485 N ALA A 94 13.193 13.687 24.067 1.00 0.00 N ATOM 1486 CA ALA A 94 12.657 12.524 24.756 1.00 0.00 C ATOM 1487 C ALA A 94 11.185 12.729 25.111 1.00 0.00 C ATOM 1488 O ALA A 94 10.386 11.822 24.913 1.00 0.00 O ATOM 1489 CB ALA A 94 13.491 12.204 25.999 1.00 0.00 C ATOM 0 H ALA A 94 14.020 14.079 24.516 1.00 0.00 H new ATOM 0 HA ALA A 94 12.716 11.669 24.083 1.00 0.00 H new ATOM 0 HB1 ALA A 94 13.075 11.331 26.502 1.00 0.00 H new ATOM 0 HB2 ALA A 94 14.520 11.997 25.704 1.00 0.00 H new ATOM 0 HB3 ALA A 94 13.473 13.056 26.678 1.00 0.00 H new ATOM 1495 N ASP A 95 10.812 13.910 25.610 1.00 0.00 N ATOM 1496 CA ASP A 95 9.417 14.251 25.874 1.00 0.00 C ATOM 1497 C ASP A 95 8.594 14.306 24.586 1.00 0.00 C ATOM 1498 O ASP A 95 7.466 13.827 24.572 1.00 0.00 O ATOM 1499 CB ASP A 95 9.342 15.582 26.628 1.00 0.00 C ATOM 1500 CG ASP A 95 7.903 15.905 27.016 1.00 0.00 C ATOM 1501 OD1 ASP A 95 7.459 15.355 28.046 1.00 0.00 O ATOM 1502 OD2 ASP A 95 7.278 16.692 26.272 1.00 0.00 O ATOM 0 H ASP A 95 11.470 14.654 25.841 1.00 0.00 H new ATOM 0 HA ASP A 95 8.986 13.465 26.495 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.962 15.533 27.523 1.00 0.00 H new ATOM 0 HB3 ASP A 95 9.743 16.381 26.005 1.00 0.00 H new ATOM 1507 N TYR A 96 9.139 14.865 23.503 1.00 0.00 N ATOM 1508 CA TYR A 96 8.445 14.890 22.222 1.00 0.00 C ATOM 1509 C TYR A 96 8.147 13.463 21.755 1.00 0.00 C ATOM 1510 O TYR A 96 7.032 13.167 21.335 1.00 0.00 O ATOM 1511 CB TYR A 96 9.240 15.678 21.174 1.00 0.00 C ATOM 1512 CG TYR A 96 8.446 15.934 19.906 1.00 0.00 C ATOM 1513 CD1 TYR A 96 8.429 14.976 18.873 1.00 0.00 C ATOM 1514 CD2 TYR A 96 7.599 17.054 19.830 1.00 0.00 C ATOM 1515 CE1 TYR A 96 7.567 15.136 17.775 1.00 0.00 C ATOM 1516 CE2 TYR A 96 6.745 17.218 18.726 1.00 0.00 C ATOM 1517 CZ TYR A 96 6.724 16.258 17.703 1.00 0.00 C ATOM 1518 OH TYR A 96 5.899 16.435 16.632 1.00 0.00 O ATOM 0 H TYR A 96 10.059 15.305 23.492 1.00 0.00 H new ATOM 0 HA TYR A 96 7.494 15.407 22.352 1.00 0.00 H new ATOM 0 HB2 TYR A 96 9.551 16.631 21.601 1.00 0.00 H new ATOM 0 HB3 TYR A 96 10.148 15.129 20.924 1.00 0.00 H new ATOM 0 HD1 TYR A 96 9.080 14.116 18.925 1.00 0.00 H new ATOM 0 HD2 TYR A 96 7.605 17.789 20.621 1.00 0.00 H new ATOM 0 HE1 TYR A 96 7.552 14.397 16.987 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.104 18.085 18.665 1.00 0.00 H new ATOM 0 HH TYR A 96 5.386 17.262 16.747 1.00 0.00 H new ATOM 1528 N LEU A 97 9.134 12.566 21.839 1.00 0.00 N ATOM 1529 CA LEU A 97 8.920 11.146 21.582 1.00 0.00 C ATOM 1530 C LEU A 97 7.922 10.575 22.596 1.00 0.00 C ATOM 1531 O LEU A 97 7.054 9.783 22.235 1.00 0.00 O ATOM 1532 CB LEU A 97 10.248 10.375 21.640 1.00 0.00 C ATOM 1533 CG LEU A 97 10.997 10.321 20.298 1.00 0.00 C ATOM 1534 CD1 LEU A 97 11.499 11.690 19.830 1.00 0.00 C ATOM 1535 CD2 LEU A 97 12.191 9.372 20.446 1.00 0.00 C ATOM 0 H LEU A 97 10.095 12.805 22.085 1.00 0.00 H new ATOM 0 HA LEU A 97 8.508 11.032 20.579 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.893 10.838 22.386 1.00 0.00 H new ATOM 0 HB3 LEU A 97 10.051 9.357 21.976 1.00 0.00 H new ATOM 0 HG LEU A 97 10.293 9.969 19.544 1.00 0.00 H new ATOM 0 HD11 LEU A 97 12.018 11.581 18.878 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.652 12.365 19.706 1.00 0.00 H new ATOM 0 HD13 LEU A 97 12.184 12.099 20.572 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.735 9.321 19.503 1.00 0.00 H new ATOM 0 HD22 LEU A 97 12.855 9.741 21.228 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.834 8.377 20.713 1.00 0.00 H new ATOM 1547 N SER A 98 8.056 10.965 23.863 1.00 0.00 N ATOM 1548 CA SER A 98 7.283 10.583 25.042 1.00 0.00 C ATOM 1549 C SER A 98 7.479 9.123 25.451 1.00 0.00 C ATOM 1550 O SER A 98 7.733 8.847 26.620 1.00 0.00 O ATOM 1551 CB SER A 98 5.819 11.021 24.950 1.00 0.00 C ATOM 1552 OG SER A 98 5.085 10.297 23.980 1.00 0.00 O ATOM 0 H SER A 98 8.789 11.628 24.114 1.00 0.00 H new ATOM 0 HA SER A 98 7.698 11.149 25.876 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.346 10.895 25.924 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.778 12.084 24.710 1.00 0.00 H new ATOM 0 HG SER A 98 5.705 9.842 23.373 1.00 0.00 H new ATOM 1558 N ILE A 99 7.407 8.201 24.487 1.00 0.00 N ATOM 1559 CA ILE A 99 7.717 6.792 24.669 1.00 0.00 C ATOM 1560 C ILE A 99 6.688 6.176 25.627 1.00 0.00 C ATOM 1561 O ILE A 99 5.495 6.204 25.254 1.00 0.00 O ATOM 1562 CB ILE A 99 9.199 6.599 25.079 1.00 0.00 C ATOM 1563 CG1 ILE A 99 10.121 7.472 24.202 1.00 0.00 C ATOM 1564 CG2 ILE A 99 9.609 5.126 24.946 1.00 0.00 C ATOM 1565 CD1 ILE A 99 11.613 7.229 24.441 1.00 0.00 C ATOM 1566 OXT ILE A 99 7.092 5.700 26.711 1.00 0.00 O ATOM 0 H ILE A 99 7.123 8.427 23.534 1.00 0.00 H new ATOM 0 HA ILE A 99 7.628 6.247 23.729 1.00 0.00 H new ATOM 0 HB ILE A 99 9.303 6.904 26.120 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.895 7.282 23.153 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.899 8.522 24.391 1.00 0.00 H new ATOM 0 HG21 ILE A 99 10.653 5.011 25.238 1.00 0.00 H new ATOM 0 HG22 ILE A 99 8.981 4.514 25.593 1.00 0.00 H new ATOM 0 HG23 ILE A 99 9.485 4.806 23.912 1.00 0.00 H new ATOM 0 HD11 ILE A 99 12.197 7.879 23.789 1.00 0.00 H new ATOM 0 HD12 ILE A 99 11.855 7.447 25.481 1.00 0.00 H new ATOM 0 HD13 ILE A 99 11.851 6.188 24.224 1.00 0.00 H new ATOM 1579 N THR B 157 13.539 4.277 29.555 1.00 0.00 N ATOM 1580 CA THR B 157 14.645 4.751 30.409 1.00 0.00 C ATOM 1581 C THR B 157 15.159 6.129 29.984 1.00 0.00 C ATOM 1582 O THR B 157 15.530 6.916 30.853 1.00 0.00 O ATOM 1583 CB THR B 157 15.794 3.732 30.515 1.00 0.00 C ATOM 1584 OG1 THR B 157 16.443 3.556 29.272 1.00 0.00 O ATOM 1585 CG2 THR B 157 15.299 2.369 31.008 1.00 0.00 C ATOM 0 HA THR B 157 14.223 4.856 31.408 1.00 0.00 H new ATOM 0 HB THR B 157 16.499 4.139 31.239 1.00 0.00 H new ATOM 0 HG1 THR B 157 17.160 2.895 29.368 1.00 0.00 H new ATOM 0 HG21 THR B 157 16.139 1.677 31.070 1.00 0.00 H new ATOM 0 HG22 THR B 157 14.848 2.481 31.994 1.00 0.00 H new ATOM 0 HG23 THR B 157 14.557 1.978 30.312 1.00 0.00 H new ATOM 1595 N LEU B 158 15.194 6.425 28.675 1.00 0.00 N ATOM 1596 CA LEU B 158 15.822 7.643 28.155 1.00 0.00 C ATOM 1597 C LEU B 158 15.336 8.888 28.886 1.00 0.00 C ATOM 1598 O LEU B 158 16.147 9.644 29.412 1.00 0.00 O ATOM 1599 CB LEU B 158 15.617 7.811 26.643 1.00 0.00 C ATOM 1600 CG LEU B 158 16.209 9.127 26.092 1.00 0.00 C ATOM 1601 CD1 LEU B 158 17.731 9.187 26.277 1.00 0.00 C ATOM 1602 CD2 LEU B 158 15.878 9.273 24.605 1.00 0.00 C ATOM 0 H LEU B 158 14.789 5.828 27.953 1.00 0.00 H new ATOM 0 HA LEU B 158 16.890 7.527 28.337 1.00 0.00 H new ATOM 0 HB2 LEU B 158 16.075 6.969 26.125 1.00 0.00 H new ATOM 0 HB3 LEU B 158 14.550 7.779 26.422 1.00 0.00 H new ATOM 0 HG LEU B 158 15.761 9.945 26.656 1.00 0.00 H new ATOM 0 HD11 LEU B 158 18.109 10.128 25.877 1.00 0.00 H new ATOM 0 HD12 LEU B 158 17.971 9.121 27.338 1.00 0.00 H new ATOM 0 HD13 LEU B 158 18.195 8.355 25.748 1.00 0.00 H new ATOM 0 HD21 LEU B 158 16.301 10.204 24.228 1.00 0.00 H new ATOM 0 HD22 LEU B 158 16.301 8.433 24.054 1.00 0.00 H new ATOM 0 HD23 LEU B 158 14.796 9.286 24.473 1.00 0.00 H new ATOM 1614 N LYS B 159 14.023 9.123 28.890 1.00 0.00 N ATOM 1615 CA LYS B 159 13.461 10.323 29.487 1.00 0.00 C ATOM 1616 C LYS B 159 13.919 10.446 30.944 1.00 0.00 C ATOM 1617 O LYS B 159 14.368 11.505 31.370 1.00 0.00 O ATOM 1618 CB LYS B 159 11.932 10.292 29.344 1.00 0.00 C ATOM 1619 CG LYS B 159 11.306 11.654 29.665 1.00 0.00 C ATOM 1620 CD LYS B 159 9.785 11.583 29.472 1.00 0.00 C ATOM 1621 CE LYS B 159 9.127 12.951 29.689 1.00 0.00 C ATOM 1622 NZ LYS B 159 9.294 13.436 31.070 1.00 0.00 N ATOM 0 H LYS B 159 13.332 8.493 28.484 1.00 0.00 H new ATOM 0 HA LYS B 159 13.821 11.212 28.968 1.00 0.00 H new ATOM 0 HB2 LYS B 159 11.667 10.000 28.328 1.00 0.00 H new ATOM 0 HB3 LYS B 159 11.519 9.535 30.011 1.00 0.00 H new ATOM 0 HG2 LYS B 159 11.539 11.939 30.691 1.00 0.00 H new ATOM 0 HG3 LYS B 159 11.729 12.421 29.017 1.00 0.00 H new ATOM 0 HD2 LYS B 159 9.561 11.226 28.467 1.00 0.00 H new ATOM 0 HD3 LYS B 159 9.362 10.860 30.169 1.00 0.00 H new ATOM 0 HE2 LYS B 159 9.559 13.674 28.997 1.00 0.00 H new ATOM 0 HE3 LYS B 159 8.064 12.882 29.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 159 8.749 14.312 31.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 159 8.951 12.714 31.735 1.00 0.00 H new ATOM 0 HZ3 LYS B 159 10.300 13.624 31.252 1.00 0.00 H new ATOM 1636 N GLU B 160 13.828 9.351 31.698 1.00 0.00 N ATOM 1637 CA GLU B 160 14.164 9.306 33.111 1.00 0.00 C ATOM 1638 C GLU B 160 15.656 9.585 33.341 1.00 0.00 C ATOM 1639 O GLU B 160 16.027 10.422 34.169 1.00 0.00 O ATOM 1640 CB GLU B 160 13.753 7.949 33.704 1.00 0.00 C ATOM 1641 CG GLU B 160 12.287 7.570 33.412 1.00 0.00 C ATOM 1642 CD GLU B 160 12.135 6.642 32.205 1.00 0.00 C ATOM 1643 OE1 GLU B 160 12.351 7.125 31.072 1.00 0.00 O ATOM 1644 OE2 GLU B 160 11.830 5.452 32.437 1.00 0.00 O ATOM 0 H GLU B 160 13.511 8.454 31.331 1.00 0.00 H new ATOM 0 HA GLU B 160 13.609 10.092 33.623 1.00 0.00 H new ATOM 0 HB2 GLU B 160 14.407 7.174 33.305 1.00 0.00 H new ATOM 0 HB3 GLU B 160 13.906 7.971 34.783 1.00 0.00 H new ATOM 0 HG2 GLU B 160 11.861 7.086 34.291 1.00 0.00 H new ATOM 0 HG3 GLU B 160 11.711 8.479 33.239 1.00 0.00 H new ATOM 1651 N ARG B 161 16.532 8.844 32.656 1.00 0.00 N ATOM 1652 CA ARG B 161 17.969 8.996 32.847 1.00 0.00 C ATOM 1653 C ARG B 161 18.408 10.385 32.381 1.00 0.00 C ATOM 1654 O ARG B 161 19.134 11.081 33.087 1.00 0.00 O ATOM 1655 CB ARG B 161 18.752 7.827 32.224 1.00 0.00 C ATOM 1656 CG ARG B 161 18.787 7.798 30.692 1.00 0.00 C ATOM 1657 CD ARG B 161 19.218 6.412 30.193 1.00 0.00 C ATOM 1658 NE ARG B 161 19.380 6.371 28.730 1.00 0.00 N ATOM 1659 CZ ARG B 161 20.513 6.667 28.074 1.00 0.00 C ATOM 1660 NH1 ARG B 161 21.559 7.176 28.730 1.00 0.00 N ATOM 1661 NH2 ARG B 161 20.601 6.445 26.758 1.00 0.00 N ATOM 0 H ARG B 161 16.269 8.138 31.969 1.00 0.00 H new ATOM 0 HA ARG B 161 18.209 8.940 33.909 1.00 0.00 H new ATOM 0 HB2 ARG B 161 19.777 7.862 32.593 1.00 0.00 H new ATOM 0 HB3 ARG B 161 18.317 6.892 32.578 1.00 0.00 H new ATOM 0 HG2 ARG B 161 17.802 8.045 30.295 1.00 0.00 H new ATOM 0 HG3 ARG B 161 19.479 8.556 30.323 1.00 0.00 H new ATOM 0 HD2 ARG B 161 20.158 6.133 30.669 1.00 0.00 H new ATOM 0 HD3 ARG B 161 18.476 5.673 30.495 1.00 0.00 H new ATOM 0 HE ARG B 161 18.570 6.097 28.173 1.00 0.00 H new ATOM 0 HH11 ARG B 161 21.499 7.342 29.735 1.00 0.00 H new ATOM 0 HH12 ARG B 161 22.417 7.399 28.226 1.00 0.00 H new ATOM 0 HH21 ARG B 161 19.807 6.051 26.253 1.00 0.00 H new ATOM 0 HH22 ARG B 161 21.462 6.670 26.259 1.00 0.00 H new ATOM 1675 N CYS B 162 17.915 10.820 31.220 1.00 0.00 N ATOM 1676 CA CYS B 162 18.181 12.155 30.709 1.00 0.00 C ATOM 1677 C CYS B 162 17.727 13.217 31.709 1.00 0.00 C ATOM 1678 O CYS B 162 18.511 14.093 32.061 1.00 0.00 O ATOM 1679 CB CYS B 162 17.512 12.357 29.352 1.00 0.00 C ATOM 1680 SG CYS B 162 17.911 14.034 28.828 1.00 0.00 S ATOM 0 H CYS B 162 17.322 10.254 30.613 1.00 0.00 H new ATOM 0 HA CYS B 162 19.257 12.261 30.572 1.00 0.00 H new ATOM 0 HB2 CYS B 162 17.876 11.628 28.628 1.00 0.00 H new ATOM 0 HB3 CYS B 162 16.433 12.221 29.427 1.00 0.00 H new ATOM 0 HG CYS B 162 17.731 14.142 27.545 1.00 0.00 H new ATOM 1686 N LEU B 163 16.493 13.120 32.214 1.00 0.00 N ATOM 1687 CA LEU B 163 15.977 14.020 33.241 1.00 0.00 C ATOM 1688 C LEU B 163 16.928 14.056 34.434 1.00 0.00 C ATOM 1689 O LEU B 163 17.298 15.133 34.898 1.00 0.00 O ATOM 1690 CB LEU B 163 14.549 13.606 33.635 1.00 0.00 C ATOM 1691 CG LEU B 163 13.867 14.560 34.635 1.00 0.00 C ATOM 1692 CD1 LEU B 163 12.349 14.515 34.417 1.00 0.00 C ATOM 1693 CD2 LEU B 163 14.147 14.184 36.099 1.00 0.00 C ATOM 0 H LEU B 163 15.823 12.410 31.918 1.00 0.00 H new ATOM 0 HA LEU B 163 15.920 15.035 32.847 1.00 0.00 H new ATOM 0 HB2 LEU B 163 13.939 13.546 32.734 1.00 0.00 H new ATOM 0 HB3 LEU B 163 14.579 12.606 34.067 1.00 0.00 H new ATOM 0 HG LEU B 163 14.274 15.555 34.455 1.00 0.00 H new ATOM 0 HD11 LEU B 163 11.860 15.188 35.122 1.00 0.00 H new ATOM 0 HD12 LEU B 163 12.118 14.826 33.398 1.00 0.00 H new ATOM 0 HD13 LEU B 163 11.989 13.499 34.576 1.00 0.00 H new ATOM 0 HD21 LEU B 163 13.642 14.890 36.759 1.00 0.00 H new ATOM 0 HD22 LEU B 163 13.777 13.177 36.293 1.00 0.00 H new ATOM 0 HD23 LEU B 163 15.221 14.218 36.285 1.00 0.00 H new ATOM 1705 N GLN B 164 17.346 12.888 34.930 1.00 0.00 N ATOM 1706 CA GLN B 164 18.314 12.842 36.021 1.00 0.00 C ATOM 1707 C GLN B 164 19.625 13.548 35.646 1.00 0.00 C ATOM 1708 O GLN B 164 20.164 14.302 36.457 1.00 0.00 O ATOM 1709 CB GLN B 164 18.524 11.398 36.481 1.00 0.00 C ATOM 1710 CG GLN B 164 17.281 10.920 37.243 1.00 0.00 C ATOM 1711 CD GLN B 164 17.282 9.408 37.405 1.00 0.00 C ATOM 1712 OE1 GLN B 164 17.649 8.881 38.450 1.00 0.00 O ATOM 1713 NE2 GLN B 164 16.863 8.706 36.357 1.00 0.00 N ATOM 0 H GLN B 164 17.033 11.976 34.597 1.00 0.00 H new ATOM 0 HA GLN B 164 17.912 13.397 36.869 1.00 0.00 H new ATOM 0 HB2 GLN B 164 18.707 10.754 35.621 1.00 0.00 H new ATOM 0 HB3 GLN B 164 19.404 11.333 37.121 1.00 0.00 H new ATOM 0 HG2 GLN B 164 17.249 11.393 38.224 1.00 0.00 H new ATOM 0 HG3 GLN B 164 16.383 11.230 36.710 1.00 0.00 H new ATOM 0 HE21 GLN B 164 16.567 9.186 35.507 1.00 0.00 H new ATOM 0 HE22 GLN B 164 16.838 7.687 36.403 1.00 0.00 H new ATOM 1722 N VAL B 165 20.147 13.352 34.431 1.00 0.00 N ATOM 1723 CA VAL B 165 21.327 14.095 33.992 1.00 0.00 C ATOM 1724 C VAL B 165 21.052 15.607 34.021 1.00 0.00 C ATOM 1725 O VAL B 165 21.849 16.349 34.595 1.00 0.00 O ATOM 1726 CB VAL B 165 21.851 13.599 32.631 1.00 0.00 C ATOM 1727 CG1 VAL B 165 23.044 14.444 32.159 1.00 0.00 C ATOM 1728 CG2 VAL B 165 22.339 12.147 32.734 1.00 0.00 C ATOM 0 H VAL B 165 19.776 12.695 33.745 1.00 0.00 H new ATOM 0 HA VAL B 165 22.135 13.903 34.698 1.00 0.00 H new ATOM 0 HB VAL B 165 21.024 13.680 31.926 1.00 0.00 H new ATOM 0 HG11 VAL B 165 23.395 14.073 31.196 1.00 0.00 H new ATOM 0 HG12 VAL B 165 22.735 15.484 32.056 1.00 0.00 H new ATOM 0 HG13 VAL B 165 23.850 14.375 32.889 1.00 0.00 H new ATOM 0 HG21 VAL B 165 22.705 11.816 31.762 1.00 0.00 H new ATOM 0 HG22 VAL B 165 23.145 12.085 33.465 1.00 0.00 H new ATOM 0 HG23 VAL B 165 21.514 11.507 33.048 1.00 0.00 H new ATOM 1738 N VAL B 166 19.932 16.069 33.445 1.00 0.00 N ATOM 1739 CA VAL B 166 19.551 17.482 33.480 1.00 0.00 C ATOM 1740 C VAL B 166 19.578 17.981 34.924 1.00 0.00 C ATOM 1741 O VAL B 166 20.291 18.930 35.230 1.00 0.00 O ATOM 1742 CB VAL B 166 18.174 17.732 32.827 1.00 0.00 C ATOM 1743 CG1 VAL B 166 17.719 19.186 33.027 1.00 0.00 C ATOM 1744 CG2 VAL B 166 18.213 17.463 31.320 1.00 0.00 C ATOM 0 H VAL B 166 19.271 15.474 32.945 1.00 0.00 H new ATOM 0 HA VAL B 166 20.276 18.045 32.892 1.00 0.00 H new ATOM 0 HB VAL B 166 17.477 17.048 33.311 1.00 0.00 H new ATOM 0 HG11 VAL B 166 16.747 19.331 32.556 1.00 0.00 H new ATOM 0 HG12 VAL B 166 17.642 19.400 34.093 1.00 0.00 H new ATOM 0 HG13 VAL B 166 18.446 19.860 32.574 1.00 0.00 H new ATOM 0 HG21 VAL B 166 17.228 17.648 30.892 1.00 0.00 H new ATOM 0 HG22 VAL B 166 18.943 18.123 30.851 1.00 0.00 H new ATOM 0 HG23 VAL B 166 18.496 16.425 31.143 1.00 0.00 H new ATOM 1754 N ARG B 167 18.813 17.334 35.808 1.00 0.00 N ATOM 1755 CA ARG B 167 18.772 17.630 37.236 1.00 0.00 C ATOM 1756 C ARG B 167 20.195 17.786 37.783 1.00 0.00 C ATOM 1757 O ARG B 167 20.540 18.825 38.346 1.00 0.00 O ATOM 1758 CB ARG B 167 18.005 16.501 37.941 1.00 0.00 C ATOM 1759 CG ARG B 167 17.973 16.599 39.476 1.00 0.00 C ATOM 1760 CD ARG B 167 17.938 15.192 40.086 1.00 0.00 C ATOM 1761 NE ARG B 167 19.195 14.473 39.821 1.00 0.00 N ATOM 1762 CZ ARG B 167 19.390 13.158 39.987 1.00 0.00 C ATOM 1763 NH1 ARG B 167 18.417 12.387 40.483 1.00 0.00 N ATOM 1764 NH2 ARG B 167 20.567 12.622 39.652 1.00 0.00 N ATOM 0 H ARG B 167 18.191 16.571 35.540 1.00 0.00 H new ATOM 0 HA ARG B 167 18.256 18.573 37.420 1.00 0.00 H new ATOM 0 HB2 ARG B 167 16.980 16.492 37.571 1.00 0.00 H new ATOM 0 HB3 ARG B 167 18.453 15.548 37.662 1.00 0.00 H new ATOM 0 HG2 ARG B 167 18.850 17.139 39.833 1.00 0.00 H new ATOM 0 HG3 ARG B 167 17.098 17.166 39.795 1.00 0.00 H new ATOM 0 HD2 ARG B 167 17.774 15.262 41.161 1.00 0.00 H new ATOM 0 HD3 ARG B 167 17.100 14.632 39.671 1.00 0.00 H new ATOM 0 HE ARG B 167 19.985 15.023 39.482 1.00 0.00 H new ATOM 0 HH11 ARG B 167 17.519 12.799 40.738 1.00 0.00 H new ATOM 0 HH12 ARG B 167 18.572 11.387 40.607 1.00 0.00 H new ATOM 0 HH21 ARG B 167 21.307 13.213 39.274 1.00 0.00 H new ATOM 0 HH22 ARG B 167 20.725 11.622 39.775 1.00 0.00 H new ATOM 1778 N SER B 168 21.021 16.750 37.612 1.00 0.00 N ATOM 1779 CA SER B 168 22.386 16.736 38.118 1.00 0.00 C ATOM 1780 C SER B 168 23.212 17.898 37.552 1.00 0.00 C ATOM 1781 O SER B 168 24.048 18.458 38.255 1.00 0.00 O ATOM 1782 CB SER B 168 23.048 15.391 37.809 1.00 0.00 C ATOM 1783 OG SER B 168 22.230 14.326 38.260 1.00 0.00 O ATOM 0 H SER B 168 20.756 15.898 37.117 1.00 0.00 H new ATOM 0 HA SER B 168 22.347 16.867 39.199 1.00 0.00 H new ATOM 0 HB2 SER B 168 23.218 15.299 36.736 1.00 0.00 H new ATOM 0 HB3 SER B 168 24.024 15.339 38.292 1.00 0.00 H new ATOM 0 HG SER B 168 21.533 14.145 37.595 1.00 0.00 H new ATOM 1789 N LEU B 169 23.000 18.245 36.282 1.00 0.00 N ATOM 1790 CA LEU B 169 23.700 19.336 35.622 1.00 0.00 C ATOM 1791 C LEU B 169 23.266 20.686 36.200 1.00 0.00 C ATOM 1792 O LEU B 169 24.111 21.463 36.639 1.00 0.00 O ATOM 1793 CB LEU B 169 23.471 19.240 34.106 1.00 0.00 C ATOM 1794 CG LEU B 169 24.083 20.388 33.288 1.00 0.00 C ATOM 1795 CD1 LEU B 169 25.574 20.578 33.588 1.00 0.00 C ATOM 1796 CD2 LEU B 169 23.886 20.081 31.799 1.00 0.00 C ATOM 0 H LEU B 169 22.329 17.768 35.680 1.00 0.00 H new ATOM 0 HA LEU B 169 24.772 19.255 35.805 1.00 0.00 H new ATOM 0 HB2 LEU B 169 23.885 18.297 33.749 1.00 0.00 H new ATOM 0 HB3 LEU B 169 22.398 19.209 33.916 1.00 0.00 H new ATOM 0 HG LEU B 169 23.580 21.316 33.562 1.00 0.00 H new ATOM 0 HD11 LEU B 169 25.964 21.400 32.987 1.00 0.00 H new ATOM 0 HD12 LEU B 169 25.706 20.807 34.645 1.00 0.00 H new ATOM 0 HD13 LEU B 169 26.114 19.663 33.345 1.00 0.00 H new ATOM 0 HD21 LEU B 169 24.315 20.886 31.202 1.00 0.00 H new ATOM 0 HD22 LEU B 169 24.382 19.142 31.552 1.00 0.00 H new ATOM 0 HD23 LEU B 169 22.821 19.996 31.583 1.00 0.00 H new ATOM 1808 N VAL B 170 21.963 20.983 36.187 1.00 0.00 N ATOM 1809 CA VAL B 170 21.460 22.298 36.577 1.00 0.00 C ATOM 1810 C VAL B 170 21.544 22.520 38.090 1.00 0.00 C ATOM 1811 O VAL B 170 21.739 23.651 38.529 1.00 0.00 O ATOM 1812 CB VAL B 170 20.046 22.559 36.024 1.00 0.00 C ATOM 1813 CG1 VAL B 170 20.007 22.374 34.500 1.00 0.00 C ATOM 1814 CG2 VAL B 170 18.960 21.705 36.693 1.00 0.00 C ATOM 0 H VAL B 170 21.236 20.324 35.908 1.00 0.00 H new ATOM 0 HA VAL B 170 22.116 23.039 36.119 1.00 0.00 H new ATOM 0 HB VAL B 170 19.819 23.597 36.266 1.00 0.00 H new ATOM 0 HG11 VAL B 170 18.997 22.564 34.136 1.00 0.00 H new ATOM 0 HG12 VAL B 170 20.700 23.073 34.031 1.00 0.00 H new ATOM 0 HG13 VAL B 170 20.296 21.353 34.250 1.00 0.00 H new ATOM 0 HG21 VAL B 170 17.990 21.941 36.255 1.00 0.00 H new ATOM 0 HG22 VAL B 170 19.181 20.649 36.538 1.00 0.00 H new ATOM 0 HG23 VAL B 170 18.937 21.918 37.762 1.00 0.00 H new ATOM 1824 N LYS B 171 21.392 21.455 38.886 1.00 0.00 N ATOM 1825 CA LYS B 171 21.440 21.508 40.344 1.00 0.00 C ATOM 1826 C LYS B 171 20.383 22.479 40.890 1.00 0.00 C ATOM 1827 O LYS B 171 19.238 22.408 40.392 1.00 0.00 O ATOM 1828 CB LYS B 171 22.865 21.834 40.832 1.00 0.00 C ATOM 1829 CG LYS B 171 23.904 20.873 40.243 1.00 0.00 C ATOM 1830 CD LYS B 171 25.321 21.278 40.665 1.00 0.00 C ATOM 1831 CE LYS B 171 26.373 20.301 40.122 1.00 0.00 C ATOM 1832 NZ LYS B 171 26.299 20.165 38.656 1.00 0.00 N ATOM 1833 OXT LYS B 171 20.721 23.252 41.813 1.00 0.00 O ATOM 0 H LYS B 171 21.229 20.516 38.523 1.00 0.00 H new ATOM 0 HA LYS B 171 21.192 20.524 40.742 1.00 0.00 H new ATOM 0 HB2 LYS B 171 23.119 22.857 40.555 1.00 0.00 H new ATOM 0 HB3 LYS B 171 22.897 21.781 41.920 1.00 0.00 H new ATOM 0 HG2 LYS B 171 23.697 19.857 40.578 1.00 0.00 H new ATOM 0 HG3 LYS B 171 23.830 20.872 39.156 1.00 0.00 H new ATOM 0 HD2 LYS B 171 25.536 22.283 40.303 1.00 0.00 H new ATOM 0 HD3 LYS B 171 25.382 21.311 41.753 1.00 0.00 H new ATOM 0 HE2 LYS B 171 27.368 20.646 40.404 1.00 0.00 H new ATOM 0 HE3 LYS B 171 26.232 19.324 40.584 1.00 0.00 H new ATOM 0 HZ1 LYS B 171 27.180 19.740 38.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 171 25.495 19.555 38.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 171 26.170 21.103 38.226 1.00 0.00 H new