USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 706 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 20 LYS NZ :NH3+ -168:sc= 1.74 (180deg=1.13) USER MOD Set 1.2: A 88 THR OG1 : rot -82:sc= 1.95 USER MOD Set 2.1: A 30 THR OG1 : rot 180:sc= 0.00321 USER MOD Set 2.2: A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 21 THR OG1 : rot 40:sc= 0.269 USER MOD Set 3.2: A 24 SER OG : rot -46:sc= 1.25 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0.207 X(o=0.21,f=0) USER MOD Single : A 35 THR OG1 : rot 48:sc= 0.765 USER MOD Single : A 36 SER OG : rot 62:sc= 0.0824 USER MOD Single : A 39 HIS : no HE2:sc= 0.154 K(o=0.15,f=-0.98) USER MOD Single : A 43 TYR OH : rot -133:sc= 0.0621 USER MOD Single : A 50 LYS NZ :NH3+ -162:sc= -0.0238 (180deg=-0.241) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HD1:sc= -0.0571 X(o=-0.057,f=-0.12) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.212 K(o=-0.21,f=-3.7!) USER MOD Single : A 72 SER OG : rot 35:sc= 0.744 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0.0581 USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.0057) USER MOD Single : A 79 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.113) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 84 THR OG1 : rot 76:sc= 1.26 USER MOD Single : A 87 ASN : amide:sc= -0.0242 K(o=-0.024,f=-1.2) USER MOD Single : A 90 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.18) USER MOD Single : A 93 HIS :FLIP no HD1:sc= -0.15 F(o=-0.67,f=-0.15) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.023) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 26.524 44.692 22.506 1.00 0.00 N ATOM 2 CA LYS A 9 26.126 43.790 21.471 1.00 0.00 C ATOM 3 C LYS A 9 25.941 42.412 22.010 1.00 0.00 C ATOM 4 O LYS A 9 26.834 41.578 21.875 1.00 0.00 O ATOM 5 CB LYS A 9 27.014 43.865 20.217 1.00 0.00 C ATOM 6 CG LYS A 9 28.412 44.470 20.361 1.00 0.00 C ATOM 7 CD LYS A 9 29.427 43.579 21.080 1.00 0.00 C ATOM 8 CE LYS A 9 30.747 44.266 21.439 1.00 0.00 C ATOM 9 NZ LYS A 9 31.496 44.693 20.236 1.00 0.00 N ATOM 0 HA LYS A 9 25.150 44.116 21.110 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.127 42.853 19.827 1.00 0.00 H new ATOM 0 HB3 LYS A 9 26.478 44.440 19.462 1.00 0.00 H new ATOM 0 HG2 LYS A 9 28.795 44.704 19.368 1.00 0.00 H new ATOM 0 HG3 LYS A 9 28.330 45.413 20.902 1.00 0.00 H new ATOM 0 HD2 LYS A 9 28.972 43.199 21.994 1.00 0.00 H new ATOM 0 HD3 LYS A 9 29.643 42.717 20.449 1.00 0.00 H new ATOM 0 HE2 LYS A 9 30.545 45.134 22.067 1.00 0.00 H new ATOM 0 HE3 LYS A 9 31.362 43.584 22.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 32.383 45.153 20.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 31.712 43.862 19.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 30.920 45.364 19.688 1.00 0.00 H new ATOM 23 N PRO A 10 24.857 42.085 22.650 1.00 0.00 N ATOM 24 CA PRO A 10 24.704 40.873 23.402 1.00 0.00 C ATOM 25 C PRO A 10 24.353 39.680 22.583 1.00 0.00 C ATOM 26 O PRO A 10 23.316 39.056 22.800 1.00 0.00 O ATOM 27 CB PRO A 10 23.610 41.211 24.412 1.00 0.00 C ATOM 28 CG PRO A 10 22.689 42.166 23.635 1.00 0.00 C ATOM 29 CD PRO A 10 23.717 42.971 22.824 1.00 0.00 C ATOM 0 HA PRO A 10 25.647 40.577 23.862 1.00 0.00 H new ATOM 0 HB2 PRO A 10 23.078 40.319 24.741 1.00 0.00 H new ATOM 0 HB3 PRO A 10 24.019 41.685 25.304 1.00 0.00 H new ATOM 0 HG2 PRO A 10 21.986 41.632 22.995 1.00 0.00 H new ATOM 0 HG3 PRO A 10 22.099 42.800 24.297 1.00 0.00 H new ATOM 0 HD2 PRO A 10 23.306 43.275 21.861 1.00 0.00 H new ATOM 0 HD3 PRO A 10 24.005 43.882 23.349 1.00 0.00 H new ATOM 37 N GLY A 11 25.217 39.269 21.637 1.00 0.00 N ATOM 38 CA GLY A 11 25.010 38.095 20.846 1.00 0.00 C ATOM 39 C GLY A 11 25.028 38.290 19.369 1.00 0.00 C ATOM 40 O GLY A 11 24.064 37.980 18.671 1.00 0.00 O ATOM 0 H GLY A 11 26.081 39.765 21.416 1.00 0.00 H new ATOM 0 HA2 GLY A 11 25.778 37.366 21.106 1.00 0.00 H new ATOM 0 HA3 GLY A 11 24.050 37.659 21.123 1.00 0.00 H new ATOM 44 N ASP A 12 26.176 38.755 18.845 1.00 0.00 N ATOM 45 CA ASP A 12 26.578 38.535 17.491 1.00 0.00 C ATOM 46 C ASP A 12 27.532 37.391 17.488 1.00 0.00 C ATOM 47 O ASP A 12 27.788 36.794 18.532 1.00 0.00 O ATOM 48 CB ASP A 12 27.124 39.849 16.909 1.00 0.00 C ATOM 49 CG ASP A 12 26.817 39.938 15.421 1.00 0.00 C ATOM 50 OD1 ASP A 12 27.458 39.220 14.609 1.00 0.00 O ATOM 51 OD2 ASP A 12 25.900 40.725 15.065 1.00 0.00 O ATOM 0 H ASP A 12 26.847 39.303 19.383 1.00 0.00 H new ATOM 0 HA ASP A 12 25.752 38.257 16.836 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.680 40.697 17.430 1.00 0.00 H new ATOM 0 HB3 ASP A 12 28.201 39.905 17.069 1.00 0.00 H new ATOM 56 N THR A 13 28.078 36.993 16.324 1.00 0.00 N ATOM 57 CA THR A 13 28.983 35.891 16.208 1.00 0.00 C ATOM 58 C THR A 13 30.411 36.308 16.126 1.00 0.00 C ATOM 59 O THR A 13 30.734 37.446 15.791 1.00 0.00 O ATOM 60 CB THR A 13 28.723 34.974 15.049 1.00 0.00 C ATOM 61 OG1 THR A 13 28.700 35.651 13.801 1.00 0.00 O ATOM 62 CG2 THR A 13 27.353 34.298 15.230 1.00 0.00 C ATOM 0 H THR A 13 27.883 37.453 15.435 1.00 0.00 H new ATOM 0 HA THR A 13 28.794 35.347 17.133 1.00 0.00 H new ATOM 0 HB THR A 13 29.540 34.252 15.037 1.00 0.00 H new ATOM 0 HG1 THR A 13 28.529 35.007 13.083 1.00 0.00 H new ATOM 0 HG21 THR A 13 27.162 33.631 14.389 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.350 33.723 16.156 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.574 35.060 15.273 1.00 0.00 H new ATOM 70 N PHE A 14 31.337 35.365 16.376 1.00 0.00 N ATOM 71 CA PHE A 14 32.731 35.529 16.104 1.00 0.00 C ATOM 72 C PHE A 14 33.271 34.195 15.718 1.00 0.00 C ATOM 73 O PHE A 14 32.799 33.159 16.183 1.00 0.00 O ATOM 74 CB PHE A 14 33.631 36.062 17.232 1.00 0.00 C ATOM 75 CG PHE A 14 32.897 36.767 18.320 1.00 0.00 C ATOM 76 CD1 PHE A 14 32.363 36.019 19.343 1.00 0.00 C ATOM 77 CD2 PHE A 14 32.769 38.136 18.348 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.679 36.615 20.376 1.00 0.00 C ATOM 79 CE2 PHE A 14 32.101 38.745 19.384 1.00 0.00 C ATOM 80 CZ PHE A 14 31.556 37.984 20.390 1.00 0.00 C ATOM 0 H PHE A 14 31.107 34.458 16.781 1.00 0.00 H new ATOM 0 HA PHE A 14 32.763 36.299 15.333 1.00 0.00 H new ATOM 0 HB2 PHE A 14 34.185 35.228 17.664 1.00 0.00 H new ATOM 0 HB3 PHE A 14 34.365 36.744 16.804 1.00 0.00 H new ATOM 0 HD1 PHE A 14 32.483 34.946 19.335 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.194 38.734 17.555 1.00 0.00 H new ATOM 0 HE1 PHE A 14 31.245 36.017 21.164 1.00 0.00 H new ATOM 0 HE2 PHE A 14 32.005 39.820 19.407 1.00 0.00 H new ATOM 0 HZ PHE A 14 31.026 38.466 21.199 1.00 0.00 H new ATOM 90 N GLU A 15 34.307 34.178 14.861 1.00 0.00 N ATOM 91 CA GLU A 15 35.106 33.024 14.582 1.00 0.00 C ATOM 92 C GLU A 15 36.414 33.151 15.284 1.00 0.00 C ATOM 93 O GLU A 15 37.199 34.073 15.066 1.00 0.00 O ATOM 94 CB GLU A 15 35.321 32.752 13.083 1.00 0.00 C ATOM 95 CG GLU A 15 34.018 32.393 12.365 1.00 0.00 C ATOM 96 CD GLU A 15 34.220 31.918 10.933 1.00 0.00 C ATOM 97 OE1 GLU A 15 34.659 32.721 10.067 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.891 30.736 10.647 1.00 0.00 O ATOM 0 H GLU A 15 34.601 35.004 14.340 1.00 0.00 H new ATOM 0 HA GLU A 15 34.552 32.162 14.954 1.00 0.00 H new ATOM 0 HB2 GLU A 15 35.760 33.633 12.615 1.00 0.00 H new ATOM 0 HB3 GLU A 15 36.036 31.938 12.963 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.506 31.613 12.928 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.364 33.265 12.361 1.00 0.00 H new ATOM 105 N VAL A 16 36.689 32.194 16.188 1.00 0.00 N ATOM 106 CA VAL A 16 37.830 32.136 17.047 1.00 0.00 C ATOM 107 C VAL A 16 38.836 31.225 16.430 1.00 0.00 C ATOM 108 O VAL A 16 38.661 30.009 16.372 1.00 0.00 O ATOM 109 CB VAL A 16 37.405 31.697 18.417 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.544 31.109 19.267 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.806 32.915 19.140 1.00 0.00 C ATOM 0 H VAL A 16 36.064 31.400 16.328 1.00 0.00 H new ATOM 0 HA VAL A 16 38.292 33.116 17.162 1.00 0.00 H new ATOM 0 HB VAL A 16 36.679 30.893 18.292 1.00 0.00 H new ATOM 0 HG11 VAL A 16 38.156 30.816 20.242 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.960 30.236 18.764 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.325 31.858 19.398 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.488 32.624 20.141 1.00 0.00 H new ATOM 0 HG22 VAL A 16 37.558 33.701 19.213 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.947 33.285 18.580 1.00 0.00 H new ATOM 121 N GLU A 17 39.936 31.813 15.924 1.00 0.00 N ATOM 122 CA GLU A 17 41.075 31.122 15.405 1.00 0.00 C ATOM 123 C GLU A 17 42.175 31.207 16.407 1.00 0.00 C ATOM 124 O GLU A 17 43.015 32.106 16.389 1.00 0.00 O ATOM 125 CB GLU A 17 41.480 31.672 14.027 1.00 0.00 C ATOM 126 CG GLU A 17 40.701 30.957 12.922 1.00 0.00 C ATOM 127 CD GLU A 17 40.484 31.812 11.681 1.00 0.00 C ATOM 128 OE1 GLU A 17 41.343 31.800 10.760 1.00 0.00 O ATOM 129 OE2 GLU A 17 39.409 32.463 11.589 1.00 0.00 O ATOM 0 H GLU A 17 40.035 32.827 15.875 1.00 0.00 H new ATOM 0 HA GLU A 17 40.835 30.071 15.242 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.286 32.744 13.984 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.551 31.536 13.874 1.00 0.00 H new ATOM 0 HG2 GLU A 17 41.236 30.050 12.640 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.732 30.647 13.314 1.00 0.00 H new ATOM 136 N LEU A 18 42.167 30.252 17.354 1.00 0.00 N ATOM 137 CA LEU A 18 42.931 30.286 18.564 1.00 0.00 C ATOM 138 C LEU A 18 43.848 29.115 18.638 1.00 0.00 C ATOM 139 O LEU A 18 43.507 27.992 18.269 1.00 0.00 O ATOM 140 CB LEU A 18 41.965 30.248 19.760 1.00 0.00 C ATOM 141 CG LEU A 18 42.576 30.192 21.171 1.00 0.00 C ATOM 142 CD1 LEU A 18 43.309 31.491 21.544 1.00 0.00 C ATOM 143 CD2 LEU A 18 41.467 29.891 22.193 1.00 0.00 C ATOM 0 H LEU A 18 41.597 29.410 17.271 1.00 0.00 H new ATOM 0 HA LEU A 18 43.528 31.198 18.584 1.00 0.00 H new ATOM 0 HB2 LEU A 18 41.328 31.131 19.705 1.00 0.00 H new ATOM 0 HB3 LEU A 18 41.317 29.380 19.640 1.00 0.00 H new ATOM 0 HG LEU A 18 43.321 29.396 21.182 1.00 0.00 H new ATOM 0 HD11 LEU A 18 43.722 31.400 22.549 1.00 0.00 H new ATOM 0 HD12 LEU A 18 44.117 31.669 20.834 1.00 0.00 H new ATOM 0 HD13 LEU A 18 42.609 32.326 21.514 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.896 29.850 23.194 1.00 0.00 H new ATOM 0 HD22 LEU A 18 40.712 30.677 22.153 1.00 0.00 H new ATOM 0 HD23 LEU A 18 41.005 28.932 21.957 1.00 0.00 H new ATOM 155 N ALA A 19 45.065 29.330 19.167 1.00 0.00 N ATOM 156 CA ALA A 19 46.042 28.323 19.448 1.00 0.00 C ATOM 157 C ALA A 19 46.060 28.002 20.903 1.00 0.00 C ATOM 158 O ALA A 19 45.938 28.872 21.764 1.00 0.00 O ATOM 159 CB ALA A 19 47.441 28.783 19.005 1.00 0.00 C ATOM 0 H ALA A 19 45.387 30.266 19.414 1.00 0.00 H new ATOM 0 HA ALA A 19 45.770 27.428 18.889 1.00 0.00 H new ATOM 0 HB1 ALA A 19 48.168 28.002 19.228 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.437 28.980 17.933 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.711 29.694 19.540 1.00 0.00 H new ATOM 165 N LYS A 20 46.215 26.706 21.224 1.00 0.00 N ATOM 166 CA LYS A 20 46.220 26.193 22.559 1.00 0.00 C ATOM 167 C LYS A 20 47.407 26.557 23.384 1.00 0.00 C ATOM 168 O LYS A 20 48.479 26.898 22.887 1.00 0.00 O ATOM 169 CB LYS A 20 46.118 24.659 22.502 1.00 0.00 C ATOM 170 CG LYS A 20 44.734 24.177 22.065 1.00 0.00 C ATOM 171 CD LYS A 20 44.714 22.684 21.731 1.00 0.00 C ATOM 172 CE LYS A 20 43.296 22.123 21.613 1.00 0.00 C ATOM 173 NZ LYS A 20 43.320 20.782 20.986 1.00 0.00 N ATOM 0 H LYS A 20 46.343 25.980 20.519 1.00 0.00 H new ATOM 0 HA LYS A 20 45.365 26.657 23.050 1.00 0.00 H new ATOM 0 HB2 LYS A 20 46.868 24.274 21.811 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.349 24.247 23.484 1.00 0.00 H new ATOM 0 HG2 LYS A 20 44.015 24.378 22.859 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.413 24.746 21.192 1.00 0.00 H new ATOM 0 HD2 LYS A 20 45.245 22.519 20.793 1.00 0.00 H new ATOM 0 HD3 LYS A 20 45.254 22.136 22.503 1.00 0.00 H new ATOM 0 HE2 LYS A 20 42.840 22.061 22.601 1.00 0.00 H new ATOM 0 HE3 LYS A 20 42.680 22.798 21.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 42.352 20.502 20.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 43.912 20.809 20.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 43.712 20.092 21.658 1.00 0.00 H new ATOM 187 N THR A 21 47.249 26.482 24.718 1.00 0.00 N ATOM 188 CA THR A 21 48.293 26.648 25.679 1.00 0.00 C ATOM 189 C THR A 21 48.530 25.344 26.359 1.00 0.00 C ATOM 190 O THR A 21 47.709 24.894 27.157 1.00 0.00 O ATOM 191 CB THR A 21 48.050 27.708 26.713 1.00 0.00 C ATOM 192 OG1 THR A 21 46.777 27.595 27.333 1.00 0.00 O ATOM 193 CG2 THR A 21 48.109 29.082 26.026 1.00 0.00 C ATOM 0 H THR A 21 46.343 26.295 25.148 1.00 0.00 H new ATOM 0 HA THR A 21 49.164 26.987 25.118 1.00 0.00 H new ATOM 0 HB THR A 21 48.814 27.590 27.481 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.571 26.649 27.488 1.00 0.00 H new ATOM 0 HG21 THR A 21 47.934 29.865 26.764 1.00 0.00 H new ATOM 0 HG22 THR A 21 49.091 29.221 25.575 1.00 0.00 H new ATOM 0 HG23 THR A 21 47.343 29.135 25.252 1.00 0.00 H new ATOM 201 N ASP A 22 49.639 24.659 26.025 1.00 0.00 N ATOM 202 CA ASP A 22 50.010 23.362 26.497 1.00 0.00 C ATOM 203 C ASP A 22 48.970 22.321 26.264 1.00 0.00 C ATOM 204 O ASP A 22 48.606 21.534 27.137 1.00 0.00 O ATOM 205 CB ASP A 22 50.518 23.420 27.947 1.00 0.00 C ATOM 206 CG ASP A 22 51.478 22.280 28.260 1.00 0.00 C ATOM 207 OD1 ASP A 22 52.474 22.114 27.508 1.00 0.00 O ATOM 208 OD2 ASP A 22 51.274 21.546 29.264 1.00 0.00 O ATOM 0 H ASP A 22 50.326 25.043 25.376 1.00 0.00 H new ATOM 0 HA ASP A 22 50.850 23.032 25.886 1.00 0.00 H new ATOM 0 HB2 ASP A 22 51.019 24.373 28.118 1.00 0.00 H new ATOM 0 HB3 ASP A 22 49.670 23.378 28.630 1.00 0.00 H new ATOM 213 N GLY A 23 48.398 22.298 25.047 1.00 0.00 N ATOM 214 CA GLY A 23 47.358 21.384 24.690 1.00 0.00 C ATOM 215 C GLY A 23 45.989 21.758 25.145 1.00 0.00 C ATOM 216 O GLY A 23 45.022 21.082 24.795 1.00 0.00 O ATOM 0 H GLY A 23 48.665 22.930 24.293 1.00 0.00 H new ATOM 0 HA2 GLY A 23 47.346 21.281 23.605 1.00 0.00 H new ATOM 0 HA3 GLY A 23 47.603 20.404 25.100 1.00 0.00 H new ATOM 220 N SER A 24 45.842 22.839 25.931 1.00 0.00 N ATOM 221 CA SER A 24 44.588 23.211 26.511 1.00 0.00 C ATOM 222 C SER A 24 43.962 24.419 25.904 1.00 0.00 C ATOM 223 O SER A 24 44.623 25.339 25.425 1.00 0.00 O ATOM 224 CB SER A 24 44.665 23.386 28.038 1.00 0.00 C ATOM 225 OG SER A 24 45.360 24.549 28.461 1.00 0.00 O ATOM 0 H SER A 24 46.609 23.468 26.169 1.00 0.00 H new ATOM 0 HA SER A 24 43.942 22.363 26.282 1.00 0.00 H new ATOM 0 HB2 SER A 24 43.652 23.417 28.439 1.00 0.00 H new ATOM 0 HB3 SER A 24 45.152 22.510 28.468 1.00 0.00 H new ATOM 0 HG SER A 24 46.200 24.627 27.963 1.00 0.00 H new ATOM 231 N LEU A 25 42.618 24.449 25.925 1.00 0.00 N ATOM 232 CA LEU A 25 41.812 25.569 25.550 1.00 0.00 C ATOM 233 C LEU A 25 41.360 26.256 26.792 1.00 0.00 C ATOM 234 O LEU A 25 41.610 27.444 26.998 1.00 0.00 O ATOM 235 CB LEU A 25 40.597 25.124 24.720 1.00 0.00 C ATOM 236 CG LEU A 25 40.959 24.710 23.284 1.00 0.00 C ATOM 237 CD1 LEU A 25 39.781 23.988 22.607 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.394 25.923 22.446 1.00 0.00 C ATOM 0 H LEU A 25 42.063 23.646 26.220 1.00 0.00 H new ATOM 0 HA LEU A 25 42.400 26.248 24.933 1.00 0.00 H new ATOM 0 HB2 LEU A 25 40.111 24.286 25.220 1.00 0.00 H new ATOM 0 HB3 LEU A 25 39.873 25.938 24.684 1.00 0.00 H new ATOM 0 HG LEU A 25 41.800 24.020 23.344 1.00 0.00 H new ATOM 0 HD11 LEU A 25 40.062 23.705 21.592 1.00 0.00 H new ATOM 0 HD12 LEU A 25 39.527 23.093 23.176 1.00 0.00 H new ATOM 0 HD13 LEU A 25 38.918 24.653 22.573 1.00 0.00 H new ATOM 0 HD21 LEU A 25 41.643 25.597 21.436 1.00 0.00 H new ATOM 0 HD22 LEU A 25 40.580 26.646 22.403 1.00 0.00 H new ATOM 0 HD23 LEU A 25 42.268 26.387 22.904 1.00 0.00 H new ATOM 250 N GLY A 26 40.689 25.535 27.707 1.00 0.00 N ATOM 251 CA GLY A 26 40.312 26.002 29.005 1.00 0.00 C ATOM 252 C GLY A 26 38.853 26.289 29.089 1.00 0.00 C ATOM 253 O GLY A 26 38.449 27.388 29.467 1.00 0.00 O ATOM 0 H GLY A 26 40.394 24.575 27.532 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.579 25.254 29.752 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.874 26.905 29.244 1.00 0.00 H new ATOM 257 N ILE A 27 38.008 25.293 28.767 1.00 0.00 N ATOM 258 CA ILE A 27 36.589 25.466 28.732 1.00 0.00 C ATOM 259 C ILE A 27 35.904 24.237 29.220 1.00 0.00 C ATOM 260 O ILE A 27 36.335 23.108 28.988 1.00 0.00 O ATOM 261 CB ILE A 27 36.114 25.914 27.381 1.00 0.00 C ATOM 262 CG1 ILE A 27 34.588 25.890 27.195 1.00 0.00 C ATOM 263 CG2 ILE A 27 36.855 25.159 26.264 1.00 0.00 C ATOM 264 CD1 ILE A 27 34.102 26.632 25.950 1.00 0.00 C ATOM 0 H ILE A 27 38.316 24.351 28.527 1.00 0.00 H new ATOM 0 HA ILE A 27 36.320 26.272 29.414 1.00 0.00 H new ATOM 0 HB ILE A 27 36.369 26.971 27.311 1.00 0.00 H new ATOM 0 HG12 ILE A 27 34.255 24.853 27.141 1.00 0.00 H new ATOM 0 HG13 ILE A 27 34.118 26.330 28.074 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.495 25.500 25.293 1.00 0.00 H new ATOM 0 HG22 ILE A 27 37.925 25.352 26.342 1.00 0.00 H new ATOM 0 HG23 ILE A 27 36.671 24.089 26.364 1.00 0.00 H new ATOM 0 HD11 ILE A 27 33.015 26.569 25.890 1.00 0.00 H new ATOM 0 HD12 ILE A 27 34.402 27.678 26.010 1.00 0.00 H new ATOM 0 HD13 ILE A 27 34.541 26.179 25.061 1.00 0.00 H new ATOM 276 N SER A 28 34.802 24.454 29.960 1.00 0.00 N ATOM 277 CA SER A 28 33.867 23.466 30.401 1.00 0.00 C ATOM 278 C SER A 28 32.580 23.723 29.696 1.00 0.00 C ATOM 279 O SER A 28 31.962 24.769 29.890 1.00 0.00 O ATOM 280 CB SER A 28 33.633 23.539 31.920 1.00 0.00 C ATOM 281 OG SER A 28 32.724 22.563 32.409 1.00 0.00 O ATOM 0 H SER A 28 34.547 25.391 30.273 1.00 0.00 H new ATOM 0 HA SER A 28 34.261 22.475 30.177 1.00 0.00 H new ATOM 0 HB2 SER A 28 34.588 23.420 32.431 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.257 24.530 32.173 1.00 0.00 H new ATOM 0 HG SER A 28 32.624 22.666 33.378 1.00 0.00 H new ATOM 287 N VAL A 29 32.139 22.788 28.836 1.00 0.00 N ATOM 288 CA VAL A 29 30.933 22.910 28.076 1.00 0.00 C ATOM 289 C VAL A 29 29.820 22.117 28.671 1.00 0.00 C ATOM 290 O VAL A 29 30.016 21.194 29.459 1.00 0.00 O ATOM 291 CB VAL A 29 31.053 22.555 26.624 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.970 23.572 25.923 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.569 21.121 26.414 1.00 0.00 C ATOM 0 H VAL A 29 32.639 21.916 28.663 1.00 0.00 H new ATOM 0 HA VAL A 29 30.713 23.977 28.123 1.00 0.00 H new ATOM 0 HB VAL A 29 30.057 22.595 26.184 1.00 0.00 H new ATOM 0 HG11 VAL A 29 32.058 23.315 24.867 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.546 24.571 26.019 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.957 23.551 26.385 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.638 20.912 25.346 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.554 21.019 26.869 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.880 20.415 26.878 1.00 0.00 H new ATOM 303 N THR A 30 28.577 22.474 28.302 1.00 0.00 N ATOM 304 CA THR A 30 27.375 21.803 28.692 1.00 0.00 C ATOM 305 C THR A 30 26.430 21.850 27.541 1.00 0.00 C ATOM 306 O THR A 30 26.758 22.400 26.491 1.00 0.00 O ATOM 307 CB THR A 30 26.785 22.418 29.927 1.00 0.00 C ATOM 308 OG1 THR A 30 25.774 21.620 30.522 1.00 0.00 O ATOM 309 CG2 THR A 30 26.208 23.822 29.683 1.00 0.00 C ATOM 0 H THR A 30 28.401 23.276 27.697 1.00 0.00 H new ATOM 0 HA THR A 30 27.589 20.765 28.945 1.00 0.00 H new ATOM 0 HB THR A 30 27.630 22.490 30.611 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.430 22.071 31.321 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.796 24.213 30.613 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.999 24.484 29.330 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.419 23.766 28.933 1.00 0.00 H new ATOM 317 N GLY A 31 25.217 21.286 27.680 1.00 0.00 N ATOM 318 CA GLY A 31 24.181 21.392 26.700 1.00 0.00 C ATOM 319 C GLY A 31 23.845 20.098 26.040 1.00 0.00 C ATOM 320 O GLY A 31 24.041 19.024 26.606 1.00 0.00 O ATOM 0 H GLY A 31 24.949 20.740 28.499 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.284 21.791 27.174 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.486 22.110 25.938 1.00 0.00 H new ATOM 324 N GLY A 32 23.295 20.176 24.815 1.00 0.00 N ATOM 325 CA GLY A 32 22.977 19.051 23.993 1.00 0.00 C ATOM 326 C GLY A 32 21.525 18.724 23.942 1.00 0.00 C ATOM 327 O GLY A 32 20.756 18.980 24.867 1.00 0.00 O ATOM 0 H GLY A 32 23.061 21.067 24.377 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.330 19.244 22.980 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.521 18.181 24.360 1.00 0.00 H new ATOM 331 N VAL A 33 21.091 18.110 22.827 1.00 0.00 N ATOM 332 CA VAL A 33 19.715 17.895 22.503 1.00 0.00 C ATOM 333 C VAL A 33 19.069 16.750 23.205 1.00 0.00 C ATOM 334 O VAL A 33 17.846 16.657 23.297 1.00 0.00 O ATOM 335 CB VAL A 33 19.565 17.810 21.013 1.00 0.00 C ATOM 336 CG1 VAL A 33 19.995 16.445 20.449 1.00 0.00 C ATOM 337 CG2 VAL A 33 18.137 18.176 20.579 1.00 0.00 C ATOM 0 H VAL A 33 21.729 17.747 22.119 1.00 0.00 H new ATOM 0 HA VAL A 33 19.167 18.758 22.881 1.00 0.00 H new ATOM 0 HB VAL A 33 20.247 18.545 20.586 1.00 0.00 H new ATOM 0 HG11 VAL A 33 19.865 16.441 19.367 1.00 0.00 H new ATOM 0 HG12 VAL A 33 21.043 16.266 20.689 1.00 0.00 H new ATOM 0 HG13 VAL A 33 19.382 15.659 20.891 1.00 0.00 H new ATOM 0 HG21 VAL A 33 18.057 18.106 19.494 1.00 0.00 H new ATOM 0 HG22 VAL A 33 17.429 17.488 21.040 1.00 0.00 H new ATOM 0 HG23 VAL A 33 17.911 19.195 20.894 1.00 0.00 H new ATOM 347 N ASN A 34 19.847 15.818 23.783 1.00 0.00 N ATOM 348 CA ASN A 34 19.344 14.661 24.457 1.00 0.00 C ATOM 349 C ASN A 34 18.883 14.997 25.833 1.00 0.00 C ATOM 350 O ASN A 34 18.080 14.303 26.456 1.00 0.00 O ATOM 351 CB ASN A 34 20.456 13.599 24.485 1.00 0.00 C ATOM 352 CG ASN A 34 19.979 12.155 24.553 1.00 0.00 C ATOM 353 OD1 ASN A 34 20.233 11.369 23.643 1.00 0.00 O ATOM 354 ND2 ASN A 34 19.308 11.758 25.668 1.00 0.00 N ATOM 0 H ASN A 34 20.866 15.872 23.781 1.00 0.00 H new ATOM 0 HA ASN A 34 18.477 14.271 23.924 1.00 0.00 H new ATOM 0 HB2 ASN A 34 21.072 13.719 23.594 1.00 0.00 H new ATOM 0 HB3 ASN A 34 21.098 13.792 25.344 1.00 0.00 H new ATOM 0 HD21 ASN A 34 19.004 10.789 25.762 1.00 0.00 H new ATOM 0 HD22 ASN A 34 19.109 12.429 26.410 1.00 0.00 H new ATOM 361 N THR A 35 19.396 16.116 26.374 1.00 0.00 N ATOM 362 CA THR A 35 19.125 16.644 27.676 1.00 0.00 C ATOM 363 C THR A 35 18.042 17.663 27.585 1.00 0.00 C ATOM 364 O THR A 35 17.663 18.100 26.499 1.00 0.00 O ATOM 365 CB THR A 35 20.352 17.245 28.295 1.00 0.00 C ATOM 366 OG1 THR A 35 21.271 17.710 27.317 1.00 0.00 O ATOM 367 CG2 THR A 35 21.098 16.144 29.067 1.00 0.00 C ATOM 0 H THR A 35 20.055 16.699 25.857 1.00 0.00 H new ATOM 0 HA THR A 35 18.803 15.823 28.317 1.00 0.00 H new ATOM 0 HB THR A 35 20.023 18.073 28.923 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.795 18.247 26.650 1.00 0.00 H new ATOM 0 HG21 THR A 35 21.994 16.564 29.524 1.00 0.00 H new ATOM 0 HG22 THR A 35 20.449 15.741 29.844 1.00 0.00 H new ATOM 0 HG23 THR A 35 21.381 15.346 28.380 1.00 0.00 H new ATOM 375 N SER A 36 17.480 18.109 28.722 1.00 0.00 N ATOM 376 CA SER A 36 16.435 19.084 28.777 1.00 0.00 C ATOM 377 C SER A 36 16.944 20.479 28.657 1.00 0.00 C ATOM 378 O SER A 36 16.692 21.355 29.482 1.00 0.00 O ATOM 379 CB SER A 36 15.571 18.963 30.043 1.00 0.00 C ATOM 380 OG SER A 36 16.311 19.116 31.245 1.00 0.00 O ATOM 0 H SER A 36 17.766 17.776 29.643 1.00 0.00 H new ATOM 0 HA SER A 36 15.808 18.868 27.912 1.00 0.00 H new ATOM 0 HB2 SER A 36 14.784 19.716 30.011 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.080 17.990 30.048 1.00 0.00 H new ATOM 0 HG SER A 36 16.714 20.009 31.270 1.00 0.00 H new ATOM 386 N VAL A 37 17.723 20.761 27.597 1.00 0.00 N ATOM 387 CA VAL A 37 18.427 21.993 27.418 1.00 0.00 C ATOM 388 C VAL A 37 17.598 22.915 26.593 1.00 0.00 C ATOM 389 O VAL A 37 17.023 22.519 25.580 1.00 0.00 O ATOM 390 CB VAL A 37 19.771 21.738 26.801 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.516 23.022 26.399 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.610 20.949 27.820 1.00 0.00 C ATOM 0 H VAL A 37 17.868 20.102 26.832 1.00 0.00 H new ATOM 0 HA VAL A 37 18.603 22.467 28.384 1.00 0.00 H new ATOM 0 HB VAL A 37 19.618 21.179 25.878 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.479 22.762 25.960 1.00 0.00 H new ATOM 0 HG12 VAL A 37 19.922 23.574 25.670 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.675 23.642 27.281 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.596 20.747 27.401 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.717 21.534 28.734 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.113 20.006 28.049 1.00 0.00 H new ATOM 402 N ARG A 38 17.494 24.193 26.997 1.00 0.00 N ATOM 403 CA ARG A 38 16.684 25.165 26.330 1.00 0.00 C ATOM 404 C ARG A 38 17.272 25.528 25.010 1.00 0.00 C ATOM 405 O ARG A 38 18.356 26.105 24.935 1.00 0.00 O ATOM 406 CB ARG A 38 16.467 26.398 27.223 1.00 0.00 C ATOM 407 CG ARG A 38 15.379 27.353 26.730 1.00 0.00 C ATOM 408 CD ARG A 38 15.052 28.481 27.711 1.00 0.00 C ATOM 409 NE ARG A 38 16.225 29.398 27.755 1.00 0.00 N ATOM 410 CZ ARG A 38 17.035 29.596 28.836 1.00 0.00 C ATOM 411 NH1 ARG A 38 16.855 28.962 30.031 1.00 0.00 N ATOM 412 NH2 ARG A 38 18.082 30.465 28.722 1.00 0.00 N ATOM 0 H ARG A 38 17.987 24.561 27.810 1.00 0.00 H new ATOM 0 HA ARG A 38 15.704 24.728 26.137 1.00 0.00 H new ATOM 0 HB2 ARG A 38 16.211 26.063 28.228 1.00 0.00 H new ATOM 0 HB3 ARG A 38 17.406 26.946 27.300 1.00 0.00 H new ATOM 0 HG2 ARG A 38 15.695 27.789 25.782 1.00 0.00 H new ATOM 0 HG3 ARG A 38 14.471 26.783 26.532 1.00 0.00 H new ATOM 0 HD2 ARG A 38 14.159 29.018 27.392 1.00 0.00 H new ATOM 0 HD3 ARG A 38 14.845 28.078 28.702 1.00 0.00 H new ATOM 0 HE ARG A 38 16.441 29.922 26.907 1.00 0.00 H new ATOM 0 HH11 ARG A 38 16.085 28.303 30.148 1.00 0.00 H new ATOM 0 HH12 ARG A 38 17.490 29.147 30.807 1.00 0.00 H new ATOM 0 HH21 ARG A 38 18.247 30.952 27.841 1.00 0.00 H new ATOM 0 HH22 ARG A 38 18.699 30.627 29.518 1.00 0.00 H new ATOM 426 N HIS A 39 16.597 25.112 23.923 1.00 0.00 N ATOM 427 CA HIS A 39 17.033 25.152 22.562 1.00 0.00 C ATOM 428 C HIS A 39 18.085 24.172 22.170 1.00 0.00 C ATOM 429 O HIS A 39 18.526 24.143 21.022 1.00 0.00 O ATOM 430 CB HIS A 39 17.321 26.579 22.063 1.00 0.00 C ATOM 431 CG HIS A 39 16.816 26.852 20.677 1.00 0.00 C ATOM 432 ND1 HIS A 39 17.311 26.246 19.541 1.00 0.00 N ATOM 433 CD2 HIS A 39 15.790 27.637 20.251 1.00 0.00 C ATOM 434 CE1 HIS A 39 16.566 26.689 18.493 1.00 0.00 C ATOM 435 NE2 HIS A 39 15.635 27.540 18.884 1.00 0.00 N ATOM 0 H HIS A 39 15.662 24.712 24.007 1.00 0.00 H new ATOM 0 HA HIS A 39 16.158 24.793 22.020 1.00 0.00 H new ATOM 0 HB2 HIS A 39 16.868 27.292 22.751 1.00 0.00 H new ATOM 0 HB3 HIS A 39 18.397 26.752 22.088 1.00 0.00 H new ATOM 0 HD1 HIS A 39 18.090 25.589 19.496 1.00 0.00 H new ATOM 0 HD2 HIS A 39 15.180 28.252 20.895 1.00 0.00 H new ATOM 0 HE1 HIS A 39 16.717 26.383 17.468 1.00 0.00 H new ATOM 443 N GLY A 40 18.529 23.277 23.070 1.00 0.00 N ATOM 444 CA GLY A 40 19.334 22.139 22.746 1.00 0.00 C ATOM 445 C GLY A 40 20.744 22.354 22.318 1.00 0.00 C ATOM 446 O GLY A 40 21.396 21.414 21.864 1.00 0.00 O ATOM 0 H GLY A 40 18.319 23.349 24.065 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.350 21.487 23.620 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.828 21.593 21.950 1.00 0.00 H new ATOM 450 N GLY A 41 21.281 23.581 22.439 1.00 0.00 N ATOM 451 CA GLY A 41 22.598 23.911 21.991 1.00 0.00 C ATOM 452 C GLY A 41 23.684 23.502 22.925 1.00 0.00 C ATOM 453 O GLY A 41 23.441 22.932 23.988 1.00 0.00 O ATOM 0 H GLY A 41 20.785 24.366 22.861 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.769 23.438 21.024 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.656 24.988 21.834 1.00 0.00 H new ATOM 457 N ILE A 42 24.944 23.777 22.542 1.00 0.00 N ATOM 458 CA ILE A 42 26.121 23.522 23.314 1.00 0.00 C ATOM 459 C ILE A 42 26.590 24.817 23.884 1.00 0.00 C ATOM 460 O ILE A 42 26.724 25.795 23.150 1.00 0.00 O ATOM 461 CB ILE A 42 27.171 22.880 22.457 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.662 21.574 21.826 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.481 22.649 23.230 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.314 20.464 22.817 1.00 0.00 C ATOM 0 H ILE A 42 25.153 24.203 21.639 1.00 0.00 H new ATOM 0 HA ILE A 42 25.906 22.830 24.129 1.00 0.00 H new ATOM 0 HB ILE A 42 27.390 23.577 21.648 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.777 21.798 21.231 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.422 21.201 21.139 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.214 22.182 22.572 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.868 23.605 23.584 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.291 21.996 24.082 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.965 19.586 22.273 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.199 20.203 23.397 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.529 20.810 23.489 1.00 0.00 H new ATOM 476 N TYR A 43 26.819 24.905 25.206 1.00 0.00 N ATOM 477 CA TYR A 43 27.043 26.154 25.863 1.00 0.00 C ATOM 478 C TYR A 43 28.246 26.131 26.742 1.00 0.00 C ATOM 479 O TYR A 43 28.655 25.078 27.227 1.00 0.00 O ATOM 480 CB TYR A 43 25.865 26.565 26.762 1.00 0.00 C ATOM 481 CG TYR A 43 24.615 26.717 25.966 1.00 0.00 C ATOM 482 CD1 TYR A 43 24.355 27.893 25.302 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.716 25.680 25.874 1.00 0.00 C ATOM 484 CE1 TYR A 43 23.223 28.031 24.535 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.582 25.810 25.108 1.00 0.00 C ATOM 486 CZ TYR A 43 22.339 26.983 24.433 1.00 0.00 C ATOM 487 OH TYR A 43 21.154 27.088 23.672 1.00 0.00 O ATOM 0 H TYR A 43 26.849 24.097 25.828 1.00 0.00 H new ATOM 0 HA TYR A 43 27.175 26.864 25.047 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.717 25.815 27.539 1.00 0.00 H new ATOM 0 HB3 TYR A 43 26.097 27.504 27.265 1.00 0.00 H new ATOM 0 HD1 TYR A 43 25.048 28.717 25.384 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.902 24.759 26.406 1.00 0.00 H new ATOM 0 HE1 TYR A 43 23.029 28.958 24.015 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.882 24.991 25.036 1.00 0.00 H new ATOM 0 HH TYR A 43 20.398 26.748 24.195 1.00 0.00 H new ATOM 497 N VAL A 44 28.837 27.304 27.035 1.00 0.00 N ATOM 498 CA VAL A 44 29.853 27.440 28.032 1.00 0.00 C ATOM 499 C VAL A 44 29.270 27.403 29.403 1.00 0.00 C ATOM 500 O VAL A 44 28.394 28.201 29.734 1.00 0.00 O ATOM 501 CB VAL A 44 30.674 28.691 27.936 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.900 28.622 28.861 1.00 0.00 C ATOM 503 CG2 VAL A 44 31.138 28.920 26.488 1.00 0.00 C ATOM 0 H VAL A 44 28.602 28.179 26.567 1.00 0.00 H new ATOM 0 HA VAL A 44 30.511 26.592 27.844 1.00 0.00 H new ATOM 0 HB VAL A 44 30.045 29.524 28.251 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.476 29.543 28.770 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.571 28.500 29.893 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.523 27.774 28.576 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.733 29.832 26.436 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.743 28.074 26.162 1.00 0.00 H new ATOM 0 HG23 VAL A 44 30.268 29.017 25.838 1.00 0.00 H new ATOM 513 N LYS A 45 29.745 26.489 30.269 1.00 0.00 N ATOM 514 CA LYS A 45 29.414 26.463 31.660 1.00 0.00 C ATOM 515 C LYS A 45 30.425 27.217 32.454 1.00 0.00 C ATOM 516 O LYS A 45 30.073 28.033 33.303 1.00 0.00 O ATOM 517 CB LYS A 45 29.272 25.020 32.171 1.00 0.00 C ATOM 518 CG LYS A 45 28.953 24.915 33.664 1.00 0.00 C ATOM 519 CD LYS A 45 28.348 23.570 34.072 1.00 0.00 C ATOM 520 CE LYS A 45 26.850 23.478 33.777 1.00 0.00 C ATOM 521 NZ LYS A 45 26.341 22.111 34.028 1.00 0.00 N ATOM 0 H LYS A 45 30.382 25.742 29.991 1.00 0.00 H new ATOM 0 HA LYS A 45 28.448 26.953 31.787 1.00 0.00 H new ATOM 0 HB2 LYS A 45 28.484 24.522 31.606 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.198 24.482 31.969 1.00 0.00 H new ATOM 0 HG2 LYS A 45 29.867 25.080 34.234 1.00 0.00 H new ATOM 0 HG3 LYS A 45 28.260 25.712 33.935 1.00 0.00 H new ATOM 0 HD2 LYS A 45 28.867 22.769 33.545 1.00 0.00 H new ATOM 0 HD3 LYS A 45 28.514 23.411 35.137 1.00 0.00 H new ATOM 0 HE2 LYS A 45 26.309 24.191 34.399 1.00 0.00 H new ATOM 0 HE3 LYS A 45 26.663 23.754 32.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 25.323 22.076 33.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 26.843 21.436 33.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 26.500 21.859 35.024 1.00 0.00 H new ATOM 535 N ALA A 46 31.727 26.991 32.203 1.00 0.00 N ATOM 536 CA ALA A 46 32.759 27.711 32.885 1.00 0.00 C ATOM 537 C ALA A 46 33.982 27.825 32.041 1.00 0.00 C ATOM 538 O ALA A 46 34.238 26.992 31.175 1.00 0.00 O ATOM 539 CB ALA A 46 33.111 27.033 34.219 1.00 0.00 C ATOM 0 H ALA A 46 32.066 26.308 31.526 1.00 0.00 H new ATOM 0 HA ALA A 46 32.380 28.713 33.087 1.00 0.00 H new ATOM 0 HB1 ALA A 46 33.898 27.599 34.718 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.227 27.001 34.856 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.459 26.017 34.030 1.00 0.00 H new ATOM 545 N ILE A 47 34.789 28.877 32.272 1.00 0.00 N ATOM 546 CA ILE A 47 36.040 29.100 31.617 1.00 0.00 C ATOM 547 C ILE A 47 37.144 28.902 32.597 1.00 0.00 C ATOM 548 O ILE A 47 37.158 29.432 33.707 1.00 0.00 O ATOM 549 CB ILE A 47 36.014 30.384 30.841 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.598 30.211 29.429 1.00 0.00 C ATOM 551 CG2 ILE A 47 36.683 31.577 31.543 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.678 29.450 28.475 1.00 0.00 C ATOM 0 H ILE A 47 34.557 29.606 32.947 1.00 0.00 H new ATOM 0 HA ILE A 47 36.237 28.363 30.838 1.00 0.00 H new ATOM 0 HB ILE A 47 34.954 30.629 30.770 1.00 0.00 H new ATOM 0 HG12 ILE A 47 36.809 31.195 29.009 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.549 29.684 29.501 1.00 0.00 H new ATOM 0 HG21 ILE A 47 36.615 32.459 30.906 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.178 31.772 32.489 1.00 0.00 H new ATOM 0 HG23 ILE A 47 37.731 31.347 31.732 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.155 29.366 27.499 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.487 28.453 28.872 1.00 0.00 H new ATOM 0 HD13 ILE A 47 34.735 29.987 28.373 1.00 0.00 H new ATOM 564 N ILE A 48 38.054 27.962 32.284 1.00 0.00 N ATOM 565 CA ILE A 48 39.041 27.396 33.151 1.00 0.00 C ATOM 566 C ILE A 48 40.201 28.300 33.387 1.00 0.00 C ATOM 567 O ILE A 48 40.784 28.702 32.382 1.00 0.00 O ATOM 568 CB ILE A 48 39.542 26.086 32.618 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.377 25.144 32.272 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.536 25.391 33.564 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.492 24.722 33.443 1.00 0.00 C ATOM 0 H ILE A 48 38.102 27.566 31.345 1.00 0.00 H new ATOM 0 HA ILE A 48 38.538 27.242 34.106 1.00 0.00 H new ATOM 0 HB ILE A 48 40.088 26.321 31.704 1.00 0.00 H new ATOM 0 HG12 ILE A 48 37.750 25.631 31.525 1.00 0.00 H new ATOM 0 HG13 ILE A 48 38.786 24.246 31.808 1.00 0.00 H new ATOM 0 HG21 ILE A 48 40.861 24.449 33.122 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.401 26.036 33.721 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.051 25.195 34.520 1.00 0.00 H new ATOM 0 HD11 ILE A 48 36.704 24.060 33.084 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.095 24.199 34.185 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.044 25.606 33.897 1.00 0.00 H new ATOM 583 N PRO A 49 40.638 28.653 34.559 1.00 0.00 N ATOM 584 CA PRO A 49 41.669 29.630 34.752 1.00 0.00 C ATOM 585 C PRO A 49 42.972 29.268 34.124 1.00 0.00 C ATOM 586 O PRO A 49 43.372 28.105 34.139 1.00 0.00 O ATOM 587 CB PRO A 49 41.813 29.760 36.266 1.00 0.00 C ATOM 588 CG PRO A 49 41.307 28.412 36.806 1.00 0.00 C ATOM 589 CD PRO A 49 40.165 28.107 35.823 1.00 0.00 C ATOM 0 HA PRO A 49 41.392 30.565 34.266 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.848 29.942 36.554 1.00 0.00 H new ATOM 0 HB3 PRO A 49 41.224 30.591 36.653 1.00 0.00 H new ATOM 0 HG2 PRO A 49 42.081 27.645 36.788 1.00 0.00 H new ATOM 0 HG3 PRO A 49 40.955 28.487 37.835 1.00 0.00 H new ATOM 0 HD2 PRO A 49 39.976 27.036 35.750 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.232 28.575 36.137 1.00 0.00 H new ATOM 597 N LYS A 50 43.631 30.260 33.500 1.00 0.00 N ATOM 598 CA LYS A 50 44.776 30.110 32.657 1.00 0.00 C ATOM 599 C LYS A 50 44.657 29.146 31.526 1.00 0.00 C ATOM 600 O LYS A 50 45.616 28.472 31.158 1.00 0.00 O ATOM 601 CB LYS A 50 46.081 29.912 33.445 1.00 0.00 C ATOM 602 CG LYS A 50 46.397 31.094 34.364 1.00 0.00 C ATOM 603 CD LYS A 50 47.871 31.130 34.776 1.00 0.00 C ATOM 604 CE LYS A 50 48.380 32.522 35.152 1.00 0.00 C ATOM 605 NZ LYS A 50 48.407 33.418 33.973 1.00 0.00 N ATOM 0 H LYS A 50 43.343 31.234 33.591 1.00 0.00 H new ATOM 0 HA LYS A 50 44.822 31.079 32.160 1.00 0.00 H new ATOM 0 HB2 LYS A 50 46.007 29.002 34.041 1.00 0.00 H new ATOM 0 HB3 LYS A 50 46.905 29.769 32.746 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.141 32.024 33.857 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.774 31.035 35.256 1.00 0.00 H new ATOM 0 HD2 LYS A 50 48.017 30.460 35.624 1.00 0.00 H new ATOM 0 HD3 LYS A 50 48.476 30.743 33.956 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.740 32.950 35.923 1.00 0.00 H new ATOM 0 HE3 LYS A 50 49.381 32.444 35.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 49.023 34.232 34.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 48.773 32.898 33.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 47.444 33.754 33.770 1.00 0.00 H new ATOM 619 N GLY A 51 43.481 29.055 30.879 1.00 0.00 N ATOM 620 CA GLY A 51 43.373 28.514 29.560 1.00 0.00 C ATOM 621 C GLY A 51 43.646 29.515 28.490 1.00 0.00 C ATOM 622 O GLY A 51 43.539 30.724 28.689 1.00 0.00 O ATOM 0 H GLY A 51 42.593 29.361 31.277 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.070 27.683 29.457 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.371 28.108 29.422 1.00 0.00 H new ATOM 626 N ALA A 52 43.961 29.055 27.266 1.00 0.00 N ATOM 627 CA ALA A 52 43.936 29.820 26.058 1.00 0.00 C ATOM 628 C ALA A 52 42.678 30.574 25.798 1.00 0.00 C ATOM 629 O ALA A 52 42.688 31.794 25.645 1.00 0.00 O ATOM 630 CB ALA A 52 44.245 28.896 24.869 1.00 0.00 C ATOM 0 H ALA A 52 44.251 28.089 27.111 1.00 0.00 H new ATOM 0 HA ALA A 52 44.699 30.588 26.184 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.227 29.474 23.945 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.232 28.452 25.000 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.495 28.106 24.817 1.00 0.00 H new ATOM 636 N ALA A 53 41.543 29.852 25.770 1.00 0.00 N ATOM 637 CA ALA A 53 40.202 30.286 25.533 1.00 0.00 C ATOM 638 C ALA A 53 39.704 31.205 26.594 1.00 0.00 C ATOM 639 O ALA A 53 39.188 32.281 26.295 1.00 0.00 O ATOM 640 CB ALA A 53 39.263 29.073 25.413 1.00 0.00 C ATOM 0 H ALA A 53 41.574 28.846 25.933 1.00 0.00 H new ATOM 0 HA ALA A 53 40.209 30.842 24.596 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.245 29.418 25.233 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.586 28.444 24.583 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.293 28.497 26.338 1.00 0.00 H new ATOM 646 N GLU A 54 39.910 30.815 27.865 1.00 0.00 N ATOM 647 CA GLU A 54 39.805 31.650 29.020 1.00 0.00 C ATOM 648 C GLU A 54 40.373 33.015 28.834 1.00 0.00 C ATOM 649 O GLU A 54 39.683 34.032 28.890 1.00 0.00 O ATOM 650 CB GLU A 54 40.556 30.974 30.180 1.00 0.00 C ATOM 651 CG GLU A 54 40.478 31.536 31.601 1.00 0.00 C ATOM 652 CD GLU A 54 40.588 33.032 31.861 1.00 0.00 C ATOM 653 OE1 GLU A 54 41.718 33.586 31.838 1.00 0.00 O ATOM 654 OE2 GLU A 54 39.541 33.664 32.170 1.00 0.00 O ATOM 0 H GLU A 54 40.166 29.856 28.099 1.00 0.00 H new ATOM 0 HA GLU A 54 38.741 31.772 29.222 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.211 29.941 30.225 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.610 30.946 29.905 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.528 31.208 32.022 1.00 0.00 H new ATOM 0 HG3 GLU A 54 41.266 31.053 32.179 1.00 0.00 H new ATOM 661 N SER A 55 41.701 33.054 28.627 1.00 0.00 N ATOM 662 CA SER A 55 42.482 34.251 28.610 1.00 0.00 C ATOM 663 C SER A 55 42.189 35.146 27.456 1.00 0.00 C ATOM 664 O SER A 55 42.215 36.368 27.604 1.00 0.00 O ATOM 665 CB SER A 55 43.981 33.914 28.668 1.00 0.00 C ATOM 666 OG SER A 55 44.795 35.054 28.898 1.00 0.00 O ATOM 0 H SER A 55 42.255 32.213 28.464 1.00 0.00 H new ATOM 0 HA SER A 55 42.197 34.811 29.501 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.154 33.185 29.459 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.279 33.444 27.731 1.00 0.00 H new ATOM 0 HG SER A 55 45.736 34.783 28.927 1.00 0.00 H new ATOM 672 N ASP A 56 41.874 34.582 26.277 1.00 0.00 N ATOM 673 CA ASP A 56 41.542 35.266 25.066 1.00 0.00 C ATOM 674 C ASP A 56 40.442 36.260 25.216 1.00 0.00 C ATOM 675 O ASP A 56 40.661 37.460 25.066 1.00 0.00 O ATOM 676 CB ASP A 56 41.220 34.223 23.981 1.00 0.00 C ATOM 677 CG ASP A 56 40.991 34.862 22.619 1.00 0.00 C ATOM 678 OD1 ASP A 56 39.834 35.277 22.341 1.00 0.00 O ATOM 679 OD2 ASP A 56 41.970 34.971 21.832 1.00 0.00 O ATOM 0 H ASP A 56 41.850 33.569 26.163 1.00 0.00 H new ATOM 0 HA ASP A 56 42.408 35.858 24.772 1.00 0.00 H new ATOM 0 HB2 ASP A 56 42.040 33.508 23.912 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.332 33.662 24.271 1.00 0.00 H new ATOM 684 N GLY A 57 39.217 35.798 25.525 1.00 0.00 N ATOM 685 CA GLY A 57 38.125 36.660 25.857 1.00 0.00 C ATOM 686 C GLY A 57 37.001 36.677 24.879 1.00 0.00 C ATOM 687 O GLY A 57 35.935 37.212 25.180 1.00 0.00 O ATOM 0 H GLY A 57 38.980 34.806 25.545 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.733 36.363 26.830 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.506 37.676 25.964 1.00 0.00 H new ATOM 691 N ARG A 58 37.154 36.088 23.680 1.00 0.00 N ATOM 692 CA ARG A 58 36.062 35.934 22.769 1.00 0.00 C ATOM 693 C ARG A 58 35.085 34.894 23.195 1.00 0.00 C ATOM 694 O ARG A 58 33.910 34.963 22.835 1.00 0.00 O ATOM 695 CB ARG A 58 36.545 35.668 21.333 1.00 0.00 C ATOM 696 CG ARG A 58 36.878 36.973 20.606 1.00 0.00 C ATOM 697 CD ARG A 58 37.460 36.824 19.199 1.00 0.00 C ATOM 698 NE ARG A 58 37.597 38.216 18.686 1.00 0.00 N ATOM 699 CZ ARG A 58 38.061 38.555 17.447 1.00 0.00 C ATOM 700 NH1 ARG A 58 38.488 37.624 16.546 1.00 0.00 N ATOM 701 NH2 ARG A 58 38.113 39.878 17.115 1.00 0.00 N ATOM 0 H ARG A 58 38.040 35.716 23.339 1.00 0.00 H new ATOM 0 HA ARG A 58 35.535 36.888 22.782 1.00 0.00 H new ATOM 0 HB2 ARG A 58 37.427 35.028 21.357 1.00 0.00 H new ATOM 0 HB3 ARG A 58 35.774 35.129 20.782 1.00 0.00 H new ATOM 0 HG2 ARG A 58 35.970 37.572 20.541 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.587 37.534 21.214 1.00 0.00 H new ATOM 0 HD2 ARG A 58 38.424 36.316 19.223 1.00 0.00 H new ATOM 0 HD3 ARG A 58 36.803 36.232 18.562 1.00 0.00 H new ATOM 0 HE ARG A 58 37.323 38.976 19.309 1.00 0.00 H new ATOM 0 HH11 ARG A 58 38.468 36.633 16.788 1.00 0.00 H new ATOM 0 HH12 ARG A 58 38.828 37.919 15.630 1.00 0.00 H new ATOM 0 HH21 ARG A 58 37.810 40.584 17.785 1.00 0.00 H new ATOM 0 HH22 ARG A 58 38.455 40.160 16.196 1.00 0.00 H new ATOM 715 N ILE A 59 35.522 33.913 24.005 1.00 0.00 N ATOM 716 CA ILE A 59 34.720 32.855 24.537 1.00 0.00 C ATOM 717 C ILE A 59 34.464 33.136 25.978 1.00 0.00 C ATOM 718 O ILE A 59 35.357 33.571 26.705 1.00 0.00 O ATOM 719 CB ILE A 59 35.389 31.528 24.338 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.633 31.321 22.834 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.515 30.402 24.918 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.366 30.027 22.480 1.00 0.00 C ATOM 0 H ILE A 59 36.495 33.856 24.306 1.00 0.00 H new ATOM 0 HA ILE A 59 33.767 32.806 24.010 1.00 0.00 H new ATOM 0 HB ILE A 59 36.345 31.507 24.861 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.673 31.332 22.319 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.208 32.165 22.453 1.00 0.00 H new ATOM 0 HG21 ILE A 59 35.011 29.443 24.768 1.00 0.00 H new ATOM 0 HG22 ILE A 59 34.365 30.570 25.985 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.549 30.394 24.413 1.00 0.00 H new ATOM 0 HD11 ILE A 59 36.494 29.965 21.399 1.00 0.00 H new ATOM 0 HD12 ILE A 59 37.343 30.019 22.962 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.784 29.173 22.826 1.00 0.00 H new ATOM 734 N HIS A 60 33.218 32.954 26.450 1.00 0.00 N ATOM 735 CA HIS A 60 32.813 33.382 27.753 1.00 0.00 C ATOM 736 C HIS A 60 31.674 32.577 28.281 1.00 0.00 C ATOM 737 O HIS A 60 30.903 31.966 27.543 1.00 0.00 O ATOM 738 CB HIS A 60 32.399 34.861 27.689 1.00 0.00 C ATOM 739 CG HIS A 60 32.349 35.556 29.016 1.00 0.00 C ATOM 740 ND1 HIS A 60 31.220 35.715 29.792 1.00 0.00 N ATOM 741 CD2 HIS A 60 33.377 36.084 29.735 1.00 0.00 C ATOM 742 CE1 HIS A 60 31.618 36.321 30.942 1.00 0.00 C ATOM 743 NE2 HIS A 60 32.918 36.553 30.949 1.00 0.00 N ATOM 0 H HIS A 60 32.477 32.500 25.916 1.00 0.00 H new ATOM 0 HA HIS A 60 33.658 33.243 28.428 1.00 0.00 H new ATOM 0 HB2 HIS A 60 33.098 35.392 27.042 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.417 34.929 27.221 1.00 0.00 H new ATOM 0 HD2 HIS A 60 34.404 36.129 29.403 1.00 0.00 H new ATOM 0 HE1 HIS A 60 30.952 36.581 31.751 1.00 0.00 H new ATOM 0 HE2 HIS A 60 33.466 36.986 31.693 1.00 0.00 H new ATOM 751 N LYS A 61 31.488 32.557 29.612 1.00 0.00 N ATOM 752 CA LYS A 61 30.419 31.888 30.288 1.00 0.00 C ATOM 753 C LYS A 61 29.050 32.202 29.791 1.00 0.00 C ATOM 754 O LYS A 61 28.621 33.354 29.752 1.00 0.00 O ATOM 755 CB LYS A 61 30.505 32.221 31.787 1.00 0.00 C ATOM 756 CG LYS A 61 29.520 31.484 32.697 1.00 0.00 C ATOM 757 CD LYS A 61 29.565 31.985 34.142 1.00 0.00 C ATOM 758 CE LYS A 61 30.886 31.732 34.869 1.00 0.00 C ATOM 759 NZ LYS A 61 30.799 32.299 36.233 1.00 0.00 N ATOM 0 H LYS A 61 32.120 33.035 30.254 1.00 0.00 H new ATOM 0 HA LYS A 61 30.557 30.825 30.088 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.517 32.004 32.129 1.00 0.00 H new ATOM 0 HB3 LYS A 61 30.350 33.293 31.910 1.00 0.00 H new ATOM 0 HG2 LYS A 61 28.510 31.605 32.306 1.00 0.00 H new ATOM 0 HG3 LYS A 61 29.743 30.417 32.679 1.00 0.00 H new ATOM 0 HD2 LYS A 61 29.364 33.056 34.146 1.00 0.00 H new ATOM 0 HD3 LYS A 61 28.761 31.507 34.702 1.00 0.00 H new ATOM 0 HE2 LYS A 61 31.091 30.662 34.918 1.00 0.00 H new ATOM 0 HE3 LYS A 61 31.711 32.190 34.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 31.694 32.132 36.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 30.621 33.322 36.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 30.021 31.842 36.750 1.00 0.00 H new ATOM 773 N GLY A 62 28.300 31.165 29.375 1.00 0.00 N ATOM 774 CA GLY A 62 26.963 31.286 28.884 1.00 0.00 C ATOM 775 C GLY A 62 26.821 31.346 27.402 1.00 0.00 C ATOM 776 O GLY A 62 25.692 31.378 26.913 1.00 0.00 O ATOM 0 H GLY A 62 28.640 30.203 29.381 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.383 30.440 29.252 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.519 32.186 29.310 1.00 0.00 H new ATOM 780 N ASP A 63 27.918 31.398 26.624 1.00 0.00 N ATOM 781 CA ASP A 63 27.827 31.545 25.204 1.00 0.00 C ATOM 782 C ASP A 63 27.524 30.282 24.474 1.00 0.00 C ATOM 783 O ASP A 63 27.482 29.214 25.083 1.00 0.00 O ATOM 784 CB ASP A 63 28.962 32.430 24.662 1.00 0.00 C ATOM 785 CG ASP A 63 30.309 31.796 24.347 1.00 0.00 C ATOM 786 OD1 ASP A 63 30.375 30.654 23.819 1.00 0.00 O ATOM 787 OD2 ASP A 63 31.323 32.508 24.578 1.00 0.00 O ATOM 0 H ASP A 63 28.872 31.338 26.981 1.00 0.00 H new ATOM 0 HA ASP A 63 26.924 32.111 24.977 1.00 0.00 H new ATOM 0 HB2 ASP A 63 28.601 32.905 23.750 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.135 33.224 25.388 1.00 0.00 H new ATOM 792 N ARG A 64 27.252 30.326 23.157 1.00 0.00 N ATOM 793 CA ARG A 64 26.734 29.234 22.394 1.00 0.00 C ATOM 794 C ARG A 64 27.642 28.825 21.285 1.00 0.00 C ATOM 795 O ARG A 64 27.964 29.628 20.410 1.00 0.00 O ATOM 796 CB ARG A 64 25.377 29.639 21.791 1.00 0.00 C ATOM 797 CG ARG A 64 24.659 28.579 20.954 1.00 0.00 C ATOM 798 CD ARG A 64 23.405 29.094 20.247 1.00 0.00 C ATOM 799 NE ARG A 64 22.926 27.970 19.395 1.00 0.00 N ATOM 800 CZ ARG A 64 21.855 28.010 18.549 1.00 0.00 C ATOM 801 NH1 ARG A 64 21.079 29.112 18.340 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.564 26.874 17.849 1.00 0.00 N ATOM 0 H ARG A 64 27.401 31.166 22.597 1.00 0.00 H new ATOM 0 HA ARG A 64 26.633 28.386 23.072 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.716 29.936 22.606 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.530 30.520 21.168 1.00 0.00 H new ATOM 0 HG2 ARG A 64 25.351 28.189 20.208 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.384 27.745 21.600 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.643 29.389 20.969 1.00 0.00 H new ATOM 0 HD3 ARG A 64 23.630 29.973 19.643 1.00 0.00 H new ATOM 0 HE ARG A 64 23.444 27.093 19.448 1.00 0.00 H new ATOM 0 HH11 ARG A 64 21.284 29.981 18.832 1.00 0.00 H new ATOM 0 HH12 ARG A 64 20.293 29.067 17.691 1.00 0.00 H new ATOM 0 HH21 ARG A 64 22.138 26.040 17.969 1.00 0.00 H new ATOM 0 HH22 ARG A 64 20.772 26.860 17.206 1.00 0.00 H new ATOM 816 N VAL A 65 28.024 27.539 21.211 1.00 0.00 N ATOM 817 CA VAL A 65 28.872 27.021 20.183 1.00 0.00 C ATOM 818 C VAL A 65 28.069 26.713 18.966 1.00 0.00 C ATOM 819 O VAL A 65 27.059 26.013 19.026 1.00 0.00 O ATOM 820 CB VAL A 65 29.611 25.766 20.540 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.659 25.429 19.467 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.337 25.903 21.888 1.00 0.00 C ATOM 0 H VAL A 65 27.733 26.835 21.889 1.00 0.00 H new ATOM 0 HA VAL A 65 29.609 27.807 20.021 1.00 0.00 H new ATOM 0 HB VAL A 65 28.868 24.971 20.606 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.184 24.515 19.745 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.163 25.285 18.507 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.374 26.248 19.387 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.862 24.975 22.115 1.00 0.00 H new ATOM 0 HG22 VAL A 65 31.055 26.722 21.833 1.00 0.00 H new ATOM 0 HG23 VAL A 65 29.610 26.110 22.673 1.00 0.00 H new ATOM 832 N LEU A 66 28.487 27.231 17.798 1.00 0.00 N ATOM 833 CA LEU A 66 27.856 26.967 16.543 1.00 0.00 C ATOM 834 C LEU A 66 28.603 25.918 15.793 1.00 0.00 C ATOM 835 O LEU A 66 28.001 24.986 15.260 1.00 0.00 O ATOM 836 CB LEU A 66 27.725 28.251 15.705 1.00 0.00 C ATOM 837 CG LEU A 66 26.405 29.017 15.899 1.00 0.00 C ATOM 838 CD1 LEU A 66 26.102 29.388 17.360 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.395 30.287 15.031 1.00 0.00 C ATOM 0 H LEU A 66 29.291 27.854 17.725 1.00 0.00 H new ATOM 0 HA LEU A 66 26.850 26.597 16.742 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.554 28.915 15.952 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.827 27.992 14.651 1.00 0.00 H new ATOM 0 HG LEU A 66 25.617 28.332 15.586 1.00 0.00 H new ATOM 0 HD11 LEU A 66 25.155 29.925 17.410 1.00 0.00 H new ATOM 0 HD12 LEU A 66 26.036 28.480 17.960 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.900 30.022 17.747 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.456 30.820 15.177 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.226 30.931 15.319 1.00 0.00 H new ATOM 0 HD23 LEU A 66 26.496 30.011 13.981 1.00 0.00 H new ATOM 851 N ALA A 67 29.942 26.007 15.704 1.00 0.00 N ATOM 852 CA ALA A 67 30.702 25.057 14.953 1.00 0.00 C ATOM 853 C ALA A 67 32.093 24.865 15.450 1.00 0.00 C ATOM 854 O ALA A 67 32.790 25.833 15.750 1.00 0.00 O ATOM 855 CB ALA A 67 30.764 25.476 13.474 1.00 0.00 C ATOM 0 H ALA A 67 30.498 26.736 16.151 1.00 0.00 H new ATOM 0 HA ALA A 67 30.182 24.107 15.073 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.345 24.745 12.913 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.754 25.526 13.067 1.00 0.00 H new ATOM 0 HB3 ALA A 67 31.237 26.455 13.393 1.00 0.00 H new ATOM 861 N VAL A 68 32.562 23.607 15.528 1.00 0.00 N ATOM 862 CA VAL A 68 33.887 23.260 15.937 1.00 0.00 C ATOM 863 C VAL A 68 34.672 22.882 14.728 1.00 0.00 C ATOM 864 O VAL A 68 34.332 21.920 14.042 1.00 0.00 O ATOM 865 CB VAL A 68 33.937 22.084 16.867 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.379 21.872 17.357 1.00 0.00 C ATOM 867 CG2 VAL A 68 32.999 22.285 18.069 1.00 0.00 C ATOM 0 H VAL A 68 31.991 22.795 15.295 1.00 0.00 H new ATOM 0 HA VAL A 68 34.288 24.129 16.459 1.00 0.00 H new ATOM 0 HB VAL A 68 33.602 21.202 16.321 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.412 21.017 18.032 1.00 0.00 H new ATOM 0 HG12 VAL A 68 36.030 21.685 16.503 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.719 22.764 17.884 1.00 0.00 H new ATOM 0 HG21 VAL A 68 33.057 21.416 18.725 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.299 23.176 18.620 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.975 22.405 17.715 1.00 0.00 H new ATOM 877 N ASN A 69 35.742 23.617 14.377 1.00 0.00 N ATOM 878 CA ASN A 69 36.628 23.317 13.295 1.00 0.00 C ATOM 879 C ASN A 69 35.955 23.256 11.967 1.00 0.00 C ATOM 880 O ASN A 69 36.232 22.400 11.128 1.00 0.00 O ATOM 881 CB ASN A 69 37.529 22.107 13.593 1.00 0.00 C ATOM 882 CG ASN A 69 38.870 22.229 12.883 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.242 23.286 12.376 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.666 21.125 12.863 1.00 0.00 N ATOM 0 H ASN A 69 36.003 24.467 14.876 1.00 0.00 H new ATOM 0 HA ASN A 69 37.299 24.172 13.213 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.690 22.027 14.668 1.00 0.00 H new ATOM 0 HB3 ASN A 69 37.029 21.192 13.276 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.585 21.167 12.423 1.00 0.00 H new ATOM 0 HD22 ASN A 69 39.343 20.256 13.288 1.00 0.00 H new ATOM 891 N GLY A 70 35.001 24.175 11.736 1.00 0.00 N ATOM 892 CA GLY A 70 34.179 24.201 10.565 1.00 0.00 C ATOM 893 C GLY A 70 32.874 23.500 10.728 1.00 0.00 C ATOM 894 O GLY A 70 31.871 23.903 10.141 1.00 0.00 O ATOM 0 H GLY A 70 34.794 24.930 12.390 1.00 0.00 H new ATOM 0 HA2 GLY A 70 33.991 25.238 10.288 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.725 23.744 9.739 1.00 0.00 H new ATOM 898 N VAL A 71 32.832 22.418 11.526 1.00 0.00 N ATOM 899 CA VAL A 71 31.745 21.490 11.584 1.00 0.00 C ATOM 900 C VAL A 71 30.701 21.932 12.553 1.00 0.00 C ATOM 901 O VAL A 71 30.952 22.081 13.748 1.00 0.00 O ATOM 902 CB VAL A 71 32.211 20.106 11.923 1.00 0.00 C ATOM 903 CG1 VAL A 71 31.060 19.096 11.778 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.372 19.704 10.997 1.00 0.00 C ATOM 0 H VAL A 71 33.593 22.179 12.162 1.00 0.00 H new ATOM 0 HA VAL A 71 31.303 21.464 10.588 1.00 0.00 H new ATOM 0 HB VAL A 71 32.553 20.100 12.958 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.418 18.098 12.028 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.248 19.370 12.452 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.696 19.104 10.750 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.706 18.697 11.248 1.00 0.00 H new ATOM 0 HG22 VAL A 71 33.035 19.726 9.961 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.198 20.403 11.125 1.00 0.00 H new ATOM 914 N SER A 72 29.470 22.195 12.080 1.00 0.00 N ATOM 915 CA SER A 72 28.430 22.724 12.906 1.00 0.00 C ATOM 916 C SER A 72 27.827 21.694 13.799 1.00 0.00 C ATOM 917 O SER A 72 27.600 20.548 13.412 1.00 0.00 O ATOM 918 CB SER A 72 27.346 23.487 12.124 1.00 0.00 C ATOM 919 OG SER A 72 26.421 24.136 12.984 1.00 0.00 O ATOM 0 H SER A 72 29.193 22.038 11.111 1.00 0.00 H new ATOM 0 HA SER A 72 28.926 23.459 13.539 1.00 0.00 H new ATOM 0 HB2 SER A 72 27.819 24.226 11.478 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.811 22.793 11.476 1.00 0.00 H new ATOM 0 HG SER A 72 26.887 24.453 13.786 1.00 0.00 H new ATOM 925 N LEU A 73 27.546 22.078 15.056 1.00 0.00 N ATOM 926 CA LEU A 73 27.135 21.191 16.099 1.00 0.00 C ATOM 927 C LEU A 73 25.659 21.002 16.186 1.00 0.00 C ATOM 928 O LEU A 73 25.127 20.595 17.217 1.00 0.00 O ATOM 929 CB LEU A 73 27.632 21.699 17.463 1.00 0.00 C ATOM 930 CG LEU A 73 29.155 21.706 17.667 1.00 0.00 C ATOM 931 CD1 LEU A 73 29.444 22.120 19.119 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.812 20.346 17.376 1.00 0.00 C ATOM 0 H LEU A 73 27.608 23.050 15.359 1.00 0.00 H new ATOM 0 HA LEU A 73 27.579 20.228 15.847 1.00 0.00 H new ATOM 0 HB2 LEU A 73 27.262 22.714 17.607 1.00 0.00 H new ATOM 0 HB3 LEU A 73 27.184 21.083 18.243 1.00 0.00 H new ATOM 0 HG LEU A 73 29.584 22.413 16.957 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.521 22.132 19.287 1.00 0.00 H new ATOM 0 HD12 LEU A 73 29.038 23.115 19.301 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.979 21.407 19.800 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.887 20.419 17.539 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.395 19.590 18.042 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.620 20.063 16.341 1.00 0.00 H new ATOM 944 N GLU A 74 24.904 21.281 15.109 1.00 0.00 N ATOM 945 CA GLU A 74 23.477 21.182 15.067 1.00 0.00 C ATOM 946 C GLU A 74 22.944 19.810 15.294 1.00 0.00 C ATOM 947 O GLU A 74 23.214 18.881 14.534 1.00 0.00 O ATOM 948 CB GLU A 74 22.969 21.698 13.710 1.00 0.00 C ATOM 949 CG GLU A 74 23.050 23.219 13.571 1.00 0.00 C ATOM 950 CD GLU A 74 21.984 23.915 14.407 1.00 0.00 C ATOM 951 OE1 GLU A 74 20.773 23.685 14.144 1.00 0.00 O ATOM 952 OE2 GLU A 74 22.342 24.728 15.300 1.00 0.00 O ATOM 0 H GLU A 74 25.307 21.591 14.225 1.00 0.00 H new ATOM 0 HA GLU A 74 23.112 21.792 15.894 1.00 0.00 H new ATOM 0 HB2 GLU A 74 23.551 21.236 12.913 1.00 0.00 H new ATOM 0 HB3 GLU A 74 21.935 21.382 13.573 1.00 0.00 H new ATOM 0 HG2 GLU A 74 24.037 23.561 13.881 1.00 0.00 H new ATOM 0 HG3 GLU A 74 22.931 23.496 12.524 1.00 0.00 H new ATOM 959 N GLY A 75 22.162 19.630 16.373 1.00 0.00 N ATOM 960 CA GLY A 75 21.553 18.386 16.734 1.00 0.00 C ATOM 961 C GLY A 75 22.443 17.493 17.528 1.00 0.00 C ATOM 962 O GLY A 75 22.136 16.317 17.721 1.00 0.00 O ATOM 0 H GLY A 75 21.944 20.385 17.023 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.649 18.587 17.308 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.245 17.865 15.827 1.00 0.00 H new ATOM 966 N ALA A 76 23.592 18.007 18.004 1.00 0.00 N ATOM 967 CA ALA A 76 24.532 17.267 18.785 1.00 0.00 C ATOM 968 C ALA A 76 24.102 16.955 20.177 1.00 0.00 C ATOM 969 O ALA A 76 23.261 17.615 20.787 1.00 0.00 O ATOM 970 CB ALA A 76 25.890 17.990 18.819 1.00 0.00 C ATOM 0 H ALA A 76 23.876 18.973 17.838 1.00 0.00 H new ATOM 0 HA ALA A 76 24.611 16.305 18.279 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.594 17.413 19.418 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.274 18.091 17.804 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.765 18.979 19.259 1.00 0.00 H new ATOM 976 N THR A 77 24.705 15.902 20.756 1.00 0.00 N ATOM 977 CA THR A 77 24.569 15.568 22.139 1.00 0.00 C ATOM 978 C THR A 77 25.650 16.230 22.924 1.00 0.00 C ATOM 979 O THR A 77 26.609 16.767 22.373 1.00 0.00 O ATOM 980 CB THR A 77 24.582 14.095 22.417 1.00 0.00 C ATOM 981 OG1 THR A 77 25.804 13.479 22.041 1.00 0.00 O ATOM 982 CG2 THR A 77 23.470 13.409 21.604 1.00 0.00 C ATOM 0 H THR A 77 25.309 15.260 20.243 1.00 0.00 H new ATOM 0 HA THR A 77 23.586 15.929 22.442 1.00 0.00 H new ATOM 0 HB THR A 77 24.439 13.982 23.492 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.763 12.521 22.244 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.479 12.338 21.806 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.503 13.823 21.888 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.639 13.579 20.541 1.00 0.00 H new ATOM 990 N HIS A 78 25.545 16.186 24.265 1.00 0.00 N ATOM 991 CA HIS A 78 26.565 16.596 25.179 1.00 0.00 C ATOM 992 C HIS A 78 27.877 15.933 24.935 1.00 0.00 C ATOM 993 O HIS A 78 28.892 16.597 24.730 1.00 0.00 O ATOM 994 CB HIS A 78 26.107 16.313 26.619 1.00 0.00 C ATOM 995 CG HIS A 78 27.093 16.647 27.697 1.00 0.00 C ATOM 996 ND1 HIS A 78 27.545 15.735 28.629 1.00 0.00 N ATOM 997 CD2 HIS A 78 27.642 17.842 28.048 1.00 0.00 C ATOM 998 CE1 HIS A 78 28.329 16.421 29.504 1.00 0.00 C ATOM 999 NE2 HIS A 78 28.410 17.699 29.187 1.00 0.00 N ATOM 0 H HIS A 78 24.705 15.847 24.735 1.00 0.00 H new ATOM 0 HA HIS A 78 26.718 17.664 25.023 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.191 16.873 26.805 1.00 0.00 H new ATOM 0 HB3 HIS A 78 25.855 15.255 26.698 1.00 0.00 H new ATOM 0 HD2 HIS A 78 27.498 18.769 27.513 1.00 0.00 H new ATOM 0 HE1 HIS A 78 28.824 15.974 30.354 1.00 0.00 H new ATOM 0 HE2 HIS A 78 28.929 18.427 29.678 1.00 0.00 H new ATOM 1007 N LYS A 79 27.912 14.589 24.917 1.00 0.00 N ATOM 1008 CA LYS A 79 29.082 13.815 24.638 1.00 0.00 C ATOM 1009 C LYS A 79 29.736 14.109 23.333 1.00 0.00 C ATOM 1010 O LYS A 79 30.955 14.245 23.235 1.00 0.00 O ATOM 1011 CB LYS A 79 28.772 12.309 24.687 1.00 0.00 C ATOM 1012 CG LYS A 79 30.022 11.465 24.951 1.00 0.00 C ATOM 1013 CD LYS A 79 29.778 10.279 25.887 1.00 0.00 C ATOM 1014 CE LYS A 79 28.993 9.101 25.305 1.00 0.00 C ATOM 1015 NZ LYS A 79 29.723 8.490 24.172 1.00 0.00 N ATOM 0 H LYS A 79 27.089 14.016 25.105 1.00 0.00 H new ATOM 0 HA LYS A 79 29.782 14.105 25.422 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.036 12.117 25.468 1.00 0.00 H new ATOM 0 HB3 LYS A 79 28.322 12.002 23.743 1.00 0.00 H new ATOM 0 HG2 LYS A 79 30.406 11.093 24.001 1.00 0.00 H new ATOM 0 HG3 LYS A 79 30.795 12.102 25.380 1.00 0.00 H new ATOM 0 HD2 LYS A 79 30.745 9.909 26.229 1.00 0.00 H new ATOM 0 HD3 LYS A 79 29.246 10.642 26.767 1.00 0.00 H new ATOM 0 HE2 LYS A 79 28.824 8.353 26.080 1.00 0.00 H new ATOM 0 HE3 LYS A 79 28.013 9.441 24.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 29.262 7.598 23.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 29.715 9.142 23.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 30.706 8.300 24.454 1.00 0.00 H new ATOM 1029 N GLN A 80 28.936 14.238 22.259 1.00 0.00 N ATOM 1030 CA GLN A 80 29.383 14.431 20.914 1.00 0.00 C ATOM 1031 C GLN A 80 30.176 15.671 20.678 1.00 0.00 C ATOM 1032 O GLN A 80 31.247 15.636 20.073 1.00 0.00 O ATOM 1033 CB GLN A 80 28.100 14.401 20.069 1.00 0.00 C ATOM 1034 CG GLN A 80 28.387 14.563 18.575 1.00 0.00 C ATOM 1035 CD GLN A 80 27.220 14.061 17.737 1.00 0.00 C ATOM 1036 OE1 GLN A 80 26.415 14.820 17.202 1.00 0.00 O ATOM 1037 NE2 GLN A 80 27.131 12.706 17.642 1.00 0.00 N ATOM 0 H GLN A 80 27.919 14.206 22.334 1.00 0.00 H new ATOM 0 HA GLN A 80 30.094 13.649 20.646 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.579 13.459 20.237 1.00 0.00 H new ATOM 0 HB3 GLN A 80 27.432 15.198 20.397 1.00 0.00 H new ATOM 0 HG2 GLN A 80 28.576 15.612 18.349 1.00 0.00 H new ATOM 0 HG3 GLN A 80 29.291 14.013 18.313 1.00 0.00 H new ATOM 0 HE21 GLN A 80 27.823 12.116 18.104 1.00 0.00 H new ATOM 0 HE22 GLN A 80 26.372 12.281 17.109 1.00 0.00 H new ATOM 1046 N ALA A 81 29.712 16.822 21.197 1.00 0.00 N ATOM 1047 CA ALA A 81 30.422 18.064 21.194 1.00 0.00 C ATOM 1048 C ALA A 81 31.675 18.011 21.998 1.00 0.00 C ATOM 1049 O ALA A 81 32.676 18.618 21.622 1.00 0.00 O ATOM 1050 CB ALA A 81 29.496 19.150 21.765 1.00 0.00 C ATOM 0 H ALA A 81 28.796 16.890 21.641 1.00 0.00 H new ATOM 0 HA ALA A 81 30.712 18.286 20.167 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.018 20.107 21.772 1.00 0.00 H new ATOM 0 HB2 ALA A 81 28.602 19.229 21.146 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.210 18.886 22.783 1.00 0.00 H new ATOM 1056 N VAL A 82 31.699 17.235 23.097 1.00 0.00 N ATOM 1057 CA VAL A 82 32.841 17.061 23.940 1.00 0.00 C ATOM 1058 C VAL A 82 33.899 16.290 23.228 1.00 0.00 C ATOM 1059 O VAL A 82 35.050 16.719 23.168 1.00 0.00 O ATOM 1060 CB VAL A 82 32.491 16.433 25.256 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.733 16.034 26.072 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.680 17.448 26.078 1.00 0.00 C ATOM 0 H VAL A 82 30.886 16.706 23.412 1.00 0.00 H new ATOM 0 HA VAL A 82 33.233 18.052 24.171 1.00 0.00 H new ATOM 0 HB VAL A 82 31.923 15.526 25.049 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.420 15.585 27.015 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.325 15.315 25.506 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.335 16.920 26.275 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.416 17.009 27.040 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.278 18.345 26.240 1.00 0.00 H new ATOM 0 HG23 VAL A 82 30.771 17.711 25.537 1.00 0.00 H new ATOM 1072 N GLU A 83 33.555 15.154 22.594 1.00 0.00 N ATOM 1073 CA GLU A 83 34.460 14.384 21.799 1.00 0.00 C ATOM 1074 C GLU A 83 35.039 15.155 20.662 1.00 0.00 C ATOM 1075 O GLU A 83 36.238 15.102 20.395 1.00 0.00 O ATOM 1076 CB GLU A 83 33.822 13.106 21.229 1.00 0.00 C ATOM 1077 CG GLU A 83 33.411 12.087 22.293 1.00 0.00 C ATOM 1078 CD GLU A 83 33.057 10.744 21.671 1.00 0.00 C ATOM 1079 OE1 GLU A 83 32.117 10.674 20.835 1.00 0.00 O ATOM 1080 OE2 GLU A 83 33.702 9.726 22.042 1.00 0.00 O ATOM 0 H GLU A 83 32.616 14.759 22.637 1.00 0.00 H new ATOM 0 HA GLU A 83 35.254 14.113 22.494 1.00 0.00 H new ATOM 0 HB2 GLU A 83 32.943 13.380 20.645 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.526 12.635 20.543 1.00 0.00 H new ATOM 0 HG2 GLU A 83 34.225 11.956 23.006 1.00 0.00 H new ATOM 0 HG3 GLU A 83 32.556 12.467 22.852 1.00 0.00 H new ATOM 1087 N THR A 84 34.188 15.947 19.985 1.00 0.00 N ATOM 1088 CA THR A 84 34.506 16.828 18.904 1.00 0.00 C ATOM 1089 C THR A 84 35.458 17.905 19.296 1.00 0.00 C ATOM 1090 O THR A 84 36.464 18.121 18.622 1.00 0.00 O ATOM 1091 CB THR A 84 33.263 17.421 18.308 1.00 0.00 C ATOM 1092 OG1 THR A 84 32.420 16.390 17.816 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.540 18.351 17.115 1.00 0.00 C ATOM 0 H THR A 84 33.194 15.972 20.215 1.00 0.00 H new ATOM 0 HA THR A 84 35.005 16.219 18.150 1.00 0.00 H new ATOM 0 HB THR A 84 32.803 17.994 19.113 1.00 0.00 H new ATOM 0 HG1 THR A 84 31.969 15.950 18.567 1.00 0.00 H new ATOM 0 HG21 THR A 84 32.598 18.744 16.734 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.174 19.177 17.437 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.045 17.792 16.327 1.00 0.00 H new ATOM 1101 N LEU A 85 35.222 18.603 20.421 1.00 0.00 N ATOM 1102 CA LEU A 85 36.088 19.602 20.966 1.00 0.00 C ATOM 1103 C LEU A 85 37.403 19.082 21.435 1.00 0.00 C ATOM 1104 O LEU A 85 38.432 19.735 21.270 1.00 0.00 O ATOM 1105 CB LEU A 85 35.419 20.344 22.136 1.00 0.00 C ATOM 1106 CG LEU A 85 34.365 21.378 21.708 1.00 0.00 C ATOM 1107 CD1 LEU A 85 33.451 21.742 22.890 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.017 22.649 21.140 1.00 0.00 C ATOM 0 H LEU A 85 34.381 18.462 20.981 1.00 0.00 H new ATOM 0 HA LEU A 85 36.277 20.280 20.134 1.00 0.00 H new ATOM 0 HB2 LEU A 85 34.948 19.613 22.793 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.189 20.848 22.720 1.00 0.00 H new ATOM 0 HG LEU A 85 33.765 20.923 20.920 1.00 0.00 H new ATOM 0 HD11 LEU A 85 32.712 22.475 22.566 1.00 0.00 H new ATOM 0 HD12 LEU A 85 32.942 20.846 23.246 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.050 22.163 23.697 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.241 23.357 20.848 1.00 0.00 H new ATOM 0 HD22 LEU A 85 35.654 23.102 21.900 1.00 0.00 H new ATOM 0 HD23 LEU A 85 35.619 22.391 20.269 1.00 0.00 H new ATOM 1120 N ARG A 86 37.452 17.874 22.026 1.00 0.00 N ATOM 1121 CA ARG A 86 38.677 17.252 22.425 1.00 0.00 C ATOM 1122 C ARG A 86 39.512 16.839 21.261 1.00 0.00 C ATOM 1123 O ARG A 86 40.738 16.913 21.315 1.00 0.00 O ATOM 1124 CB ARG A 86 38.452 16.091 23.407 1.00 0.00 C ATOM 1125 CG ARG A 86 38.454 16.519 24.875 1.00 0.00 C ATOM 1126 CD ARG A 86 37.222 17.313 25.314 1.00 0.00 C ATOM 1127 NE ARG A 86 37.481 17.898 26.659 1.00 0.00 N ATOM 1128 CZ ARG A 86 37.106 17.365 27.858 1.00 0.00 C ATOM 1129 NH1 ARG A 86 36.571 16.113 27.940 1.00 0.00 N ATOM 1130 NH2 ARG A 86 37.249 18.112 28.991 1.00 0.00 N ATOM 0 H ARG A 86 36.622 17.317 22.231 1.00 0.00 H new ATOM 0 HA ARG A 86 39.242 18.014 22.962 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.500 15.613 23.178 1.00 0.00 H new ATOM 0 HB3 ARG A 86 39.229 15.342 23.255 1.00 0.00 H new ATOM 0 HG2 ARG A 86 38.536 15.629 25.498 1.00 0.00 H new ATOM 0 HG3 ARG A 86 39.343 17.122 25.062 1.00 0.00 H new ATOM 0 HD2 ARG A 86 37.006 18.103 24.594 1.00 0.00 H new ATOM 0 HD3 ARG A 86 36.347 16.664 25.347 1.00 0.00 H new ATOM 0 HE ARG A 86 37.988 18.783 26.687 1.00 0.00 H new ATOM 0 HH11 ARG A 86 36.445 15.556 27.095 1.00 0.00 H new ATOM 0 HH12 ARG A 86 36.297 15.734 28.846 1.00 0.00 H new ATOM 0 HH21 ARG A 86 37.632 19.056 28.935 1.00 0.00 H new ATOM 0 HH22 ARG A 86 36.973 17.727 29.894 1.00 0.00 H new ATOM 1144 N ASN A 87 38.886 16.469 20.129 1.00 0.00 N ATOM 1145 CA ASN A 87 39.540 16.184 18.890 1.00 0.00 C ATOM 1146 C ASN A 87 39.710 17.404 18.051 1.00 0.00 C ATOM 1147 O ASN A 87 39.429 17.417 16.853 1.00 0.00 O ATOM 1148 CB ASN A 87 38.768 15.085 18.142 1.00 0.00 C ATOM 1149 CG ASN A 87 39.623 14.380 17.100 1.00 0.00 C ATOM 1150 OD1 ASN A 87 40.822 14.617 16.959 1.00 0.00 O ATOM 1151 ND2 ASN A 87 38.989 13.447 16.341 1.00 0.00 N ATOM 0 H ASN A 87 37.873 16.364 20.076 1.00 0.00 H new ATOM 0 HA ASN A 87 40.545 15.824 19.107 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.398 14.353 18.860 1.00 0.00 H new ATOM 0 HB3 ASN A 87 37.897 15.524 17.656 1.00 0.00 H new ATOM 0 HD21 ASN A 87 39.508 12.925 15.635 1.00 0.00 H new ATOM 0 HD22 ASN A 87 37.994 13.269 16.477 1.00 0.00 H new ATOM 1158 N THR A 88 40.222 18.492 18.653 1.00 0.00 N ATOM 1159 CA THR A 88 40.709 19.667 17.999 1.00 0.00 C ATOM 1160 C THR A 88 42.193 19.564 17.918 1.00 0.00 C ATOM 1161 O THR A 88 42.825 18.905 18.743 1.00 0.00 O ATOM 1162 CB THR A 88 40.356 20.948 18.696 1.00 0.00 C ATOM 1163 OG1 THR A 88 40.591 20.884 20.095 1.00 0.00 O ATOM 1164 CG2 THR A 88 38.865 21.256 18.477 1.00 0.00 C ATOM 0 H THR A 88 40.301 18.554 19.668 1.00 0.00 H new ATOM 0 HA THR A 88 40.234 19.709 17.019 1.00 0.00 H new ATOM 0 HB THR A 88 40.990 21.727 18.274 1.00 0.00 H new ATOM 0 HG1 THR A 88 39.834 20.443 20.534 1.00 0.00 H new ATOM 0 HG21 THR A 88 38.608 22.186 18.983 1.00 0.00 H new ATOM 0 HG22 THR A 88 38.667 21.357 17.410 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.262 20.444 18.883 1.00 0.00 H new ATOM 1172 N GLY A 89 42.828 20.232 16.937 1.00 0.00 N ATOM 1173 CA GLY A 89 44.250 20.234 16.792 1.00 0.00 C ATOM 1174 C GLY A 89 44.893 21.300 17.610 1.00 0.00 C ATOM 1175 O GLY A 89 44.326 21.772 18.594 1.00 0.00 O ATOM 0 H GLY A 89 42.342 20.783 16.229 1.00 0.00 H new ATOM 0 HA2 GLY A 89 44.646 19.262 17.087 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.507 20.378 15.743 1.00 0.00 H new ATOM 1179 N GLN A 90 46.117 21.720 17.246 1.00 0.00 N ATOM 1180 CA GLN A 90 46.857 22.721 17.948 1.00 0.00 C ATOM 1181 C GLN A 90 46.259 24.079 17.808 1.00 0.00 C ATOM 1182 O GLN A 90 46.028 24.786 18.788 1.00 0.00 O ATOM 1183 CB GLN A 90 48.329 22.707 17.501 1.00 0.00 C ATOM 1184 CG GLN A 90 49.336 23.197 18.543 1.00 0.00 C ATOM 1185 CD GLN A 90 49.322 24.701 18.777 1.00 0.00 C ATOM 1186 OE1 GLN A 90 49.436 25.505 17.855 1.00 0.00 O ATOM 1187 NE2 GLN A 90 49.236 25.111 20.071 1.00 0.00 N ATOM 0 H GLN A 90 46.609 21.349 16.433 1.00 0.00 H new ATOM 0 HA GLN A 90 46.811 22.477 19.009 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.594 21.689 17.215 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.426 23.325 16.608 1.00 0.00 H new ATOM 0 HG2 GLN A 90 49.135 22.693 19.489 1.00 0.00 H new ATOM 0 HG3 GLN A 90 50.337 22.900 18.230 1.00 0.00 H new ATOM 0 HE21 GLN A 90 49.142 24.424 20.819 1.00 0.00 H new ATOM 0 HE22 GLN A 90 49.266 26.106 20.294 1.00 0.00 H new ATOM 1196 N VAL A 91 45.950 24.473 16.559 1.00 0.00 N ATOM 1197 CA VAL A 91 45.209 25.655 16.244 1.00 0.00 C ATOM 1198 C VAL A 91 43.794 25.266 15.986 1.00 0.00 C ATOM 1199 O VAL A 91 43.495 24.294 15.296 1.00 0.00 O ATOM 1200 CB VAL A 91 45.774 26.409 15.076 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.979 27.696 14.800 1.00 0.00 C ATOM 1202 CG2 VAL A 91 47.239 26.765 15.378 1.00 0.00 C ATOM 0 H VAL A 91 46.229 23.944 15.733 1.00 0.00 H new ATOM 0 HA VAL A 91 45.273 26.335 17.094 1.00 0.00 H new ATOM 0 HB VAL A 91 45.708 25.778 14.190 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.415 28.217 13.948 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.942 27.443 14.579 1.00 0.00 H new ATOM 0 HG13 VAL A 91 45.015 28.341 15.678 1.00 0.00 H new ATOM 0 HG21 VAL A 91 47.661 27.314 14.536 1.00 0.00 H new ATOM 0 HG22 VAL A 91 47.286 27.384 16.274 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.810 25.850 15.538 1.00 0.00 H new ATOM 1212 N VAL A 92 42.851 26.004 16.598 1.00 0.00 N ATOM 1213 CA VAL A 92 41.468 25.669 16.743 1.00 0.00 C ATOM 1214 C VAL A 92 40.629 26.714 16.094 1.00 0.00 C ATOM 1215 O VAL A 92 40.751 27.899 16.402 1.00 0.00 O ATOM 1216 CB VAL A 92 41.161 25.593 18.209 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.679 25.252 18.444 1.00 0.00 C ATOM 1218 CG2 VAL A 92 42.012 24.453 18.793 1.00 0.00 C ATOM 0 H VAL A 92 43.074 26.904 17.024 1.00 0.00 H new ATOM 0 HA VAL A 92 41.253 24.712 16.267 1.00 0.00 H new ATOM 0 HB VAL A 92 41.377 26.553 18.677 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.482 25.203 19.515 1.00 0.00 H new ATOM 0 HG12 VAL A 92 39.053 26.023 17.995 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.451 24.288 17.989 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.817 24.364 19.862 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.754 23.516 18.298 1.00 0.00 H new ATOM 0 HG23 VAL A 92 43.068 24.669 18.633 1.00 0.00 H new ATOM 1228 N HIS A 93 39.748 26.317 15.159 1.00 0.00 N ATOM 1229 CA HIS A 93 38.953 27.201 14.364 1.00 0.00 C ATOM 1230 C HIS A 93 37.500 27.081 14.671 1.00 0.00 C ATOM 1231 O HIS A 93 36.801 26.306 14.021 1.00 0.00 O ATOM 1232 CB HIS A 93 39.125 26.803 12.889 1.00 0.00 C ATOM 1233 CG HIS A 93 40.539 26.845 12.390 1.00 0.00 C ATOM 1234 ND1 HIS A 93 41.643 27.486 12.858 1.00 0.00 N flip ATOM 1235 CD2 HIS A 93 40.948 26.196 11.242 1.00 0.00 C flip ATOM 1236 CE1 HIS A 93 42.728 27.257 12.037 1.00 0.00 C flip ATOM 1237 NE2 HIS A 93 42.267 26.479 11.075 1.00 0.00 N flip ATOM 0 H HIS A 93 39.582 25.333 14.947 1.00 0.00 H new ATOM 0 HA HIS A 93 39.280 28.219 14.574 1.00 0.00 H new ATOM 0 HB2 HIS A 93 38.735 25.795 12.751 1.00 0.00 H new ATOM 0 HB3 HIS A 93 38.517 27.467 12.274 1.00 0.00 H new ATOM 0 HD2 HIS A 93 40.336 25.581 10.599 1.00 0.00 H new ATOM 0 HE1 HIS A 93 43.734 27.632 12.155 1.00 0.00 H new ATOM 0 HE2 HIS A 93 42.832 26.132 10.300 1.00 0.00 H new ATOM 1245 N LEU A 94 36.937 27.806 15.654 1.00 0.00 N ATOM 1246 CA LEU A 94 35.553 27.662 15.982 1.00 0.00 C ATOM 1247 C LEU A 94 34.698 28.881 15.937 1.00 0.00 C ATOM 1248 O LEU A 94 35.126 30.007 16.183 1.00 0.00 O ATOM 1249 CB LEU A 94 35.307 26.838 17.257 1.00 0.00 C ATOM 1250 CG LEU A 94 36.089 27.185 18.536 1.00 0.00 C ATOM 1251 CD1 LEU A 94 35.346 28.259 19.348 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.189 25.879 19.341 1.00 0.00 C ATOM 0 H LEU A 94 37.439 28.490 16.220 1.00 0.00 H new ATOM 0 HA LEU A 94 35.201 27.086 15.126 1.00 0.00 H new ATOM 0 HB2 LEU A 94 34.245 26.907 17.493 1.00 0.00 H new ATOM 0 HB3 LEU A 94 35.514 25.795 17.019 1.00 0.00 H new ATOM 0 HG LEU A 94 37.075 27.586 18.301 1.00 0.00 H new ATOM 0 HD11 LEU A 94 35.914 28.492 20.249 1.00 0.00 H new ATOM 0 HD12 LEU A 94 35.237 29.160 18.745 1.00 0.00 H new ATOM 0 HD13 LEU A 94 34.360 27.887 19.627 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.737 26.062 20.265 1.00 0.00 H new ATOM 0 HD22 LEU A 94 35.187 25.520 19.578 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.714 25.127 18.751 1.00 0.00 H new ATOM 1264 N LEU A 95 33.415 28.672 15.590 1.00 0.00 N ATOM 1265 CA LEU A 95 32.418 29.683 15.417 1.00 0.00 C ATOM 1266 C LEU A 95 31.493 29.637 16.584 1.00 0.00 C ATOM 1267 O LEU A 95 30.958 28.584 16.927 1.00 0.00 O ATOM 1268 CB LEU A 95 31.621 29.426 14.128 1.00 0.00 C ATOM 1269 CG LEU A 95 30.423 30.346 13.838 1.00 0.00 C ATOM 1270 CD1 LEU A 95 30.826 31.797 13.526 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.609 29.786 12.659 1.00 0.00 C ATOM 0 H LEU A 95 33.051 27.735 15.419 1.00 0.00 H new ATOM 0 HA LEU A 95 32.896 30.660 15.346 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.310 29.496 13.287 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.257 28.399 14.157 1.00 0.00 H new ATOM 0 HG LEU A 95 29.826 30.368 14.749 1.00 0.00 H new ATOM 0 HD11 LEU A 95 29.932 32.389 13.332 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.361 32.217 14.378 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.471 31.815 12.647 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.762 30.442 12.458 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.242 29.730 11.774 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.245 28.789 12.909 1.00 0.00 H new ATOM 1283 N LEU A 96 31.261 30.790 17.236 1.00 0.00 N ATOM 1284 CA LEU A 96 30.349 30.869 18.334 1.00 0.00 C ATOM 1285 C LEU A 96 29.558 32.131 18.276 1.00 0.00 C ATOM 1286 O LEU A 96 29.939 33.110 17.637 1.00 0.00 O ATOM 1287 CB LEU A 96 30.965 30.611 19.719 1.00 0.00 C ATOM 1288 CG LEU A 96 32.135 31.447 20.264 1.00 0.00 C ATOM 1289 CD1 LEU A 96 33.377 31.493 19.358 1.00 0.00 C ATOM 1290 CD2 LEU A 96 31.680 32.827 20.768 1.00 0.00 C ATOM 0 H LEU A 96 31.710 31.675 17.000 1.00 0.00 H new ATOM 0 HA LEU A 96 29.665 30.030 18.208 1.00 0.00 H new ATOM 0 HB2 LEU A 96 30.155 30.696 20.443 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.292 29.571 19.728 1.00 0.00 H new ATOM 0 HG LEU A 96 32.489 30.902 21.139 1.00 0.00 H new ATOM 0 HD11 LEU A 96 34.147 32.106 19.827 1.00 0.00 H new ATOM 0 HD12 LEU A 96 33.757 30.482 19.211 1.00 0.00 H new ATOM 0 HD13 LEU A 96 33.108 31.924 18.394 1.00 0.00 H new ATOM 0 HD21 LEU A 96 32.541 33.380 21.143 1.00 0.00 H new ATOM 0 HD22 LEU A 96 31.222 33.381 19.948 1.00 0.00 H new ATOM 0 HD23 LEU A 96 30.953 32.700 21.570 1.00 0.00 H new ATOM 1302 N GLU A 97 28.397 32.133 18.954 1.00 0.00 N ATOM 1303 CA GLU A 97 27.666 33.323 19.265 1.00 0.00 C ATOM 1304 C GLU A 97 28.056 33.735 20.643 1.00 0.00 C ATOM 1305 O GLU A 97 28.286 32.893 21.510 1.00 0.00 O ATOM 1306 CB GLU A 97 26.146 33.111 19.377 1.00 0.00 C ATOM 1307 CG GLU A 97 25.327 33.116 18.086 1.00 0.00 C ATOM 1308 CD GLU A 97 23.842 33.126 18.419 1.00 0.00 C ATOM 1309 OE1 GLU A 97 23.468 32.899 19.601 1.00 0.00 O ATOM 1310 OE2 GLU A 97 23.024 33.442 17.513 1.00 0.00 O ATOM 0 H GLU A 97 27.953 31.281 19.297 1.00 0.00 H new ATOM 0 HA GLU A 97 27.886 34.032 18.467 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.977 32.157 19.877 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.747 33.888 20.029 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.581 33.990 17.487 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.569 32.238 17.487 1.00 0.00 H new ATOM 1317 N LYS A 98 28.001 35.049 20.925 1.00 0.00 N ATOM 1318 CA LYS A 98 28.047 35.564 22.258 1.00 0.00 C ATOM 1319 C LYS A 98 26.732 35.353 22.926 1.00 0.00 C ATOM 1320 O LYS A 98 25.686 35.232 22.291 1.00 0.00 O ATOM 1321 CB LYS A 98 28.421 37.055 22.188 1.00 0.00 C ATOM 1322 CG LYS A 98 28.331 37.911 23.452 1.00 0.00 C ATOM 1323 CD LYS A 98 29.373 37.593 24.527 1.00 0.00 C ATOM 1324 CE LYS A 98 30.762 38.152 24.214 1.00 0.00 C ATOM 1325 NZ LYS A 98 31.731 37.719 25.246 1.00 0.00 N ATOM 0 H LYS A 98 27.923 35.771 20.209 1.00 0.00 H new ATOM 0 HA LYS A 98 28.798 35.042 22.850 1.00 0.00 H new ATOM 0 HB2 LYS A 98 29.446 37.118 21.822 1.00 0.00 H new ATOM 0 HB3 LYS A 98 27.784 37.517 21.434 1.00 0.00 H new ATOM 0 HG2 LYS A 98 28.431 38.959 23.170 1.00 0.00 H new ATOM 0 HG3 LYS A 98 27.338 37.790 23.884 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.034 37.997 25.481 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.443 36.512 24.645 1.00 0.00 H new ATOM 0 HE2 LYS A 98 31.088 37.809 23.232 1.00 0.00 H new ATOM 0 HE3 LYS A 98 30.724 39.241 24.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 32.671 38.104 25.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 31.426 38.068 26.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 31.778 36.680 25.264 1.00 0.00 H new ATOM 1339 N GLY A 99 26.744 35.244 24.266 1.00 0.00 N ATOM 1340 CA GLY A 99 25.584 35.072 25.084 1.00 0.00 C ATOM 1341 C GLY A 99 25.390 36.244 25.983 1.00 0.00 C ATOM 1342 O GLY A 99 26.292 37.058 26.171 1.00 0.00 O ATOM 0 H GLY A 99 27.608 35.278 24.807 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.705 34.943 24.453 1.00 0.00 H new ATOM 0 HA3 GLY A 99 25.685 34.165 25.679 1.00 0.00 H new ATOM 1346 N GLN A 100 24.190 36.379 26.579 1.00 0.00 N ATOM 1347 CA GLN A 100 23.831 37.459 27.444 1.00 0.00 C ATOM 1348 C GLN A 100 24.417 37.382 28.812 1.00 0.00 C ATOM 1349 O GLN A 100 25.159 36.462 29.152 1.00 0.00 O ATOM 1350 CB GLN A 100 22.298 37.572 27.500 1.00 0.00 C ATOM 1351 CG GLN A 100 21.592 36.379 28.149 1.00 0.00 C ATOM 1352 CD GLN A 100 20.087 36.439 27.931 1.00 0.00 C ATOM 1353 OE1 GLN A 100 19.595 36.470 26.804 1.00 0.00 O ATOM 1354 NE2 GLN A 100 19.302 36.420 29.042 1.00 0.00 N ATOM 0 H GLN A 100 23.437 35.703 26.451 1.00 0.00 H new ATOM 0 HA GLN A 100 24.265 38.362 27.014 1.00 0.00 H new ATOM 0 HB2 GLN A 100 22.034 38.476 28.049 1.00 0.00 H new ATOM 0 HB3 GLN A 100 21.919 37.693 26.485 1.00 0.00 H new ATOM 0 HG2 GLN A 100 21.985 35.451 27.733 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.806 36.365 29.218 1.00 0.00 H new ATOM 0 HE21 GLN A 100 19.729 36.394 29.968 1.00 0.00 H new ATOM 0 HE22 GLN A 100 18.286 36.431 28.949 1.00 0.00 H new ATOM 1363 N VAL A 101 24.124 38.376 29.669 1.00 0.00 N ATOM 1364 CA VAL A 101 24.644 38.465 30.999 1.00 0.00 C ATOM 1365 C VAL A 101 23.811 37.730 31.992 1.00 0.00 C ATOM 1366 O VAL A 101 22.588 37.724 31.857 1.00 0.00 O ATOM 1367 CB VAL A 101 24.820 39.882 31.457 1.00 0.00 C ATOM 1368 CG1 VAL A 101 25.859 40.566 30.554 1.00 0.00 C ATOM 1369 CG2 VAL A 101 23.504 40.677 31.460 1.00 0.00 C ATOM 0 H VAL A 101 23.502 39.147 29.427 1.00 0.00 H new ATOM 0 HA VAL A 101 25.624 37.991 30.947 1.00 0.00 H new ATOM 0 HB VAL A 101 25.165 39.862 32.491 1.00 0.00 H new ATOM 0 HG11 VAL A 101 25.997 41.598 30.876 1.00 0.00 H new ATOM 0 HG12 VAL A 101 26.808 40.034 30.623 1.00 0.00 H new ATOM 0 HG13 VAL A 101 25.510 40.551 29.522 1.00 0.00 H new ATOM 0 HG21 VAL A 101 23.695 41.695 31.801 1.00 0.00 H new ATOM 0 HG22 VAL A 101 23.092 40.703 30.451 1.00 0.00 H new ATOM 0 HG23 VAL A 101 22.791 40.198 32.131 1.00 0.00 H new ATOM 1379 N PRO A 102 24.351 37.097 32.991 1.00 0.00 N ATOM 1380 CA PRO A 102 23.624 36.714 34.166 1.00 0.00 C ATOM 1381 C PRO A 102 23.253 37.878 35.018 1.00 0.00 C ATOM 1382 O PRO A 102 22.040 38.200 35.125 1.00 0.00 O ATOM 1383 CB PRO A 102 24.555 35.766 34.918 1.00 0.00 C ATOM 1384 CG PRO A 102 25.478 35.202 33.826 1.00 0.00 C ATOM 1385 CD PRO A 102 25.640 36.426 32.910 1.00 0.00 C ATOM 1386 OXT PRO A 102 24.146 38.524 35.629 1.00 0.00 O ATOM 0 HA PRO A 102 22.676 36.247 33.898 1.00 0.00 H new ATOM 0 HB2 PRO A 102 25.122 36.291 35.687 1.00 0.00 H new ATOM 0 HB3 PRO A 102 23.998 34.973 35.418 1.00 0.00 H new ATOM 0 HG2 PRO A 102 26.431 34.861 34.229 1.00 0.00 H new ATOM 0 HG3 PRO A 102 25.030 34.355 33.306 1.00 0.00 H new ATOM 0 HD2 PRO A 102 26.449 37.073 33.248 1.00 0.00 H new ATOM 0 HD3 PRO A 102 25.873 36.131 31.887 1.00 0.00 H new TER 1394 PRO A 102