USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 832 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 97 TYR OH : rot 180:sc= -0.558 USER MOD Set 1.2: A 108 LYS NZ :NH3+ 157:sc= -1.22 (180deg=-2.03!) USER MOD Set 2.1: A 70 THR OG1 : rot -32:sc= -4.57! USER MOD Set 2.2: A 92 SER OG : rot 70:sc= 1.18 USER MOD Set 3.1: A 13 TYR OH : rot 79:sc= -0.299! USER MOD Set 3.2: A 19 LYS NZ :NH3+ -115:sc= 0.17! (180deg=-2.39!) USER MOD Single : A 5 ASN : amide:sc= -0.213 K(o=-0.21,f=-7.1!) USER MOD Single : A 6 THR OG1 : rot 180:sc=-0.00837 USER MOD Single : A 15 GLN : amide:sc= 0.393 K(o=0.39,f=-1.8) USER MOD Single : A 16 THR OG1 : rot 103:sc= 1.06 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HE2:sc= -0.125! C(o=-0.13!,f=-11!) USER MOD Single : A 23 ASN : amide:sc= -7.6! C(o=-7.6!,f=-9.9!) USER MOD Single : A 24 TYR OH : rot -27:sc= 0.908 USER MOD Single : A 26 THR OG1 : rot -49:sc= -1.2! USER MOD Single : A 27 LYS NZ :NH3+ -92:sc= -3.8! (180deg=-5.17!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.652 K(o=-0.65,f=-4.4!) USER MOD Single : A 38 SER OG : rot 68:sc= 0.761 USER MOD Single : A 39 LYS NZ :NH3+ 150:sc= -0.0914 (180deg=-0.679) USER MOD Single : A 41 ASN : amide:sc= -1.5! C(o=-1.5!,f=-12!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -130:sc= -2.04! USER MOD Single : A 58 ASN : amide:sc= -3.2! C(o=-3.2!,f=-10!) USER MOD Single : A 62 LYS NZ :NH3+ 168:sc= -1.06! (180deg=-1.67!) USER MOD Single : A 66 LYS NZ :NH3+ -160:sc= 0.0244! (180deg=-0.555!) USER MOD Single : A 67 SER OG : rot 66:sc= 1.03 USER MOD Single : A 77 ASN : amide:sc= -4.9! C(o=-4.9!,f=-5.4!) USER MOD Single : A 78 TYR OH : rot -165:sc= 0.261 USER MOD Single : A 79 THR OG1 : rot -59:sc= -0.154! USER MOD Single : A 80 SER OG : rot -67:sc= 1.05 USER MOD Single : A 84 ASN : amide:sc= -1.78! C(o=-1.8!,f=-13!) USER MOD Single : A 85 SER OG : rot 143:sc= 0.932 USER MOD Single : A 90 TYR OH : rot 30:sc= 0.866 USER MOD Single : A 91 SER OG : rot 157:sc= -0.279! USER MOD Single : A 98 LYS NZ :NH3+ -118:sc= -1.54! (180deg=-2.03!) USER MOD Single : A 99 THR OG1 : rot 57:sc= 1.1 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot -9:sc= 1.6 USER MOD Single : A 104 GLN : amide:sc= -0.291 K(o=-0.29,f=-2.5!) USER MOD Single : A 105 THR OG1 : rot -99:sc= 0.576 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 3 15.589 49.704 12.151 1.00 0.00 N ATOM 2 CA VAL A 3 14.922 48.774 11.191 1.00 0.00 C ATOM 3 C VAL A 3 15.979 48.069 10.321 1.00 0.00 C ATOM 4 O VAL A 3 15.914 48.107 9.109 1.00 0.00 O ATOM 5 CB VAL A 3 13.947 49.563 10.298 1.00 0.00 C ATOM 6 CG1 VAL A 3 12.765 48.664 9.923 1.00 0.00 C ATOM 7 CG2 VAL A 3 13.421 50.799 11.046 1.00 0.00 C ATOM 0 HA VAL A 3 14.366 48.021 11.750 1.00 0.00 H new ATOM 0 HB VAL A 3 14.473 49.886 9.399 1.00 0.00 H new ATOM 0 HG11 VAL A 3 12.072 49.219 9.291 1.00 0.00 H new ATOM 0 HG12 VAL A 3 13.129 47.790 9.383 1.00 0.00 H new ATOM 0 HG13 VAL A 3 12.251 48.342 10.829 1.00 0.00 H new ATOM 0 HG21 VAL A 3 12.733 51.348 10.403 1.00 0.00 H new ATOM 0 HG22 VAL A 3 12.900 50.483 11.950 1.00 0.00 H new ATOM 0 HG23 VAL A 3 14.257 51.444 11.316 1.00 0.00 H new ATOM 17 N ILE A 4 16.950 47.431 10.936 1.00 0.00 N ATOM 18 CA ILE A 4 18.018 46.711 10.163 1.00 0.00 C ATOM 19 C ILE A 4 18.274 45.343 10.825 1.00 0.00 C ATOM 20 O ILE A 4 18.141 45.193 12.027 1.00 0.00 O ATOM 21 CB ILE A 4 19.308 47.543 10.178 1.00 0.00 C ATOM 22 CG1 ILE A 4 19.113 48.821 9.343 1.00 0.00 C ATOM 23 CG2 ILE A 4 20.453 46.713 9.588 1.00 0.00 C ATOM 24 CD1 ILE A 4 19.744 50.016 10.067 1.00 0.00 C ATOM 0 H ILE A 4 17.049 47.378 11.950 1.00 0.00 H new ATOM 0 HA ILE A 4 17.698 46.566 9.131 1.00 0.00 H new ATOM 0 HB ILE A 4 19.549 47.820 11.204 1.00 0.00 H new ATOM 0 HG12 ILE A 4 19.569 48.697 8.361 1.00 0.00 H new ATOM 0 HG13 ILE A 4 18.050 49.002 9.181 1.00 0.00 H new ATOM 0 HG21 ILE A 4 21.371 47.301 9.597 1.00 0.00 H new ATOM 0 HG22 ILE A 4 20.594 45.811 10.184 1.00 0.00 H new ATOM 0 HG23 ILE A 4 20.210 46.435 8.562 1.00 0.00 H new ATOM 0 HD11 ILE A 4 19.603 50.918 9.471 1.00 0.00 H new ATOM 0 HD12 ILE A 4 19.268 50.145 11.039 1.00 0.00 H new ATOM 0 HD13 ILE A 4 20.810 49.836 10.206 1.00 0.00 H new ATOM 36 N ASN A 5 18.613 44.340 10.056 1.00 0.00 N ATOM 37 CA ASN A 5 18.853 42.987 10.656 1.00 0.00 C ATOM 38 C ASN A 5 19.900 42.232 9.836 1.00 0.00 C ATOM 39 O ASN A 5 19.804 41.026 9.658 1.00 0.00 O ATOM 40 CB ASN A 5 17.538 42.207 10.627 1.00 0.00 C ATOM 41 CG ASN A 5 17.050 42.109 9.177 1.00 0.00 C ATOM 42 OD1 ASN A 5 17.662 42.650 8.274 1.00 0.00 O ATOM 43 ND2 ASN A 5 15.973 41.433 8.906 1.00 0.00 N ATOM 0 H ASN A 5 18.734 44.395 9.045 1.00 0.00 H new ATOM 0 HA ASN A 5 19.212 43.096 11.679 1.00 0.00 H new ATOM 0 HB2 ASN A 5 17.682 41.210 11.044 1.00 0.00 H new ATOM 0 HB3 ASN A 5 16.790 42.706 11.243 1.00 0.00 H new ATOM 0 HD21 ASN A 5 15.646 41.359 7.943 1.00 0.00 H new ATOM 0 HD22 ASN A 5 15.455 40.977 9.657 1.00 0.00 H new ATOM 50 N THR A 6 20.895 42.915 9.339 1.00 0.00 N ATOM 51 CA THR A 6 21.940 42.216 8.528 1.00 0.00 C ATOM 52 C THR A 6 23.317 42.425 9.169 1.00 0.00 C ATOM 53 O THR A 6 23.615 43.481 9.696 1.00 0.00 O ATOM 54 CB THR A 6 21.947 42.770 7.094 1.00 0.00 C ATOM 55 OG1 THR A 6 22.543 44.059 7.087 1.00 0.00 O ATOM 56 CG2 THR A 6 20.514 42.864 6.554 1.00 0.00 C ATOM 0 H THR A 6 21.032 43.919 9.456 1.00 0.00 H new ATOM 0 HA THR A 6 21.714 41.150 8.498 1.00 0.00 H new ATOM 0 HB THR A 6 22.521 42.097 6.457 1.00 0.00 H new ATOM 0 HG1 THR A 6 22.549 44.412 6.173 1.00 0.00 H new ATOM 0 HG21 THR A 6 20.533 43.258 5.538 1.00 0.00 H new ATOM 0 HG22 THR A 6 20.061 41.873 6.551 1.00 0.00 H new ATOM 0 HG23 THR A 6 19.929 43.528 7.190 1.00 0.00 H new ATOM 64 N PHE A 7 24.160 41.423 9.120 1.00 0.00 N ATOM 65 CA PHE A 7 25.528 41.516 9.746 1.00 0.00 C ATOM 66 C PHE A 7 26.213 42.859 9.447 1.00 0.00 C ATOM 67 O PHE A 7 26.239 43.748 10.273 1.00 0.00 O ATOM 68 CB PHE A 7 26.412 40.391 9.197 1.00 0.00 C ATOM 69 CG PHE A 7 25.821 39.068 9.582 1.00 0.00 C ATOM 70 CD1 PHE A 7 25.887 38.632 10.918 1.00 0.00 C ATOM 71 CD2 PHE A 7 25.189 38.271 8.617 1.00 0.00 C ATOM 72 CE1 PHE A 7 25.321 37.404 11.283 1.00 0.00 C ATOM 73 CE2 PHE A 7 24.625 37.036 8.985 1.00 0.00 C ATOM 74 CZ PHE A 7 24.692 36.607 10.318 1.00 0.00 C ATOM 0 H PHE A 7 23.961 40.530 8.668 1.00 0.00 H new ATOM 0 HA PHE A 7 25.400 41.429 10.825 1.00 0.00 H new ATOM 0 HB2 PHE A 7 26.487 40.468 8.112 1.00 0.00 H new ATOM 0 HB3 PHE A 7 27.423 40.480 9.594 1.00 0.00 H new ATOM 0 HD1 PHE A 7 26.374 39.244 11.662 1.00 0.00 H new ATOM 0 HD2 PHE A 7 25.135 38.605 7.591 1.00 0.00 H new ATOM 0 HE1 PHE A 7 25.370 37.071 12.309 1.00 0.00 H new ATOM 0 HE2 PHE A 7 24.141 36.419 8.242 1.00 0.00 H new ATOM 0 HZ PHE A 7 24.258 35.660 10.602 1.00 0.00 H new ATOM 84 N ASP A 8 26.773 43.000 8.273 1.00 0.00 N ATOM 85 CA ASP A 8 27.477 44.272 7.891 1.00 0.00 C ATOM 86 C ASP A 8 26.598 45.485 8.200 1.00 0.00 C ATOM 87 O ASP A 8 27.053 46.446 8.789 1.00 0.00 O ATOM 88 CB ASP A 8 27.802 44.238 6.393 1.00 0.00 C ATOM 89 CG ASP A 8 29.258 43.831 6.210 1.00 0.00 C ATOM 90 OD1 ASP A 8 29.657 42.857 6.821 1.00 0.00 O ATOM 91 OD2 ASP A 8 29.956 44.511 5.476 1.00 0.00 O ATOM 0 H ASP A 8 26.775 42.281 7.550 1.00 0.00 H new ATOM 0 HA ASP A 8 28.398 44.355 8.468 1.00 0.00 H new ATOM 0 HB2 ASP A 8 27.147 43.533 5.882 1.00 0.00 H new ATOM 0 HB3 ASP A 8 27.626 45.217 5.947 1.00 0.00 H new ATOM 96 N GLY A 9 25.350 45.449 7.808 1.00 0.00 N ATOM 97 CA GLY A 9 24.431 46.596 8.081 1.00 0.00 C ATOM 98 C GLY A 9 24.427 46.942 9.573 1.00 0.00 C ATOM 99 O GLY A 9 24.558 48.099 9.944 1.00 0.00 O ATOM 0 H GLY A 9 24.925 44.669 7.307 1.00 0.00 H new ATOM 0 HA2 GLY A 9 24.743 47.465 7.502 1.00 0.00 H new ATOM 0 HA3 GLY A 9 23.421 46.344 7.758 1.00 0.00 H new ATOM 103 N VAL A 10 24.262 45.965 10.444 1.00 0.00 N ATOM 104 CA VAL A 10 24.251 46.274 11.905 1.00 0.00 C ATOM 105 C VAL A 10 25.649 46.807 12.293 1.00 0.00 C ATOM 106 O VAL A 10 25.786 47.824 12.959 1.00 0.00 O ATOM 107 CB VAL A 10 23.907 44.997 12.705 1.00 0.00 C ATOM 108 CG1 VAL A 10 24.213 45.216 14.186 1.00 0.00 C ATOM 109 CG2 VAL A 10 22.411 44.668 12.552 1.00 0.00 C ATOM 0 H VAL A 10 24.137 44.982 10.204 1.00 0.00 H new ATOM 0 HA VAL A 10 23.497 47.027 12.134 1.00 0.00 H new ATOM 0 HB VAL A 10 24.506 44.172 12.320 1.00 0.00 H new ATOM 0 HG11 VAL A 10 23.969 44.313 14.745 1.00 0.00 H new ATOM 0 HG12 VAL A 10 25.272 45.444 14.309 1.00 0.00 H new ATOM 0 HG13 VAL A 10 23.617 46.048 14.562 1.00 0.00 H new ATOM 0 HG21 VAL A 10 22.177 43.767 13.119 1.00 0.00 H new ATOM 0 HG22 VAL A 10 21.815 45.499 12.929 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.180 44.505 11.499 1.00 0.00 H new ATOM 119 N ALA A 11 26.697 46.144 11.845 1.00 0.00 N ATOM 120 CA ALA A 11 28.096 46.608 12.146 1.00 0.00 C ATOM 121 C ALA A 11 28.280 48.054 11.645 1.00 0.00 C ATOM 122 O ALA A 11 28.669 48.955 12.394 1.00 0.00 O ATOM 123 CB ALA A 11 29.084 45.683 11.428 1.00 0.00 C ATOM 0 H ALA A 11 26.642 45.296 11.280 1.00 0.00 H new ATOM 0 HA ALA A 11 28.275 46.580 13.221 1.00 0.00 H new ATOM 0 HB1 ALA A 11 30.104 46.007 11.637 1.00 0.00 H new ATOM 0 HB2 ALA A 11 28.948 44.661 11.782 1.00 0.00 H new ATOM 0 HB3 ALA A 11 28.904 45.722 10.354 1.00 0.00 H new ATOM 129 N ASP A 12 27.985 48.270 10.384 1.00 0.00 N ATOM 130 CA ASP A 12 28.094 49.627 9.769 1.00 0.00 C ATOM 131 C ASP A 12 27.339 50.629 10.626 1.00 0.00 C ATOM 132 O ASP A 12 27.849 51.680 10.986 1.00 0.00 O ATOM 133 CB ASP A 12 27.439 49.591 8.384 1.00 0.00 C ATOM 134 CG ASP A 12 28.361 48.906 7.380 1.00 0.00 C ATOM 135 OD1 ASP A 12 29.270 48.210 7.807 1.00 0.00 O ATOM 136 OD2 ASP A 12 28.149 49.088 6.198 1.00 0.00 O ATOM 0 H ASP A 12 27.666 47.543 9.743 1.00 0.00 H new ATOM 0 HA ASP A 12 29.143 49.914 9.693 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.489 49.059 8.437 1.00 0.00 H new ATOM 0 HB3 ASP A 12 27.218 50.606 8.052 1.00 0.00 H new ATOM 141 N TYR A 13 26.122 50.292 10.961 1.00 0.00 N ATOM 142 CA TYR A 13 25.273 51.189 11.803 1.00 0.00 C ATOM 143 C TYR A 13 25.988 51.470 13.129 1.00 0.00 C ATOM 144 O TYR A 13 26.076 52.599 13.585 1.00 0.00 O ATOM 145 CB TYR A 13 23.940 50.479 12.073 1.00 0.00 C ATOM 146 CG TYR A 13 22.842 51.491 12.309 1.00 0.00 C ATOM 147 CD1 TYR A 13 22.188 52.090 11.222 1.00 0.00 C ATOM 148 CD2 TYR A 13 22.466 51.818 13.616 1.00 0.00 C ATOM 149 CE1 TYR A 13 21.163 53.017 11.448 1.00 0.00 C ATOM 150 CE2 TYR A 13 21.444 52.744 13.837 1.00 0.00 C ATOM 151 CZ TYR A 13 20.794 53.343 12.755 1.00 0.00 C ATOM 152 OH TYR A 13 19.793 54.266 12.979 1.00 0.00 O ATOM 0 H TYR A 13 25.672 49.420 10.683 1.00 0.00 H new ATOM 0 HA TYR A 13 25.095 52.134 11.290 1.00 0.00 H new ATOM 0 HB2 TYR A 13 23.681 49.843 11.226 1.00 0.00 H new ATOM 0 HB3 TYR A 13 24.037 49.829 12.942 1.00 0.00 H new ATOM 0 HD1 TYR A 13 22.475 51.837 10.212 1.00 0.00 H new ATOM 0 HD2 TYR A 13 22.966 51.355 14.454 1.00 0.00 H new ATOM 0 HE1 TYR A 13 20.658 53.479 10.613 1.00 0.00 H new ATOM 0 HE2 TYR A 13 21.156 52.998 14.846 1.00 0.00 H new ATOM 0 HH TYR A 13 18.920 53.838 12.856 1.00 0.00 H new ATOM 162 N LEU A 14 26.498 50.440 13.749 1.00 0.00 N ATOM 163 CA LEU A 14 27.204 50.612 15.046 1.00 0.00 C ATOM 164 C LEU A 14 28.543 51.347 14.837 1.00 0.00 C ATOM 165 O LEU A 14 28.853 52.288 15.555 1.00 0.00 O ATOM 166 CB LEU A 14 27.423 49.226 15.662 1.00 0.00 C ATOM 167 CG LEU A 14 26.073 48.644 16.133 1.00 0.00 C ATOM 168 CD1 LEU A 14 26.235 47.158 16.446 1.00 0.00 C ATOM 169 CD2 LEU A 14 25.597 49.369 17.393 1.00 0.00 C ATOM 0 H LEU A 14 26.454 49.480 13.407 1.00 0.00 H new ATOM 0 HA LEU A 14 26.604 51.220 15.724 1.00 0.00 H new ATOM 0 HB2 LEU A 14 27.881 48.561 14.930 1.00 0.00 H new ATOM 0 HB3 LEU A 14 28.112 49.297 16.503 1.00 0.00 H new ATOM 0 HG LEU A 14 25.338 48.778 15.339 1.00 0.00 H new ATOM 0 HD11 LEU A 14 25.280 46.750 16.778 1.00 0.00 H new ATOM 0 HD12 LEU A 14 26.563 46.631 15.550 1.00 0.00 H new ATOM 0 HD13 LEU A 14 26.978 47.031 17.234 1.00 0.00 H new ATOM 0 HD21 LEU A 14 24.644 48.950 17.716 1.00 0.00 H new ATOM 0 HD22 LEU A 14 26.335 49.244 18.185 1.00 0.00 H new ATOM 0 HD23 LEU A 14 25.472 50.430 17.177 1.00 0.00 H new ATOM 181 N GLN A 15 29.338 50.949 13.864 1.00 0.00 N ATOM 182 CA GLN A 15 30.638 51.659 13.631 1.00 0.00 C ATOM 183 C GLN A 15 30.393 53.116 13.181 1.00 0.00 C ATOM 184 O GLN A 15 31.270 53.950 13.292 1.00 0.00 O ATOM 185 CB GLN A 15 31.446 50.911 12.560 1.00 0.00 C ATOM 186 CG GLN A 15 31.801 49.511 13.076 1.00 0.00 C ATOM 187 CD GLN A 15 33.318 49.354 13.227 1.00 0.00 C ATOM 188 OE1 GLN A 15 34.084 49.864 12.434 1.00 0.00 O ATOM 189 NE2 GLN A 15 33.786 48.661 14.225 1.00 0.00 N ATOM 0 H GLN A 15 29.144 50.173 13.231 1.00 0.00 H new ATOM 0 HA GLN A 15 31.198 51.678 14.566 1.00 0.00 H new ATOM 0 HB2 GLN A 15 30.868 50.836 11.639 1.00 0.00 H new ATOM 0 HB3 GLN A 15 32.354 51.464 12.322 1.00 0.00 H new ATOM 0 HG2 GLN A 15 31.316 49.339 14.037 1.00 0.00 H new ATOM 0 HG3 GLN A 15 31.420 48.757 12.387 1.00 0.00 H new ATOM 0 HE21 GLN A 15 33.145 48.232 14.893 1.00 0.00 H new ATOM 0 HE22 GLN A 15 34.793 48.548 14.339 1.00 0.00 H new ATOM 198 N THR A 16 29.231 53.424 12.658 1.00 0.00 N ATOM 199 CA THR A 16 28.962 54.823 12.183 1.00 0.00 C ATOM 200 C THR A 16 28.095 55.606 13.182 1.00 0.00 C ATOM 201 O THR A 16 28.401 56.732 13.526 1.00 0.00 O ATOM 202 CB THR A 16 28.214 54.774 10.842 1.00 0.00 C ATOM 203 OG1 THR A 16 28.739 53.727 10.029 1.00 0.00 O ATOM 204 CG2 THR A 16 28.371 56.113 10.118 1.00 0.00 C ATOM 0 H THR A 16 28.457 52.771 12.539 1.00 0.00 H new ATOM 0 HA THR A 16 29.924 55.324 12.080 1.00 0.00 H new ATOM 0 HB THR A 16 27.157 54.584 11.030 1.00 0.00 H new ATOM 0 HG1 THR A 16 28.124 52.964 10.041 1.00 0.00 H new ATOM 0 HG21 THR A 16 27.840 56.077 9.167 1.00 0.00 H new ATOM 0 HG22 THR A 16 27.957 56.911 10.735 1.00 0.00 H new ATOM 0 HG23 THR A 16 29.428 56.307 9.936 1.00 0.00 H new ATOM 212 N TYR A 17 26.984 55.046 13.592 1.00 0.00 N ATOM 213 CA TYR A 17 26.053 55.774 14.514 1.00 0.00 C ATOM 214 C TYR A 17 26.226 55.293 15.960 1.00 0.00 C ATOM 215 O TYR A 17 25.719 55.899 16.885 1.00 0.00 O ATOM 216 CB TYR A 17 24.618 55.503 14.052 1.00 0.00 C ATOM 217 CG TYR A 17 24.446 55.999 12.635 1.00 0.00 C ATOM 218 CD1 TYR A 17 24.359 57.374 12.385 1.00 0.00 C ATOM 219 CD2 TYR A 17 24.367 55.088 11.570 1.00 0.00 C ATOM 220 CE1 TYR A 17 24.194 57.839 11.074 1.00 0.00 C ATOM 221 CE2 TYR A 17 24.204 55.557 10.257 1.00 0.00 C ATOM 222 CZ TYR A 17 24.118 56.932 10.012 1.00 0.00 C ATOM 223 OH TYR A 17 23.955 57.392 8.724 1.00 0.00 O ATOM 0 H TYR A 17 26.679 54.110 13.327 1.00 0.00 H new ATOM 0 HA TYR A 17 26.275 56.841 14.485 1.00 0.00 H new ATOM 0 HB2 TYR A 17 24.403 54.436 14.104 1.00 0.00 H new ATOM 0 HB3 TYR A 17 23.911 56.004 14.713 1.00 0.00 H new ATOM 0 HD1 TYR A 17 24.419 58.076 13.203 1.00 0.00 H new ATOM 0 HD2 TYR A 17 24.432 54.027 11.761 1.00 0.00 H new ATOM 0 HE1 TYR A 17 24.125 58.900 10.883 1.00 0.00 H new ATOM 0 HE2 TYR A 17 24.145 54.857 9.437 1.00 0.00 H new ATOM 0 HH TYR A 17 23.923 56.632 8.107 1.00 0.00 H new ATOM 233 N HIS A 18 26.934 54.212 16.155 1.00 0.00 N ATOM 234 CA HIS A 18 27.159 53.669 17.535 1.00 0.00 C ATOM 235 C HIS A 18 25.828 53.341 18.238 1.00 0.00 C ATOM 236 O HIS A 18 25.810 52.624 19.218 1.00 0.00 O ATOM 237 CB HIS A 18 27.951 54.688 18.364 1.00 0.00 C ATOM 238 CG HIS A 18 29.386 54.699 17.911 1.00 0.00 C ATOM 239 ND1 HIS A 18 29.836 53.917 16.861 1.00 0.00 N ATOM 240 CD2 HIS A 18 30.484 55.390 18.362 1.00 0.00 C ATOM 241 CE1 HIS A 18 31.155 54.153 16.715 1.00 0.00 C ATOM 242 NE2 HIS A 18 31.601 55.043 17.605 1.00 0.00 N ATOM 0 H HIS A 18 27.373 53.672 15.409 1.00 0.00 H new ATOM 0 HA HIS A 18 27.726 52.742 17.448 1.00 0.00 H new ATOM 0 HB2 HIS A 18 27.516 55.681 18.251 1.00 0.00 H new ATOM 0 HB3 HIS A 18 27.895 54.434 19.422 1.00 0.00 H new ATOM 0 HD1 HIS A 18 29.272 53.278 16.300 1.00 0.00 H new ATOM 0 HD2 HIS A 18 30.482 56.096 19.180 1.00 0.00 H new ATOM 0 HE1 HIS A 18 31.776 53.680 15.969 1.00 0.00 H new ATOM 250 N LYS A 19 24.721 53.856 17.764 1.00 0.00 N ATOM 251 CA LYS A 19 23.408 53.548 18.412 1.00 0.00 C ATOM 252 C LYS A 19 22.891 52.201 17.886 1.00 0.00 C ATOM 253 O LYS A 19 22.980 51.910 16.704 1.00 0.00 O ATOM 254 CB LYS A 19 22.397 54.666 18.085 0.50 0.00 C ATOM 255 CG LYS A 19 21.127 54.070 17.450 0.50 0.00 C ATOM 256 CD LYS A 19 20.115 55.180 17.129 0.50 0.00 C ATOM 257 CE LYS A 19 20.451 55.839 15.785 0.50 0.00 C ATOM 258 NZ LYS A 19 19.363 55.553 14.798 0.50 0.00 N ATOM 0 H LYS A 19 24.669 54.477 16.956 1.00 0.00 H new ATOM 0 HA LYS A 19 23.533 53.489 19.493 1.00 0.00 H new ATOM 0 HB2 LYS A 19 22.137 55.208 18.994 0.50 0.00 H new ATOM 0 HB3 LYS A 19 22.849 55.386 17.403 0.50 0.00 H new ATOM 0 HG2 LYS A 19 21.387 53.532 16.538 0.50 0.00 H new ATOM 0 HG3 LYS A 19 20.678 53.346 18.130 0.50 0.00 H new ATOM 0 HD2 LYS A 19 19.108 54.764 17.095 0.50 0.00 H new ATOM 0 HD3 LYS A 19 20.124 55.929 17.921 0.50 0.00 H new ATOM 0 HE2 LYS A 19 20.564 56.915 15.915 0.50 0.00 H new ATOM 0 HE3 LYS A 19 21.403 55.461 15.411 0.50 0.00 H new ATOM 0 HZ1 LYS A 19 19.740 54.967 14.026 0.50 0.00 H new ATOM 0 HZ2 LYS A 19 18.589 55.046 15.272 0.50 0.00 H new ATOM 0 HZ3 LYS A 19 19.003 56.448 14.409 0.50 0.00 H new ATOM 272 N LEU A 20 22.332 51.379 18.744 1.00 0.00 N ATOM 273 CA LEU A 20 21.802 50.063 18.277 1.00 0.00 C ATOM 274 C LEU A 20 20.692 50.291 17.238 1.00 0.00 C ATOM 275 O LEU A 20 19.747 51.016 17.488 1.00 0.00 O ATOM 276 CB LEU A 20 21.241 49.295 19.478 1.00 0.00 C ATOM 277 CG LEU A 20 22.261 48.252 19.935 1.00 0.00 C ATOM 278 CD1 LEU A 20 22.109 48.020 21.438 1.00 0.00 C ATOM 279 CD2 LEU A 20 22.014 46.942 19.183 1.00 0.00 C ATOM 0 H LEU A 20 22.222 51.563 19.741 1.00 0.00 H new ATOM 0 HA LEU A 20 22.604 49.486 17.817 1.00 0.00 H new ATOM 0 HB2 LEU A 20 21.019 49.984 20.293 1.00 0.00 H new ATOM 0 HB3 LEU A 20 20.304 48.809 19.207 1.00 0.00 H new ATOM 0 HG LEU A 20 23.270 48.606 19.725 1.00 0.00 H new ATOM 0 HD11 LEU A 20 22.835 47.277 21.767 1.00 0.00 H new ATOM 0 HD12 LEU A 20 22.281 48.956 21.970 1.00 0.00 H new ATOM 0 HD13 LEU A 20 21.102 47.662 21.651 1.00 0.00 H new ATOM 0 HD21 LEU A 20 22.739 46.195 19.506 1.00 0.00 H new ATOM 0 HD22 LEU A 20 21.006 46.585 19.395 1.00 0.00 H new ATOM 0 HD23 LEU A 20 22.120 47.112 18.112 1.00 0.00 H new ATOM 291 N PRO A 21 20.812 49.679 16.077 1.00 0.00 N ATOM 292 CA PRO A 21 19.822 49.821 14.975 1.00 0.00 C ATOM 293 C PRO A 21 18.386 49.968 15.486 1.00 0.00 C ATOM 294 O PRO A 21 17.888 49.123 16.200 1.00 0.00 O ATOM 295 CB PRO A 21 19.989 48.528 14.181 1.00 0.00 C ATOM 296 CG PRO A 21 21.399 48.073 14.423 1.00 0.00 C ATOM 297 CD PRO A 21 21.905 48.769 15.697 1.00 0.00 C ATOM 0 HA PRO A 21 19.996 50.721 14.386 1.00 0.00 H new ATOM 0 HB2 PRO A 21 19.274 47.774 14.509 1.00 0.00 H new ATOM 0 HB3 PRO A 21 19.810 48.696 13.119 1.00 0.00 H new ATOM 0 HG2 PRO A 21 21.436 46.990 14.539 1.00 0.00 H new ATOM 0 HG3 PRO A 21 22.033 48.325 13.573 1.00 0.00 H new ATOM 0 HD2 PRO A 21 22.114 48.048 16.487 1.00 0.00 H new ATOM 0 HD3 PRO A 21 22.830 49.315 15.511 1.00 0.00 H new ATOM 305 N ASP A 22 17.743 51.039 15.111 1.00 0.00 N ATOM 306 CA ASP A 22 16.336 51.314 15.540 1.00 0.00 C ATOM 307 C ASP A 22 15.414 50.135 15.179 1.00 0.00 C ATOM 308 O ASP A 22 14.647 50.177 14.231 1.00 0.00 O ATOM 309 CB ASP A 22 15.884 52.598 14.838 1.00 0.00 C ATOM 310 CG ASP A 22 17.123 53.453 14.549 1.00 0.00 C ATOM 311 OD1 ASP A 22 17.790 53.182 13.561 1.00 0.00 O ATOM 312 OD2 ASP A 22 17.406 54.348 15.327 1.00 0.00 O ATOM 0 H ASP A 22 18.144 51.757 14.508 1.00 0.00 H new ATOM 0 HA ASP A 22 16.285 51.437 16.622 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.363 52.360 13.911 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.182 53.147 15.466 1.00 0.00 H new ATOM 317 N ASN A 23 15.506 49.079 15.945 1.00 0.00 N ATOM 318 CA ASN A 23 14.668 47.858 15.711 1.00 0.00 C ATOM 319 C ASN A 23 15.128 46.707 16.630 1.00 0.00 C ATOM 320 O ASN A 23 14.755 45.565 16.425 1.00 0.00 O ATOM 321 CB ASN A 23 14.827 47.404 14.259 1.00 0.00 C ATOM 322 CG ASN A 23 16.313 47.326 13.918 1.00 0.00 C ATOM 323 OD1 ASN A 23 16.870 48.239 13.344 1.00 0.00 O ATOM 324 ND2 ASN A 23 16.986 46.270 14.245 1.00 0.00 N ATOM 0 H ASN A 23 16.140 49.008 16.741 1.00 0.00 H new ATOM 0 HA ASN A 23 13.628 48.105 15.925 1.00 0.00 H new ATOM 0 HB2 ASN A 23 14.357 46.431 14.116 1.00 0.00 H new ATOM 0 HB3 ASN A 23 14.324 48.102 13.590 1.00 0.00 H new ATOM 0 HD21 ASN A 23 17.979 46.208 14.020 1.00 0.00 H new ATOM 0 HD22 ASN A 23 16.523 45.500 14.728 1.00 0.00 H new ATOM 331 N TYR A 24 15.941 46.991 17.632 1.00 0.00 N ATOM 332 CA TYR A 24 16.435 45.903 18.532 1.00 0.00 C ATOM 333 C TYR A 24 15.888 46.073 19.950 1.00 0.00 C ATOM 334 O TYR A 24 15.386 47.118 20.321 1.00 0.00 O ATOM 335 CB TYR A 24 17.966 45.955 18.579 1.00 0.00 C ATOM 336 CG TYR A 24 18.523 45.127 17.453 1.00 0.00 C ATOM 337 CD1 TYR A 24 18.501 43.736 17.532 1.00 0.00 C ATOM 338 CD2 TYR A 24 19.037 45.754 16.322 1.00 0.00 C ATOM 339 CE1 TYR A 24 18.996 42.970 16.474 1.00 0.00 C ATOM 340 CE2 TYR A 24 19.533 44.991 15.266 1.00 0.00 C ATOM 341 CZ TYR A 24 19.512 43.598 15.342 1.00 0.00 C ATOM 342 OH TYR A 24 19.997 42.846 14.294 1.00 0.00 O ATOM 0 H TYR A 24 16.278 47.927 17.859 1.00 0.00 H new ATOM 0 HA TYR A 24 16.093 44.945 18.141 1.00 0.00 H new ATOM 0 HB2 TYR A 24 18.310 46.986 18.493 1.00 0.00 H new ATOM 0 HB3 TYR A 24 18.326 45.578 19.536 1.00 0.00 H new ATOM 0 HD1 TYR A 24 18.102 43.251 18.410 1.00 0.00 H new ATOM 0 HD2 TYR A 24 19.052 46.832 16.262 1.00 0.00 H new ATOM 0 HE1 TYR A 24 18.979 41.892 16.533 1.00 0.00 H new ATOM 0 HE2 TYR A 24 19.933 45.478 14.389 1.00 0.00 H new ATOM 0 HH TYR A 24 20.310 41.980 14.630 1.00 0.00 H new ATOM 352 N ILE A 25 16.003 45.047 20.748 1.00 0.00 N ATOM 353 CA ILE A 25 15.503 45.113 22.155 1.00 0.00 C ATOM 354 C ILE A 25 16.283 44.099 22.993 1.00 0.00 C ATOM 355 O ILE A 25 16.629 43.031 22.522 1.00 0.00 O ATOM 356 CB ILE A 25 13.999 44.775 22.174 1.00 0.00 C ATOM 357 CG1 ILE A 25 13.642 44.016 20.891 1.00 0.00 C ATOM 358 CG2 ILE A 25 13.180 46.070 22.234 1.00 0.00 C ATOM 359 CD1 ILE A 25 12.278 43.345 21.040 1.00 0.00 C ATOM 0 H ILE A 25 16.426 44.157 20.485 1.00 0.00 H new ATOM 0 HA ILE A 25 15.644 46.113 22.566 1.00 0.00 H new ATOM 0 HB ILE A 25 13.774 44.162 23.047 1.00 0.00 H new ATOM 0 HG12 ILE A 25 13.627 44.703 20.045 1.00 0.00 H new ATOM 0 HG13 ILE A 25 14.404 43.266 20.679 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.117 45.828 22.247 1.00 0.00 H new ATOM 0 HG22 ILE A 25 13.438 46.622 23.138 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.402 46.682 21.360 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.034 42.809 20.123 1.00 0.00 H new ATOM 0 HD12 ILE A 25 12.307 42.644 21.874 1.00 0.00 H new ATOM 0 HD13 ILE A 25 11.518 44.103 21.230 1.00 0.00 H new ATOM 371 N THR A 26 16.541 44.401 24.237 1.00 0.00 N ATOM 372 CA THR A 26 17.306 43.434 25.085 1.00 0.00 C ATOM 373 C THR A 26 16.474 42.174 25.305 1.00 0.00 C ATOM 374 O THR A 26 15.253 42.214 25.305 1.00 0.00 O ATOM 375 CB THR A 26 17.600 44.060 26.451 1.00 0.00 C ATOM 376 OG1 THR A 26 16.370 44.355 27.083 1.00 0.00 O ATOM 377 CG2 THR A 26 18.406 45.352 26.280 1.00 0.00 C ATOM 0 H THR A 26 16.260 45.265 24.701 1.00 0.00 H new ATOM 0 HA THR A 26 18.239 43.187 24.578 1.00 0.00 H new ATOM 0 HB THR A 26 18.181 43.363 27.055 1.00 0.00 H new ATOM 0 HG1 THR A 26 15.788 44.834 26.457 1.00 0.00 H new ATOM 0 HG21 THR A 26 18.608 45.787 27.259 1.00 0.00 H new ATOM 0 HG22 THR A 26 19.349 45.129 25.780 1.00 0.00 H new ATOM 0 HG23 THR A 26 17.835 46.060 25.679 1.00 0.00 H new ATOM 385 N LYS A 27 17.115 41.053 25.526 1.00 0.00 N ATOM 386 CA LYS A 27 16.347 39.810 25.786 1.00 0.00 C ATOM 387 C LYS A 27 15.358 40.092 26.923 1.00 0.00 C ATOM 388 O LYS A 27 14.169 39.851 26.795 1.00 0.00 O ATOM 389 CB LYS A 27 17.313 38.689 26.197 1.00 0.00 C ATOM 390 CG LYS A 27 17.300 37.568 25.146 1.00 0.00 C ATOM 391 CD LYS A 27 18.716 37.372 24.581 1.00 0.00 C ATOM 392 CE LYS A 27 18.976 38.382 23.454 1.00 0.00 C ATOM 393 NZ LYS A 27 20.447 38.486 23.209 1.00 0.00 N ATOM 0 H LYS A 27 18.130 40.951 25.536 1.00 0.00 H new ATOM 0 HA LYS A 27 15.809 39.497 24.891 1.00 0.00 H new ATOM 0 HB2 LYS A 27 18.322 39.088 26.302 1.00 0.00 H new ATOM 0 HB3 LYS A 27 17.026 38.289 27.170 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.945 36.640 25.594 1.00 0.00 H new ATOM 0 HG3 LYS A 27 16.608 37.818 24.342 1.00 0.00 H new ATOM 0 HD2 LYS A 27 19.454 37.501 25.373 1.00 0.00 H new ATOM 0 HD3 LYS A 27 18.828 36.356 24.203 1.00 0.00 H new ATOM 0 HE2 LYS A 27 18.466 38.067 22.544 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.572 39.357 23.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 20.842 39.255 23.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 20.906 37.589 23.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.618 38.687 22.203 1.00 0.00 H new ATOM 407 N SER A 28 15.833 40.626 28.027 1.00 0.00 N ATOM 408 CA SER A 28 14.913 40.943 29.168 1.00 0.00 C ATOM 409 C SER A 28 13.681 41.687 28.650 1.00 0.00 C ATOM 410 O SER A 28 12.558 41.215 28.787 1.00 0.00 O ATOM 411 CB SER A 28 15.637 41.805 30.200 0.50 0.00 C ATOM 412 OG SER A 28 14.675 42.461 31.014 0.50 0.00 O ATOM 0 H SER A 28 16.814 40.855 28.186 1.00 0.00 H new ATOM 0 HA SER A 28 14.600 40.011 29.638 1.00 0.00 H new ATOM 0 HB2 SER A 28 16.291 41.186 30.815 0.50 0.00 H new ATOM 0 HB3 SER A 28 16.270 42.538 29.700 0.50 0.00 H new ATOM 0 HG SER A 28 15.133 43.015 31.680 0.50 0.00 H new ATOM 418 N GLU A 29 13.874 42.824 28.025 1.00 0.00 N ATOM 419 CA GLU A 29 12.709 43.571 27.468 1.00 0.00 C ATOM 420 C GLU A 29 11.833 42.611 26.648 1.00 0.00 C ATOM 421 O GLU A 29 10.650 42.442 26.914 1.00 0.00 O ATOM 422 CB GLU A 29 13.216 44.701 26.561 1.00 0.00 C ATOM 423 CG GLU A 29 13.857 45.813 27.405 1.00 0.00 C ATOM 424 CD GLU A 29 14.686 46.714 26.499 1.00 0.00 C ATOM 425 OE1 GLU A 29 15.506 46.180 25.755 1.00 0.00 O ATOM 426 OE2 GLU A 29 14.482 47.917 26.549 1.00 0.00 O ATOM 0 H GLU A 29 14.783 43.263 27.879 1.00 0.00 H new ATOM 0 HA GLU A 29 12.122 43.994 28.283 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.944 44.308 25.851 1.00 0.00 H new ATOM 0 HB3 GLU A 29 12.390 45.108 25.978 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.085 46.395 27.909 1.00 0.00 H new ATOM 0 HG3 GLU A 29 14.487 45.379 28.182 1.00 0.00 H new ATOM 433 N ALA A 30 12.408 41.970 25.658 1.00 0.00 N ATOM 434 CA ALA A 30 11.620 41.017 24.823 1.00 0.00 C ATOM 435 C ALA A 30 10.908 39.993 25.711 1.00 0.00 C ATOM 436 O ALA A 30 9.721 39.752 25.570 1.00 0.00 O ATOM 437 CB ALA A 30 12.567 40.296 23.865 1.00 0.00 C ATOM 0 H ALA A 30 13.389 42.068 25.395 1.00 0.00 H new ATOM 0 HA ALA A 30 10.869 41.569 24.259 1.00 0.00 H new ATOM 0 HB1 ALA A 30 12.000 39.597 23.250 1.00 0.00 H new ATOM 0 HB2 ALA A 30 13.061 41.026 23.223 1.00 0.00 H new ATOM 0 HB3 ALA A 30 13.317 39.750 24.437 1.00 0.00 H new ATOM 443 N GLN A 31 11.625 39.393 26.621 1.00 0.00 N ATOM 444 CA GLN A 31 11.008 38.384 27.526 1.00 0.00 C ATOM 445 C GLN A 31 9.939 39.053 28.407 1.00 0.00 C ATOM 446 O GLN A 31 8.828 38.559 28.538 1.00 0.00 O ATOM 447 CB GLN A 31 12.107 37.783 28.405 1.00 0.00 C ATOM 448 CG GLN A 31 13.136 37.066 27.520 1.00 0.00 C ATOM 449 CD GLN A 31 14.322 36.619 28.373 1.00 0.00 C ATOM 450 OE1 GLN A 31 15.363 37.238 28.363 1.00 0.00 O ATOM 451 NE2 GLN A 31 14.201 35.567 29.125 1.00 0.00 N ATOM 0 H GLN A 31 12.619 39.560 26.777 1.00 0.00 H new ATOM 0 HA GLN A 31 10.531 37.600 26.938 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.594 38.568 28.984 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.674 37.082 29.119 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.677 36.204 27.037 1.00 0.00 H new ATOM 0 HG3 GLN A 31 13.476 37.732 26.727 1.00 0.00 H new ATOM 0 HE21 GLN A 31 13.325 35.045 29.134 1.00 0.00 H new ATOM 0 HE22 GLN A 31 14.982 35.263 29.706 1.00 0.00 H new ATOM 460 N ALA A 32 10.263 40.176 29.020 1.00 0.00 N ATOM 461 CA ALA A 32 9.272 40.878 29.896 1.00 0.00 C ATOM 462 C ALA A 32 8.098 41.403 29.060 1.00 0.00 C ATOM 463 O ALA A 32 6.975 41.469 29.523 1.00 0.00 O ATOM 464 CB ALA A 32 9.952 42.058 30.615 1.00 0.00 C ATOM 0 H ALA A 32 11.172 40.632 28.948 1.00 0.00 H new ATOM 0 HA ALA A 32 8.897 40.168 30.633 1.00 0.00 H new ATOM 0 HB1 ALA A 32 9.225 42.564 31.251 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.773 41.686 31.228 1.00 0.00 H new ATOM 0 HB3 ALA A 32 10.339 42.760 29.876 1.00 0.00 H new ATOM 470 N LEU A 33 8.342 41.771 27.830 1.00 0.00 N ATOM 471 CA LEU A 33 7.244 42.295 26.970 1.00 0.00 C ATOM 472 C LEU A 33 6.255 41.160 26.670 1.00 0.00 C ATOM 473 O LEU A 33 5.120 41.397 26.294 1.00 0.00 O ATOM 474 CB LEU A 33 7.849 42.817 25.662 1.00 0.00 C ATOM 475 CG LEU A 33 8.332 44.268 25.840 1.00 0.00 C ATOM 476 CD1 LEU A 33 9.507 44.537 24.896 1.00 0.00 C ATOM 477 CD2 LEU A 33 7.184 45.218 25.495 1.00 0.00 C ATOM 0 H LEU A 33 9.258 41.731 27.384 1.00 0.00 H new ATOM 0 HA LEU A 33 6.719 43.104 27.478 1.00 0.00 H new ATOM 0 HB2 LEU A 33 8.683 42.183 25.360 1.00 0.00 H new ATOM 0 HB3 LEU A 33 7.107 42.768 24.865 1.00 0.00 H new ATOM 0 HG LEU A 33 8.651 44.425 26.870 1.00 0.00 H new ATOM 0 HD11 LEU A 33 9.848 45.564 25.023 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.323 43.853 25.127 1.00 0.00 H new ATOM 0 HD13 LEU A 33 9.187 44.386 23.865 1.00 0.00 H new ATOM 0 HD21 LEU A 33 7.516 46.249 25.618 1.00 0.00 H new ATOM 0 HD22 LEU A 33 6.876 45.056 24.462 1.00 0.00 H new ATOM 0 HD23 LEU A 33 6.341 45.026 26.159 1.00 0.00 H new ATOM 489 N GLY A 34 6.666 39.926 26.873 1.00 0.00 N ATOM 490 CA GLY A 34 5.738 38.773 26.621 1.00 0.00 C ATOM 491 C GLY A 34 6.400 37.733 25.708 1.00 0.00 C ATOM 492 O GLY A 34 5.817 36.712 25.396 1.00 0.00 O ATOM 0 H GLY A 34 7.598 39.670 27.200 1.00 0.00 H new ATOM 0 HA2 GLY A 34 5.461 38.309 27.568 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.818 39.134 26.162 1.00 0.00 H new ATOM 496 N TRP A 35 7.620 37.964 25.292 1.00 0.00 N ATOM 497 CA TRP A 35 8.314 36.968 24.418 1.00 0.00 C ATOM 498 C TRP A 35 8.415 35.638 25.171 1.00 0.00 C ATOM 499 O TRP A 35 9.060 35.547 26.199 1.00 0.00 O ATOM 500 CB TRP A 35 9.721 37.476 24.060 1.00 0.00 C ATOM 501 CG TRP A 35 10.404 36.488 23.166 1.00 0.00 C ATOM 502 CD1 TRP A 35 9.838 35.895 22.090 1.00 0.00 C ATOM 503 CD2 TRP A 35 11.763 35.963 23.257 1.00 0.00 C ATOM 504 NE1 TRP A 35 10.757 35.031 21.522 1.00 0.00 N ATOM 505 CE2 TRP A 35 11.960 35.041 22.201 1.00 0.00 C ATOM 506 CE3 TRP A 35 12.829 36.193 24.146 1.00 0.00 C ATOM 507 CZ2 TRP A 35 13.170 34.371 22.030 1.00 0.00 C ATOM 508 CZ3 TRP A 35 14.054 35.518 23.980 1.00 0.00 C ATOM 509 CH2 TRP A 35 14.222 34.607 22.922 1.00 0.00 C ATOM 0 H TRP A 35 8.164 38.796 25.519 1.00 0.00 H new ATOM 0 HA TRP A 35 7.749 36.828 23.496 1.00 0.00 H new ATOM 0 HB2 TRP A 35 9.653 38.444 23.563 1.00 0.00 H new ATOM 0 HB3 TRP A 35 10.306 37.624 24.968 1.00 0.00 H new ATOM 0 HD1 TRP A 35 8.833 36.068 21.733 1.00 0.00 H new ATOM 0 HE1 TRP A 35 10.569 34.456 20.701 1.00 0.00 H new ATOM 0 HE3 TRP A 35 12.707 36.891 24.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 13.295 33.674 21.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 14.867 35.701 24.667 1.00 0.00 H new ATOM 0 HH2 TRP A 35 15.162 34.090 22.798 1.00 0.00 H new ATOM 520 N VAL A 36 7.756 34.615 24.685 1.00 0.00 N ATOM 521 CA VAL A 36 7.794 33.295 25.387 1.00 0.00 C ATOM 522 C VAL A 36 8.347 32.203 24.457 1.00 0.00 C ATOM 523 O VAL A 36 7.974 32.096 23.295 1.00 0.00 O ATOM 524 CB VAL A 36 6.378 32.926 25.828 1.00 0.00 C ATOM 525 CG1 VAL A 36 6.320 31.439 26.193 1.00 0.00 C ATOM 526 CG2 VAL A 36 5.991 33.760 27.056 1.00 0.00 C ATOM 0 H VAL A 36 7.194 34.637 23.834 1.00 0.00 H new ATOM 0 HA VAL A 36 8.448 33.371 26.255 1.00 0.00 H new ATOM 0 HB VAL A 36 5.685 33.128 25.011 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.309 31.181 26.507 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.595 30.840 25.325 1.00 0.00 H new ATOM 0 HG13 VAL A 36 7.015 31.237 27.008 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.981 33.497 27.371 1.00 0.00 H new ATOM 0 HG22 VAL A 36 6.689 33.557 27.868 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.028 34.819 26.803 1.00 0.00 H new ATOM 536 N ALA A 37 9.219 31.377 24.983 1.00 0.00 N ATOM 537 CA ALA A 37 9.815 30.268 24.184 1.00 0.00 C ATOM 538 C ALA A 37 8.714 29.398 23.591 1.00 0.00 C ATOM 539 O ALA A 37 8.643 29.213 22.396 1.00 0.00 O ATOM 540 CB ALA A 37 10.690 29.412 25.096 1.00 0.00 C ATOM 0 H ALA A 37 9.546 31.428 25.948 1.00 0.00 H new ATOM 0 HA ALA A 37 10.412 30.690 23.375 1.00 0.00 H new ATOM 0 HB1 ALA A 37 11.130 28.598 24.519 1.00 0.00 H new ATOM 0 HB2 ALA A 37 11.484 30.027 25.520 1.00 0.00 H new ATOM 0 HB3 ALA A 37 10.082 28.999 25.901 1.00 0.00 H new ATOM 546 N SER A 38 7.856 28.861 24.411 1.00 0.00 N ATOM 547 CA SER A 38 6.768 27.997 23.879 1.00 0.00 C ATOM 548 C SER A 38 5.724 28.864 23.159 1.00 0.00 C ATOM 549 O SER A 38 4.534 28.762 23.402 1.00 0.00 O ATOM 550 CB SER A 38 6.125 27.238 25.038 1.00 0.00 C ATOM 551 OG SER A 38 5.323 28.134 25.794 1.00 0.00 O ATOM 0 H SER A 38 7.861 28.983 25.424 1.00 0.00 H new ATOM 0 HA SER A 38 7.175 27.282 23.164 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.516 26.418 24.658 1.00 0.00 H new ATOM 0 HB3 SER A 38 6.895 26.797 25.671 1.00 0.00 H new ATOM 0 HG SER A 38 4.553 28.416 25.257 1.00 0.00 H new ATOM 557 N LYS A 39 6.170 29.711 22.271 1.00 0.00 N ATOM 558 CA LYS A 39 5.227 30.592 21.521 1.00 0.00 C ATOM 559 C LYS A 39 5.973 31.330 20.404 1.00 0.00 C ATOM 560 O LYS A 39 5.557 31.321 19.262 1.00 0.00 O ATOM 561 CB LYS A 39 4.615 31.615 22.479 1.00 0.00 C ATOM 562 CG LYS A 39 3.520 32.405 21.758 1.00 0.00 C ATOM 563 CD LYS A 39 2.590 33.041 22.798 1.00 0.00 C ATOM 564 CE LYS A 39 1.176 33.174 22.230 1.00 0.00 C ATOM 565 NZ LYS A 39 0.586 31.814 22.056 1.00 0.00 N ATOM 0 H LYS A 39 7.154 29.832 22.031 1.00 0.00 H new ATOM 0 HA LYS A 39 4.440 29.978 21.083 1.00 0.00 H new ATOM 0 HB2 LYS A 39 4.198 31.109 23.350 1.00 0.00 H new ATOM 0 HB3 LYS A 39 5.386 32.293 22.844 1.00 0.00 H new ATOM 0 HG2 LYS A 39 3.965 33.177 21.130 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.953 31.747 21.100 1.00 0.00 H new ATOM 0 HD2 LYS A 39 2.571 32.431 23.701 1.00 0.00 H new ATOM 0 HD3 LYS A 39 2.969 34.022 23.084 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.556 33.769 22.901 1.00 0.00 H new ATOM 0 HE3 LYS A 39 1.203 33.697 21.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -0.446 31.866 22.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 0.811 31.457 21.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 0.982 31.170 22.770 1.00 0.00 H new ATOM 579 N GLY A 40 7.071 31.973 20.728 1.00 0.00 N ATOM 580 CA GLY A 40 7.840 32.720 19.678 1.00 0.00 C ATOM 581 C GLY A 40 7.084 34.002 19.305 1.00 0.00 C ATOM 582 O GLY A 40 7.335 34.609 18.282 1.00 0.00 O ATOM 0 H GLY A 40 7.466 32.013 21.667 1.00 0.00 H new ATOM 0 HA2 GLY A 40 8.835 32.967 20.048 1.00 0.00 H new ATOM 0 HA3 GLY A 40 7.974 32.094 18.796 1.00 0.00 H new ATOM 586 N ASN A 41 6.147 34.414 20.127 1.00 0.00 N ATOM 587 CA ASN A 41 5.368 35.649 19.816 1.00 0.00 C ATOM 588 C ASN A 41 6.331 36.804 19.543 1.00 0.00 C ATOM 589 O ASN A 41 7.189 37.117 20.346 1.00 0.00 O ATOM 590 CB ASN A 41 4.434 36.014 20.987 1.00 0.00 C ATOM 591 CG ASN A 41 5.147 35.870 22.333 1.00 0.00 C ATOM 592 OD1 ASN A 41 5.612 34.803 22.688 1.00 0.00 O ATOM 593 ND2 ASN A 41 5.231 36.906 23.116 1.00 0.00 N ATOM 0 H ASN A 41 5.891 33.948 20.997 1.00 0.00 H new ATOM 0 HA ASN A 41 4.757 35.464 18.933 1.00 0.00 H new ATOM 0 HB2 ASN A 41 4.081 37.038 20.868 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.555 35.370 20.968 1.00 0.00 H new ATOM 0 HD21 ASN A 41 5.686 36.823 24.025 1.00 0.00 H new ATOM 0 HD22 ASN A 41 4.842 37.801 22.821 1.00 0.00 H new ATOM 600 N LEU A 42 6.184 37.431 18.412 1.00 0.00 N ATOM 601 CA LEU A 42 7.060 38.591 18.060 1.00 0.00 C ATOM 602 C LEU A 42 6.413 39.359 16.909 1.00 0.00 C ATOM 603 O LEU A 42 6.145 40.530 17.007 1.00 0.00 O ATOM 604 CB LEU A 42 8.433 38.074 17.601 1.00 0.00 C ATOM 605 CG LEU A 42 9.520 39.130 17.858 1.00 0.00 C ATOM 606 CD1 LEU A 42 9.967 39.090 19.315 1.00 0.00 C ATOM 607 CD2 LEU A 42 10.741 38.851 16.973 1.00 0.00 C ATOM 0 H LEU A 42 5.488 37.190 17.706 1.00 0.00 H new ATOM 0 HA LEU A 42 7.183 39.238 18.928 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.678 37.155 18.133 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.400 37.829 16.539 1.00 0.00 H new ATOM 0 HG LEU A 42 9.102 40.110 17.627 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.737 39.844 19.480 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.114 39.294 19.963 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.370 38.104 19.545 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.506 39.604 17.161 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.139 37.863 17.204 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.446 38.888 15.924 1.00 0.00 H new ATOM 619 N ALA A 43 6.166 38.694 15.823 1.00 0.00 N ATOM 620 CA ALA A 43 5.535 39.356 14.635 1.00 0.00 C ATOM 621 C ALA A 43 4.253 40.098 15.050 1.00 0.00 C ATOM 622 O ALA A 43 3.893 41.113 14.484 1.00 0.00 O ATOM 623 CB ALA A 43 5.176 38.281 13.593 1.00 0.00 C ATOM 0 H ALA A 43 6.375 37.704 15.697 1.00 0.00 H new ATOM 0 HA ALA A 43 6.240 40.073 14.214 1.00 0.00 H new ATOM 0 HB1 ALA A 43 4.716 38.754 12.725 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.081 37.757 13.284 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.476 37.569 14.031 1.00 0.00 H new ATOM 629 N ASP A 44 3.549 39.572 16.012 1.00 0.00 N ATOM 630 CA ASP A 44 2.270 40.195 16.459 1.00 0.00 C ATOM 631 C ASP A 44 2.548 41.507 17.195 1.00 0.00 C ATOM 632 O ASP A 44 2.207 42.577 16.734 1.00 0.00 O ATOM 633 CB ASP A 44 1.566 39.210 17.396 1.00 0.00 C ATOM 634 CG ASP A 44 2.619 38.439 18.195 1.00 0.00 C ATOM 635 OD1 ASP A 44 3.177 37.506 17.647 1.00 0.00 O ATOM 636 OD2 ASP A 44 2.860 38.794 19.336 1.00 0.00 O ATOM 0 H ASP A 44 3.809 38.724 16.516 1.00 0.00 H new ATOM 0 HA ASP A 44 1.640 40.416 15.597 1.00 0.00 H new ATOM 0 HB2 ASP A 44 0.899 39.745 18.072 1.00 0.00 H new ATOM 0 HB3 ASP A 44 0.950 38.519 16.821 1.00 0.00 H new ATOM 641 N VAL A 45 3.201 41.424 18.317 1.00 0.00 N ATOM 642 CA VAL A 45 3.525 42.633 19.105 1.00 0.00 C ATOM 643 C VAL A 45 4.586 43.449 18.362 1.00 0.00 C ATOM 644 O VAL A 45 4.655 44.660 18.492 1.00 0.00 O ATOM 645 CB VAL A 45 4.019 42.181 20.494 1.00 0.00 C ATOM 646 CG1 VAL A 45 2.895 41.402 21.189 1.00 0.00 C ATOM 647 CG2 VAL A 45 5.225 41.248 20.360 1.00 0.00 C ATOM 0 H VAL A 45 3.529 40.549 18.726 1.00 0.00 H new ATOM 0 HA VAL A 45 2.650 43.269 19.234 1.00 0.00 H new ATOM 0 HB VAL A 45 4.303 43.064 21.067 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.232 41.077 22.173 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.021 42.044 21.299 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.632 40.531 20.589 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.559 40.940 21.351 1.00 0.00 H new ATOM 0 HG22 VAL A 45 4.942 40.368 19.783 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.035 41.771 19.851 1.00 0.00 H new ATOM 657 N ALA A 46 5.415 42.795 17.588 1.00 0.00 N ATOM 658 CA ALA A 46 6.478 43.518 16.843 1.00 0.00 C ATOM 659 C ALA A 46 6.630 42.916 15.428 1.00 0.00 C ATOM 660 O ALA A 46 7.574 42.196 15.161 1.00 0.00 O ATOM 661 CB ALA A 46 7.775 43.338 17.627 1.00 0.00 C ATOM 0 H ALA A 46 5.397 41.786 17.442 1.00 0.00 H new ATOM 0 HA ALA A 46 6.231 44.574 16.737 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.585 43.855 17.113 1.00 0.00 H new ATOM 0 HB2 ALA A 46 7.656 43.754 18.628 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.011 42.276 17.701 1.00 0.00 H new ATOM 667 N PRO A 47 5.727 43.221 14.520 1.00 0.00 N ATOM 668 CA PRO A 47 5.784 42.688 13.123 1.00 0.00 C ATOM 669 C PRO A 47 7.066 43.065 12.352 1.00 0.00 C ATOM 670 O PRO A 47 6.994 43.579 11.255 1.00 0.00 O ATOM 671 CB PRO A 47 4.559 43.288 12.416 1.00 0.00 C ATOM 672 CG PRO A 47 3.709 43.918 13.472 1.00 0.00 C ATOM 673 CD PRO A 47 4.565 44.104 14.725 1.00 0.00 C ATOM 0 HA PRO A 47 5.789 41.598 13.152 1.00 0.00 H new ATOM 0 HB2 PRO A 47 4.865 44.027 11.676 1.00 0.00 H new ATOM 0 HB3 PRO A 47 4.004 42.515 11.884 1.00 0.00 H new ATOM 0 HG2 PRO A 47 3.325 44.878 13.128 1.00 0.00 H new ATOM 0 HG3 PRO A 47 2.846 43.289 13.691 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.873 45.143 14.843 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.014 43.831 15.625 1.00 0.00 H new ATOM 681 N GLY A 48 8.230 42.793 12.889 1.00 0.00 N ATOM 682 CA GLY A 48 9.487 43.124 12.134 1.00 0.00 C ATOM 683 C GLY A 48 10.551 43.675 13.076 1.00 0.00 C ATOM 684 O GLY A 48 11.256 44.607 12.752 1.00 0.00 O ATOM 0 H GLY A 48 8.368 42.363 13.803 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.863 42.231 11.635 1.00 0.00 H new ATOM 0 HA3 GLY A 48 9.268 43.856 11.356 1.00 0.00 H new ATOM 688 N LYS A 49 10.684 43.097 14.230 1.00 0.00 N ATOM 689 CA LYS A 49 11.715 43.587 15.191 1.00 0.00 C ATOM 690 C LYS A 49 12.650 42.432 15.565 1.00 0.00 C ATOM 691 O LYS A 49 12.239 41.289 15.607 1.00 0.00 O ATOM 692 CB LYS A 49 11.021 44.142 16.439 1.00 0.00 C ATOM 693 CG LYS A 49 11.800 45.352 16.956 1.00 0.00 C ATOM 694 CD LYS A 49 11.014 46.026 18.079 1.00 0.00 C ATOM 695 CE LYS A 49 11.807 47.215 18.617 1.00 0.00 C ATOM 696 NZ LYS A 49 11.018 47.863 19.704 1.00 0.00 N ATOM 0 H LYS A 49 10.127 42.307 14.554 1.00 0.00 H new ATOM 0 HA LYS A 49 12.304 44.382 14.733 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.997 44.429 16.202 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.966 43.374 17.210 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.778 45.039 17.321 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.974 46.059 16.145 1.00 0.00 H new ATOM 0 HD2 LYS A 49 10.045 46.360 17.709 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.820 45.313 18.880 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.773 46.884 18.997 1.00 0.00 H new ATOM 0 HE3 LYS A 49 12.007 47.929 17.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.547 48.676 20.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 10.106 48.189 19.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.849 47.177 20.467 1.00 0.00 H new ATOM 710 N SER A 50 13.903 42.706 15.825 1.00 0.00 N ATOM 711 CA SER A 50 14.846 41.596 16.177 1.00 0.00 C ATOM 712 C SER A 50 15.393 41.784 17.600 1.00 0.00 C ATOM 713 O SER A 50 15.767 42.867 17.996 1.00 0.00 O ATOM 714 CB SER A 50 15.991 41.580 15.160 1.00 0.00 C ATOM 715 OG SER A 50 15.439 41.661 13.846 1.00 0.00 O ATOM 0 H SER A 50 14.313 43.640 15.810 1.00 0.00 H new ATOM 0 HA SER A 50 14.316 40.644 16.146 1.00 0.00 H new ATOM 0 HB2 SER A 50 16.666 42.417 15.338 1.00 0.00 H new ATOM 0 HB3 SER A 50 16.579 40.668 15.267 1.00 0.00 H new ATOM 0 HG SER A 50 16.163 41.653 13.186 1.00 0.00 H new ATOM 721 N ILE A 51 15.446 40.730 18.374 1.00 0.00 N ATOM 722 CA ILE A 51 15.964 40.863 19.775 1.00 0.00 C ATOM 723 C ILE A 51 17.459 41.124 19.741 1.00 0.00 C ATOM 724 O ILE A 51 18.153 40.747 18.814 1.00 0.00 O ATOM 725 CB ILE A 51 15.697 39.588 20.600 1.00 0.00 C ATOM 726 CG1 ILE A 51 14.503 38.811 20.022 1.00 0.00 C ATOM 727 CG2 ILE A 51 15.399 39.983 22.055 1.00 0.00 C ATOM 728 CD1 ILE A 51 13.239 39.669 20.068 1.00 0.00 C ATOM 0 H ILE A 51 15.157 39.790 18.103 1.00 0.00 H new ATOM 0 HA ILE A 51 15.442 41.695 20.247 1.00 0.00 H new ATOM 0 HB ILE A 51 16.579 38.948 20.560 1.00 0.00 H new ATOM 0 HG12 ILE A 51 14.715 38.518 18.994 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.349 37.893 20.590 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.209 39.086 22.644 1.00 0.00 H new ATOM 0 HG22 ILE A 51 16.255 40.515 22.470 1.00 0.00 H new ATOM 0 HG23 ILE A 51 14.521 40.629 22.084 1.00 0.00 H new ATOM 0 HD11 ILE A 51 12.402 39.106 19.656 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.020 39.940 21.101 1.00 0.00 H new ATOM 0 HD13 ILE A 51 13.392 40.574 19.480 1.00 0.00 H new ATOM 740 N GLY A 52 17.972 41.758 20.751 1.00 0.00 N ATOM 741 CA GLY A 52 19.431 42.038 20.777 1.00 0.00 C ATOM 742 C GLY A 52 19.694 43.308 21.574 1.00 0.00 C ATOM 743 O GLY A 52 18.812 44.125 21.772 1.00 0.00 O ATOM 0 H GLY A 52 17.448 42.094 21.559 1.00 0.00 H new ATOM 0 HA2 GLY A 52 19.964 41.199 21.224 1.00 0.00 H new ATOM 0 HA3 GLY A 52 19.808 42.150 19.760 1.00 0.00 H new ATOM 747 N GLY A 53 20.899 43.475 22.043 1.00 0.00 N ATOM 748 CA GLY A 53 21.225 44.699 22.830 1.00 0.00 C ATOM 749 C GLY A 53 21.448 44.360 24.306 1.00 0.00 C ATOM 750 O GLY A 53 21.374 45.225 25.155 1.00 0.00 O ATOM 0 H GLY A 53 21.671 42.820 21.917 1.00 0.00 H new ATOM 0 HA2 GLY A 53 22.119 45.170 22.422 1.00 0.00 H new ATOM 0 HA3 GLY A 53 20.414 45.421 22.738 1.00 0.00 H new ATOM 754 N ASP A 54 21.716 43.122 24.626 1.00 0.00 N ATOM 755 CA ASP A 54 21.941 42.746 26.056 1.00 0.00 C ATOM 756 C ASP A 54 23.316 43.236 26.526 1.00 0.00 C ATOM 757 O ASP A 54 23.949 44.054 25.882 1.00 0.00 O ATOM 758 CB ASP A 54 21.852 41.227 26.164 1.00 0.00 C ATOM 759 CG ASP A 54 20.910 40.760 25.077 1.00 0.00 C ATOM 760 OD1 ASP A 54 19.716 40.756 25.320 1.00 0.00 O ATOM 761 OD2 ASP A 54 21.389 40.454 24.000 1.00 0.00 O ATOM 0 H ASP A 54 21.789 42.353 23.960 1.00 0.00 H new ATOM 0 HA ASP A 54 21.187 43.212 26.691 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.836 40.774 26.043 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.484 40.931 27.146 1.00 0.00 H new ATOM 766 N ILE A 55 23.762 42.769 27.666 1.00 0.00 N ATOM 767 CA ILE A 55 25.085 43.219 28.209 1.00 0.00 C ATOM 768 C ILE A 55 25.912 42.017 28.687 1.00 0.00 C ATOM 769 O ILE A 55 25.448 41.201 29.465 1.00 0.00 O ATOM 770 CB ILE A 55 24.836 44.145 29.394 1.00 0.00 C ATOM 771 CG1 ILE A 55 24.123 45.416 28.912 1.00 0.00 C ATOM 772 CG2 ILE A 55 26.169 44.515 30.047 1.00 0.00 C ATOM 773 CD1 ILE A 55 25.107 46.323 28.166 1.00 0.00 C ATOM 0 H ILE A 55 23.266 42.093 28.247 1.00 0.00 H new ATOM 0 HA ILE A 55 25.635 43.735 27.421 1.00 0.00 H new ATOM 0 HB ILE A 55 24.208 43.636 30.125 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.293 45.150 28.257 1.00 0.00 H new ATOM 0 HG13 ILE A 55 23.699 45.949 29.763 1.00 0.00 H new ATOM 0 HG21 ILE A 55 25.988 45.177 30.894 1.00 0.00 H new ATOM 0 HG22 ILE A 55 26.668 43.610 30.394 1.00 0.00 H new ATOM 0 HG23 ILE A 55 26.802 45.022 29.319 1.00 0.00 H new ATOM 0 HD11 ILE A 55 24.590 47.221 27.829 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.922 46.602 28.834 1.00 0.00 H new ATOM 0 HD13 ILE A 55 25.510 45.791 27.304 1.00 0.00 H new ATOM 785 N PHE A 56 27.131 41.902 28.223 1.00 0.00 N ATOM 786 CA PHE A 56 27.997 40.762 28.647 1.00 0.00 C ATOM 787 C PHE A 56 29.436 41.255 28.867 1.00 0.00 C ATOM 788 O PHE A 56 29.912 42.157 28.190 1.00 0.00 O ATOM 789 CB PHE A 56 27.980 39.678 27.570 1.00 0.00 C ATOM 790 CG PHE A 56 28.322 38.346 28.196 1.00 0.00 C ATOM 791 CD1 PHE A 56 27.407 37.728 29.056 1.00 0.00 C ATOM 792 CD2 PHE A 56 29.545 37.725 27.911 1.00 0.00 C ATOM 793 CE1 PHE A 56 27.712 36.489 29.630 1.00 0.00 C ATOM 794 CE2 PHE A 56 29.851 36.484 28.488 1.00 0.00 C ATOM 795 CZ PHE A 56 28.934 35.867 29.347 1.00 0.00 C ATOM 0 H PHE A 56 27.564 42.551 27.567 1.00 0.00 H new ATOM 0 HA PHE A 56 27.616 40.348 29.581 1.00 0.00 H new ATOM 0 HB2 PHE A 56 26.997 39.631 27.101 1.00 0.00 H new ATOM 0 HB3 PHE A 56 28.697 39.918 26.785 1.00 0.00 H new ATOM 0 HD1 PHE A 56 26.465 38.208 29.277 1.00 0.00 H new ATOM 0 HD2 PHE A 56 30.252 38.202 27.248 1.00 0.00 H new ATOM 0 HE1 PHE A 56 27.004 36.012 30.292 1.00 0.00 H new ATOM 0 HE2 PHE A 56 30.794 36.005 28.270 1.00 0.00 H new ATOM 0 HZ PHE A 56 29.169 34.911 29.791 1.00 0.00 H new ATOM 805 N SER A 57 30.127 40.668 29.816 1.00 0.00 N ATOM 806 CA SER A 57 31.532 41.087 30.106 1.00 0.00 C ATOM 807 C SER A 57 32.531 40.202 29.353 1.00 0.00 C ATOM 808 O SER A 57 33.687 40.541 29.220 1.00 0.00 O ATOM 809 CB SER A 57 31.787 40.989 31.612 1.00 0.00 C ATOM 810 OG SER A 57 30.722 40.252 32.223 1.00 0.00 O ATOM 0 H SER A 57 29.774 39.913 30.404 1.00 0.00 H new ATOM 0 HA SER A 57 31.668 42.116 29.773 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.741 40.496 31.800 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.852 41.986 32.048 1.00 0.00 H new ATOM 0 HG SER A 57 30.379 40.751 32.994 1.00 0.00 H new ATOM 816 N ASN A 58 32.096 39.076 28.858 1.00 0.00 N ATOM 817 CA ASN A 58 33.014 38.165 28.093 1.00 0.00 C ATOM 818 C ASN A 58 34.117 37.586 28.994 1.00 0.00 C ATOM 819 O ASN A 58 35.158 37.166 28.516 1.00 0.00 O ATOM 820 CB ASN A 58 33.646 38.940 26.931 1.00 0.00 C ATOM 821 CG ASN A 58 34.288 37.966 25.936 1.00 0.00 C ATOM 822 OD1 ASN A 58 33.892 36.821 25.837 1.00 0.00 O ATOM 823 ND2 ASN A 58 35.257 38.378 25.177 1.00 0.00 N ATOM 0 H ASN A 58 31.137 38.740 28.948 1.00 0.00 H new ATOM 0 HA ASN A 58 32.426 37.331 27.710 1.00 0.00 H new ATOM 0 HB2 ASN A 58 32.887 39.539 26.428 1.00 0.00 H new ATOM 0 HB3 ASN A 58 34.398 39.632 27.311 1.00 0.00 H new ATOM 0 HD21 ASN A 58 35.682 37.742 24.502 1.00 0.00 H new ATOM 0 HD22 ASN A 58 35.594 39.338 25.255 1.00 0.00 H new ATOM 830 N ARG A 59 33.888 37.524 30.281 1.00 0.00 N ATOM 831 CA ARG A 59 34.904 36.925 31.209 1.00 0.00 C ATOM 832 C ARG A 59 35.298 35.550 30.669 1.00 0.00 C ATOM 833 O ARG A 59 36.434 35.128 30.760 1.00 0.00 O ATOM 834 CB ARG A 59 34.273 36.721 32.598 1.00 0.00 C ATOM 835 CG ARG A 59 34.656 37.870 33.552 1.00 0.00 C ATOM 836 CD ARG A 59 33.961 37.674 34.912 1.00 0.00 C ATOM 837 NE ARG A 59 32.572 37.135 34.706 1.00 0.00 N ATOM 838 CZ ARG A 59 31.755 37.704 33.870 1.00 0.00 C ATOM 839 NH1 ARG A 59 32.005 38.893 33.438 1.00 0.00 N ATOM 840 NH2 ARG A 59 30.660 37.114 33.523 1.00 0.00 N ATOM 0 H ARG A 59 33.039 37.863 30.734 1.00 0.00 H new ATOM 0 HA ARG A 59 35.769 37.585 31.281 1.00 0.00 H new ATOM 0 HB2 ARG A 59 33.188 36.667 32.504 1.00 0.00 H new ATOM 0 HB3 ARG A 59 34.604 35.770 33.016 1.00 0.00 H new ATOM 0 HG2 ARG A 59 35.737 37.898 33.687 1.00 0.00 H new ATOM 0 HG3 ARG A 59 34.364 38.827 33.119 1.00 0.00 H new ATOM 0 HD2 ARG A 59 34.539 36.986 35.530 1.00 0.00 H new ATOM 0 HD3 ARG A 59 33.916 38.623 35.447 1.00 0.00 H new ATOM 0 HE ARG A 59 32.268 36.313 35.228 1.00 0.00 H new ATOM 0 HH11 ARG A 59 32.842 39.384 33.752 1.00 0.00 H new ATOM 0 HH12 ARG A 59 31.366 39.342 32.782 1.00 0.00 H new ATOM 0 HH21 ARG A 59 30.432 36.196 33.905 1.00 0.00 H new ATOM 0 HH22 ARG A 59 30.023 37.566 32.867 1.00 0.00 H new ATOM 854 N GLU A 60 34.338 34.839 30.140 1.00 0.00 N ATOM 855 CA GLU A 60 34.599 33.476 29.602 1.00 0.00 C ATOM 856 C GLU A 60 35.604 33.570 28.446 1.00 0.00 C ATOM 857 O GLU A 60 36.153 32.579 28.002 1.00 0.00 O ATOM 858 CB GLU A 60 33.274 32.880 29.112 1.00 0.00 C ATOM 859 CG GLU A 60 32.339 32.621 30.311 1.00 0.00 C ATOM 860 CD GLU A 60 31.961 33.940 31.010 1.00 0.00 C ATOM 861 OE1 GLU A 60 31.773 34.928 30.320 1.00 0.00 O ATOM 862 OE2 GLU A 60 31.881 33.943 32.226 1.00 0.00 O ATOM 0 H GLU A 60 33.371 35.152 30.058 1.00 0.00 H new ATOM 0 HA GLU A 60 35.018 32.835 30.377 1.00 0.00 H new ATOM 0 HB2 GLU A 60 32.797 33.562 28.408 1.00 0.00 H new ATOM 0 HB3 GLU A 60 33.460 31.949 28.577 1.00 0.00 H new ATOM 0 HG2 GLU A 60 31.436 32.114 29.970 1.00 0.00 H new ATOM 0 HG3 GLU A 60 32.829 31.956 31.022 1.00 0.00 H new ATOM 869 N GLY A 61 35.870 34.764 27.982 1.00 0.00 N ATOM 870 CA GLY A 61 36.861 34.950 26.881 1.00 0.00 C ATOM 871 C GLY A 61 36.396 34.251 25.601 1.00 0.00 C ATOM 872 O GLY A 61 37.192 33.685 24.878 1.00 0.00 O ATOM 0 H GLY A 61 35.440 35.624 28.322 1.00 0.00 H new ATOM 0 HA2 GLY A 61 37.001 36.014 26.689 1.00 0.00 H new ATOM 0 HA3 GLY A 61 37.828 34.551 27.186 1.00 0.00 H new ATOM 876 N LYS A 62 35.125 34.299 25.304 1.00 0.00 N ATOM 877 CA LYS A 62 34.619 33.649 24.059 1.00 0.00 C ATOM 878 C LYS A 62 34.742 34.645 22.895 1.00 0.00 C ATOM 879 O LYS A 62 34.568 34.291 21.743 1.00 0.00 O ATOM 880 CB LYS A 62 33.143 33.252 24.254 1.00 0.00 C ATOM 881 CG LYS A 62 32.882 31.849 23.673 1.00 0.00 C ATOM 882 CD LYS A 62 32.161 31.963 22.318 1.00 0.00 C ATOM 883 CE LYS A 62 33.160 31.810 21.167 1.00 0.00 C ATOM 884 NZ LYS A 62 33.218 33.083 20.396 1.00 0.00 N ATOM 0 H LYS A 62 34.414 34.761 25.870 1.00 0.00 H new ATOM 0 HA LYS A 62 35.202 32.755 23.839 1.00 0.00 H new ATOM 0 HB2 LYS A 62 32.894 33.265 25.315 1.00 0.00 H new ATOM 0 HB3 LYS A 62 32.496 33.981 23.765 1.00 0.00 H new ATOM 0 HG2 LYS A 62 33.825 31.317 23.548 1.00 0.00 H new ATOM 0 HG3 LYS A 62 32.277 31.266 24.368 1.00 0.00 H new ATOM 0 HD2 LYS A 62 31.390 31.196 22.243 1.00 0.00 H new ATOM 0 HD3 LYS A 62 31.659 32.928 22.246 1.00 0.00 H new ATOM 0 HE2 LYS A 62 34.147 31.562 21.557 1.00 0.00 H new ATOM 0 HE3 LYS A 62 32.859 30.990 20.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 34.031 33.059 19.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 32.341 33.198 19.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 33.323 33.882 21.053 1.00 0.00 H new ATOM 898 N LEU A 63 35.036 35.886 23.194 1.00 0.00 N ATOM 899 CA LEU A 63 35.172 36.919 22.119 1.00 0.00 C ATOM 900 C LEU A 63 36.390 37.806 22.427 1.00 0.00 C ATOM 901 O LEU A 63 36.885 37.801 23.539 1.00 0.00 O ATOM 902 CB LEU A 63 33.900 37.781 22.085 1.00 0.00 C ATOM 903 CG LEU A 63 32.683 36.898 21.784 1.00 0.00 C ATOM 904 CD1 LEU A 63 31.387 37.684 21.999 1.00 0.00 C ATOM 905 CD2 LEU A 63 32.756 36.427 20.332 1.00 0.00 C ATOM 0 H LEU A 63 35.189 36.231 24.142 1.00 0.00 H new ATOM 0 HA LEU A 63 35.309 36.436 21.152 1.00 0.00 H new ATOM 0 HB2 LEU A 63 33.766 38.287 23.041 1.00 0.00 H new ATOM 0 HB3 LEU A 63 33.995 38.557 21.325 1.00 0.00 H new ATOM 0 HG LEU A 63 32.689 36.041 22.457 1.00 0.00 H new ATOM 0 HD11 LEU A 63 30.533 37.043 21.781 1.00 0.00 H new ATOM 0 HD12 LEU A 63 31.333 38.021 23.034 1.00 0.00 H new ATOM 0 HD13 LEU A 63 31.371 38.548 21.335 1.00 0.00 H new ATOM 0 HD21 LEU A 63 31.894 35.798 20.110 1.00 0.00 H new ATOM 0 HD22 LEU A 63 32.755 37.292 19.668 1.00 0.00 H new ATOM 0 HD23 LEU A 63 33.671 35.855 20.181 1.00 0.00 H new ATOM 917 N PRO A 64 36.879 38.559 21.460 1.00 0.00 N ATOM 918 CA PRO A 64 38.052 39.462 21.666 1.00 0.00 C ATOM 919 C PRO A 64 37.991 40.190 23.024 1.00 0.00 C ATOM 920 O PRO A 64 36.921 40.558 23.496 1.00 0.00 O ATOM 921 CB PRO A 64 37.934 40.450 20.508 1.00 0.00 C ATOM 922 CG PRO A 64 37.265 39.693 19.407 1.00 0.00 C ATOM 923 CD PRO A 64 36.390 38.621 20.070 1.00 0.00 C ATOM 0 HA PRO A 64 38.998 38.921 21.682 1.00 0.00 H new ATOM 0 HB2 PRO A 64 37.350 41.324 20.795 1.00 0.00 H new ATOM 0 HB3 PRO A 64 38.915 40.810 20.198 1.00 0.00 H new ATOM 0 HG2 PRO A 64 36.660 40.360 18.793 1.00 0.00 H new ATOM 0 HG3 PRO A 64 38.004 39.236 18.749 1.00 0.00 H new ATOM 0 HD2 PRO A 64 35.334 38.890 20.031 1.00 0.00 H new ATOM 0 HD3 PRO A 64 36.492 37.658 19.569 1.00 0.00 H new ATOM 931 N GLY A 65 39.120 40.350 23.676 1.00 0.00 N ATOM 932 CA GLY A 65 39.127 41.014 25.016 1.00 0.00 C ATOM 933 C GLY A 65 40.301 41.990 25.121 1.00 0.00 C ATOM 934 O GLY A 65 40.923 42.339 24.137 1.00 0.00 O ATOM 0 H GLY A 65 40.034 40.049 23.337 1.00 0.00 H new ATOM 0 HA2 GLY A 65 38.188 41.546 25.170 1.00 0.00 H new ATOM 0 HA3 GLY A 65 39.200 40.262 25.801 1.00 0.00 H new ATOM 938 N LYS A 66 40.584 42.431 26.314 1.00 0.00 N ATOM 939 CA LYS A 66 41.701 43.402 26.560 1.00 0.00 C ATOM 940 C LYS A 66 41.643 43.802 28.040 1.00 0.00 C ATOM 941 O LYS A 66 41.040 43.121 28.852 1.00 0.00 O ATOM 942 CB LYS A 66 41.525 44.664 25.675 1.00 0.00 C ATOM 943 CG LYS A 66 40.252 45.422 26.078 1.00 0.00 C ATOM 944 CD LYS A 66 40.207 46.777 25.356 1.00 0.00 C ATOM 945 CE LYS A 66 39.960 47.907 26.366 1.00 0.00 C ATOM 946 NZ LYS A 66 38.551 47.836 26.861 1.00 0.00 N ATOM 0 H LYS A 66 40.077 42.155 27.155 1.00 0.00 H new ATOM 0 HA LYS A 66 42.659 42.945 26.314 1.00 0.00 H new ATOM 0 HB2 LYS A 66 42.393 45.315 25.780 1.00 0.00 H new ATOM 0 HB3 LYS A 66 41.468 44.376 24.625 1.00 0.00 H new ATOM 0 HG2 LYS A 66 39.371 44.834 25.823 1.00 0.00 H new ATOM 0 HG3 LYS A 66 40.233 45.573 27.157 1.00 0.00 H new ATOM 0 HD2 LYS A 66 41.146 46.948 24.830 1.00 0.00 H new ATOM 0 HD3 LYS A 66 39.417 46.771 24.605 1.00 0.00 H new ATOM 0 HE2 LYS A 66 40.655 47.820 27.201 1.00 0.00 H new ATOM 0 HE3 LYS A 66 40.144 48.874 25.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 38.277 48.756 27.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 37.917 47.599 26.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 38.478 47.103 27.595 1.00 0.00 H new ATOM 960 N SER A 67 42.205 44.925 28.392 1.00 0.00 N ATOM 961 CA SER A 67 42.125 45.387 29.808 1.00 0.00 C ATOM 962 C SER A 67 40.681 45.839 30.073 1.00 0.00 C ATOM 963 O SER A 67 40.370 47.020 30.027 1.00 0.00 O ATOM 964 CB SER A 67 43.087 46.560 30.008 1.00 0.00 C ATOM 965 OG SER A 67 42.563 47.708 29.354 1.00 0.00 O ATOM 0 H SER A 67 42.716 45.543 27.762 1.00 0.00 H new ATOM 0 HA SER A 67 42.399 44.587 30.496 1.00 0.00 H new ATOM 0 HB2 SER A 67 43.219 46.761 31.071 1.00 0.00 H new ATOM 0 HB3 SER A 67 44.069 46.313 29.605 1.00 0.00 H new ATOM 0 HG SER A 67 41.737 47.990 29.800 1.00 0.00 H new ATOM 971 N GLY A 68 39.794 44.900 30.302 1.00 0.00 N ATOM 972 CA GLY A 68 38.358 45.255 30.525 1.00 0.00 C ATOM 973 C GLY A 68 37.678 45.367 29.161 1.00 0.00 C ATOM 974 O GLY A 68 37.913 46.319 28.428 1.00 0.00 O ATOM 0 H GLY A 68 40.004 43.903 30.344 1.00 0.00 H new ATOM 0 HA2 GLY A 68 37.868 44.494 31.133 1.00 0.00 H new ATOM 0 HA3 GLY A 68 38.279 46.197 31.068 1.00 0.00 H new ATOM 978 N ARG A 69 36.862 44.405 28.796 1.00 0.00 N ATOM 979 CA ARG A 69 36.184 44.465 27.465 1.00 0.00 C ATOM 980 C ARG A 69 34.677 44.284 27.651 1.00 0.00 C ATOM 981 O ARG A 69 34.221 43.529 28.500 1.00 0.00 O ATOM 982 CB ARG A 69 36.733 43.360 26.550 1.00 0.00 C ATOM 983 CG ARG A 69 36.023 43.397 25.183 1.00 0.00 C ATOM 984 CD ARG A 69 36.718 44.405 24.263 1.00 0.00 C ATOM 985 NE ARG A 69 38.084 43.884 23.947 1.00 0.00 N ATOM 986 CZ ARG A 69 38.864 44.490 23.107 1.00 0.00 C ATOM 987 NH1 ARG A 69 38.479 45.581 22.529 1.00 0.00 N ATOM 988 NH2 ARG A 69 40.041 44.006 22.858 1.00 0.00 N ATOM 0 H ARG A 69 36.638 43.586 29.361 1.00 0.00 H new ATOM 0 HA ARG A 69 36.377 45.434 27.005 1.00 0.00 H new ATOM 0 HB2 ARG A 69 37.806 43.491 26.414 1.00 0.00 H new ATOM 0 HB3 ARG A 69 36.588 42.386 27.017 1.00 0.00 H new ATOM 0 HG2 ARG A 69 36.038 42.406 24.729 1.00 0.00 H new ATOM 0 HG3 ARG A 69 34.976 43.672 25.314 1.00 0.00 H new ATOM 0 HD2 ARG A 69 36.143 44.544 23.348 1.00 0.00 H new ATOM 0 HD3 ARG A 69 36.785 45.379 24.748 1.00 0.00 H new ATOM 0 HE ARG A 69 38.410 43.032 24.403 1.00 0.00 H new ATOM 0 HH11 ARG A 69 37.558 45.969 22.733 1.00 0.00 H new ATOM 0 HH12 ARG A 69 39.096 46.054 21.869 1.00 0.00 H new ATOM 0 HH21 ARG A 69 40.350 43.152 23.322 1.00 0.00 H new ATOM 0 HH22 ARG A 69 40.658 44.479 22.198 1.00 0.00 H new ATOM 1002 N THR A 70 33.900 44.977 26.854 1.00 0.00 N ATOM 1003 CA THR A 70 32.414 44.861 26.955 1.00 0.00 C ATOM 1004 C THR A 70 31.909 44.117 25.720 1.00 0.00 C ATOM 1005 O THR A 70 32.287 44.454 24.611 1.00 0.00 O ATOM 1006 CB THR A 70 31.795 46.257 26.966 1.00 0.00 C ATOM 1007 OG1 THR A 70 31.903 46.805 25.661 1.00 0.00 O ATOM 1008 CG2 THR A 70 32.527 47.162 27.963 1.00 0.00 C ATOM 0 H THR A 70 34.234 45.620 26.136 1.00 0.00 H new ATOM 0 HA THR A 70 32.142 44.331 27.868 1.00 0.00 H new ATOM 0 HB THR A 70 30.750 46.189 27.267 1.00 0.00 H new ATOM 0 HG1 THR A 70 32.715 46.465 25.230 1.00 0.00 H new ATOM 0 HG21 THR A 70 32.072 48.153 27.957 1.00 0.00 H new ATOM 0 HG22 THR A 70 32.454 46.735 28.963 1.00 0.00 H new ATOM 0 HG23 THR A 70 33.576 47.243 27.679 1.00 0.00 H new ATOM 1016 N TRP A 71 31.076 43.115 25.879 1.00 0.00 N ATOM 1017 CA TRP A 71 30.580 42.375 24.673 1.00 0.00 C ATOM 1018 C TRP A 71 29.042 42.299 24.663 1.00 0.00 C ATOM 1019 O TRP A 71 28.409 42.076 25.680 1.00 0.00 O ATOM 1020 CB TRP A 71 31.186 40.966 24.659 1.00 0.00 C ATOM 1021 CG TRP A 71 32.431 40.987 23.825 1.00 0.00 C ATOM 1022 CD1 TRP A 71 33.697 40.877 24.296 1.00 0.00 C ATOM 1023 CD2 TRP A 71 32.546 41.149 22.382 1.00 0.00 C ATOM 1024 NE1 TRP A 71 34.578 40.941 23.225 1.00 0.00 N ATOM 1025 CE2 TRP A 71 33.916 41.119 22.027 1.00 0.00 C ATOM 1026 CE3 TRP A 71 31.600 41.315 21.356 1.00 0.00 C ATOM 1027 CZ2 TRP A 71 34.333 41.253 20.700 1.00 0.00 C ATOM 1028 CZ3 TRP A 71 32.011 41.453 20.021 1.00 0.00 C ATOM 1029 CH2 TRP A 71 33.374 41.423 19.694 1.00 0.00 C ATOM 0 H TRP A 71 30.723 42.781 26.776 1.00 0.00 H new ATOM 0 HA TRP A 71 30.890 42.914 23.777 1.00 0.00 H new ATOM 0 HB2 TRP A 71 31.417 40.644 25.674 1.00 0.00 H new ATOM 0 HB3 TRP A 71 30.471 40.251 24.252 1.00 0.00 H new ATOM 0 HD1 TRP A 71 33.975 40.759 25.333 1.00 0.00 H new ATOM 0 HE1 TRP A 71 35.591 40.866 23.313 1.00 0.00 H new ATOM 0 HE3 TRP A 71 30.547 41.337 21.597 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 35.384 41.226 20.453 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 31.274 41.583 19.242 1.00 0.00 H new ATOM 0 HH2 TRP A 71 33.685 41.531 18.665 1.00 0.00 H new ATOM 1040 N ARG A 72 28.448 42.497 23.510 1.00 0.00 N ATOM 1041 CA ARG A 72 26.955 42.452 23.384 1.00 0.00 C ATOM 1042 C ARG A 72 26.581 41.777 22.054 1.00 0.00 C ATOM 1043 O ARG A 72 27.336 41.817 21.088 1.00 0.00 O ATOM 1044 CB ARG A 72 26.395 43.880 23.413 1.00 0.00 C ATOM 1045 CG ARG A 72 26.693 44.530 24.769 1.00 0.00 C ATOM 1046 CD ARG A 72 27.916 45.428 24.619 1.00 0.00 C ATOM 1047 NE ARG A 72 27.473 46.718 24.006 1.00 0.00 N ATOM 1048 CZ ARG A 72 28.290 47.723 23.894 1.00 0.00 C ATOM 1049 NH1 ARG A 72 29.531 47.606 24.249 1.00 0.00 N ATOM 1050 NH2 ARG A 72 27.863 48.841 23.405 1.00 0.00 N ATOM 0 H ARG A 72 28.941 42.691 22.638 1.00 0.00 H new ATOM 0 HA ARG A 72 26.533 41.884 24.213 1.00 0.00 H new ATOM 0 HB2 ARG A 72 26.839 44.470 22.612 1.00 0.00 H new ATOM 0 HB3 ARG A 72 25.319 43.862 23.237 1.00 0.00 H new ATOM 0 HG2 ARG A 72 25.835 45.112 25.106 1.00 0.00 H new ATOM 0 HG3 ARG A 72 26.876 43.765 25.523 1.00 0.00 H new ATOM 0 HD2 ARG A 72 28.378 45.607 25.590 1.00 0.00 H new ATOM 0 HD3 ARG A 72 28.667 44.947 23.992 1.00 0.00 H new ATOM 0 HE ARG A 72 26.514 46.811 23.670 1.00 0.00 H new ATOM 0 HH11 ARG A 72 29.874 46.720 24.620 1.00 0.00 H new ATOM 0 HH12 ARG A 72 30.165 48.400 24.157 1.00 0.00 H new ATOM 0 HH21 ARG A 72 26.891 48.930 23.110 1.00 0.00 H new ATOM 0 HH22 ARG A 72 28.498 49.634 23.314 1.00 0.00 H new ATOM 1064 N GLU A 73 25.427 41.156 21.994 1.00 0.00 N ATOM 1065 CA GLU A 73 25.008 40.460 20.737 1.00 0.00 C ATOM 1066 C GLU A 73 23.690 41.032 20.162 1.00 0.00 C ATOM 1067 O GLU A 73 23.048 41.894 20.746 1.00 0.00 O ATOM 1068 CB GLU A 73 24.843 38.971 21.054 1.00 0.00 C ATOM 1069 CG GLU A 73 23.647 38.768 22.000 1.00 0.00 C ATOM 1070 CD GLU A 73 22.450 38.244 21.213 1.00 0.00 C ATOM 1071 OE1 GLU A 73 22.537 37.152 20.678 1.00 0.00 O ATOM 1072 OE2 GLU A 73 21.447 38.937 21.179 1.00 0.00 O ATOM 0 H GLU A 73 24.757 41.101 22.762 1.00 0.00 H new ATOM 0 HA GLU A 73 25.773 40.615 19.976 1.00 0.00 H new ATOM 0 HB2 GLU A 73 24.689 38.409 20.133 1.00 0.00 H new ATOM 0 HB3 GLU A 73 25.752 38.585 21.515 1.00 0.00 H new ATOM 0 HG2 GLU A 73 23.911 38.064 22.789 1.00 0.00 H new ATOM 0 HG3 GLU A 73 23.391 39.710 22.485 1.00 0.00 H new ATOM 1079 N ALA A 74 23.291 40.541 19.006 1.00 0.00 N ATOM 1080 CA ALA A 74 22.041 41.035 18.355 1.00 0.00 C ATOM 1081 C ALA A 74 21.543 40.011 17.322 1.00 0.00 C ATOM 1082 O ALA A 74 22.321 39.407 16.611 1.00 0.00 O ATOM 1083 CB ALA A 74 22.332 42.374 17.662 1.00 0.00 C ATOM 0 H ALA A 74 23.785 39.815 18.487 1.00 0.00 H new ATOM 0 HA ALA A 74 21.268 41.172 19.111 1.00 0.00 H new ATOM 0 HB1 ALA A 74 21.424 42.741 17.184 1.00 0.00 H new ATOM 0 HB2 ALA A 74 22.672 43.100 18.401 1.00 0.00 H new ATOM 0 HB3 ALA A 74 23.107 42.233 16.908 1.00 0.00 H new ATOM 1089 N ASP A 75 20.245 39.823 17.238 1.00 0.00 N ATOM 1090 CA ASP A 75 19.668 38.839 16.257 1.00 0.00 C ATOM 1091 C ASP A 75 19.914 39.323 14.822 1.00 0.00 C ATOM 1092 O ASP A 75 20.007 40.513 14.570 1.00 0.00 O ATOM 1093 CB ASP A 75 18.152 38.699 16.503 1.00 0.00 C ATOM 1094 CG ASP A 75 17.844 37.284 16.957 1.00 0.00 C ATOM 1095 OD1 ASP A 75 18.470 36.842 17.895 1.00 0.00 O ATOM 1096 OD2 ASP A 75 17.014 36.646 16.337 1.00 0.00 O ATOM 0 H ASP A 75 19.555 40.311 17.809 1.00 0.00 H new ATOM 0 HA ASP A 75 20.151 37.872 16.393 1.00 0.00 H new ATOM 0 HB2 ASP A 75 17.827 39.414 17.259 1.00 0.00 H new ATOM 0 HB3 ASP A 75 17.602 38.928 15.590 1.00 0.00 H new ATOM 1101 N ILE A 76 20.026 38.418 13.872 1.00 0.00 N ATOM 1102 CA ILE A 76 20.271 38.842 12.458 1.00 0.00 C ATOM 1103 C ILE A 76 19.379 38.024 11.507 1.00 0.00 C ATOM 1104 O ILE A 76 18.993 36.902 11.802 1.00 0.00 O ATOM 1105 CB ILE A 76 21.756 38.618 12.104 1.00 0.00 C ATOM 1106 CG1 ILE A 76 22.623 39.700 12.761 1.00 0.00 C ATOM 1107 CG2 ILE A 76 21.958 38.686 10.586 1.00 0.00 C ATOM 1108 CD1 ILE A 76 22.303 41.072 12.152 1.00 0.00 C ATOM 0 H ILE A 76 19.958 37.411 14.017 1.00 0.00 H new ATOM 0 HA ILE A 76 20.030 39.899 12.350 1.00 0.00 H new ATOM 0 HB ILE A 76 22.048 37.634 12.470 1.00 0.00 H new ATOM 0 HG12 ILE A 76 22.442 39.719 13.836 1.00 0.00 H new ATOM 0 HG13 ILE A 76 23.678 39.467 12.619 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.010 38.526 10.351 1.00 0.00 H new ATOM 0 HG22 ILE A 76 21.358 37.914 10.104 1.00 0.00 H new ATOM 0 HG23 ILE A 76 21.650 39.666 10.221 1.00 0.00 H new ATOM 0 HD11 ILE A 76 22.923 41.834 12.625 1.00 0.00 H new ATOM 0 HD12 ILE A 76 22.507 41.051 11.081 1.00 0.00 H new ATOM 0 HD13 ILE A 76 21.251 41.307 12.317 1.00 0.00 H new ATOM 1120 N ASN A 77 19.062 38.591 10.362 1.00 0.00 N ATOM 1121 CA ASN A 77 18.212 37.884 9.353 1.00 0.00 C ATOM 1122 C ASN A 77 16.883 37.449 9.967 1.00 0.00 C ATOM 1123 O ASN A 77 16.566 36.274 10.010 1.00 0.00 O ATOM 1124 CB ASN A 77 18.969 36.663 8.840 1.00 0.00 C ATOM 1125 CG ASN A 77 20.235 37.120 8.128 1.00 0.00 C ATOM 1126 OD1 ASN A 77 20.416 38.293 7.851 1.00 0.00 O ATOM 1127 ND2 ASN A 77 21.125 36.239 7.816 1.00 0.00 N ATOM 0 H ASN A 77 19.362 39.525 10.084 1.00 0.00 H new ATOM 0 HA ASN A 77 17.996 38.566 8.530 1.00 0.00 H new ATOM 0 HB2 ASN A 77 19.222 36.003 9.669 1.00 0.00 H new ATOM 0 HB3 ASN A 77 18.340 36.091 8.158 1.00 0.00 H new ATOM 0 HD21 ASN A 77 21.980 36.525 7.338 1.00 0.00 H new ATOM 0 HD22 ASN A 77 20.974 35.257 8.048 1.00 0.00 H new ATOM 1134 N TYR A 78 16.090 38.387 10.406 1.00 0.00 N ATOM 1135 CA TYR A 78 14.759 38.037 10.983 1.00 0.00 C ATOM 1136 C TYR A 78 13.672 38.821 10.248 1.00 0.00 C ATOM 1137 O TYR A 78 13.929 39.860 9.658 1.00 0.00 O ATOM 1138 CB TYR A 78 14.708 38.386 12.475 1.00 0.00 C ATOM 1139 CG TYR A 78 13.285 38.223 12.972 1.00 0.00 C ATOM 1140 CD1 TYR A 78 12.734 36.938 13.116 1.00 0.00 C ATOM 1141 CD2 TYR A 78 12.512 39.353 13.279 1.00 0.00 C ATOM 1142 CE1 TYR A 78 11.410 36.785 13.569 1.00 0.00 C ATOM 1143 CE2 TYR A 78 11.192 39.203 13.732 1.00 0.00 C ATOM 1144 CZ TYR A 78 10.641 37.918 13.877 1.00 0.00 C ATOM 1145 OH TYR A 78 9.345 37.777 14.323 1.00 0.00 O ATOM 0 H TYR A 78 16.306 39.384 10.390 1.00 0.00 H new ATOM 0 HA TYR A 78 14.597 36.965 10.867 1.00 0.00 H new ATOM 0 HB2 TYR A 78 15.380 37.737 13.037 1.00 0.00 H new ATOM 0 HB3 TYR A 78 15.047 39.410 12.634 1.00 0.00 H new ATOM 0 HD1 TYR A 78 13.327 36.067 12.879 1.00 0.00 H new ATOM 0 HD2 TYR A 78 12.934 40.341 13.166 1.00 0.00 H new ATOM 0 HE1 TYR A 78 10.987 35.798 13.679 1.00 0.00 H new ATOM 0 HE2 TYR A 78 10.600 40.075 13.969 1.00 0.00 H new ATOM 0 HH TYR A 78 8.883 38.639 14.262 1.00 0.00 H new ATOM 1155 N THR A 79 12.460 38.335 10.289 1.00 0.00 N ATOM 1156 CA THR A 79 11.335 39.042 9.604 1.00 0.00 C ATOM 1157 C THR A 79 10.088 38.985 10.502 1.00 0.00 C ATOM 1158 O THR A 79 9.791 39.907 11.247 1.00 0.00 O ATOM 1159 CB THR A 79 11.016 38.366 8.252 1.00 0.00 C ATOM 1160 OG1 THR A 79 10.378 37.111 8.487 1.00 0.00 O ATOM 1161 CG2 THR A 79 12.298 38.139 7.440 1.00 0.00 C ATOM 0 H THR A 79 12.198 37.474 10.770 1.00 0.00 H new ATOM 0 HA THR A 79 11.624 40.077 9.422 1.00 0.00 H new ATOM 0 HB THR A 79 10.355 39.021 7.685 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.968 36.539 9.020 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.049 37.662 6.492 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.781 39.097 7.248 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.976 37.497 8.002 1.00 0.00 H new ATOM 1169 N SER A 80 9.374 37.896 10.438 1.00 0.00 N ATOM 1170 CA SER A 80 8.146 37.738 11.271 1.00 0.00 C ATOM 1171 C SER A 80 7.959 36.266 11.629 1.00 0.00 C ATOM 1172 O SER A 80 7.472 35.486 10.829 1.00 0.00 O ATOM 1173 CB SER A 80 6.923 38.223 10.480 1.00 0.00 C ATOM 1174 OG SER A 80 5.860 37.285 10.625 1.00 0.00 O ATOM 0 H SER A 80 9.590 37.100 9.838 1.00 0.00 H new ATOM 0 HA SER A 80 8.251 38.327 12.182 1.00 0.00 H new ATOM 0 HB2 SER A 80 6.609 39.203 10.840 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.180 38.338 9.427 1.00 0.00 H new ATOM 0 HG SER A 80 6.102 36.445 10.182 1.00 0.00 H new ATOM 1180 N GLY A 81 8.334 35.873 12.813 1.00 0.00 N ATOM 1181 CA GLY A 81 8.168 34.437 13.203 1.00 0.00 C ATOM 1182 C GLY A 81 9.113 34.092 14.355 1.00 0.00 C ATOM 1183 O GLY A 81 8.882 34.473 15.485 1.00 0.00 O ATOM 0 H GLY A 81 8.746 36.475 13.526 1.00 0.00 H new ATOM 0 HA2 GLY A 81 7.136 34.250 13.500 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.375 33.794 12.348 1.00 0.00 H new ATOM 1187 N PHE A 82 10.181 33.388 14.070 1.00 0.00 N ATOM 1188 CA PHE A 82 11.161 33.024 15.141 1.00 0.00 C ATOM 1189 C PHE A 82 12.570 33.442 14.698 1.00 0.00 C ATOM 1190 O PHE A 82 12.750 34.016 13.641 1.00 0.00 O ATOM 1191 CB PHE A 82 11.120 31.508 15.380 1.00 0.00 C ATOM 1192 CG PHE A 82 11.681 31.197 16.749 1.00 0.00 C ATOM 1193 CD1 PHE A 82 10.906 31.430 17.892 1.00 0.00 C ATOM 1194 CD2 PHE A 82 12.979 30.684 16.876 1.00 0.00 C ATOM 1195 CE1 PHE A 82 11.426 31.150 19.163 1.00 0.00 C ATOM 1196 CE2 PHE A 82 13.502 30.407 18.148 1.00 0.00 C ATOM 1197 CZ PHE A 82 12.724 30.640 19.292 1.00 0.00 C ATOM 0 H PHE A 82 10.417 33.048 13.138 1.00 0.00 H new ATOM 0 HA PHE A 82 10.903 33.539 16.067 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.095 31.145 15.304 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.698 30.993 14.613 1.00 0.00 H new ATOM 0 HD1 PHE A 82 9.906 31.826 17.794 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.576 30.502 15.995 1.00 0.00 H new ATOM 0 HE1 PHE A 82 10.826 31.328 20.043 1.00 0.00 H new ATOM 0 HE2 PHE A 82 14.503 30.014 18.247 1.00 0.00 H new ATOM 0 HZ PHE A 82 13.126 30.426 20.271 1.00 0.00 H new ATOM 1207 N ARG A 83 13.567 33.163 15.496 1.00 0.00 N ATOM 1208 CA ARG A 83 14.959 33.546 15.114 1.00 0.00 C ATOM 1209 C ARG A 83 15.534 32.492 14.162 1.00 0.00 C ATOM 1210 O ARG A 83 14.824 31.851 13.413 1.00 0.00 O ATOM 1211 CB ARG A 83 15.848 33.608 16.367 1.00 0.00 C ATOM 1212 CG ARG A 83 15.012 33.954 17.601 1.00 0.00 C ATOM 1213 CD ARG A 83 15.908 34.586 18.673 1.00 0.00 C ATOM 1214 NE ARG A 83 17.197 33.823 18.786 1.00 0.00 N ATOM 1215 CZ ARG A 83 18.219 34.346 19.411 1.00 0.00 C ATOM 1216 NH1 ARG A 83 18.110 35.510 19.950 1.00 0.00 N ATOM 1217 NH2 ARG A 83 19.348 33.712 19.476 1.00 0.00 N ATOM 0 H ARG A 83 13.478 32.687 16.394 1.00 0.00 H new ATOM 0 HA ARG A 83 14.936 34.522 14.629 1.00 0.00 H new ATOM 0 HB2 ARG A 83 16.346 32.650 16.515 1.00 0.00 H new ATOM 0 HB3 ARG A 83 16.630 34.355 16.229 1.00 0.00 H new ATOM 0 HG2 ARG A 83 14.213 34.643 17.329 1.00 0.00 H new ATOM 0 HG3 ARG A 83 14.537 33.055 17.994 1.00 0.00 H new ATOM 0 HD2 ARG A 83 16.113 35.626 18.419 1.00 0.00 H new ATOM 0 HD3 ARG A 83 15.393 34.588 19.633 1.00 0.00 H new ATOM 0 HE ARG A 83 17.275 32.893 18.374 1.00 0.00 H new ATOM 0 HH11 ARG A 83 17.229 36.020 19.888 1.00 0.00 H new ATOM 0 HH12 ARG A 83 18.905 35.922 20.439 1.00 0.00 H new ATOM 0 HH21 ARG A 83 19.445 32.796 19.037 1.00 0.00 H new ATOM 0 HH22 ARG A 83 20.139 34.129 19.966 1.00 0.00 H new ATOM 1231 N ASN A 84 16.824 32.303 14.216 1.00 0.00 N ATOM 1232 CA ASN A 84 17.489 31.283 13.362 1.00 0.00 C ATOM 1233 C ASN A 84 18.915 31.068 13.896 1.00 0.00 C ATOM 1234 O ASN A 84 19.125 30.975 15.095 1.00 0.00 O ATOM 1235 CB ASN A 84 17.513 31.760 11.900 1.00 0.00 C ATOM 1236 CG ASN A 84 18.188 33.132 11.803 1.00 0.00 C ATOM 1237 OD1 ASN A 84 18.830 33.581 12.740 1.00 0.00 O ATOM 1238 ND2 ASN A 84 18.075 33.821 10.708 1.00 0.00 N ATOM 0 H ASN A 84 17.454 32.822 14.827 1.00 0.00 H new ATOM 0 HA ASN A 84 16.943 30.340 13.394 1.00 0.00 H new ATOM 0 HB2 ASN A 84 18.049 31.038 11.283 1.00 0.00 H new ATOM 0 HB3 ASN A 84 16.496 31.818 11.512 1.00 0.00 H new ATOM 0 HD21 ASN A 84 18.522 34.735 10.632 1.00 0.00 H new ATOM 0 HD22 ASN A 84 17.539 33.448 9.924 1.00 0.00 H new ATOM 1245 N SER A 85 19.890 30.986 13.033 1.00 0.00 N ATOM 1246 CA SER A 85 21.294 30.773 13.497 1.00 0.00 C ATOM 1247 C SER A 85 22.124 32.024 13.201 1.00 0.00 C ATOM 1248 O SER A 85 23.200 32.208 13.735 1.00 0.00 O ATOM 1249 CB SER A 85 21.885 29.573 12.763 0.50 0.00 C ATOM 1250 OG SER A 85 22.086 29.915 11.395 0.50 0.00 O ATOM 0 H SER A 85 19.776 31.057 12.022 1.00 0.00 H new ATOM 0 HA SER A 85 21.305 30.584 14.570 1.00 0.00 H new ATOM 0 HB2 SER A 85 22.830 29.281 13.220 0.50 0.00 H new ATOM 0 HB3 SER A 85 21.215 28.717 12.842 0.50 0.00 H new ATOM 0 HG SER A 85 22.914 29.501 11.072 0.50 0.00 H new ATOM 1256 N ASP A 86 21.612 32.881 12.355 1.00 0.00 N ATOM 1257 CA ASP A 86 22.326 34.139 11.993 1.00 0.00 C ATOM 1258 C ASP A 86 22.410 35.067 13.213 1.00 0.00 C ATOM 1259 O ASP A 86 21.401 35.569 13.679 1.00 0.00 O ATOM 1260 CB ASP A 86 21.530 34.850 10.895 1.00 0.00 C ATOM 1261 CG ASP A 86 21.845 34.217 9.549 1.00 0.00 C ATOM 1262 OD1 ASP A 86 23.012 34.054 9.255 1.00 0.00 O ATOM 1263 OD2 ASP A 86 20.912 33.908 8.828 1.00 0.00 O ATOM 0 H ASP A 86 20.712 32.758 11.892 1.00 0.00 H new ATOM 0 HA ASP A 86 23.333 33.899 11.651 1.00 0.00 H new ATOM 0 HB2 ASP A 86 20.462 34.779 11.101 1.00 0.00 H new ATOM 0 HB3 ASP A 86 21.781 35.911 10.878 1.00 0.00 H new ATOM 1268 N ARG A 87 23.589 35.290 13.744 1.00 0.00 N ATOM 1269 CA ARG A 87 23.710 36.188 14.941 1.00 0.00 C ATOM 1270 C ARG A 87 24.982 37.054 14.828 1.00 0.00 C ATOM 1271 O ARG A 87 26.010 36.595 14.353 1.00 0.00 O ATOM 1272 CB ARG A 87 23.767 35.321 16.213 1.00 0.00 C ATOM 1273 CG ARG A 87 22.421 34.618 16.385 1.00 0.00 C ATOM 1274 CD ARG A 87 21.472 35.528 17.190 1.00 0.00 C ATOM 1275 NE ARG A 87 20.016 35.423 16.784 1.00 0.00 N ATOM 1276 CZ ARG A 87 19.648 34.897 15.642 1.00 0.00 C ATOM 1277 NH1 ARG A 87 20.224 33.845 15.161 1.00 0.00 N ATOM 1278 NH2 ARG A 87 18.546 35.290 15.088 1.00 0.00 N ATOM 0 H ARG A 87 24.466 34.894 13.406 1.00 0.00 H new ATOM 0 HA ARG A 87 22.846 36.851 14.991 1.00 0.00 H new ATOM 0 HB2 ARG A 87 24.570 34.588 16.135 1.00 0.00 H new ATOM 0 HB3 ARG A 87 23.984 35.940 17.083 1.00 0.00 H new ATOM 0 HG2 ARG A 87 21.988 34.393 15.410 1.00 0.00 H new ATOM 0 HG3 ARG A 87 22.557 33.668 16.901 1.00 0.00 H new ATOM 0 HD2 ARG A 87 21.561 35.281 18.248 1.00 0.00 H new ATOM 0 HD3 ARG A 87 21.795 36.563 17.076 1.00 0.00 H new ATOM 0 HE ARG A 87 19.300 35.773 17.420 1.00 0.00 H new ATOM 0 HH11 ARG A 87 20.987 33.402 15.673 1.00 0.00 H new ATOM 0 HH12 ARG A 87 19.916 33.458 14.269 1.00 0.00 H new ATOM 0 HH21 ARG A 87 17.974 36.003 15.541 1.00 0.00 H new ATOM 0 HH22 ARG A 87 18.250 34.887 14.199 1.00 0.00 H new ATOM 1292 N ILE A 88 24.909 38.309 15.235 1.00 0.00 N ATOM 1293 CA ILE A 88 26.111 39.212 15.151 1.00 0.00 C ATOM 1294 C ILE A 88 26.563 39.629 16.559 1.00 0.00 C ATOM 1295 O ILE A 88 25.760 39.902 17.436 1.00 0.00 O ATOM 1296 CB ILE A 88 25.776 40.471 14.343 1.00 0.00 C ATOM 1297 CG1 ILE A 88 27.043 41.309 14.114 1.00 0.00 C ATOM 1298 CG2 ILE A 88 24.752 41.316 15.110 1.00 0.00 C ATOM 1299 CD1 ILE A 88 26.698 42.525 13.239 1.00 0.00 C ATOM 0 H ILE A 88 24.071 38.744 15.620 1.00 0.00 H new ATOM 0 HA ILE A 88 26.914 38.665 14.657 1.00 0.00 H new ATOM 0 HB ILE A 88 25.364 40.169 13.380 1.00 0.00 H new ATOM 0 HG12 ILE A 88 27.452 41.638 15.069 1.00 0.00 H new ATOM 0 HG13 ILE A 88 27.810 40.704 13.630 1.00 0.00 H new ATOM 0 HG21 ILE A 88 24.515 42.211 14.535 1.00 0.00 H new ATOM 0 HG22 ILE A 88 23.844 40.734 15.267 1.00 0.00 H new ATOM 0 HG23 ILE A 88 25.168 41.605 16.075 1.00 0.00 H new ATOM 0 HD11 ILE A 88 27.595 43.122 13.075 1.00 0.00 H new ATOM 0 HD12 ILE A 88 26.308 42.184 12.280 1.00 0.00 H new ATOM 0 HD13 ILE A 88 25.945 43.133 13.741 1.00 0.00 H new ATOM 1311 N LEU A 89 27.855 39.704 16.768 1.00 0.00 N ATOM 1312 CA LEU A 89 28.387 40.120 18.099 1.00 0.00 C ATOM 1313 C LEU A 89 29.175 41.425 17.946 1.00 0.00 C ATOM 1314 O LEU A 89 29.999 41.557 17.051 1.00 0.00 O ATOM 1315 CB LEU A 89 29.320 39.022 18.651 1.00 0.00 C ATOM 1316 CG LEU A 89 28.567 38.056 19.583 1.00 0.00 C ATOM 1317 CD1 LEU A 89 28.272 38.747 20.917 1.00 0.00 C ATOM 1318 CD2 LEU A 89 27.254 37.608 18.934 1.00 0.00 C ATOM 0 H LEU A 89 28.566 39.493 16.068 1.00 0.00 H new ATOM 0 HA LEU A 89 27.557 40.271 18.789 1.00 0.00 H new ATOM 0 HB2 LEU A 89 29.756 38.464 17.823 1.00 0.00 H new ATOM 0 HB3 LEU A 89 30.145 39.483 19.194 1.00 0.00 H new ATOM 0 HG LEU A 89 29.191 37.180 19.759 1.00 0.00 H new ATOM 0 HD11 LEU A 89 27.739 38.059 21.573 1.00 0.00 H new ATOM 0 HD12 LEU A 89 29.209 39.045 21.388 1.00 0.00 H new ATOM 0 HD13 LEU A 89 27.658 39.630 20.741 1.00 0.00 H new ATOM 0 HD21 LEU A 89 26.731 36.925 19.604 1.00 0.00 H new ATOM 0 HD22 LEU A 89 26.627 38.479 18.742 1.00 0.00 H new ATOM 0 HD23 LEU A 89 27.468 37.101 17.993 1.00 0.00 H new ATOM 1330 N TYR A 90 28.939 42.376 18.820 1.00 0.00 N ATOM 1331 CA TYR A 90 29.678 43.675 18.742 1.00 0.00 C ATOM 1332 C TYR A 90 30.237 44.045 20.124 1.00 0.00 C ATOM 1333 O TYR A 90 29.606 43.824 21.146 1.00 0.00 O ATOM 1334 CB TYR A 90 28.740 44.774 18.225 1.00 0.00 C ATOM 1335 CG TYR A 90 27.830 45.277 19.329 1.00 0.00 C ATOM 1336 CD1 TYR A 90 26.626 44.613 19.623 1.00 0.00 C ATOM 1337 CD2 TYR A 90 28.174 46.437 20.033 1.00 0.00 C ATOM 1338 CE1 TYR A 90 25.770 45.120 20.622 1.00 0.00 C ATOM 1339 CE2 TYR A 90 27.326 46.931 21.028 1.00 0.00 C ATOM 1340 CZ TYR A 90 26.125 46.282 21.324 1.00 0.00 C ATOM 1341 OH TYR A 90 25.306 46.785 22.314 1.00 0.00 O ATOM 0 H TYR A 90 28.266 42.307 19.584 1.00 0.00 H new ATOM 0 HA TYR A 90 30.513 43.575 18.049 1.00 0.00 H new ATOM 0 HB2 TYR A 90 29.328 45.602 17.828 1.00 0.00 H new ATOM 0 HB3 TYR A 90 28.139 44.387 17.402 1.00 0.00 H new ATOM 0 HD1 TYR A 90 26.357 43.716 19.085 1.00 0.00 H new ATOM 0 HD2 TYR A 90 29.096 46.951 19.807 1.00 0.00 H new ATOM 0 HE1 TYR A 90 24.842 44.615 20.847 1.00 0.00 H new ATOM 0 HE2 TYR A 90 27.602 47.822 21.573 1.00 0.00 H new ATOM 0 HH TYR A 90 24.815 46.050 22.737 1.00 0.00 H new ATOM 1351 N SER A 91 31.432 44.587 20.158 1.00 0.00 N ATOM 1352 CA SER A 91 32.076 44.937 21.468 1.00 0.00 C ATOM 1353 C SER A 91 32.039 46.438 21.756 1.00 0.00 C ATOM 1354 O SER A 91 31.604 47.236 20.955 1.00 0.00 O ATOM 1355 CB SER A 91 33.542 44.540 21.372 1.00 0.00 C ATOM 1356 OG SER A 91 34.111 45.254 20.282 1.00 0.00 O ATOM 0 H SER A 91 31.992 44.803 19.333 1.00 0.00 H new ATOM 0 HA SER A 91 31.535 44.420 22.260 1.00 0.00 H new ATOM 0 HB2 SER A 91 34.064 44.777 22.299 1.00 0.00 H new ATOM 0 HB3 SER A 91 33.638 43.465 21.218 1.00 0.00 H new ATOM 0 HG SER A 91 35.081 45.318 20.404 1.00 0.00 H new ATOM 1362 N SER A 92 32.554 46.818 22.903 1.00 0.00 N ATOM 1363 CA SER A 92 32.640 48.268 23.290 1.00 0.00 C ATOM 1364 C SER A 92 33.373 49.013 22.193 1.00 0.00 C ATOM 1365 O SER A 92 32.917 50.012 21.670 1.00 0.00 O ATOM 1366 CB SER A 92 33.475 48.397 24.570 1.00 0.00 C ATOM 1367 OG SER A 92 34.098 47.132 24.848 1.00 0.00 O ATOM 0 H SER A 92 32.926 46.174 23.601 1.00 0.00 H new ATOM 0 HA SER A 92 31.638 48.669 23.442 1.00 0.00 H new ATOM 0 HB2 SER A 92 34.232 49.172 24.450 1.00 0.00 H new ATOM 0 HB3 SER A 92 32.842 48.697 25.405 1.00 0.00 H new ATOM 0 HG SER A 92 34.788 46.953 24.176 1.00 0.00 H new ATOM 1373 N ASP A 93 34.530 48.510 21.881 1.00 0.00 N ATOM 1374 CA ASP A 93 35.406 49.102 20.835 1.00 0.00 C ATOM 1375 C ASP A 93 34.734 48.990 19.457 1.00 0.00 C ATOM 1376 O ASP A 93 35.309 49.347 18.449 1.00 0.00 O ATOM 1377 CB ASP A 93 36.712 48.304 20.845 1.00 0.00 C ATOM 1378 CG ASP A 93 36.419 46.888 21.342 1.00 0.00 C ATOM 1379 OD1 ASP A 93 36.337 46.699 22.553 1.00 0.00 O ATOM 1380 OD2 ASP A 93 36.247 46.021 20.514 1.00 0.00 O ATOM 0 H ASP A 93 34.920 47.679 22.326 1.00 0.00 H new ATOM 0 HA ASP A 93 35.590 50.158 21.034 1.00 0.00 H new ATOM 0 HB2 ASP A 93 37.142 48.271 19.844 1.00 0.00 H new ATOM 0 HB3 ASP A 93 37.445 48.787 21.491 1.00 0.00 H new ATOM 1385 N TRP A 94 33.525 48.498 19.427 1.00 0.00 N ATOM 1386 CA TRP A 94 32.763 48.342 18.163 1.00 0.00 C ATOM 1387 C TRP A 94 33.359 47.230 17.290 1.00 0.00 C ATOM 1388 O TRP A 94 33.120 47.198 16.099 1.00 0.00 O ATOM 1389 CB TRP A 94 32.743 49.674 17.403 1.00 0.00 C ATOM 1390 CG TRP A 94 32.148 50.733 18.283 1.00 0.00 C ATOM 1391 CD1 TRP A 94 32.775 51.864 18.670 1.00 0.00 C ATOM 1392 CD2 TRP A 94 30.821 50.775 18.886 1.00 0.00 C ATOM 1393 NE1 TRP A 94 31.920 52.596 19.471 1.00 0.00 N ATOM 1394 CE2 TRP A 94 30.705 51.970 19.632 1.00 0.00 C ATOM 1395 CE3 TRP A 94 29.717 49.903 18.855 1.00 0.00 C ATOM 1396 CZ2 TRP A 94 29.540 52.291 20.325 1.00 0.00 C ATOM 1397 CZ3 TRP A 94 28.539 50.223 19.550 1.00 0.00 C ATOM 1398 CH2 TRP A 94 28.451 51.415 20.284 1.00 0.00 C ATOM 0 H TRP A 94 33.021 48.188 20.258 1.00 0.00 H new ATOM 0 HA TRP A 94 31.740 48.056 18.408 1.00 0.00 H new ATOM 0 HB2 TRP A 94 33.754 49.954 17.109 1.00 0.00 H new ATOM 0 HB3 TRP A 94 32.161 49.575 16.487 1.00 0.00 H new ATOM 0 HD1 TRP A 94 33.780 52.150 18.398 1.00 0.00 H new ATOM 0 HE1 TRP A 94 32.160 53.493 19.893 1.00 0.00 H new ATOM 0 HE3 TRP A 94 29.776 48.982 18.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 29.478 53.210 20.890 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 27.697 49.548 19.519 1.00 0.00 H new ATOM 0 HH2 TRP A 94 27.543 51.656 20.817 1.00 0.00 H new ATOM 1409 N LEU A 95 34.093 46.295 17.853 1.00 0.00 N ATOM 1410 CA LEU A 95 34.635 45.190 17.011 1.00 0.00 C ATOM 1411 C LEU A 95 33.474 44.238 16.719 1.00 0.00 C ATOM 1412 O LEU A 95 32.791 43.797 17.629 1.00 0.00 O ATOM 1413 CB LEU A 95 35.750 44.455 17.768 1.00 0.00 C ATOM 1414 CG LEU A 95 37.071 45.218 17.601 1.00 0.00 C ATOM 1415 CD1 LEU A 95 38.215 44.438 18.254 1.00 0.00 C ATOM 1416 CD2 LEU A 95 37.373 45.401 16.110 1.00 0.00 C ATOM 0 H LEU A 95 34.334 46.253 18.843 1.00 0.00 H new ATOM 0 HA LEU A 95 35.059 45.575 16.084 1.00 0.00 H new ATOM 0 HB2 LEU A 95 35.495 44.375 18.825 1.00 0.00 H new ATOM 0 HB3 LEU A 95 35.854 43.439 17.387 1.00 0.00 H new ATOM 0 HG LEU A 95 36.979 46.192 18.082 1.00 0.00 H new ATOM 0 HD11 LEU A 95 39.148 44.988 18.130 1.00 0.00 H new ATOM 0 HD12 LEU A 95 38.008 44.310 19.316 1.00 0.00 H new ATOM 0 HD13 LEU A 95 38.305 43.460 17.781 1.00 0.00 H new ATOM 0 HD21 LEU A 95 38.311 45.943 15.993 1.00 0.00 H new ATOM 0 HD22 LEU A 95 37.456 44.424 15.633 1.00 0.00 H new ATOM 0 HD23 LEU A 95 36.567 45.966 15.642 1.00 0.00 H new ATOM 1428 N ILE A 96 33.205 43.946 15.474 1.00 0.00 N ATOM 1429 CA ILE A 96 32.043 43.059 15.191 1.00 0.00 C ATOM 1430 C ILE A 96 32.467 41.711 14.617 1.00 0.00 C ATOM 1431 O ILE A 96 33.340 41.602 13.772 1.00 0.00 O ATOM 1432 CB ILE A 96 31.098 43.744 14.215 1.00 0.00 C ATOM 1433 CG1 ILE A 96 30.713 45.119 14.762 1.00 0.00 C ATOM 1434 CG2 ILE A 96 29.845 42.894 14.058 1.00 0.00 C ATOM 1435 CD1 ILE A 96 31.375 46.193 13.908 1.00 0.00 C ATOM 0 H ILE A 96 33.725 44.274 14.660 1.00 0.00 H new ATOM 0 HA ILE A 96 31.541 42.873 16.141 1.00 0.00 H new ATOM 0 HB ILE A 96 31.588 43.862 13.248 1.00 0.00 H new ATOM 0 HG12 ILE A 96 29.630 45.241 14.748 1.00 0.00 H new ATOM 0 HG13 ILE A 96 31.031 45.214 15.800 1.00 0.00 H new ATOM 0 HG21 ILE A 96 29.162 43.378 13.360 1.00 0.00 H new ATOM 0 HG22 ILE A 96 30.118 41.910 13.676 1.00 0.00 H new ATOM 0 HG23 ILE A 96 29.356 42.784 15.026 1.00 0.00 H new ATOM 0 HD11 ILE A 96 31.107 47.178 14.290 1.00 0.00 H new ATOM 0 HD12 ILE A 96 32.458 46.072 13.946 1.00 0.00 H new ATOM 0 HD13 ILE A 96 31.035 46.099 12.877 1.00 0.00 H new ATOM 1447 N TYR A 97 31.817 40.690 15.091 1.00 0.00 N ATOM 1448 CA TYR A 97 32.093 39.310 14.615 1.00 0.00 C ATOM 1449 C TYR A 97 30.753 38.675 14.249 1.00 0.00 C ATOM 1450 O TYR A 97 29.718 39.047 14.789 1.00 0.00 O ATOM 1451 CB TYR A 97 32.776 38.501 15.721 1.00 0.00 C ATOM 1452 CG TYR A 97 34.220 38.924 15.834 1.00 0.00 C ATOM 1453 CD1 TYR A 97 34.532 40.221 16.245 1.00 0.00 C ATOM 1454 CD2 TYR A 97 35.249 38.022 15.526 1.00 0.00 C ATOM 1455 CE1 TYR A 97 35.865 40.622 16.345 1.00 0.00 C ATOM 1456 CE2 TYR A 97 36.585 38.426 15.630 1.00 0.00 C ATOM 1457 CZ TYR A 97 36.887 39.728 16.040 1.00 0.00 C ATOM 1458 OH TYR A 97 38.197 40.141 16.132 1.00 0.00 O ATOM 0 H TYR A 97 31.090 40.755 15.804 1.00 0.00 H new ATOM 0 HA TYR A 97 32.757 39.326 13.751 1.00 0.00 H new ATOM 0 HB2 TYR A 97 32.264 38.658 16.670 1.00 0.00 H new ATOM 0 HB3 TYR A 97 32.714 37.436 15.498 1.00 0.00 H new ATOM 0 HD1 TYR A 97 33.741 40.915 16.486 1.00 0.00 H new ATOM 0 HD2 TYR A 97 35.011 37.017 15.209 1.00 0.00 H new ATOM 0 HE1 TYR A 97 36.104 41.627 16.659 1.00 0.00 H new ATOM 0 HE2 TYR A 97 37.380 37.734 15.394 1.00 0.00 H new ATOM 0 HH TYR A 97 38.791 39.401 15.888 1.00 0.00 H new ATOM 1468 N LYS A 98 30.750 37.745 13.332 1.00 0.00 N ATOM 1469 CA LYS A 98 29.453 37.113 12.927 1.00 0.00 C ATOM 1470 C LYS A 98 29.448 35.597 13.185 1.00 0.00 C ATOM 1471 O LYS A 98 30.445 34.918 13.019 1.00 0.00 O ATOM 1472 CB LYS A 98 29.217 37.373 11.437 1.00 0.00 C ATOM 1473 CG LYS A 98 30.000 36.359 10.580 1.00 0.00 C ATOM 1474 CD LYS A 98 29.732 36.600 9.081 1.00 0.00 C ATOM 1475 CE LYS A 98 28.233 36.833 8.816 1.00 0.00 C ATOM 1476 NZ LYS A 98 27.426 35.839 9.573 1.00 0.00 N ATOM 0 H LYS A 98 31.577 37.396 12.848 1.00 0.00 H new ATOM 0 HA LYS A 98 28.658 37.555 13.528 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.153 37.301 11.214 1.00 0.00 H new ATOM 0 HB3 LYS A 98 29.528 38.387 11.185 1.00 0.00 H new ATOM 0 HG2 LYS A 98 31.067 36.449 10.784 1.00 0.00 H new ATOM 0 HG3 LYS A 98 29.708 35.344 10.849 1.00 0.00 H new ATOM 0 HD2 LYS A 98 30.303 37.464 8.741 1.00 0.00 H new ATOM 0 HD3 LYS A 98 30.077 35.742 8.504 1.00 0.00 H new ATOM 0 HE2 LYS A 98 27.955 37.844 9.114 1.00 0.00 H new ATOM 0 HE3 LYS A 98 28.025 36.747 7.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 26.887 35.250 8.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 28.058 35.235 10.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 26.768 36.336 10.207 1.00 0.00 H new ATOM 1490 N THR A 99 28.307 35.067 13.543 1.00 0.00 N ATOM 1491 CA THR A 99 28.181 33.598 13.769 1.00 0.00 C ATOM 1492 C THR A 99 26.845 33.155 13.175 1.00 0.00 C ATOM 1493 O THR A 99 25.825 33.798 13.377 1.00 0.00 O ATOM 1494 CB THR A 99 28.238 33.266 15.267 1.00 0.00 C ATOM 1495 OG1 THR A 99 27.619 32.009 15.502 1.00 0.00 O ATOM 1496 CG2 THR A 99 27.518 34.341 16.074 1.00 0.00 C ATOM 0 H THR A 99 27.448 35.597 13.690 1.00 0.00 H new ATOM 0 HA THR A 99 29.008 33.072 13.291 1.00 0.00 H new ATOM 0 HB THR A 99 29.282 33.226 15.577 1.00 0.00 H new ATOM 0 HG1 THR A 99 28.058 31.322 14.959 1.00 0.00 H new ATOM 0 HG21 THR A 99 27.566 34.093 17.134 1.00 0.00 H new ATOM 0 HG22 THR A 99 27.997 35.305 15.905 1.00 0.00 H new ATOM 0 HG23 THR A 99 26.475 34.394 15.761 1.00 0.00 H new ATOM 1504 N THR A 100 26.849 32.093 12.415 1.00 0.00 N ATOM 1505 CA THR A 100 25.588 31.610 11.760 1.00 0.00 C ATOM 1506 C THR A 100 25.243 30.209 12.236 1.00 0.00 C ATOM 1507 O THR A 100 24.412 29.537 11.646 1.00 0.00 O ATOM 1508 CB THR A 100 25.798 31.558 10.250 1.00 0.00 C ATOM 1509 OG1 THR A 100 27.067 30.981 9.978 1.00 0.00 O ATOM 1510 CG2 THR A 100 25.748 32.969 9.674 1.00 0.00 C ATOM 0 H THR A 100 27.677 31.531 12.215 1.00 0.00 H new ATOM 0 HA THR A 100 24.779 32.293 12.019 1.00 0.00 H new ATOM 0 HB THR A 100 25.012 30.957 9.793 1.00 0.00 H new ATOM 0 HG1 THR A 100 27.208 30.943 9.009 1.00 0.00 H new ATOM 0 HG21 THR A 100 25.898 32.927 8.595 1.00 0.00 H new ATOM 0 HG22 THR A 100 24.777 33.415 9.888 1.00 0.00 H new ATOM 0 HG23 THR A 100 26.533 33.575 10.127 1.00 0.00 H new ATOM 1518 N ASP A 101 25.869 29.754 13.275 1.00 0.00 N ATOM 1519 CA ASP A 101 25.574 28.386 13.769 1.00 0.00 C ATOM 1520 C ASP A 101 24.992 28.482 15.183 1.00 0.00 C ATOM 1521 O ASP A 101 25.231 27.648 16.034 1.00 0.00 O ATOM 1522 CB ASP A 101 26.877 27.594 13.763 1.00 0.00 C ATOM 1523 CG ASP A 101 28.051 28.576 13.824 1.00 0.00 C ATOM 1524 OD1 ASP A 101 27.984 29.531 14.600 1.00 0.00 O ATOM 1525 OD2 ASP A 101 29.013 28.347 13.125 1.00 0.00 O ATOM 0 H ASP A 101 26.573 30.268 13.805 1.00 0.00 H new ATOM 0 HA ASP A 101 24.845 27.882 13.134 1.00 0.00 H new ATOM 0 HB2 ASP A 101 26.909 26.914 14.614 1.00 0.00 H new ATOM 0 HB3 ASP A 101 26.943 26.982 12.863 1.00 0.00 H new ATOM 1530 N ALA A 102 24.205 29.497 15.425 1.00 0.00 N ATOM 1531 CA ALA A 102 23.568 29.677 16.763 1.00 0.00 C ATOM 1532 C ALA A 102 24.640 29.832 17.854 1.00 0.00 C ATOM 1533 O ALA A 102 24.774 29.004 18.734 1.00 0.00 O ATOM 1534 CB ALA A 102 22.662 28.475 17.066 1.00 0.00 C ATOM 0 H ALA A 102 23.973 30.219 14.743 1.00 0.00 H new ATOM 0 HA ALA A 102 22.964 30.584 16.751 1.00 0.00 H new ATOM 0 HB1 ALA A 102 22.197 28.607 18.043 1.00 0.00 H new ATOM 0 HB2 ALA A 102 21.887 28.402 16.303 1.00 0.00 H new ATOM 0 HB3 ALA A 102 23.257 27.562 17.068 1.00 0.00 H new ATOM 1540 N TYR A 103 25.388 30.901 17.808 1.00 0.00 N ATOM 1541 CA TYR A 103 26.442 31.147 18.840 1.00 0.00 C ATOM 1542 C TYR A 103 27.507 30.035 18.805 1.00 0.00 C ATOM 1543 O TYR A 103 27.894 29.527 19.832 1.00 0.00 O ATOM 1544 CB TYR A 103 25.807 31.178 20.246 1.00 0.00 C ATOM 1545 CG TYR A 103 24.590 32.086 20.295 1.00 0.00 C ATOM 1546 CD1 TYR A 103 24.745 33.469 20.189 1.00 0.00 C ATOM 1547 CD2 TYR A 103 23.309 31.543 20.484 1.00 0.00 C ATOM 1548 CE1 TYR A 103 23.631 34.309 20.268 1.00 0.00 C ATOM 1549 CE2 TYR A 103 22.191 32.386 20.560 1.00 0.00 C ATOM 1550 CZ TYR A 103 22.354 33.770 20.452 1.00 0.00 C ATOM 1551 OH TYR A 103 21.257 34.608 20.528 1.00 0.00 O ATOM 0 H TYR A 103 25.314 31.624 17.092 1.00 0.00 H new ATOM 0 HA TYR A 103 26.912 32.106 18.621 1.00 0.00 H new ATOM 0 HB2 TYR A 103 25.519 30.168 20.537 1.00 0.00 H new ATOM 0 HB3 TYR A 103 26.545 31.520 20.971 1.00 0.00 H new ATOM 0 HD1 TYR A 103 25.729 33.891 20.046 1.00 0.00 H new ATOM 0 HD2 TYR A 103 23.184 30.474 20.571 1.00 0.00 H new ATOM 0 HE1 TYR A 103 23.757 35.379 20.187 1.00 0.00 H new ATOM 0 HE2 TYR A 103 21.206 31.967 20.702 1.00 0.00 H new ATOM 0 HH TYR A 103 21.559 35.538 20.587 1.00 0.00 H new ATOM 1561 N GLN A 104 27.991 29.650 17.647 1.00 0.00 N ATOM 1562 CA GLN A 104 29.043 28.559 17.584 1.00 0.00 C ATOM 1563 C GLN A 104 30.346 29.116 16.975 1.00 0.00 C ATOM 1564 O GLN A 104 31.324 29.323 17.678 1.00 0.00 O ATOM 1565 CB GLN A 104 28.539 27.396 16.718 1.00 0.00 C ATOM 1566 CG GLN A 104 27.445 26.605 17.449 1.00 0.00 C ATOM 1567 CD GLN A 104 28.071 25.456 18.235 1.00 0.00 C ATOM 1568 OE1 GLN A 104 29.133 24.983 17.896 1.00 0.00 O ATOM 1569 NE2 GLN A 104 27.452 24.979 19.272 1.00 0.00 N ATOM 0 H GLN A 104 27.712 30.035 16.744 1.00 0.00 H new ATOM 0 HA GLN A 104 29.238 28.203 18.596 1.00 0.00 H new ATOM 0 HB2 GLN A 104 28.148 27.781 15.776 1.00 0.00 H new ATOM 0 HB3 GLN A 104 29.369 26.734 16.471 1.00 0.00 H new ATOM 0 HG2 GLN A 104 26.898 27.263 18.124 1.00 0.00 H new ATOM 0 HG3 GLN A 104 26.724 26.215 16.730 1.00 0.00 H new ATOM 0 HE21 GLN A 104 26.557 25.376 19.559 1.00 0.00 H new ATOM 0 HE22 GLN A 104 27.860 24.207 19.799 1.00 0.00 H new ATOM 1578 N THR A 105 30.381 29.341 15.678 1.00 0.00 N ATOM 1579 CA THR A 105 31.637 29.867 15.045 1.00 0.00 C ATOM 1580 C THR A 105 31.556 31.397 14.947 1.00 0.00 C ATOM 1581 O THR A 105 30.603 31.959 14.422 1.00 0.00 O ATOM 1582 CB THR A 105 31.833 29.264 13.646 1.00 0.00 C ATOM 1583 OG1 THR A 105 30.831 29.762 12.784 1.00 0.00 O ATOM 1584 CG2 THR A 105 31.755 27.734 13.706 1.00 0.00 C ATOM 0 H THR A 105 29.603 29.185 15.037 1.00 0.00 H new ATOM 0 HA THR A 105 32.489 29.583 15.663 1.00 0.00 H new ATOM 0 HB THR A 105 32.817 29.544 13.270 1.00 0.00 H new ATOM 0 HG1 THR A 105 30.115 29.099 12.698 1.00 0.00 H new ATOM 0 HG21 THR A 105 31.896 27.323 12.706 1.00 0.00 H new ATOM 0 HG22 THR A 105 32.535 27.356 14.367 1.00 0.00 H new ATOM 0 HG23 THR A 105 30.779 27.434 14.087 1.00 0.00 H new ATOM 1592 N PHE A 106 32.545 32.078 15.467 1.00 0.00 N ATOM 1593 CA PHE A 106 32.536 33.568 15.437 1.00 0.00 C ATOM 1594 C PHE A 106 33.532 34.093 14.396 1.00 0.00 C ATOM 1595 O PHE A 106 34.655 34.443 14.715 1.00 0.00 O ATOM 1596 CB PHE A 106 32.898 34.102 16.837 1.00 0.00 C ATOM 1597 CG PHE A 106 31.842 33.655 17.826 1.00 0.00 C ATOM 1598 CD1 PHE A 106 31.764 32.313 18.210 1.00 0.00 C ATOM 1599 CD2 PHE A 106 30.923 34.576 18.336 1.00 0.00 C ATOM 1600 CE1 PHE A 106 30.773 31.893 19.097 1.00 0.00 C ATOM 1601 CE2 PHE A 106 29.927 34.155 19.224 1.00 0.00 C ATOM 1602 CZ PHE A 106 29.852 32.812 19.602 1.00 0.00 C ATOM 0 H PHE A 106 33.362 31.662 15.913 1.00 0.00 H new ATOM 0 HA PHE A 106 31.541 33.915 15.158 1.00 0.00 H new ATOM 0 HB2 PHE A 106 33.877 33.731 17.139 1.00 0.00 H new ATOM 0 HB3 PHE A 106 32.961 35.190 16.820 1.00 0.00 H new ATOM 0 HD1 PHE A 106 32.474 31.599 17.818 1.00 0.00 H new ATOM 0 HD2 PHE A 106 30.982 35.614 18.044 1.00 0.00 H new ATOM 0 HE1 PHE A 106 30.718 30.856 19.393 1.00 0.00 H new ATOM 0 HE2 PHE A 106 29.217 34.868 19.617 1.00 0.00 H new ATOM 0 HZ PHE A 106 29.082 32.485 20.285 1.00 0.00 H new ATOM 1612 N THR A 107 33.123 34.161 13.153 1.00 0.00 N ATOM 1613 CA THR A 107 34.033 34.697 12.093 1.00 0.00 C ATOM 1614 C THR A 107 34.049 36.229 12.217 1.00 0.00 C ATOM 1615 O THR A 107 33.019 36.852 12.470 1.00 0.00 O ATOM 1616 CB THR A 107 33.513 34.297 10.705 1.00 0.00 C ATOM 1617 OG1 THR A 107 33.777 32.918 10.476 1.00 0.00 O ATOM 1618 CG2 THR A 107 34.205 35.129 9.622 1.00 0.00 C ATOM 0 H THR A 107 32.201 33.870 12.827 1.00 0.00 H new ATOM 0 HA THR A 107 35.037 34.292 12.216 1.00 0.00 H new ATOM 0 HB THR A 107 32.439 34.479 10.666 1.00 0.00 H new ATOM 0 HG1 THR A 107 33.443 32.664 9.590 1.00 0.00 H new ATOM 0 HG21 THR A 107 33.828 34.836 8.642 1.00 0.00 H new ATOM 0 HG22 THR A 107 34.000 36.186 9.789 1.00 0.00 H new ATOM 0 HG23 THR A 107 35.281 34.957 9.663 1.00 0.00 H new ATOM 1626 N LYS A 108 35.192 36.852 12.049 1.00 0.00 N ATOM 1627 CA LYS A 108 35.254 38.339 12.173 1.00 0.00 C ATOM 1628 C LYS A 108 34.662 38.997 10.934 1.00 0.00 C ATOM 1629 O LYS A 108 34.755 38.475 9.843 1.00 0.00 O ATOM 1630 CB LYS A 108 36.716 38.777 12.299 1.00 0.00 C ATOM 1631 CG LYS A 108 36.808 40.304 12.475 1.00 0.00 C ATOM 1632 CD LYS A 108 38.256 40.673 12.836 1.00 0.00 C ATOM 1633 CE LYS A 108 38.469 42.194 12.761 1.00 0.00 C ATOM 1634 NZ LYS A 108 37.875 42.841 13.967 1.00 0.00 N ATOM 0 H LYS A 108 36.078 36.396 11.833 1.00 0.00 H new ATOM 0 HA LYS A 108 34.687 38.639 13.054 1.00 0.00 H new ATOM 0 HB2 LYS A 108 37.179 38.278 13.150 1.00 0.00 H new ATOM 0 HB3 LYS A 108 37.271 38.473 11.411 1.00 0.00 H new ATOM 0 HG2 LYS A 108 36.507 40.809 11.557 1.00 0.00 H new ATOM 0 HG3 LYS A 108 36.127 40.636 13.259 1.00 0.00 H new ATOM 0 HD2 LYS A 108 38.486 40.319 13.841 1.00 0.00 H new ATOM 0 HD3 LYS A 108 38.944 40.171 12.155 1.00 0.00 H new ATOM 0 HE2 LYS A 108 39.534 42.420 12.701 1.00 0.00 H new ATOM 0 HE3 LYS A 108 38.008 42.592 11.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 38.330 43.762 14.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 36.855 42.980 13.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 38.025 42.232 14.797 1.00 0.00 H new ATOM 1648 N ILE A 109 34.093 40.161 11.094 1.00 0.00 N ATOM 1649 CA ILE A 109 33.538 40.890 9.918 1.00 0.00 C ATOM 1650 C ILE A 109 34.038 42.346 9.955 1.00 0.00 C ATOM 1651 O ILE A 109 34.231 42.967 8.923 1.00 0.00 O ATOM 1652 CB ILE A 109 32.003 40.832 9.922 1.00 0.00 C ATOM 1653 CG1 ILE A 109 31.443 41.483 11.195 1.00 0.00 C ATOM 1654 CG2 ILE A 109 31.562 39.365 9.847 1.00 0.00 C ATOM 1655 CD1 ILE A 109 30.004 41.008 11.442 1.00 0.00 C ATOM 0 H ILE A 109 33.988 40.639 11.989 1.00 0.00 H new ATOM 0 HA ILE A 109 33.879 40.417 8.997 1.00 0.00 H new ATOM 0 HB ILE A 109 31.619 41.380 9.061 1.00 0.00 H new ATOM 0 HG12 ILE A 109 32.070 41.228 12.049 1.00 0.00 H new ATOM 0 HG13 ILE A 109 31.464 42.568 11.097 1.00 0.00 H new ATOM 0 HG21 ILE A 109 30.473 39.312 9.849 1.00 0.00 H new ATOM 0 HG22 ILE A 109 31.945 38.916 8.931 1.00 0.00 H new ATOM 0 HG23 ILE A 109 31.953 38.823 10.708 1.00 0.00 H new ATOM 0 HD11 ILE A 109 29.617 41.476 12.347 1.00 0.00 H new ATOM 0 HD12 ILE A 109 29.378 41.286 10.594 1.00 0.00 H new ATOM 0 HD13 ILE A 109 29.994 39.925 11.561 1.00 0.00 H new ATOM 1667 N ARG A 110 34.274 42.881 11.138 1.00 0.00 N ATOM 1668 CA ARG A 110 34.789 44.289 11.266 1.00 0.00 C ATOM 1669 C ARG A 110 35.801 44.377 12.432 1.00 0.00 C ATOM 1670 O ARG A 110 35.686 43.607 13.379 1.00 0.00 O ATOM 1671 CB ARG A 110 33.618 45.246 11.530 1.00 0.00 C ATOM 1672 CG ARG A 110 32.718 45.321 10.288 1.00 0.00 C ATOM 1673 CD ARG A 110 32.768 46.729 9.689 1.00 0.00 C ATOM 1674 NE ARG A 110 31.614 46.914 8.741 1.00 0.00 N ATOM 1675 CZ ARG A 110 31.383 46.082 7.763 1.00 0.00 C ATOM 1676 NH1 ARG A 110 32.216 45.136 7.472 1.00 0.00 N ATOM 1677 NH2 ARG A 110 30.336 46.244 7.031 1.00 0.00 N ATOM 1678 OXT ARG A 110 36.684 45.212 12.357 1.00 0.00 O ATOM 0 H ARG A 110 34.130 42.398 12.025 1.00 0.00 H new ATOM 0 HA ARG A 110 35.286 44.571 10.338 1.00 0.00 H new ATOM 0 HB2 ARG A 110 33.041 44.901 12.388 1.00 0.00 H new ATOM 0 HB3 ARG A 110 33.996 46.238 11.777 1.00 0.00 H new ATOM 0 HG2 ARG A 110 33.044 44.590 9.548 1.00 0.00 H new ATOM 0 HG3 ARG A 110 31.692 45.067 10.556 1.00 0.00 H new ATOM 0 HD2 ARG A 110 32.723 47.475 10.483 1.00 0.00 H new ATOM 0 HD3 ARG A 110 33.711 46.879 9.164 1.00 0.00 H new ATOM 0 HE ARG A 110 30.994 47.714 8.867 1.00 0.00 H new ATOM 0 HH11 ARG A 110 33.075 45.029 8.012 1.00 0.00 H new ATOM 0 HH12 ARG A 110 32.014 44.497 6.703 1.00 0.00 H new ATOM 0 HH21 ARG A 110 29.697 47.017 7.219 1.00 0.00 H new ATOM 0 HH22 ARG A 110 30.146 45.600 6.264 1.00 0.00 H new TER 1692 ARG A 110