USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1038 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 130 ASN : amide:sc= 0.474 K(o=1.3,f=-1.5) USER MOD Set 1.2: A 133 SER OG : rot 94:sc= 0.851 USER MOD Set 2.1: A 26 SER OG : rot 180:sc= 0.316 USER MOD Set 2.2: A 27 THR OG1 : rot 180:sc= -0.095 USER MOD Set 3.1: A 1 MET N :NH3+ -119:sc= -1.22 (180deg=-2.47!) USER MOD Set 3.2: A 35 SER OG : rot -160:sc= 0.0237 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl -157:sc= -4.79 (180deg=-8.06!) USER MOD Single : A 4 THR OG1 : rot 180:sc=-0.00606 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0661 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 HIS :FLIP no HD1:sc= -2.45! C(o=-3.2!,f=-2.5!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.737 USER MOD Single : A 49 MET CE :methyl -126:sc= 0 (180deg=-0.925) USER MOD Single : A 53 GLN : amide:sc= -0.251 K(o=-0.25,f=-2.2!) USER MOD Single : A 63 MET CE :methyl 151:sc= -0.019 (180deg=-0.265) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 ASN :FLIP amide:sc= -2.45! F(o=-3,f=-2.5!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.0099 X(o=-0.0099,f=-0.11) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 66:sc= 0.508 USER MOD Single : A 102 ASN : amide:sc= -0.734 K(o=-0.73,f=-1.9!) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 112 LYS NZ :NH3+ 138:sc= -0.542 (180deg=-2.63!) USER MOD Single : A 116 ASN : amide:sc= -0.0813 X(o=-0.081,f=0) USER MOD Single : A 124 THR OG1 : rot 50:sc= 1.11 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -64:sc= 0.886 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.673 0.719 1.018 1.00 33.35 N ATOM 2 CA MET A 1 5.063 0.870 -0.378 1.00 42.24 C ATOM 3 C MET A 1 4.823 2.298 -0.858 1.00 43.22 C ATOM 4 O MET A 1 5.514 2.788 -1.752 1.00 22.23 O ATOM 5 CB MET A 1 4.287 -0.113 -1.257 1.00 14.42 C ATOM 6 CG MET A 1 4.972 -0.418 -2.579 1.00 32.42 C ATOM 7 SD MET A 1 4.092 0.271 -3.993 1.00 54.42 S ATOM 8 CE MET A 1 4.059 -1.141 -5.094 1.00 23.33 C ATOM 0 H1 MET A 1 5.502 0.441 1.582 1.00 33.35 H new ATOM 0 H2 MET A 1 4.299 1.622 1.374 1.00 33.35 H new ATOM 0 H3 MET A 1 3.940 -0.014 1.096 1.00 33.35 H new ATOM 0 HA MET A 1 6.128 0.653 -0.457 1.00 42.24 H new ATOM 0 HB2 MET A 1 4.144 -1.044 -0.708 1.00 14.42 H new ATOM 0 HB3 MET A 1 3.296 0.295 -1.456 1.00 14.42 H new ATOM 0 HG2 MET A 1 5.986 -0.020 -2.558 1.00 32.42 H new ATOM 0 HG3 MET A 1 5.056 -1.498 -2.699 1.00 32.42 H new ATOM 0 HE1 MET A 1 3.545 -0.871 -6.017 1.00 23.33 H new ATOM 0 HE2 MET A 1 5.080 -1.447 -5.324 1.00 23.33 H new ATOM 0 HE3 MET A 1 3.532 -1.965 -4.613 1.00 23.33 H new ATOM 18 N VAL A 2 3.839 2.962 -0.259 1.00 64.31 N ATOM 19 CA VAL A 2 3.509 4.334 -0.625 1.00 20.20 C ATOM 20 C VAL A 2 2.985 5.112 0.577 1.00 41.03 C ATOM 21 O VAL A 2 2.283 4.564 1.426 1.00 64.40 O ATOM 22 CB VAL A 2 2.457 4.377 -1.749 1.00 40.21 C ATOM 23 CG1 VAL A 2 2.109 5.816 -2.100 1.00 31.23 C ATOM 24 CG2 VAL A 2 2.956 3.627 -2.975 1.00 4.03 C ATOM 0 H VAL A 2 3.257 2.572 0.482 1.00 64.31 H new ATOM 0 HA VAL A 2 4.429 4.797 -0.981 1.00 20.20 H new ATOM 0 HB VAL A 2 1.551 3.885 -1.394 1.00 40.21 H new ATOM 0 HG11 VAL A 2 1.364 5.826 -2.896 1.00 31.23 H new ATOM 0 HG12 VAL A 2 1.707 6.318 -1.220 1.00 31.23 H new ATOM 0 HG13 VAL A 2 3.006 6.336 -2.436 1.00 31.23 H new ATOM 0 HG21 VAL A 2 2.200 3.668 -3.759 1.00 4.03 H new ATOM 0 HG22 VAL A 2 3.876 4.088 -3.334 1.00 4.03 H new ATOM 0 HG23 VAL A 2 3.150 2.587 -2.712 1.00 4.03 H new ATOM 34 N MET A 3 3.331 6.394 0.641 1.00 34.31 N ATOM 35 CA MET A 3 2.893 7.248 1.739 1.00 42.53 C ATOM 36 C MET A 3 1.679 8.077 1.332 1.00 34.30 C ATOM 37 O MET A 3 1.347 8.173 0.150 1.00 72.21 O ATOM 38 CB MET A 3 4.031 8.172 2.179 1.00 52.03 C ATOM 39 CG MET A 3 3.884 8.681 3.604 1.00 61.53 C ATOM 40 SD MET A 3 5.352 8.375 4.605 1.00 62.22 S ATOM 41 CE MET A 3 4.636 7.509 6.000 1.00 3.51 C ATOM 0 H MET A 3 3.912 6.863 -0.053 1.00 34.31 H new ATOM 0 HA MET A 3 2.610 6.607 2.574 1.00 42.53 H new ATOM 0 HB2 MET A 3 4.977 7.638 2.088 1.00 52.03 H new ATOM 0 HB3 MET A 3 4.079 9.024 1.501 1.00 52.03 H new ATOM 0 HG2 MET A 3 3.679 9.751 3.584 1.00 61.53 H new ATOM 0 HG3 MET A 3 3.024 8.200 4.071 1.00 61.53 H new ATOM 0 HE1 MET A 3 5.292 7.608 6.865 1.00 3.51 H new ATOM 0 HE2 MET A 3 3.661 7.937 6.233 1.00 3.51 H new ATOM 0 HE3 MET A 3 4.519 6.454 5.752 1.00 3.51 H new ATOM 51 N THR A 4 1.018 8.674 2.319 1.00 75.01 N ATOM 52 CA THR A 4 -0.161 9.493 2.064 1.00 61.43 C ATOM 53 C THR A 4 -0.248 10.653 3.048 1.00 2.22 C ATOM 54 O THR A 4 -0.671 10.481 4.191 1.00 34.41 O ATOM 55 CB THR A 4 -1.454 8.660 2.154 1.00 64.11 C ATOM 56 OG1 THR A 4 -1.345 7.496 1.327 1.00 54.02 O ATOM 57 CG2 THR A 4 -2.659 9.483 1.724 1.00 4.15 C ATOM 0 H THR A 4 1.279 8.606 3.303 1.00 75.01 H new ATOM 0 HA THR A 4 -0.060 9.886 1.052 1.00 61.43 H new ATOM 0 HB THR A 4 -1.593 8.356 3.192 1.00 64.11 H new ATOM 0 HG1 THR A 4 -2.170 6.971 1.391 1.00 54.02 H new ATOM 0 HG21 THR A 4 -3.560 8.874 1.796 1.00 4.15 H new ATOM 0 HG22 THR A 4 -2.756 10.353 2.374 1.00 4.15 H new ATOM 0 HG23 THR A 4 -2.525 9.813 0.694 1.00 4.15 H new ATOM 65 N VAL A 5 0.155 11.837 2.598 1.00 64.05 N ATOM 66 CA VAL A 5 0.121 13.027 3.439 1.00 42.43 C ATOM 67 C VAL A 5 -0.966 13.993 2.981 1.00 73.31 C ATOM 68 O VAL A 5 -0.920 14.512 1.866 1.00 74.35 O ATOM 69 CB VAL A 5 1.477 13.758 3.432 1.00 0.24 C ATOM 70 CG1 VAL A 5 1.981 13.937 2.008 1.00 30.34 C ATOM 71 CG2 VAL A 5 1.361 15.101 4.138 1.00 63.10 C ATOM 0 H VAL A 5 0.509 11.997 1.655 1.00 64.05 H new ATOM 0 HA VAL A 5 -0.098 12.692 4.453 1.00 42.43 H new ATOM 0 HB VAL A 5 2.201 13.149 3.974 1.00 0.24 H new ATOM 0 HG11 VAL A 5 2.940 14.455 2.024 1.00 30.34 H new ATOM 0 HG12 VAL A 5 2.104 12.960 1.540 1.00 30.34 H new ATOM 0 HG13 VAL A 5 1.261 14.524 1.438 1.00 30.34 H new ATOM 0 HG21 VAL A 5 2.328 15.604 4.124 1.00 63.10 H new ATOM 0 HG22 VAL A 5 0.623 15.719 3.626 1.00 63.10 H new ATOM 0 HG23 VAL A 5 1.049 14.944 5.170 1.00 63.10 H new ATOM 81 N ARG A 6 -1.944 14.230 3.850 1.00 64.52 N ATOM 82 CA ARG A 6 -3.044 15.132 3.535 1.00 50.54 C ATOM 83 C ARG A 6 -2.872 16.469 4.250 1.00 52.31 C ATOM 84 O ARG A 6 -2.200 16.554 5.278 1.00 61.42 O ATOM 85 CB ARG A 6 -4.380 14.499 3.928 1.00 40.41 C ATOM 86 CG ARG A 6 -4.498 13.035 3.538 1.00 12.13 C ATOM 87 CD ARG A 6 -4.112 12.119 4.689 1.00 1.43 C ATOM 88 NE ARG A 6 -4.964 10.935 4.756 1.00 64.10 N ATOM 89 CZ ARG A 6 -5.062 10.160 5.830 1.00 24.32 C ATOM 90 NH1 ARG A 6 -4.365 10.443 6.922 1.00 24.00 N ATOM 91 NH2 ARG A 6 -5.858 9.099 5.814 1.00 74.21 N ATOM 0 H ARG A 6 -1.996 13.809 4.778 1.00 64.52 H new ATOM 0 HA ARG A 6 -3.038 15.311 2.460 1.00 50.54 H new ATOM 0 HB2 ARG A 6 -4.513 14.591 5.006 1.00 40.41 H new ATOM 0 HB3 ARG A 6 -5.189 15.058 3.458 1.00 40.41 H new ATOM 0 HG2 ARG A 6 -5.521 12.821 3.229 1.00 12.13 H new ATOM 0 HG3 ARG A 6 -3.857 12.833 2.680 1.00 12.13 H new ATOM 0 HD2 ARG A 6 -3.073 11.812 4.575 1.00 1.43 H new ATOM 0 HD3 ARG A 6 -4.180 12.668 5.628 1.00 1.43 H new ATOM 0 HE ARG A 6 -5.514 10.690 3.933 1.00 64.10 H new ATOM 0 HH11 ARG A 6 -3.752 11.258 6.939 1.00 24.00 H new ATOM 0 HH12 ARG A 6 -4.442 9.846 7.745 1.00 24.00 H new ATOM 0 HH21 ARG A 6 -6.396 8.877 4.976 1.00 74.21 H new ATOM 0 HH22 ARG A 6 -5.932 8.505 6.640 1.00 74.21 H new ATOM 105 N VAL A 7 -3.484 17.513 3.699 1.00 73.44 N ATOM 106 CA VAL A 7 -3.400 18.845 4.284 1.00 42.43 C ATOM 107 C VAL A 7 -4.768 19.328 4.750 1.00 14.54 C ATOM 108 O VAL A 7 -5.789 19.028 4.130 1.00 64.13 O ATOM 109 CB VAL A 7 -2.823 19.863 3.282 1.00 62.25 C ATOM 110 CG1 VAL A 7 -1.321 19.672 3.131 1.00 33.40 C ATOM 111 CG2 VAL A 7 -3.522 19.740 1.936 1.00 23.20 C ATOM 0 H VAL A 7 -4.044 17.461 2.848 1.00 73.44 H new ATOM 0 HA VAL A 7 -2.732 18.772 5.142 1.00 42.43 H new ATOM 0 HB VAL A 7 -3.000 20.867 3.668 1.00 62.25 H new ATOM 0 HG11 VAL A 7 -0.931 20.400 2.419 1.00 33.40 H new ATOM 0 HG12 VAL A 7 -0.837 19.814 4.097 1.00 33.40 H new ATOM 0 HG13 VAL A 7 -1.117 18.665 2.768 1.00 33.40 H new ATOM 0 HG21 VAL A 7 -3.102 20.466 1.240 1.00 23.20 H new ATOM 0 HG22 VAL A 7 -3.378 18.734 1.542 1.00 23.20 H new ATOM 0 HG23 VAL A 7 -4.588 19.931 2.061 1.00 23.20 H new ATOM 121 N ILE A 8 -4.783 20.079 5.847 1.00 64.31 N ATOM 122 CA ILE A 8 -6.026 20.605 6.396 1.00 71.11 C ATOM 123 C ILE A 8 -5.852 22.043 6.872 1.00 24.25 C ATOM 124 O ILE A 8 -4.850 22.382 7.501 1.00 24.33 O ATOM 125 CB ILE A 8 -6.532 19.745 7.569 1.00 30.11 C ATOM 126 CG1 ILE A 8 -6.751 18.300 7.114 1.00 4.51 C ATOM 127 CG2 ILE A 8 -7.818 20.327 8.137 1.00 4.40 C ATOM 128 CD1 ILE A 8 -7.054 17.349 8.250 1.00 61.52 C ATOM 0 H ILE A 8 -3.948 20.336 6.373 1.00 64.31 H new ATOM 0 HA ILE A 8 -6.762 20.578 5.593 1.00 71.11 H new ATOM 0 HB ILE A 8 -5.776 19.749 8.354 1.00 30.11 H new ATOM 0 HG12 ILE A 8 -7.573 18.273 6.399 1.00 4.51 H new ATOM 0 HG13 ILE A 8 -5.861 17.954 6.589 1.00 4.51 H new ATOM 0 HG21 ILE A 8 -8.163 19.708 8.965 1.00 4.40 H new ATOM 0 HG22 ILE A 8 -7.632 21.340 8.494 1.00 4.40 H new ATOM 0 HG23 ILE A 8 -8.581 20.351 7.359 1.00 4.40 H new ATOM 0 HD11 ILE A 8 -7.198 16.344 7.854 1.00 61.52 H new ATOM 0 HD12 ILE A 8 -6.222 17.346 8.954 1.00 61.52 H new ATOM 0 HD13 ILE A 8 -7.961 17.671 8.762 1.00 61.52 H new ATOM 140 N ALA A 9 -6.835 22.884 6.570 1.00 40.10 N ATOM 141 CA ALA A 9 -6.792 24.285 6.971 1.00 72.13 C ATOM 142 C ALA A 9 -7.636 24.525 8.218 1.00 51.00 C ATOM 143 O ALA A 9 -8.499 23.724 8.577 1.00 73.34 O ATOM 144 CB ALA A 9 -7.266 25.175 5.831 1.00 32.41 C ATOM 0 H ALA A 9 -7.671 22.620 6.049 1.00 40.10 H new ATOM 0 HA ALA A 9 -5.759 24.538 7.209 1.00 72.13 H new ATOM 0 HB1 ALA A 9 -7.229 26.218 6.144 1.00 32.41 H new ATOM 0 HB2 ALA A 9 -6.619 25.033 4.965 1.00 32.41 H new ATOM 0 HB3 ALA A 9 -8.290 24.912 5.566 1.00 32.41 H new ATOM 150 N PRO A 10 -7.383 25.654 8.897 1.00 64.14 N ATOM 151 CA PRO A 10 -8.109 26.025 10.115 1.00 42.34 C ATOM 152 C PRO A 10 -9.559 26.405 9.832 1.00 25.54 C ATOM 153 O PRO A 10 -10.349 26.604 10.755 1.00 22.10 O ATOM 154 CB PRO A 10 -7.331 27.236 10.636 1.00 51.31 C ATOM 155 CG PRO A 10 -6.680 27.817 9.428 1.00 15.22 C ATOM 156 CD PRO A 10 -6.368 26.655 8.527 1.00 60.13 C ATOM 0 HA PRO A 10 -8.165 25.199 10.824 1.00 42.34 H new ATOM 0 HB2 PRO A 10 -7.994 27.957 11.114 1.00 51.31 H new ATOM 0 HB3 PRO A 10 -6.592 26.941 11.381 1.00 51.31 H new ATOM 0 HG2 PRO A 10 -7.341 28.529 8.933 1.00 15.22 H new ATOM 0 HG3 PRO A 10 -5.772 28.358 9.696 1.00 15.22 H new ATOM 0 HD2 PRO A 10 -6.441 26.931 7.475 1.00 60.13 H new ATOM 0 HD3 PRO A 10 -5.357 26.281 8.689 1.00 60.13 H new ATOM 164 N ASP A 11 -9.901 26.502 8.553 1.00 72.04 N ATOM 165 CA ASP A 11 -11.257 26.856 8.149 1.00 70.11 C ATOM 166 C ASP A 11 -12.000 25.636 7.613 1.00 14.24 C ATOM 167 O ASP A 11 -13.231 25.613 7.575 1.00 62.22 O ATOM 168 CB ASP A 11 -11.225 27.956 7.087 1.00 51.11 C ATOM 169 CG ASP A 11 -10.432 27.553 5.859 1.00 33.32 C ATOM 170 OD1 ASP A 11 -11.007 26.882 4.975 1.00 5.44 O ATOM 171 OD2 ASP A 11 -9.238 27.908 5.782 1.00 42.13 O ATOM 0 H ASP A 11 -9.258 26.341 7.777 1.00 72.04 H new ATOM 0 HA ASP A 11 -11.787 27.225 9.027 1.00 70.11 H new ATOM 0 HB2 ASP A 11 -12.245 28.202 6.792 1.00 51.11 H new ATOM 0 HB3 ASP A 11 -10.791 28.859 7.516 1.00 51.11 H new ATOM 176 N LYS A 12 -11.245 24.624 7.200 1.00 55.12 N ATOM 177 CA LYS A 12 -11.831 23.400 6.666 1.00 12.12 C ATOM 178 C LYS A 12 -10.746 22.438 6.195 1.00 24.32 C ATOM 179 O LYS A 12 -9.562 22.637 6.471 1.00 41.14 O ATOM 180 CB LYS A 12 -12.777 23.726 5.508 1.00 64.34 C ATOM 181 CG LYS A 12 -14.167 23.137 5.674 1.00 51.54 C ATOM 182 CD LYS A 12 -14.800 22.814 4.330 1.00 1.54 C ATOM 183 CE LYS A 12 -15.733 21.617 4.427 1.00 11.34 C ATOM 184 NZ LYS A 12 -15.899 20.936 3.114 1.00 70.51 N ATOM 0 H LYS A 12 -10.225 24.627 7.225 1.00 55.12 H new ATOM 0 HA LYS A 12 -12.396 22.919 7.464 1.00 12.12 H new ATOM 0 HB2 LYS A 12 -12.859 24.809 5.411 1.00 64.34 H new ATOM 0 HB3 LYS A 12 -12.343 23.355 4.580 1.00 64.34 H new ATOM 0 HG2 LYS A 12 -14.110 22.231 6.277 1.00 51.54 H new ATOM 0 HG3 LYS A 12 -14.799 23.841 6.215 1.00 51.54 H new ATOM 0 HD2 LYS A 12 -15.354 23.681 3.970 1.00 1.54 H new ATOM 0 HD3 LYS A 12 -14.018 22.609 3.598 1.00 1.54 H new ATOM 0 HE2 LYS A 12 -15.340 20.909 5.156 1.00 11.34 H new ATOM 0 HE3 LYS A 12 -16.707 21.944 4.792 1.00 11.34 H new ATOM 0 HZ1 LYS A 12 -16.542 20.126 3.222 1.00 70.51 H new ATOM 0 HZ2 LYS A 12 -16.297 21.605 2.424 1.00 70.51 H new ATOM 0 HZ3 LYS A 12 -14.974 20.601 2.777 1.00 70.51 H new ATOM 198 N THR A 13 -11.155 21.393 5.482 1.00 55.42 N ATOM 199 CA THR A 13 -10.218 20.401 4.972 1.00 31.43 C ATOM 200 C THR A 13 -9.820 20.708 3.533 1.00 2.13 C ATOM 201 O THR A 13 -10.668 21.019 2.697 1.00 62.44 O ATOM 202 CB THR A 13 -10.813 18.981 5.036 1.00 13.31 C ATOM 203 OG1 THR A 13 -9.825 18.018 4.655 1.00 62.04 O ATOM 204 CG2 THR A 13 -12.025 18.861 4.124 1.00 63.12 C ATOM 0 H THR A 13 -12.130 21.212 5.245 1.00 55.42 H new ATOM 0 HA THR A 13 -9.334 20.446 5.608 1.00 31.43 H new ATOM 0 HB THR A 13 -11.129 18.789 6.061 1.00 13.31 H new ATOM 0 HG1 THR A 13 -10.211 17.118 4.700 1.00 62.04 H new ATOM 0 HG21 THR A 13 -12.428 17.850 4.186 1.00 63.12 H new ATOM 0 HG22 THR A 13 -12.787 19.575 4.436 1.00 63.12 H new ATOM 0 HG23 THR A 13 -11.729 19.072 3.096 1.00 63.12 H new ATOM 212 N VAL A 14 -8.524 20.619 3.251 1.00 41.10 N ATOM 213 CA VAL A 14 -8.013 20.886 1.912 1.00 52.23 C ATOM 214 C VAL A 14 -8.170 19.667 1.010 1.00 34.23 C ATOM 215 O VAL A 14 -9.037 19.636 0.137 1.00 71.04 O ATOM 216 CB VAL A 14 -6.529 21.296 1.948 1.00 21.24 C ATOM 217 CG1 VAL A 14 -6.003 21.525 0.540 1.00 61.44 C ATOM 218 CG2 VAL A 14 -6.341 22.539 2.805 1.00 24.30 C ATOM 0 H VAL A 14 -7.809 20.364 3.932 1.00 41.10 H new ATOM 0 HA VAL A 14 -8.600 21.711 1.509 1.00 52.23 H new ATOM 0 HB VAL A 14 -5.957 20.483 2.395 1.00 21.24 H new ATOM 0 HG11 VAL A 14 -4.953 21.814 0.586 1.00 61.44 H new ATOM 0 HG12 VAL A 14 -6.102 20.607 -0.039 1.00 61.44 H new ATOM 0 HG13 VAL A 14 -6.577 22.319 0.062 1.00 61.44 H new ATOM 0 HG21 VAL A 14 -5.287 22.815 2.820 1.00 24.30 H new ATOM 0 HG22 VAL A 14 -6.925 23.360 2.389 1.00 24.30 H new ATOM 0 HG23 VAL A 14 -6.676 22.334 3.822 1.00 24.30 H new ATOM 228 N TRP A 15 -7.328 18.664 1.229 1.00 45.12 N ATOM 229 CA TRP A 15 -7.373 17.441 0.436 1.00 72.21 C ATOM 230 C TRP A 15 -6.280 16.470 0.869 1.00 40.31 C ATOM 231 O TRP A 15 -5.625 16.675 1.891 1.00 31.42 O ATOM 232 CB TRP A 15 -7.224 17.767 -1.051 1.00 64.50 C ATOM 233 CG TRP A 15 -8.309 17.177 -1.900 1.00 50.53 C ATOM 234 CD1 TRP A 15 -8.915 15.965 -1.731 1.00 53.52 C ATOM 235 CD2 TRP A 15 -8.915 17.774 -3.052 1.00 42.12 C ATOM 236 NE1 TRP A 15 -9.862 15.773 -2.709 1.00 24.33 N ATOM 237 CE2 TRP A 15 -9.881 16.868 -3.531 1.00 14.00 C ATOM 238 CE3 TRP A 15 -8.736 18.986 -3.725 1.00 15.04 C ATOM 239 CZ2 TRP A 15 -10.664 17.137 -4.651 1.00 3.53 C ATOM 240 CZ3 TRP A 15 -9.513 19.252 -4.836 1.00 74.20 C ATOM 241 CH2 TRP A 15 -10.468 18.332 -5.290 1.00 22.43 C ATOM 0 H TRP A 15 -6.606 18.673 1.949 1.00 45.12 H new ATOM 0 HA TRP A 15 -8.340 16.966 0.601 1.00 72.21 H new ATOM 0 HB2 TRP A 15 -7.220 18.849 -1.180 1.00 64.50 H new ATOM 0 HB3 TRP A 15 -6.259 17.401 -1.401 1.00 64.50 H new ATOM 0 HD1 TRP A 15 -8.684 15.261 -0.945 1.00 53.52 H new ATOM 0 HE1 TRP A 15 -10.454 14.948 -2.806 1.00 24.33 H new ATOM 0 HE3 TRP A 15 -8.003 19.702 -3.383 1.00 15.04 H new ATOM 0 HZ2 TRP A 15 -11.399 16.428 -5.003 1.00 3.53 H new ATOM 0 HZ3 TRP A 15 -9.382 20.185 -5.364 1.00 74.20 H new ATOM 0 HH2 TRP A 15 -11.061 18.570 -6.161 1.00 22.43 H new ATOM 252 N ASP A 16 -6.088 15.415 0.086 1.00 63.25 N ATOM 253 CA ASP A 16 -5.072 14.413 0.388 1.00 40.01 C ATOM 254 C ASP A 16 -3.968 14.423 -0.665 1.00 53.21 C ATOM 255 O ASP A 16 -4.241 14.378 -1.864 1.00 64.43 O ATOM 256 CB ASP A 16 -5.704 13.023 0.468 1.00 34.25 C ATOM 257 CG ASP A 16 -6.343 12.600 -0.840 1.00 43.42 C ATOM 258 OD1 ASP A 16 -7.256 13.310 -1.311 1.00 73.04 O ATOM 259 OD2 ASP A 16 -5.928 11.561 -1.394 1.00 31.23 O ATOM 0 H ASP A 16 -6.622 15.231 -0.763 1.00 63.25 H new ATOM 0 HA ASP A 16 -4.631 14.659 1.354 1.00 40.01 H new ATOM 0 HB2 ASP A 16 -4.941 12.296 0.748 1.00 34.25 H new ATOM 0 HB3 ASP A 16 -6.457 13.015 1.256 1.00 34.25 H new ATOM 264 N ALA A 17 -2.722 14.484 -0.208 1.00 1.31 N ATOM 265 CA ALA A 17 -1.577 14.500 -1.110 1.00 72.41 C ATOM 266 C ALA A 17 -0.804 13.187 -1.039 1.00 12.04 C ATOM 267 O ALA A 17 0.211 13.073 -0.352 1.00 3.41 O ATOM 268 CB ALA A 17 -0.663 15.671 -0.783 1.00 50.12 C ATOM 0 H ALA A 17 -2.480 14.523 0.782 1.00 1.31 H new ATOM 0 HA ALA A 17 -1.949 14.618 -2.128 1.00 72.41 H new ATOM 0 HB1 ALA A 17 0.188 15.670 -1.465 1.00 50.12 H new ATOM 0 HB2 ALA A 17 -1.215 16.605 -0.892 1.00 50.12 H new ATOM 0 HB3 ALA A 17 -0.306 15.579 0.243 1.00 50.12 H new ATOM 274 N PRO A 18 -1.294 12.170 -1.763 1.00 55.54 N ATOM 275 CA PRO A 18 -0.665 10.847 -1.798 1.00 42.13 C ATOM 276 C PRO A 18 0.669 10.859 -2.537 1.00 2.21 C ATOM 277 O PRO A 18 0.799 11.477 -3.593 1.00 50.21 O ATOM 278 CB PRO A 18 -1.685 9.989 -2.550 1.00 63.35 C ATOM 279 CG PRO A 18 -2.446 10.954 -3.392 1.00 4.42 C ATOM 280 CD PRO A 18 -2.501 12.235 -2.605 1.00 60.22 C ATOM 0 HA PRO A 18 -0.433 10.479 -0.798 1.00 42.13 H new ATOM 0 HB2 PRO A 18 -1.192 9.233 -3.162 1.00 63.35 H new ATOM 0 HB3 PRO A 18 -2.343 9.461 -1.860 1.00 63.35 H new ATOM 0 HG2 PRO A 18 -1.954 11.107 -4.353 1.00 4.42 H new ATOM 0 HG3 PRO A 18 -3.449 10.582 -3.603 1.00 4.42 H new ATOM 0 HD2 PRO A 18 -2.489 13.108 -3.257 1.00 60.22 H new ATOM 0 HD3 PRO A 18 -3.408 12.298 -2.003 1.00 60.22 H new ATOM 288 N ALA A 19 1.658 10.172 -1.974 1.00 40.13 N ATOM 289 CA ALA A 19 2.981 10.102 -2.581 1.00 44.13 C ATOM 290 C ALA A 19 3.827 9.013 -1.930 1.00 60.23 C ATOM 291 O ALA A 19 3.706 8.753 -0.734 1.00 11.23 O ATOM 292 CB ALA A 19 3.681 11.449 -2.478 1.00 24.01 C ATOM 0 H ALA A 19 1.568 9.656 -1.099 1.00 40.13 H new ATOM 0 HA ALA A 19 2.857 9.849 -3.634 1.00 44.13 H new ATOM 0 HB1 ALA A 19 4.668 11.382 -2.935 1.00 24.01 H new ATOM 0 HB2 ALA A 19 3.092 12.206 -2.996 1.00 24.01 H new ATOM 0 HB3 ALA A 19 3.785 11.726 -1.429 1.00 24.01 H new ATOM 298 N GLU A 20 4.682 8.379 -2.726 1.00 63.24 N ATOM 299 CA GLU A 20 5.547 7.316 -2.226 1.00 55.22 C ATOM 300 C GLU A 20 6.313 7.775 -0.989 1.00 15.23 C ATOM 301 O GLU A 20 6.467 7.022 -0.028 1.00 11.53 O ATOM 302 CB GLU A 20 6.529 6.874 -3.313 1.00 30.45 C ATOM 303 CG GLU A 20 7.209 5.548 -3.015 1.00 32.32 C ATOM 304 CD GLU A 20 8.716 5.617 -3.169 1.00 53.15 C ATOM 305 OE1 GLU A 20 9.332 6.524 -2.572 1.00 13.34 O ATOM 306 OE2 GLU A 20 9.279 4.765 -3.888 1.00 52.20 O ATOM 0 H GLU A 20 4.794 8.583 -3.719 1.00 63.24 H new ATOM 0 HA GLU A 20 4.918 6.470 -1.949 1.00 55.22 H new ATOM 0 HB2 GLU A 20 5.997 6.795 -4.261 1.00 30.45 H new ATOM 0 HB3 GLU A 20 7.291 7.644 -3.438 1.00 30.45 H new ATOM 0 HG2 GLU A 20 6.965 5.239 -1.998 1.00 32.32 H new ATOM 0 HG3 GLU A 20 6.814 4.783 -3.684 1.00 32.32 H new ATOM 313 N GLU A 21 6.790 9.015 -1.022 1.00 2.42 N ATOM 314 CA GLU A 21 7.541 9.574 0.096 1.00 2.13 C ATOM 315 C GLU A 21 7.202 11.048 0.297 1.00 1.31 C ATOM 316 O GLU A 21 6.736 11.721 -0.623 1.00 22.30 O ATOM 317 CB GLU A 21 9.045 9.413 -0.139 1.00 35.30 C ATOM 318 CG GLU A 21 9.873 9.502 1.132 1.00 75.01 C ATOM 319 CD GLU A 21 11.360 9.366 0.870 1.00 51.51 C ATOM 320 OE1 GLU A 21 11.727 8.813 -0.188 1.00 3.21 O ATOM 321 OE2 GLU A 21 12.156 9.813 1.722 1.00 61.02 O ATOM 0 H GLU A 21 6.670 9.651 -1.810 1.00 2.42 H new ATOM 0 HA GLU A 21 7.261 9.028 0.997 1.00 2.13 H new ATOM 0 HB2 GLU A 21 9.229 8.450 -0.615 1.00 35.30 H new ATOM 0 HB3 GLU A 21 9.380 10.182 -0.835 1.00 35.30 H new ATOM 0 HG2 GLU A 21 9.680 10.457 1.621 1.00 75.01 H new ATOM 0 HG3 GLU A 21 9.557 8.720 1.823 1.00 75.01 H new ATOM 328 N VAL A 22 7.439 11.544 1.507 1.00 11.53 N ATOM 329 CA VAL A 22 7.160 12.939 1.830 1.00 34.42 C ATOM 330 C VAL A 22 8.426 13.665 2.270 1.00 53.24 C ATOM 331 O VAL A 22 9.186 13.163 3.098 1.00 61.44 O ATOM 332 CB VAL A 22 6.101 13.056 2.943 1.00 61.21 C ATOM 333 CG1 VAL A 22 5.804 14.517 3.246 1.00 23.50 C ATOM 334 CG2 VAL A 22 4.831 12.316 2.550 1.00 25.41 C ATOM 0 H VAL A 22 7.824 11.001 2.280 1.00 11.53 H new ATOM 0 HA VAL A 22 6.775 13.404 0.922 1.00 34.42 H new ATOM 0 HB VAL A 22 6.498 12.595 3.848 1.00 61.21 H new ATOM 0 HG11 VAL A 22 5.054 14.580 4.034 1.00 23.50 H new ATOM 0 HG12 VAL A 22 6.717 15.014 3.574 1.00 23.50 H new ATOM 0 HG13 VAL A 22 5.428 15.006 2.347 1.00 23.50 H new ATOM 0 HG21 VAL A 22 4.094 12.409 3.348 1.00 25.41 H new ATOM 0 HG22 VAL A 22 4.429 12.745 1.632 1.00 25.41 H new ATOM 0 HG23 VAL A 22 5.059 11.263 2.388 1.00 25.41 H new ATOM 344 N ILE A 23 8.645 14.850 1.710 1.00 4.34 N ATOM 345 CA ILE A 23 9.819 15.647 2.046 1.00 11.11 C ATOM 346 C ILE A 23 9.445 17.109 2.269 1.00 25.45 C ATOM 347 O ILE A 23 8.833 17.743 1.409 1.00 32.24 O ATOM 348 CB ILE A 23 10.889 15.565 0.942 1.00 44.41 C ATOM 349 CG1 ILE A 23 11.312 14.112 0.717 1.00 12.12 C ATOM 350 CG2 ILE A 23 12.093 16.422 1.306 1.00 14.23 C ATOM 351 CD1 ILE A 23 10.722 13.498 -0.533 1.00 63.11 C ATOM 0 H ILE A 23 8.026 15.279 1.022 1.00 4.34 H new ATOM 0 HA ILE A 23 10.228 15.234 2.968 1.00 11.11 H new ATOM 0 HB ILE A 23 10.462 15.947 0.015 1.00 44.41 H new ATOM 0 HG12 ILE A 23 12.399 14.064 0.657 1.00 12.12 H new ATOM 0 HG13 ILE A 23 11.013 13.517 1.580 1.00 12.12 H new ATOM 0 HG21 ILE A 23 12.841 16.354 0.516 1.00 14.23 H new ATOM 0 HG22 ILE A 23 11.780 17.460 1.420 1.00 14.23 H new ATOM 0 HG23 ILE A 23 12.522 16.067 2.243 1.00 14.23 H new ATOM 0 HD11 ILE A 23 11.064 12.468 -0.629 1.00 63.11 H new ATOM 0 HD12 ILE A 23 9.634 13.514 -0.468 1.00 63.11 H new ATOM 0 HD13 ILE A 23 11.042 14.069 -1.405 1.00 63.11 H new ATOM 363 N LEU A 24 9.820 17.638 3.429 1.00 52.43 N ATOM 364 CA LEU A 24 9.526 19.027 3.765 1.00 2.25 C ATOM 365 C LEU A 24 10.415 19.510 4.907 1.00 42.30 C ATOM 366 O LEU A 24 10.979 18.720 5.664 1.00 3.22 O ATOM 367 CB LEU A 24 8.054 19.179 4.151 1.00 32.44 C ATOM 368 CG LEU A 24 7.414 17.974 4.843 1.00 11.42 C ATOM 369 CD1 LEU A 24 8.245 17.544 6.042 1.00 33.11 C ATOM 370 CD2 LEU A 24 5.989 18.298 5.268 1.00 1.40 C ATOM 0 H LEU A 24 10.327 17.127 4.151 1.00 52.43 H new ATOM 0 HA LEU A 24 9.729 19.639 2.886 1.00 2.25 H new ATOM 0 HB2 LEU A 24 7.959 20.043 4.808 1.00 32.44 H new ATOM 0 HB3 LEU A 24 7.483 19.400 3.249 1.00 32.44 H new ATOM 0 HG LEU A 24 7.381 17.147 4.134 1.00 11.42 H new ATOM 0 HD11 LEU A 24 7.775 16.686 6.522 1.00 33.11 H new ATOM 0 HD12 LEU A 24 9.247 17.271 5.711 1.00 33.11 H new ATOM 0 HD13 LEU A 24 8.310 18.367 6.754 1.00 33.11 H new ATOM 0 HD21 LEU A 24 5.549 17.430 5.758 1.00 1.40 H new ATOM 0 HD22 LEU A 24 5.998 19.140 5.960 1.00 1.40 H new ATOM 0 HD23 LEU A 24 5.397 18.557 4.390 1.00 1.40 H new ATOM 382 N PRO A 25 10.543 20.839 5.036 1.00 13.23 N ATOM 383 CA PRO A 25 11.359 21.458 6.085 1.00 63.22 C ATOM 384 C PRO A 25 10.751 21.283 7.472 1.00 24.52 C ATOM 385 O PRO A 25 9.546 21.451 7.658 1.00 3.31 O ATOM 386 CB PRO A 25 11.379 22.937 5.693 1.00 50.34 C ATOM 387 CG PRO A 25 10.135 23.135 4.897 1.00 30.21 C ATOM 388 CD PRO A 25 9.899 21.840 4.169 1.00 11.33 C ATOM 0 HA PRO A 25 12.349 21.007 6.150 1.00 63.22 H new ATOM 0 HB2 PRO A 25 11.392 23.580 6.573 1.00 50.34 H new ATOM 0 HB3 PRO A 25 12.266 23.180 5.108 1.00 50.34 H new ATOM 0 HG2 PRO A 25 9.292 23.378 5.544 1.00 30.21 H new ATOM 0 HG3 PRO A 25 10.248 23.962 4.196 1.00 30.21 H new ATOM 0 HD2 PRO A 25 8.835 21.638 4.043 1.00 11.33 H new ATOM 0 HD3 PRO A 25 10.341 21.853 3.173 1.00 11.33 H new ATOM 396 N SER A 26 11.593 20.943 8.444 1.00 50.54 N ATOM 397 CA SER A 26 11.137 20.742 9.814 1.00 4.11 C ATOM 398 C SER A 26 12.068 21.437 10.804 1.00 61.45 C ATOM 399 O SER A 26 12.921 22.236 10.416 1.00 11.45 O ATOM 400 CB SER A 26 11.058 19.248 10.133 1.00 3.03 C ATOM 401 OG SER A 26 10.340 19.020 11.333 1.00 0.35 O ATOM 0 H SER A 26 12.594 20.801 8.307 1.00 50.54 H new ATOM 0 HA SER A 26 10.143 21.180 9.908 1.00 4.11 H new ATOM 0 HB2 SER A 26 10.573 18.722 9.310 1.00 3.03 H new ATOM 0 HB3 SER A 26 12.064 18.839 10.224 1.00 3.03 H new ATOM 0 HG SER A 26 10.302 18.058 11.514 1.00 0.35 H new ATOM 407 N THR A 27 11.898 21.125 12.085 1.00 42.32 N ATOM 408 CA THR A 27 12.721 21.719 13.131 1.00 13.12 C ATOM 409 C THR A 27 14.202 21.629 12.784 1.00 62.14 C ATOM 410 O THR A 27 14.891 22.645 12.687 1.00 64.00 O ATOM 411 CB THR A 27 12.481 21.035 14.490 1.00 24.52 C ATOM 412 OG1 THR A 27 12.636 19.617 14.359 1.00 51.03 O ATOM 413 CG2 THR A 27 11.090 21.351 15.018 1.00 3.31 C ATOM 0 H THR A 27 11.198 20.465 12.423 1.00 42.32 H new ATOM 0 HA THR A 27 12.432 22.767 13.204 1.00 13.12 H new ATOM 0 HB THR A 27 13.216 21.417 15.198 1.00 24.52 H new ATOM 0 HG1 THR A 27 12.484 19.190 15.228 1.00 51.03 H new ATOM 0 HG21 THR A 27 10.944 20.857 15.979 1.00 3.31 H new ATOM 0 HG22 THR A 27 10.985 22.429 15.145 1.00 3.31 H new ATOM 0 HG23 THR A 27 10.342 20.995 14.310 1.00 3.31 H new ATOM 421 N THR A 28 14.688 20.406 12.595 1.00 30.25 N ATOM 422 CA THR A 28 16.088 20.183 12.259 1.00 63.02 C ATOM 423 C THR A 28 16.436 20.807 10.912 1.00 20.21 C ATOM 424 O THR A 28 17.608 20.985 10.584 1.00 41.04 O ATOM 425 CB THR A 28 16.424 18.680 12.218 1.00 50.24 C ATOM 426 OG1 THR A 28 15.240 17.921 11.951 1.00 74.20 O ATOM 427 CG2 THR A 28 17.038 18.227 13.534 1.00 72.55 C ATOM 0 H THR A 28 14.132 19.554 12.669 1.00 30.25 H new ATOM 0 HA THR A 28 16.680 20.659 13.041 1.00 63.02 H new ATOM 0 HB THR A 28 17.149 18.513 11.421 1.00 50.24 H new ATOM 0 HG1 THR A 28 15.462 16.967 11.925 1.00 74.20 H new ATOM 0 HG21 THR A 28 17.267 17.163 13.481 1.00 72.55 H new ATOM 0 HG22 THR A 28 17.955 18.787 13.719 1.00 72.55 H new ATOM 0 HG23 THR A 28 16.333 18.407 14.345 1.00 72.55 H new ATOM 435 N GLY A 29 15.409 21.138 10.135 1.00 32.14 N ATOM 436 CA GLY A 29 15.627 21.739 8.833 1.00 43.22 C ATOM 437 C GLY A 29 15.175 20.843 7.697 1.00 14.02 C ATOM 438 O GLY A 29 14.503 21.297 6.771 1.00 63.51 O ATOM 0 H GLY A 29 14.430 21.000 10.385 1.00 32.14 H new ATOM 0 HA2 GLY A 29 15.091 22.687 8.779 1.00 43.22 H new ATOM 0 HA3 GLY A 29 16.687 21.965 8.714 1.00 43.22 H new ATOM 442 N GLN A 30 15.544 19.568 7.768 1.00 2.31 N ATOM 443 CA GLN A 30 15.173 18.607 6.736 1.00 43.40 C ATOM 444 C GLN A 30 14.378 17.450 7.330 1.00 13.04 C ATOM 445 O GLN A 30 14.748 16.896 8.366 1.00 35.15 O ATOM 446 CB GLN A 30 16.423 18.075 6.033 1.00 71.24 C ATOM 447 CG GLN A 30 16.950 18.999 4.947 1.00 61.44 C ATOM 448 CD GLN A 30 18.032 18.351 4.104 1.00 12.53 C ATOM 449 OE1 GLN A 30 17.831 17.280 3.532 1.00 22.20 O ATOM 450 NE2 GLN A 30 19.187 19.001 4.024 1.00 64.43 N ATOM 0 H GLN A 30 16.099 19.177 8.529 1.00 2.31 H new ATOM 0 HA GLN A 30 14.544 19.119 6.007 1.00 43.40 H new ATOM 0 HB2 GLN A 30 17.206 17.915 6.774 1.00 71.24 H new ATOM 0 HB3 GLN A 30 16.197 17.103 5.594 1.00 71.24 H new ATOM 0 HG2 GLN A 30 16.125 19.303 4.302 1.00 61.44 H new ATOM 0 HG3 GLN A 30 17.346 19.905 5.406 1.00 61.44 H new ATOM 0 HE21 GLN A 30 19.309 19.887 4.515 1.00 64.43 H new ATOM 0 HE22 GLN A 30 19.952 18.615 3.471 1.00 64.43 H new ATOM 459 N LEU A 31 13.283 17.090 6.669 1.00 65.30 N ATOM 460 CA LEU A 31 12.434 15.998 7.132 1.00 23.51 C ATOM 461 C LEU A 31 12.072 15.064 5.982 1.00 61.15 C ATOM 462 O LEU A 31 11.789 15.511 4.871 1.00 45.41 O ATOM 463 CB LEU A 31 11.161 16.552 7.774 1.00 25.01 C ATOM 464 CG LEU A 31 10.804 15.990 9.150 1.00 21.44 C ATOM 465 CD1 LEU A 31 10.439 14.517 9.047 1.00 55.12 C ATOM 466 CD2 LEU A 31 11.957 16.188 10.123 1.00 24.43 C ATOM 0 H LEU A 31 12.962 17.538 5.811 1.00 65.30 H new ATOM 0 HA LEU A 31 12.991 15.429 7.876 1.00 23.51 H new ATOM 0 HB2 LEU A 31 11.263 17.634 7.861 1.00 25.01 H new ATOM 0 HB3 LEU A 31 10.326 16.364 7.099 1.00 25.01 H new ATOM 0 HG LEU A 31 9.938 16.533 9.529 1.00 21.44 H new ATOM 0 HD11 LEU A 31 10.188 14.134 10.036 1.00 55.12 H new ATOM 0 HD12 LEU A 31 9.582 14.400 8.384 1.00 55.12 H new ATOM 0 HD13 LEU A 31 11.286 13.959 8.647 1.00 55.12 H new ATOM 0 HD21 LEU A 31 11.685 15.782 11.097 1.00 24.43 H new ATOM 0 HD22 LEU A 31 12.841 15.672 9.749 1.00 24.43 H new ATOM 0 HD23 LEU A 31 12.172 17.252 10.221 1.00 24.43 H new ATOM 478 N GLY A 32 12.081 13.763 6.256 1.00 33.04 N ATOM 479 CA GLY A 32 11.749 12.787 5.235 1.00 64.20 C ATOM 480 C GLY A 32 11.079 11.553 5.807 1.00 4.44 C ATOM 481 O GLY A 32 11.695 10.798 6.560 1.00 32.22 O ATOM 0 H GLY A 32 12.312 13.368 7.167 1.00 33.04 H new ATOM 0 HA2 GLY A 32 11.089 13.246 4.499 1.00 64.20 H new ATOM 0 HA3 GLY A 32 12.657 12.493 4.709 1.00 64.20 H new ATOM 485 N ILE A 33 9.816 11.350 5.452 1.00 75.33 N ATOM 486 CA ILE A 33 9.062 10.200 5.936 1.00 61.31 C ATOM 487 C ILE A 33 8.790 9.207 4.810 1.00 1.35 C ATOM 488 O ILE A 33 8.406 9.594 3.706 1.00 45.32 O ATOM 489 CB ILE A 33 7.722 10.628 6.563 1.00 60.14 C ATOM 490 CG1 ILE A 33 7.930 11.818 7.502 1.00 64.32 C ATOM 491 CG2 ILE A 33 7.089 9.462 7.308 1.00 44.21 C ATOM 492 CD1 ILE A 33 6.654 12.308 8.148 1.00 13.11 C ATOM 0 H ILE A 33 9.292 11.967 4.831 1.00 75.33 H new ATOM 0 HA ILE A 33 9.674 9.721 6.700 1.00 61.31 H new ATOM 0 HB ILE A 33 7.046 10.934 5.765 1.00 60.14 H new ATOM 0 HG12 ILE A 33 8.637 11.536 8.282 1.00 64.32 H new ATOM 0 HG13 ILE A 33 8.382 12.637 6.943 1.00 64.32 H new ATOM 0 HG21 ILE A 33 6.143 9.780 7.745 1.00 44.21 H new ATOM 0 HG22 ILE A 33 6.910 8.641 6.614 1.00 44.21 H new ATOM 0 HG23 ILE A 33 7.760 9.128 8.099 1.00 44.21 H new ATOM 0 HD11 ILE A 33 6.877 13.152 8.800 1.00 13.11 H new ATOM 0 HD12 ILE A 33 5.952 12.622 7.375 1.00 13.11 H new ATOM 0 HD13 ILE A 33 6.211 11.503 8.735 1.00 13.11 H new ATOM 504 N LEU A 34 8.989 7.926 5.098 1.00 23.13 N ATOM 505 CA LEU A 34 8.764 6.876 4.111 1.00 74.11 C ATOM 506 C LEU A 34 7.624 5.958 4.543 1.00 43.24 C ATOM 507 O LEU A 34 7.118 6.064 5.659 1.00 15.54 O ATOM 508 CB LEU A 34 10.041 6.060 3.904 1.00 32.34 C ATOM 509 CG LEU A 34 11.330 6.863 3.730 1.00 0.32 C ATOM 510 CD1 LEU A 34 12.081 6.960 5.049 1.00 11.32 C ATOM 511 CD2 LEU A 34 12.209 6.235 2.659 1.00 43.12 C ATOM 0 H LEU A 34 9.306 7.589 6.007 1.00 23.13 H new ATOM 0 HA LEU A 34 8.487 7.350 3.169 1.00 74.11 H new ATOM 0 HB2 LEU A 34 10.164 5.393 4.757 1.00 32.34 H new ATOM 0 HB3 LEU A 34 9.907 5.430 3.024 1.00 32.34 H new ATOM 0 HG LEU A 34 11.067 7.871 3.411 1.00 0.32 H new ATOM 0 HD11 LEU A 34 12.996 7.535 4.905 1.00 11.32 H new ATOM 0 HD12 LEU A 34 11.453 7.456 5.790 1.00 11.32 H new ATOM 0 HD13 LEU A 34 12.333 5.959 5.399 1.00 11.32 H new ATOM 0 HD21 LEU A 34 13.122 6.820 2.549 1.00 43.12 H new ATOM 0 HD22 LEU A 34 12.464 5.216 2.949 1.00 43.12 H new ATOM 0 HD23 LEU A 34 11.672 6.219 1.711 1.00 43.12 H new ATOM 523 N SER A 35 7.228 5.056 3.651 1.00 72.22 N ATOM 524 CA SER A 35 6.147 4.120 3.939 1.00 63.01 C ATOM 525 C SER A 35 6.517 3.204 5.102 1.00 43.14 C ATOM 526 O SER A 35 5.661 2.807 5.890 1.00 75.32 O ATOM 527 CB SER A 35 5.824 3.284 2.699 1.00 22.11 C ATOM 528 OG SER A 35 7.008 2.877 2.035 1.00 5.34 O ATOM 0 H SER A 35 7.639 4.953 2.723 1.00 72.22 H new ATOM 0 HA SER A 35 5.265 4.696 4.219 1.00 63.01 H new ATOM 0 HB2 SER A 35 5.246 2.406 2.989 1.00 22.11 H new ATOM 0 HB3 SER A 35 5.202 3.864 2.017 1.00 22.11 H new ATOM 0 HG SER A 35 6.797 2.632 1.110 1.00 5.34 H new ATOM 534 N ASN A 36 7.801 2.873 5.201 1.00 52.42 N ATOM 535 CA ASN A 36 8.286 2.004 6.266 1.00 32.24 C ATOM 536 C ASN A 36 8.313 2.742 7.601 1.00 11.22 C ATOM 537 O ASN A 36 8.379 2.124 8.664 1.00 61.30 O ATOM 538 CB ASN A 36 9.685 1.483 5.931 1.00 74.53 C ATOM 539 CG ASN A 36 10.068 0.276 6.766 1.00 1.42 C ATOM 540 OD1 ASN A 36 10.919 0.366 7.651 1.00 64.40 O ATOM 541 ND2 ASN A 36 9.440 -0.860 6.488 1.00 54.11 N ATOM 0 H ASN A 36 8.524 3.194 4.556 1.00 52.42 H new ATOM 0 HA ASN A 36 7.602 1.160 6.351 1.00 32.24 H new ATOM 0 HB2 ASN A 36 9.728 1.219 4.874 1.00 74.53 H new ATOM 0 HB3 ASN A 36 10.414 2.278 6.091 1.00 74.53 H new ATOM 0 HD21 ASN A 36 9.656 -1.705 7.017 1.00 54.11 H new ATOM 0 HD22 ASN A 36 8.741 -0.888 5.745 1.00 54.11 H new ATOM 548 N HIS A 37 8.261 4.069 7.538 1.00 33.04 N ATOM 549 CA HIS A 37 8.278 4.893 8.742 1.00 31.52 C ATOM 550 C HIS A 37 7.250 4.396 9.755 1.00 41.33 C ATOM 551 O HIS A 37 6.302 3.697 9.399 1.00 22.32 O ATOM 552 CB HIS A 37 7.999 6.354 8.390 1.00 45.02 C ATOM 553 CG HIS A 37 8.518 7.324 9.406 1.00 11.40 C ATOM 554 ND1 HIS A 37 7.874 8.031 10.365 1.00 22.14 N flip ATOM 555 CD2 HIS A 37 9.850 7.664 9.511 1.00 63.43 C flip ATOM 556 CE1 HIS A 37 8.820 8.775 11.026 1.00 31.41 C flip ATOM 557 NE2 HIS A 37 10.004 8.536 10.492 1.00 52.31 N flip ATOM 0 H HIS A 37 8.207 4.596 6.667 1.00 33.04 H new ATOM 0 HA HIS A 37 9.269 4.818 9.190 1.00 31.52 H new ATOM 0 HB2 HIS A 37 8.448 6.578 7.423 1.00 45.02 H new ATOM 0 HB3 HIS A 37 6.923 6.494 8.282 1.00 45.02 H new ATOM 0 HD2 HIS A 37 10.644 7.278 8.889 1.00 63.43 H new ATOM 0 HE1 HIS A 37 8.627 9.447 11.849 1.00 31.41 H new ATOM 0 HE2 HIS A 37 10.887 8.953 10.787 1.00 52.31 H new ATOM 565 N ALA A 38 7.445 4.763 11.017 1.00 25.21 N ATOM 566 CA ALA A 38 6.535 4.356 12.080 1.00 1.03 C ATOM 567 C ALA A 38 5.642 5.514 12.511 1.00 12.32 C ATOM 568 O ALA A 38 5.901 6.678 12.203 1.00 22.24 O ATOM 569 CB ALA A 38 7.318 3.820 13.270 1.00 44.34 C ATOM 0 H ALA A 38 8.225 5.342 11.328 1.00 25.21 H new ATOM 0 HA ALA A 38 5.896 3.563 11.693 1.00 1.03 H new ATOM 0 HB1 ALA A 38 6.625 3.520 14.056 1.00 44.34 H new ATOM 0 HB2 ALA A 38 7.909 2.958 12.959 1.00 44.34 H new ATOM 0 HB3 ALA A 38 7.982 4.597 13.649 1.00 44.34 H new ATOM 575 N PRO A 39 4.563 5.191 13.240 1.00 2.42 N ATOM 576 CA PRO A 39 3.609 6.192 13.729 1.00 64.43 C ATOM 577 C PRO A 39 4.204 7.075 14.820 1.00 11.11 C ATOM 578 O PRO A 39 4.479 6.611 15.928 1.00 52.14 O ATOM 579 CB PRO A 39 2.464 5.345 14.290 1.00 3.34 C ATOM 580 CG PRO A 39 3.095 4.044 14.649 1.00 5.54 C ATOM 581 CD PRO A 39 4.192 3.825 13.644 1.00 30.22 C ATOM 0 HA PRO A 39 3.302 6.881 12.943 1.00 64.43 H new ATOM 0 HB2 PRO A 39 2.011 5.819 15.161 1.00 3.34 H new ATOM 0 HB3 PRO A 39 1.673 5.211 13.552 1.00 3.34 H new ATOM 0 HG2 PRO A 39 3.494 4.070 15.663 1.00 5.54 H new ATOM 0 HG3 PRO A 39 2.366 3.234 14.614 1.00 5.54 H new ATOM 0 HD2 PRO A 39 5.036 3.292 14.081 1.00 30.22 H new ATOM 0 HD3 PRO A 39 3.847 3.235 12.795 1.00 30.22 H new ATOM 589 N LEU A 40 4.400 8.350 14.502 1.00 72.34 N ATOM 590 CA LEU A 40 4.962 9.299 15.456 1.00 13.21 C ATOM 591 C LEU A 40 4.475 10.715 15.166 1.00 43.52 C ATOM 592 O LEU A 40 4.170 11.056 14.022 1.00 13.43 O ATOM 593 CB LEU A 40 6.490 9.253 15.411 1.00 1.44 C ATOM 594 CG LEU A 40 7.218 10.098 16.458 1.00 33.21 C ATOM 595 CD1 LEU A 40 8.188 9.240 17.256 1.00 75.23 C ATOM 596 CD2 LEU A 40 7.949 11.256 15.795 1.00 73.02 C ATOM 0 H LEU A 40 4.178 8.750 13.590 1.00 72.34 H new ATOM 0 HA LEU A 40 4.626 9.016 16.454 1.00 13.21 H new ATOM 0 HB2 LEU A 40 6.806 8.216 15.526 1.00 1.44 H new ATOM 0 HB3 LEU A 40 6.814 9.577 14.422 1.00 1.44 H new ATOM 0 HG LEU A 40 6.477 10.508 17.145 1.00 33.21 H new ATOM 0 HD11 LEU A 40 8.697 9.858 17.996 1.00 75.23 H new ATOM 0 HD12 LEU A 40 7.640 8.446 17.762 1.00 75.23 H new ATOM 0 HD13 LEU A 40 8.924 8.801 16.583 1.00 75.23 H new ATOM 0 HD21 LEU A 40 8.461 11.846 16.555 1.00 73.02 H new ATOM 0 HD22 LEU A 40 8.679 10.867 15.085 1.00 73.02 H new ATOM 0 HD23 LEU A 40 7.232 11.886 15.269 1.00 73.02 H new ATOM 608 N LEU A 41 4.408 11.537 16.207 1.00 12.24 N ATOM 609 CA LEU A 41 3.961 12.918 16.064 1.00 12.55 C ATOM 610 C LEU A 41 5.148 13.859 15.884 1.00 51.11 C ATOM 611 O LEU A 41 6.231 13.620 16.419 1.00 0.11 O ATOM 612 CB LEU A 41 3.143 13.340 17.287 1.00 61.33 C ATOM 613 CG LEU A 41 3.791 13.084 18.648 1.00 34.21 C ATOM 614 CD1 LEU A 41 3.845 14.367 19.463 1.00 71.21 C ATOM 615 CD2 LEU A 41 3.033 12.002 19.404 1.00 65.42 C ATOM 0 H LEU A 41 4.658 11.271 17.160 1.00 12.24 H new ATOM 0 HA LEU A 41 3.333 12.980 15.175 1.00 12.55 H new ATOM 0 HB2 LEU A 41 2.926 14.405 17.205 1.00 61.33 H new ATOM 0 HB3 LEU A 41 2.187 12.817 17.258 1.00 61.33 H new ATOM 0 HG LEU A 41 4.812 12.738 18.484 1.00 34.21 H new ATOM 0 HD11 LEU A 41 4.309 14.166 20.428 1.00 71.21 H new ATOM 0 HD12 LEU A 41 4.431 15.114 18.927 1.00 71.21 H new ATOM 0 HD13 LEU A 41 2.833 14.742 19.618 1.00 71.21 H new ATOM 0 HD21 LEU A 41 3.508 11.833 20.370 1.00 65.42 H new ATOM 0 HD22 LEU A 41 2.002 12.320 19.557 1.00 65.42 H new ATOM 0 HD23 LEU A 41 3.046 11.078 18.826 1.00 65.42 H new ATOM 627 N THR A 42 4.937 14.932 15.127 1.00 32.25 N ATOM 628 CA THR A 42 5.988 15.909 14.877 1.00 4.40 C ATOM 629 C THR A 42 5.411 17.312 14.729 1.00 51.31 C ATOM 630 O THR A 42 4.194 17.493 14.704 1.00 10.44 O ATOM 631 CB THR A 42 6.790 15.560 13.609 1.00 71.21 C ATOM 632 OG1 THR A 42 6.062 14.617 12.814 1.00 64.11 O ATOM 633 CG2 THR A 42 8.150 14.983 13.970 1.00 4.25 C ATOM 0 H THR A 42 4.047 15.146 14.677 1.00 32.25 H new ATOM 0 HA THR A 42 6.655 15.882 15.739 1.00 4.40 H new ATOM 0 HB THR A 42 6.942 16.476 13.038 1.00 71.21 H new ATOM 0 HG1 THR A 42 6.577 14.401 12.009 1.00 64.11 H new ATOM 0 HG21 THR A 42 8.698 14.744 13.058 1.00 4.25 H new ATOM 0 HG22 THR A 42 8.713 15.714 14.551 1.00 4.25 H new ATOM 0 HG23 THR A 42 8.016 14.077 14.560 1.00 4.25 H new ATOM 641 N ALA A 43 6.292 18.302 14.630 1.00 51.43 N ATOM 642 CA ALA A 43 5.869 19.689 14.481 1.00 51.31 C ATOM 643 C ALA A 43 6.582 20.358 13.311 1.00 40.32 C ATOM 644 O ALA A 43 7.728 20.031 13.000 1.00 42.41 O ATOM 645 CB ALA A 43 6.125 20.460 15.768 1.00 73.03 C ATOM 0 H ALA A 43 7.303 18.169 14.650 1.00 51.43 H new ATOM 0 HA ALA A 43 4.799 19.696 14.272 1.00 51.31 H new ATOM 0 HB1 ALA A 43 5.804 21.494 15.642 1.00 73.03 H new ATOM 0 HB2 ALA A 43 5.565 20.003 16.584 1.00 73.03 H new ATOM 0 HB3 ALA A 43 7.190 20.436 16.001 1.00 73.03 H new ATOM 651 N LEU A 44 5.897 21.295 12.665 1.00 43.45 N ATOM 652 CA LEU A 44 6.465 22.011 11.527 1.00 25.30 C ATOM 653 C LEU A 44 6.106 23.492 11.580 1.00 34.04 C ATOM 654 O LEU A 44 5.046 23.865 12.082 1.00 75.24 O ATOM 655 CB LEU A 44 5.968 21.400 10.216 1.00 41.24 C ATOM 656 CG LEU A 44 7.049 20.930 9.241 1.00 1.45 C ATOM 657 CD1 LEU A 44 7.502 19.520 9.586 1.00 74.00 C ATOM 658 CD2 LEU A 44 6.540 20.994 7.809 1.00 42.22 C ATOM 0 H LEU A 44 4.948 21.577 12.909 1.00 43.45 H new ATOM 0 HA LEU A 44 7.550 21.918 11.576 1.00 25.30 H new ATOM 0 HB2 LEU A 44 5.328 20.551 10.454 1.00 41.24 H new ATOM 0 HB3 LEU A 44 5.345 22.136 9.709 1.00 41.24 H new ATOM 0 HG LEU A 44 7.907 21.597 9.330 1.00 1.45 H new ATOM 0 HD11 LEU A 44 8.271 19.202 8.882 1.00 74.00 H new ATOM 0 HD12 LEU A 44 7.908 19.505 10.598 1.00 74.00 H new ATOM 0 HD13 LEU A 44 6.652 18.840 9.526 1.00 74.00 H new ATOM 0 HD21 LEU A 44 7.322 20.656 7.129 1.00 42.22 H new ATOM 0 HD22 LEU A 44 5.666 20.351 7.704 1.00 42.22 H new ATOM 0 HD23 LEU A 44 6.267 22.021 7.566 1.00 42.22 H new ATOM 670 N GLU A 45 6.995 24.331 11.058 1.00 31.02 N ATOM 671 CA GLU A 45 6.769 25.772 11.046 1.00 63.53 C ATOM 672 C GLU A 45 6.330 26.241 9.662 1.00 15.30 C ATOM 673 O GLU A 45 6.213 25.444 8.730 1.00 11.34 O ATOM 674 CB GLU A 45 8.040 26.513 11.468 1.00 35.31 C ATOM 675 CG GLU A 45 8.379 26.349 12.940 1.00 32.01 C ATOM 676 CD GLU A 45 8.991 27.600 13.540 1.00 33.24 C ATOM 677 OE1 GLU A 45 10.192 27.846 13.303 1.00 14.11 O ATOM 678 OE2 GLU A 45 8.268 28.332 14.248 1.00 53.53 O ATOM 0 H GLU A 45 7.877 24.038 10.638 1.00 31.02 H new ATOM 0 HA GLU A 45 5.973 25.996 11.757 1.00 63.53 H new ATOM 0 HB2 GLU A 45 8.876 26.153 10.869 1.00 35.31 H new ATOM 0 HB3 GLU A 45 7.923 27.574 11.247 1.00 35.31 H new ATOM 0 HG2 GLU A 45 7.474 26.091 13.491 1.00 32.01 H new ATOM 0 HG3 GLU A 45 9.073 25.517 13.059 1.00 32.01 H new ATOM 685 N THR A 46 6.086 27.542 9.535 1.00 53.02 N ATOM 686 CA THR A 46 5.657 28.119 8.267 1.00 61.10 C ATOM 687 C THR A 46 6.655 27.810 7.157 1.00 62.10 C ATOM 688 O THR A 46 7.859 27.731 7.396 1.00 63.31 O ATOM 689 CB THR A 46 5.483 29.646 8.375 1.00 72.43 C ATOM 690 OG1 THR A 46 4.554 29.960 9.418 1.00 12.20 O ATOM 691 CG2 THR A 46 4.991 30.228 7.058 1.00 3.43 C ATOM 0 H THR A 46 6.178 28.216 10.295 1.00 53.02 H new ATOM 0 HA THR A 46 4.695 27.667 8.023 1.00 61.10 H new ATOM 0 HB THR A 46 6.453 30.085 8.609 1.00 72.43 H new ATOM 0 HG1 THR A 46 4.450 30.932 9.482 1.00 12.20 H new ATOM 0 HG21 THR A 46 4.875 31.307 7.158 1.00 3.43 H new ATOM 0 HG22 THR A 46 5.714 30.012 6.272 1.00 3.43 H new ATOM 0 HG23 THR A 46 4.030 29.783 6.800 1.00 3.43 H new ATOM 699 N GLY A 47 6.146 27.637 5.941 1.00 62.32 N ATOM 700 CA GLY A 47 7.008 27.339 4.812 1.00 73.24 C ATOM 701 C GLY A 47 6.274 26.622 3.696 1.00 52.14 C ATOM 702 O GLY A 47 5.104 26.902 3.432 1.00 22.30 O ATOM 0 H GLY A 47 5.153 27.698 5.718 1.00 62.32 H new ATOM 0 HA2 GLY A 47 7.431 28.267 4.427 1.00 73.24 H new ATOM 0 HA3 GLY A 47 7.842 26.723 5.148 1.00 73.24 H new ATOM 706 N VAL A 48 6.962 25.696 3.036 1.00 21.42 N ATOM 707 CA VAL A 48 6.369 24.937 1.942 1.00 74.13 C ATOM 708 C VAL A 48 6.680 23.450 2.071 1.00 12.15 C ATOM 709 O VAL A 48 7.698 23.067 2.647 1.00 34.22 O ATOM 710 CB VAL A 48 6.871 25.438 0.574 1.00 31.15 C ATOM 711 CG1 VAL A 48 6.401 26.862 0.322 1.00 52.30 C ATOM 712 CG2 VAL A 48 8.387 25.347 0.499 1.00 65.25 C ATOM 0 H VAL A 48 7.931 25.453 3.240 1.00 21.42 H new ATOM 0 HA VAL A 48 5.291 25.086 2.003 1.00 74.13 H new ATOM 0 HB VAL A 48 6.452 24.800 -0.204 1.00 31.15 H new ATOM 0 HG11 VAL A 48 6.765 27.199 -0.649 1.00 52.30 H new ATOM 0 HG12 VAL A 48 5.311 26.893 0.331 1.00 52.30 H new ATOM 0 HG13 VAL A 48 6.789 27.517 1.102 1.00 52.30 H new ATOM 0 HG21 VAL A 48 8.725 25.705 -0.474 1.00 65.25 H new ATOM 0 HG22 VAL A 48 8.828 25.961 1.285 1.00 65.25 H new ATOM 0 HG23 VAL A 48 8.696 24.310 0.632 1.00 65.25 H new ATOM 722 N MET A 49 5.796 22.617 1.532 1.00 62.02 N ATOM 723 CA MET A 49 5.978 21.171 1.586 1.00 52.01 C ATOM 724 C MET A 49 6.295 20.611 0.203 1.00 25.11 C ATOM 725 O MET A 49 5.843 21.142 -0.811 1.00 55.00 O ATOM 726 CB MET A 49 4.723 20.498 2.145 1.00 14.53 C ATOM 727 CG MET A 49 4.766 18.980 2.079 1.00 12.51 C ATOM 728 SD MET A 49 3.237 18.216 2.653 1.00 13.51 S ATOM 729 CE MET A 49 2.167 18.500 1.245 1.00 62.55 C ATOM 0 H MET A 49 4.947 22.918 1.053 1.00 62.02 H new ATOM 0 HA MET A 49 6.820 20.960 2.246 1.00 52.01 H new ATOM 0 HB2 MET A 49 4.588 20.805 3.182 1.00 14.53 H new ATOM 0 HB3 MET A 49 3.853 20.853 1.592 1.00 14.53 H new ATOM 0 HG2 MET A 49 4.959 18.670 1.052 1.00 12.51 H new ATOM 0 HG3 MET A 49 5.598 18.617 2.683 1.00 12.51 H new ATOM 0 HE1 MET A 49 1.258 19.004 1.574 1.00 62.55 H new ATOM 0 HE2 MET A 49 2.684 19.123 0.515 1.00 62.55 H new ATOM 0 HE3 MET A 49 1.907 17.546 0.787 1.00 62.55 H new ATOM 739 N ARG A 50 7.076 19.536 0.170 1.00 45.10 N ATOM 740 CA ARG A 50 7.456 18.906 -1.089 1.00 35.43 C ATOM 741 C ARG A 50 6.922 17.478 -1.164 1.00 24.22 C ATOM 742 O ARG A 50 7.283 16.626 -0.352 1.00 23.41 O ATOM 743 CB ARG A 50 8.977 18.902 -1.244 1.00 24.12 C ATOM 744 CG ARG A 50 9.474 19.762 -2.394 1.00 45.21 C ATOM 745 CD ARG A 50 10.988 19.698 -2.524 1.00 62.12 C ATOM 746 NE ARG A 50 11.569 21.007 -2.810 1.00 61.14 N ATOM 747 CZ ARG A 50 12.868 21.208 -3.004 1.00 53.20 C ATOM 748 NH1 ARG A 50 13.716 20.191 -2.943 1.00 0.13 N ATOM 749 NH2 ARG A 50 13.320 22.429 -3.260 1.00 42.11 N ATOM 0 H ARG A 50 7.458 19.083 1.000 1.00 45.10 H new ATOM 0 HA ARG A 50 7.017 19.484 -1.903 1.00 35.43 H new ATOM 0 HB2 ARG A 50 9.429 19.254 -0.317 1.00 24.12 H new ATOM 0 HB3 ARG A 50 9.316 17.877 -1.395 1.00 24.12 H new ATOM 0 HG2 ARG A 50 9.014 19.429 -3.324 1.00 45.21 H new ATOM 0 HG3 ARG A 50 9.165 20.795 -2.237 1.00 45.21 H new ATOM 0 HD2 ARG A 50 11.415 19.306 -1.601 1.00 62.12 H new ATOM 0 HD3 ARG A 50 11.254 19.002 -3.319 1.00 62.12 H new ATOM 0 HE ARG A 50 10.943 21.811 -2.864 1.00 61.14 H new ATOM 0 HH11 ARG A 50 13.372 19.251 -2.747 1.00 0.13 H new ATOM 0 HH12 ARG A 50 14.713 20.348 -3.092 1.00 0.13 H new ATOM 0 HH21 ARG A 50 12.670 23.214 -3.308 1.00 42.11 H new ATOM 0 HH22 ARG A 50 14.317 22.583 -3.409 1.00 42.11 H new ATOM 763 N VAL A 51 6.061 17.224 -2.144 1.00 12.03 N ATOM 764 CA VAL A 51 5.478 15.900 -2.326 1.00 21.15 C ATOM 765 C VAL A 51 6.325 15.052 -3.267 1.00 70.54 C ATOM 766 O VAL A 51 6.736 15.511 -4.333 1.00 4.32 O ATOM 767 CB VAL A 51 4.045 15.989 -2.882 1.00 15.15 C ATOM 768 CG1 VAL A 51 3.377 14.622 -2.860 1.00 2.43 C ATOM 769 CG2 VAL A 51 3.229 17.002 -2.092 1.00 44.30 C ATOM 0 H VAL A 51 5.752 17.918 -2.824 1.00 12.03 H new ATOM 0 HA VAL A 51 5.449 15.429 -1.343 1.00 21.15 H new ATOM 0 HB VAL A 51 4.096 16.325 -3.918 1.00 15.15 H new ATOM 0 HG11 VAL A 51 2.365 14.705 -3.257 1.00 2.43 H new ATOM 0 HG12 VAL A 51 3.951 13.927 -3.473 1.00 2.43 H new ATOM 0 HG13 VAL A 51 3.336 14.254 -1.835 1.00 2.43 H new ATOM 0 HG21 VAL A 51 2.219 17.052 -2.499 1.00 44.30 H new ATOM 0 HG22 VAL A 51 3.185 16.697 -1.046 1.00 44.30 H new ATOM 0 HG23 VAL A 51 3.698 17.983 -2.164 1.00 44.30 H new ATOM 779 N ARG A 52 6.581 13.810 -2.868 1.00 4.33 N ATOM 780 CA ARG A 52 7.380 12.897 -3.676 1.00 22.00 C ATOM 781 C ARG A 52 6.520 11.763 -4.226 1.00 13.13 C ATOM 782 O ARG A 52 6.287 10.763 -3.547 1.00 45.10 O ATOM 783 CB ARG A 52 8.531 12.323 -2.848 1.00 21.31 C ATOM 784 CG ARG A 52 9.899 12.537 -3.475 1.00 71.01 C ATOM 785 CD ARG A 52 10.853 11.404 -3.132 1.00 31.32 C ATOM 786 NE ARG A 52 11.618 10.961 -4.295 1.00 35.34 N ATOM 787 CZ ARG A 52 12.402 9.889 -4.293 1.00 60.33 C ATOM 788 NH1 ARG A 52 12.524 9.154 -3.197 1.00 22.24 N ATOM 789 NH2 ARG A 52 13.066 9.550 -5.391 1.00 72.41 N ATOM 0 H ARG A 52 6.246 13.413 -1.990 1.00 4.33 H new ATOM 0 HA ARG A 52 7.790 13.459 -4.515 1.00 22.00 H new ATOM 0 HB2 ARG A 52 8.519 12.780 -1.859 1.00 21.31 H new ATOM 0 HB3 ARG A 52 8.368 11.254 -2.707 1.00 21.31 H new ATOM 0 HG2 ARG A 52 9.796 12.612 -4.558 1.00 71.01 H new ATOM 0 HG3 ARG A 52 10.316 13.482 -3.128 1.00 71.01 H new ATOM 0 HD2 ARG A 52 11.539 11.732 -2.351 1.00 31.32 H new ATOM 0 HD3 ARG A 52 10.288 10.564 -2.729 1.00 31.32 H new ATOM 0 HE ARG A 52 11.546 11.504 -5.155 1.00 35.34 H new ATOM 0 HH11 ARG A 52 12.015 9.411 -2.351 1.00 22.24 H new ATOM 0 HH12 ARG A 52 13.127 8.331 -3.199 1.00 22.24 H new ATOM 0 HH21 ARG A 52 12.974 10.113 -6.237 1.00 72.41 H new ATOM 0 HH22 ARG A 52 13.668 8.727 -5.389 1.00 72.41 H new ATOM 803 N GLN A 53 6.050 11.928 -5.458 1.00 71.41 N ATOM 804 CA GLN A 53 5.214 10.918 -6.098 1.00 3.34 C ATOM 805 C GLN A 53 6.070 9.866 -6.795 1.00 74.41 C ATOM 806 O GLN A 53 5.551 8.988 -7.485 1.00 31.42 O ATOM 807 CB GLN A 53 4.268 11.573 -7.105 1.00 40.14 C ATOM 808 CG GLN A 53 3.203 12.446 -6.462 1.00 10.14 C ATOM 809 CD GLN A 53 1.985 12.628 -7.345 1.00 72.04 C ATOM 810 OE1 GLN A 53 1.652 11.757 -8.150 1.00 14.31 O ATOM 811 NE2 GLN A 53 1.312 13.764 -7.200 1.00 61.43 N ATOM 0 H GLN A 53 6.233 12.750 -6.033 1.00 71.41 H new ATOM 0 HA GLN A 53 4.625 10.426 -5.324 1.00 3.34 H new ATOM 0 HB2 GLN A 53 4.852 12.178 -7.798 1.00 40.14 H new ATOM 0 HB3 GLN A 53 3.781 10.795 -7.693 1.00 40.14 H new ATOM 0 HG2 GLN A 53 2.897 12.001 -5.515 1.00 10.14 H new ATOM 0 HG3 GLN A 53 3.629 13.422 -6.232 1.00 10.14 H new ATOM 0 HE21 GLN A 53 1.624 14.458 -6.521 1.00 61.43 H new ATOM 0 HE22 GLN A 53 0.484 13.942 -7.768 1.00 61.43 H new ATOM 820 N ASP A 54 7.382 9.960 -6.611 1.00 52.32 N ATOM 821 CA ASP A 54 8.310 9.016 -7.222 1.00 74.42 C ATOM 822 C ASP A 54 8.295 9.146 -8.742 1.00 61.41 C ATOM 823 O ASP A 54 8.794 8.274 -9.454 1.00 75.23 O ATOM 824 CB ASP A 54 7.954 7.584 -6.817 1.00 41.20 C ATOM 825 CG ASP A 54 9.182 6.732 -6.565 1.00 23.10 C ATOM 826 OD1 ASP A 54 9.774 6.854 -5.472 1.00 63.44 O ATOM 827 OD2 ASP A 54 9.552 5.944 -7.461 1.00 20.23 O ATOM 0 H ASP A 54 7.827 10.681 -6.043 1.00 52.32 H new ATOM 0 HA ASP A 54 9.313 9.248 -6.865 1.00 74.42 H new ATOM 0 HB2 ASP A 54 7.340 7.606 -5.917 1.00 41.20 H new ATOM 0 HB3 ASP A 54 7.353 7.126 -7.602 1.00 41.20 H new ATOM 832 N ARG A 55 7.720 10.239 -9.232 1.00 32.11 N ATOM 833 CA ARG A 55 7.638 10.482 -10.667 1.00 63.21 C ATOM 834 C ARG A 55 6.935 11.805 -10.956 1.00 4.14 C ATOM 835 O ARG A 55 7.284 12.510 -11.902 1.00 1.11 O ATOM 836 CB ARG A 55 6.896 9.337 -11.358 1.00 70.53 C ATOM 837 CG ARG A 55 5.610 8.932 -10.656 1.00 3.23 C ATOM 838 CD ARG A 55 4.460 8.786 -11.640 1.00 21.44 C ATOM 839 NE ARG A 55 3.205 8.456 -10.969 1.00 61.14 N ATOM 840 CZ ARG A 55 2.038 8.367 -11.597 1.00 60.44 C ATOM 841 NH1 ARG A 55 1.966 8.581 -12.904 1.00 23.21 N ATOM 842 NH2 ARG A 55 0.939 8.062 -10.918 1.00 65.14 N ATOM 0 H ARG A 55 7.304 10.971 -8.656 1.00 32.11 H new ATOM 0 HA ARG A 55 8.654 10.537 -11.059 1.00 63.21 H new ATOM 0 HB2 ARG A 55 6.664 9.631 -12.382 1.00 70.53 H new ATOM 0 HB3 ARG A 55 7.556 8.471 -11.417 1.00 70.53 H new ATOM 0 HG2 ARG A 55 5.762 7.989 -10.131 1.00 3.23 H new ATOM 0 HG3 ARG A 55 5.354 9.678 -9.904 1.00 3.23 H new ATOM 0 HD2 ARG A 55 4.340 9.715 -12.198 1.00 21.44 H new ATOM 0 HD3 ARG A 55 4.699 8.008 -12.365 1.00 21.44 H new ATOM 0 HE ARG A 55 3.226 8.285 -9.964 1.00 61.14 H new ATOM 0 HH11 ARG A 55 2.808 8.815 -13.430 1.00 23.21 H new ATOM 0 HH12 ARG A 55 1.068 8.512 -13.383 1.00 23.21 H new ATOM 0 HH21 ARG A 55 0.990 7.896 -9.913 1.00 65.14 H new ATOM 0 HH22 ARG A 55 0.043 7.994 -11.401 1.00 65.14 H new ATOM 856 N GLU A 56 5.944 12.134 -10.133 1.00 41.43 N ATOM 857 CA GLU A 56 5.192 13.372 -10.302 1.00 0.22 C ATOM 858 C GLU A 56 5.338 14.269 -9.076 1.00 4.01 C ATOM 859 O GLU A 56 4.417 14.391 -8.269 1.00 75.42 O ATOM 860 CB GLU A 56 3.713 13.067 -10.550 1.00 64.23 C ATOM 861 CG GLU A 56 3.430 12.521 -11.940 1.00 13.13 C ATOM 862 CD GLU A 56 3.331 13.614 -12.987 1.00 33.35 C ATOM 863 OE1 GLU A 56 3.776 14.746 -12.707 1.00 14.32 O ATOM 864 OE2 GLU A 56 2.808 13.335 -14.086 1.00 42.12 O ATOM 0 H GLU A 56 5.644 11.562 -9.344 1.00 41.43 H new ATOM 0 HA GLU A 56 5.597 13.898 -11.166 1.00 0.22 H new ATOM 0 HB2 GLU A 56 3.370 12.346 -9.808 1.00 64.23 H new ATOM 0 HB3 GLU A 56 3.133 13.978 -10.401 1.00 64.23 H new ATOM 0 HG2 GLU A 56 4.220 11.825 -12.221 1.00 13.13 H new ATOM 0 HG3 GLU A 56 2.498 11.955 -11.921 1.00 13.13 H new ATOM 871 N TRP A 57 6.503 14.894 -8.943 1.00 72.33 N ATOM 872 CA TRP A 57 6.771 15.779 -7.816 1.00 11.14 C ATOM 873 C TRP A 57 5.818 16.969 -7.819 1.00 40.35 C ATOM 874 O TRP A 57 5.433 17.466 -8.878 1.00 63.54 O ATOM 875 CB TRP A 57 8.219 16.269 -7.859 1.00 1.24 C ATOM 876 CG TRP A 57 8.476 17.267 -8.947 1.00 3.44 C ATOM 877 CD1 TRP A 57 8.950 17.009 -10.201 1.00 63.40 C ATOM 878 CD2 TRP A 57 8.275 18.683 -8.876 1.00 4.23 C ATOM 879 NE1 TRP A 57 9.056 18.178 -10.914 1.00 41.32 N ATOM 880 CE2 TRP A 57 8.647 19.220 -10.124 1.00 23.21 C ATOM 881 CE3 TRP A 57 7.816 19.550 -7.880 1.00 75.53 C ATOM 882 CZ2 TRP A 57 8.574 20.583 -10.400 1.00 30.54 C ATOM 883 CZ3 TRP A 57 7.744 20.902 -8.155 1.00 74.24 C ATOM 884 CH2 TRP A 57 8.120 21.408 -9.407 1.00 23.33 C ATOM 0 H TRP A 57 7.276 14.804 -9.602 1.00 72.33 H new ATOM 0 HA TRP A 57 6.613 15.214 -6.897 1.00 11.14 H new ATOM 0 HB2 TRP A 57 8.472 16.717 -6.898 1.00 1.24 H new ATOM 0 HB3 TRP A 57 8.881 15.414 -7.997 1.00 1.24 H new ATOM 0 HD1 TRP A 57 9.204 16.029 -10.577 1.00 63.40 H new ATOM 0 HE1 TRP A 57 9.386 18.258 -11.876 1.00 41.32 H new ATOM 0 HE3 TRP A 57 7.523 19.170 -6.913 1.00 75.53 H new ATOM 0 HZ2 TRP A 57 8.865 20.975 -11.363 1.00 30.54 H new ATOM 0 HZ3 TRP A 57 7.392 21.581 -7.392 1.00 74.24 H new ATOM 0 HH2 TRP A 57 8.050 22.470 -9.592 1.00 23.33 H new ATOM 895 N VAL A 58 5.440 17.424 -6.629 1.00 25.33 N ATOM 896 CA VAL A 58 4.533 18.557 -6.495 1.00 42.35 C ATOM 897 C VAL A 58 4.888 19.406 -5.280 1.00 25.54 C ATOM 898 O VAL A 58 5.410 18.898 -4.287 1.00 41.31 O ATOM 899 CB VAL A 58 3.070 18.093 -6.374 1.00 55.42 C ATOM 900 CG1 VAL A 58 2.125 19.284 -6.436 1.00 0.23 C ATOM 901 CG2 VAL A 58 2.739 17.084 -7.463 1.00 21.41 C ATOM 0 H VAL A 58 5.749 17.024 -5.743 1.00 25.33 H new ATOM 0 HA VAL A 58 4.642 19.158 -7.398 1.00 42.35 H new ATOM 0 HB VAL A 58 2.941 17.606 -5.407 1.00 55.42 H new ATOM 0 HG11 VAL A 58 1.096 18.937 -6.349 1.00 0.23 H new ATOM 0 HG12 VAL A 58 2.348 19.968 -5.617 1.00 0.23 H new ATOM 0 HG13 VAL A 58 2.254 19.802 -7.386 1.00 0.23 H new ATOM 0 HG21 VAL A 58 1.701 16.767 -7.362 1.00 21.41 H new ATOM 0 HG22 VAL A 58 2.885 17.543 -8.441 1.00 21.41 H new ATOM 0 HG23 VAL A 58 3.394 16.218 -7.368 1.00 21.41 H new ATOM 911 N ALA A 59 4.602 20.700 -5.364 1.00 53.52 N ATOM 912 CA ALA A 59 4.888 21.619 -4.270 1.00 5.53 C ATOM 913 C ALA A 59 3.635 22.377 -3.846 1.00 53.12 C ATOM 914 O ALA A 59 2.804 22.737 -4.681 1.00 61.11 O ATOM 915 CB ALA A 59 5.985 22.594 -4.672 1.00 65.14 C ATOM 0 H ALA A 59 4.172 21.136 -6.179 1.00 53.52 H new ATOM 0 HA ALA A 59 5.232 21.033 -3.418 1.00 5.53 H new ATOM 0 HB1 ALA A 59 6.188 23.274 -3.845 1.00 65.14 H new ATOM 0 HB2 ALA A 59 6.891 22.041 -4.918 1.00 65.14 H new ATOM 0 HB3 ALA A 59 5.662 23.166 -5.542 1.00 65.14 H new ATOM 921 N ILE A 60 3.504 22.615 -2.546 1.00 0.24 N ATOM 922 CA ILE A 60 2.351 23.330 -2.013 1.00 2.45 C ATOM 923 C ILE A 60 2.752 24.226 -0.845 1.00 34.43 C ATOM 924 O ILE A 60 3.649 23.891 -0.072 1.00 34.43 O ATOM 925 CB ILE A 60 1.252 22.358 -1.546 1.00 12.00 C ATOM 926 CG1 ILE A 60 0.876 21.398 -2.677 1.00 11.32 C ATOM 927 CG2 ILE A 60 0.030 23.129 -1.070 1.00 53.22 C ATOM 928 CD1 ILE A 60 -0.192 20.399 -2.291 1.00 54.24 C ATOM 0 H ILE A 60 4.182 22.323 -1.842 1.00 0.24 H new ATOM 0 HA ILE A 60 1.959 23.946 -2.823 1.00 2.45 H new ATOM 0 HB ILE A 60 1.636 21.773 -0.710 1.00 12.00 H new ATOM 0 HG12 ILE A 60 0.529 21.976 -3.533 1.00 11.32 H new ATOM 0 HG13 ILE A 60 1.768 20.859 -2.997 1.00 11.32 H new ATOM 0 HG21 ILE A 60 -0.738 22.428 -0.743 1.00 53.22 H new ATOM 0 HG22 ILE A 60 0.309 23.775 -0.238 1.00 53.22 H new ATOM 0 HG23 ILE A 60 -0.358 23.737 -1.887 1.00 53.22 H new ATOM 0 HD11 ILE A 60 -0.408 19.751 -3.141 1.00 54.24 H new ATOM 0 HD12 ILE A 60 0.160 19.795 -1.455 1.00 54.24 H new ATOM 0 HD13 ILE A 60 -1.098 20.930 -1.999 1.00 54.24 H new ATOM 940 N ALA A 61 2.079 25.365 -0.722 1.00 14.01 N ATOM 941 CA ALA A 61 2.361 26.307 0.354 1.00 63.00 C ATOM 942 C ALA A 61 1.528 25.993 1.592 1.00 61.42 C ATOM 943 O ALA A 61 0.441 25.421 1.493 1.00 44.12 O ATOM 944 CB ALA A 61 2.102 27.732 -0.111 1.00 2.41 C ATOM 0 H ALA A 61 1.334 25.658 -1.354 1.00 14.01 H new ATOM 0 HA ALA A 61 3.413 26.209 0.622 1.00 63.00 H new ATOM 0 HB1 ALA A 61 2.317 28.425 0.703 1.00 2.41 H new ATOM 0 HB2 ALA A 61 2.745 27.960 -0.961 1.00 2.41 H new ATOM 0 HB3 ALA A 61 1.058 27.834 -0.408 1.00 2.41 H new ATOM 950 N LEU A 62 2.044 26.368 2.757 1.00 14.31 N ATOM 951 CA LEU A 62 1.347 26.126 4.016 1.00 71.33 C ATOM 952 C LEU A 62 2.059 26.816 5.174 1.00 4.13 C ATOM 953 O LEU A 62 3.283 26.753 5.289 1.00 0.40 O ATOM 954 CB LEU A 62 1.248 24.623 4.285 1.00 2.23 C ATOM 955 CG LEU A 62 2.466 23.789 3.889 1.00 65.45 C ATOM 956 CD1 LEU A 62 2.906 22.903 5.044 1.00 5.42 C ATOM 957 CD2 LEU A 62 2.159 22.948 2.658 1.00 43.34 C ATOM 0 H LEU A 62 2.942 26.841 2.856 1.00 14.31 H new ATOM 0 HA LEU A 62 0.343 26.541 3.933 1.00 71.33 H new ATOM 0 HB2 LEU A 62 1.062 24.476 5.349 1.00 2.23 H new ATOM 0 HB3 LEU A 62 0.379 24.236 3.753 1.00 2.23 H new ATOM 0 HG LEU A 62 3.283 24.468 3.647 1.00 65.45 H new ATOM 0 HD11 LEU A 62 3.774 22.317 4.743 1.00 5.42 H new ATOM 0 HD12 LEU A 62 3.167 23.525 5.900 1.00 5.42 H new ATOM 0 HD13 LEU A 62 2.092 22.231 5.318 1.00 5.42 H new ATOM 0 HD21 LEU A 62 3.037 22.361 2.390 1.00 43.34 H new ATOM 0 HD22 LEU A 62 1.326 22.278 2.873 1.00 43.34 H new ATOM 0 HD23 LEU A 62 1.893 23.602 1.828 1.00 43.34 H new ATOM 969 N MET A 63 1.285 27.472 6.032 1.00 53.53 N ATOM 970 CA MET A 63 1.842 28.172 7.184 1.00 70.32 C ATOM 971 C MET A 63 2.134 27.198 8.322 1.00 52.45 C ATOM 972 O MET A 63 2.084 25.983 8.139 1.00 32.34 O ATOM 973 CB MET A 63 0.879 29.260 7.662 1.00 35.52 C ATOM 974 CG MET A 63 1.571 30.555 8.054 1.00 54.04 C ATOM 975 SD MET A 63 1.464 31.815 6.769 1.00 53.44 S ATOM 976 CE MET A 63 2.307 33.181 7.563 1.00 44.12 C ATOM 0 H MET A 63 0.270 27.534 5.952 1.00 53.53 H new ATOM 0 HA MET A 63 2.779 28.637 6.877 1.00 70.32 H new ATOM 0 HB2 MET A 63 0.158 29.468 6.872 1.00 35.52 H new ATOM 0 HB3 MET A 63 0.316 28.885 8.517 1.00 35.52 H new ATOM 0 HG2 MET A 63 1.124 30.938 8.971 1.00 54.04 H new ATOM 0 HG3 MET A 63 2.619 30.351 8.271 1.00 54.04 H new ATOM 0 HE1 MET A 63 2.775 33.809 6.805 1.00 44.12 H new ATOM 0 HE2 MET A 63 1.588 33.772 8.130 1.00 44.12 H new ATOM 0 HE3 MET A 63 3.071 32.794 8.237 1.00 44.12 H new ATOM 986 N GLY A 64 2.439 27.742 9.496 1.00 21.10 N ATOM 987 CA GLY A 64 2.735 26.907 10.645 1.00 32.34 C ATOM 988 C GLY A 64 1.656 25.873 10.904 1.00 3.52 C ATOM 989 O GLY A 64 0.524 26.020 10.447 1.00 52.15 O ATOM 0 H GLY A 64 2.486 28.746 9.672 1.00 21.10 H new ATOM 0 HA2 GLY A 64 3.688 26.402 10.487 1.00 32.34 H new ATOM 0 HA3 GLY A 64 2.850 27.536 11.528 1.00 32.34 H new ATOM 993 N GLY A 65 2.009 24.823 11.640 1.00 51.34 N ATOM 994 CA GLY A 65 1.052 23.776 11.944 1.00 33.10 C ATOM 995 C GLY A 65 1.710 22.540 12.524 1.00 71.54 C ATOM 996 O GLY A 65 2.922 22.516 12.740 1.00 13.24 O ATOM 0 H GLY A 65 2.940 24.679 12.031 1.00 51.34 H new ATOM 0 HA2 GLY A 65 0.314 24.156 12.650 1.00 33.10 H new ATOM 0 HA3 GLY A 65 0.514 23.505 11.036 1.00 33.10 H new ATOM 1000 N PHE A 66 0.910 21.509 12.777 1.00 1.02 N ATOM 1001 CA PHE A 66 1.422 20.264 13.338 1.00 12.01 C ATOM 1002 C PHE A 66 1.302 19.124 12.331 1.00 44.12 C ATOM 1003 O PHE A 66 0.365 19.080 11.535 1.00 14.32 O ATOM 1004 CB PHE A 66 0.665 19.908 14.620 1.00 43.53 C ATOM 1005 CG PHE A 66 1.127 20.681 15.822 1.00 14.51 C ATOM 1006 CD1 PHE A 66 2.277 20.312 16.500 1.00 31.13 C ATOM 1007 CD2 PHE A 66 0.410 21.777 16.274 1.00 15.44 C ATOM 1008 CE1 PHE A 66 2.704 21.021 17.607 1.00 44.31 C ATOM 1009 CE2 PHE A 66 0.832 22.491 17.380 1.00 24.21 C ATOM 1010 CZ PHE A 66 1.980 22.112 18.048 1.00 64.41 C ATOM 0 H PHE A 66 -0.095 21.511 12.602 1.00 1.02 H new ATOM 0 HA PHE A 66 2.476 20.408 13.574 1.00 12.01 H new ATOM 0 HB2 PHE A 66 -0.399 20.091 14.467 1.00 43.53 H new ATOM 0 HB3 PHE A 66 0.780 18.842 14.817 1.00 43.53 H new ATOM 0 HD1 PHE A 66 2.847 19.460 16.160 1.00 31.13 H new ATOM 0 HD2 PHE A 66 -0.489 22.077 15.756 1.00 15.44 H new ATOM 0 HE1 PHE A 66 3.603 20.723 18.127 1.00 44.31 H new ATOM 0 HE2 PHE A 66 0.265 23.344 17.721 1.00 24.21 H new ATOM 0 HZ PHE A 66 2.311 22.667 18.913 1.00 64.41 H new ATOM 1020 N ALA A 67 2.260 18.204 12.372 1.00 62.34 N ATOM 1021 CA ALA A 67 2.262 17.063 11.464 1.00 24.24 C ATOM 1022 C ALA A 67 2.358 15.750 12.234 1.00 71.32 C ATOM 1023 O ALA A 67 3.103 15.644 13.207 1.00 30.43 O ATOM 1024 CB ALA A 67 3.410 17.180 10.472 1.00 31.11 C ATOM 0 H ALA A 67 3.044 18.226 13.024 1.00 62.34 H new ATOM 0 HA ALA A 67 1.320 17.065 10.915 1.00 24.24 H new ATOM 0 HB1 ALA A 67 3.399 16.322 9.800 1.00 31.11 H new ATOM 0 HB2 ALA A 67 3.298 18.096 9.892 1.00 31.11 H new ATOM 0 HB3 ALA A 67 4.356 17.206 11.012 1.00 31.11 H new ATOM 1030 N GLU A 68 1.598 14.753 11.791 1.00 61.12 N ATOM 1031 CA GLU A 68 1.597 13.447 12.440 1.00 1.21 C ATOM 1032 C GLU A 68 1.447 12.329 11.413 1.00 73.21 C ATOM 1033 O GLU A 68 0.440 12.248 10.709 1.00 14.13 O ATOM 1034 CB GLU A 68 0.467 13.365 13.469 1.00 42.34 C ATOM 1035 CG GLU A 68 0.818 12.538 14.694 1.00 71.45 C ATOM 1036 CD GLU A 68 -0.340 11.683 15.172 1.00 52.53 C ATOM 1037 OE1 GLU A 68 -0.843 10.865 14.374 1.00 33.12 O ATOM 1038 OE2 GLU A 68 -0.743 11.834 16.344 1.00 11.12 O ATOM 0 H GLU A 68 0.976 14.825 10.986 1.00 61.12 H new ATOM 0 HA GLU A 68 2.552 13.322 12.950 1.00 1.21 H new ATOM 0 HB2 GLU A 68 0.202 14.374 13.786 1.00 42.34 H new ATOM 0 HB3 GLU A 68 -0.416 12.938 12.993 1.00 42.34 H new ATOM 0 HG2 GLU A 68 1.668 11.896 14.463 1.00 71.45 H new ATOM 0 HG3 GLU A 68 1.131 13.203 15.499 1.00 71.45 H new ATOM 1045 N VAL A 69 2.456 11.468 11.332 1.00 21.31 N ATOM 1046 CA VAL A 69 2.437 10.353 10.392 1.00 2.40 C ATOM 1047 C VAL A 69 2.204 9.030 11.113 1.00 53.44 C ATOM 1048 O VAL A 69 2.606 8.860 12.263 1.00 51.01 O ATOM 1049 CB VAL A 69 3.754 10.267 9.597 1.00 13.23 C ATOM 1050 CG1 VAL A 69 4.876 9.742 10.479 1.00 64.21 C ATOM 1051 CG2 VAL A 69 3.576 9.390 8.367 1.00 42.52 C ATOM 0 H VAL A 69 3.297 11.521 11.906 1.00 21.31 H new ATOM 0 HA VAL A 69 1.615 10.536 9.700 1.00 2.40 H new ATOM 0 HB VAL A 69 4.025 11.269 9.264 1.00 13.23 H new ATOM 0 HG11 VAL A 69 5.798 9.688 9.901 1.00 64.21 H new ATOM 0 HG12 VAL A 69 5.017 10.413 11.326 1.00 64.21 H new ATOM 0 HG13 VAL A 69 4.617 8.748 10.843 1.00 64.21 H new ATOM 0 HG21 VAL A 69 4.516 9.340 7.817 1.00 42.52 H new ATOM 0 HG22 VAL A 69 3.282 8.387 8.675 1.00 42.52 H new ATOM 0 HG23 VAL A 69 2.803 9.814 7.727 1.00 42.52 H new ATOM 1061 N GLU A 70 1.551 8.097 10.427 1.00 23.43 N ATOM 1062 CA GLU A 70 1.264 6.788 11.003 1.00 1.12 C ATOM 1063 C GLU A 70 0.673 5.850 9.955 1.00 55.21 C ATOM 1064 O GLU A 70 -0.369 6.138 9.367 1.00 61.13 O ATOM 1065 CB GLU A 70 0.299 6.926 12.183 1.00 61.03 C ATOM 1066 CG GLU A 70 -0.979 7.672 11.839 1.00 12.12 C ATOM 1067 CD GLU A 70 -2.226 6.907 12.239 1.00 52.52 C ATOM 1068 OE1 GLU A 70 -2.446 5.805 11.694 1.00 43.31 O ATOM 1069 OE2 GLU A 70 -2.982 7.411 13.096 1.00 74.25 O ATOM 0 H GLU A 70 1.211 8.223 9.473 1.00 23.43 H new ATOM 0 HA GLU A 70 2.202 6.362 11.358 1.00 1.12 H new ATOM 0 HB2 GLU A 70 0.042 5.932 12.550 1.00 61.03 H new ATOM 0 HB3 GLU A 70 0.805 7.445 12.997 1.00 61.03 H new ATOM 0 HG2 GLU A 70 -0.976 8.641 12.339 1.00 12.12 H new ATOM 0 HG3 GLU A 70 -1.005 7.866 10.767 1.00 12.12 H new ATOM 1076 N ASN A 71 1.346 4.727 9.727 1.00 51.33 N ATOM 1077 CA ASN A 71 0.888 3.747 8.749 1.00 63.04 C ATOM 1078 C ASN A 71 0.607 4.410 7.404 1.00 44.52 C ATOM 1079 O ASN A 71 -0.463 4.234 6.825 1.00 74.53 O ATOM 1080 CB ASN A 71 -0.371 3.041 9.254 1.00 32.35 C ATOM 1081 CG ASN A 71 -0.118 2.244 10.520 1.00 74.33 C ATOM 1082 OD1 ASN A 71 -0.122 2.791 11.622 1.00 23.04 O ATOM 1083 ND2 ASN A 71 0.103 0.943 10.365 1.00 14.43 N ATOM 0 H ASN A 71 2.210 4.473 10.206 1.00 51.33 H new ATOM 0 HA ASN A 71 1.680 3.010 8.613 1.00 63.04 H new ATOM 0 HB2 ASN A 71 -1.148 3.781 9.443 1.00 32.35 H new ATOM 0 HB3 ASN A 71 -0.747 2.375 8.477 1.00 32.35 H new ATOM 0 HD21 ASN A 71 0.279 0.355 11.180 1.00 14.43 H new ATOM 0 HD22 ASN A 71 0.097 0.532 9.431 1.00 14.43 H new ATOM 1090 N ASN A 72 1.578 5.175 6.913 1.00 72.40 N ATOM 1091 CA ASN A 72 1.435 5.865 5.636 1.00 23.22 C ATOM 1092 C ASN A 72 0.281 6.862 5.683 1.00 64.24 C ATOM 1093 O ASN A 72 -0.401 7.082 4.683 1.00 52.31 O ATOM 1094 CB ASN A 72 1.207 4.855 4.510 1.00 54.14 C ATOM 1095 CG ASN A 72 1.965 3.560 4.731 1.00 55.40 C ATOM 1096 OD1 ASN A 72 3.157 3.467 4.154 1.00 43.23 O flip ATOM 1097 ND2 ASN A 72 1.483 2.655 5.413 1.00 0.03 N flip ATOM 0 H ASN A 72 2.471 5.332 7.380 1.00 72.40 H new ATOM 0 HA ASN A 72 2.357 6.413 5.442 1.00 23.22 H new ATOM 0 HB2 ASN A 72 0.142 4.640 4.429 1.00 54.14 H new ATOM 0 HB3 ASN A 72 1.516 5.296 3.562 1.00 54.14 H new ATOM 0 HD21 ASN A 72 0.563 2.771 5.837 1.00 0.03 H new ATOM 0 HD22 ASN A 72 2.004 1.789 5.553 1.00 0.03 H new ATOM 1104 N GLU A 73 0.071 7.461 6.850 1.00 10.34 N ATOM 1105 CA GLU A 73 -1.000 8.435 7.027 1.00 74.45 C ATOM 1106 C GLU A 73 -0.487 9.687 7.731 1.00 12.04 C ATOM 1107 O GLU A 73 -0.387 9.726 8.958 1.00 62.23 O ATOM 1108 CB GLU A 73 -2.151 7.821 7.827 1.00 22.32 C ATOM 1109 CG GLU A 73 -2.531 6.422 7.372 1.00 63.32 C ATOM 1110 CD GLU A 73 -4.014 6.283 7.088 1.00 2.23 C ATOM 1111 OE1 GLU A 73 -4.797 6.189 8.056 1.00 12.21 O ATOM 1112 OE2 GLU A 73 -4.391 6.269 5.898 1.00 42.03 O ATOM 0 H GLU A 73 0.628 7.289 7.687 1.00 10.34 H new ATOM 0 HA GLU A 73 -1.364 8.719 6.040 1.00 74.45 H new ATOM 0 HB2 GLU A 73 -1.873 7.788 8.880 1.00 22.32 H new ATOM 0 HB3 GLU A 73 -3.024 8.469 7.748 1.00 22.32 H new ATOM 0 HG2 GLU A 73 -1.968 6.171 6.473 1.00 63.32 H new ATOM 0 HG3 GLU A 73 -2.243 5.704 8.140 1.00 63.32 H new ATOM 1119 N VAL A 74 -0.163 10.710 6.947 1.00 62.34 N ATOM 1120 CA VAL A 74 0.340 11.964 7.494 1.00 14.10 C ATOM 1121 C VAL A 74 -0.765 13.012 7.569 1.00 2.35 C ATOM 1122 O VAL A 74 -1.542 13.181 6.629 1.00 1.21 O ATOM 1123 CB VAL A 74 1.502 12.519 6.650 1.00 43.21 C ATOM 1124 CG1 VAL A 74 2.501 13.252 7.533 1.00 52.44 C ATOM 1125 CG2 VAL A 74 2.183 11.398 5.878 1.00 15.44 C ATOM 0 H VAL A 74 -0.240 10.695 5.930 1.00 62.34 H new ATOM 0 HA VAL A 74 0.702 11.748 8.499 1.00 14.10 H new ATOM 0 HB VAL A 74 1.098 13.231 5.931 1.00 43.21 H new ATOM 0 HG11 VAL A 74 3.315 13.637 6.919 1.00 52.44 H new ATOM 0 HG12 VAL A 74 2.003 14.081 8.036 1.00 52.44 H new ATOM 0 HG13 VAL A 74 2.902 12.564 8.277 1.00 52.44 H new ATOM 0 HG21 VAL A 74 3.002 11.808 5.287 1.00 15.44 H new ATOM 0 HG22 VAL A 74 2.575 10.660 6.578 1.00 15.44 H new ATOM 0 HG23 VAL A 74 1.461 10.921 5.215 1.00 15.44 H new ATOM 1135 N THR A 75 -0.829 13.716 8.696 1.00 53.25 N ATOM 1136 CA THR A 75 -1.839 14.748 8.895 1.00 41.20 C ATOM 1137 C THR A 75 -1.197 16.081 9.263 1.00 15.05 C ATOM 1138 O THR A 75 -0.755 16.275 10.396 1.00 45.11 O ATOM 1139 CB THR A 75 -2.839 14.350 9.997 1.00 3.42 C ATOM 1140 OG1 THR A 75 -3.652 15.475 10.350 1.00 71.11 O ATOM 1141 CG2 THR A 75 -2.109 13.839 11.230 1.00 34.14 C ATOM 0 H THR A 75 -0.194 13.590 9.484 1.00 53.25 H new ATOM 0 HA THR A 75 -2.374 14.854 7.951 1.00 41.20 H new ATOM 0 HB THR A 75 -3.472 13.551 9.612 1.00 3.42 H new ATOM 0 HG1 THR A 75 -4.286 15.214 11.050 1.00 71.11 H new ATOM 0 HG21 THR A 75 -2.835 13.564 11.995 1.00 34.14 H new ATOM 0 HG22 THR A 75 -1.513 12.966 10.964 1.00 34.14 H new ATOM 0 HG23 THR A 75 -1.455 14.621 11.615 1.00 34.14 H new ATOM 1149 N ILE A 76 -1.152 16.996 8.301 1.00 5.24 N ATOM 1150 CA ILE A 76 -0.566 18.312 8.526 1.00 25.35 C ATOM 1151 C ILE A 76 -1.646 19.365 8.742 1.00 15.50 C ATOM 1152 O ILE A 76 -2.227 19.881 7.785 1.00 25.42 O ATOM 1153 CB ILE A 76 0.326 18.741 7.346 1.00 75.42 C ATOM 1154 CG1 ILE A 76 1.442 17.718 7.123 1.00 11.33 C ATOM 1155 CG2 ILE A 76 0.908 20.123 7.597 1.00 4.31 C ATOM 1156 CD1 ILE A 76 2.348 18.056 5.960 1.00 54.12 C ATOM 0 H ILE A 76 -1.514 16.851 7.359 1.00 5.24 H new ATOM 0 HA ILE A 76 0.047 18.235 9.424 1.00 25.35 H new ATOM 0 HB ILE A 76 -0.285 18.785 6.445 1.00 75.42 H new ATOM 0 HG12 ILE A 76 2.042 17.643 8.030 1.00 11.33 H new ATOM 0 HG13 ILE A 76 0.997 16.738 6.953 1.00 11.33 H new ATOM 0 HG21 ILE A 76 1.536 20.412 6.754 1.00 4.31 H new ATOM 0 HG22 ILE A 76 0.098 20.844 7.710 1.00 4.31 H new ATOM 0 HG23 ILE A 76 1.508 20.105 8.507 1.00 4.31 H new ATOM 0 HD11 ILE A 76 3.115 17.288 5.861 1.00 54.12 H new ATOM 0 HD12 ILE A 76 1.761 18.102 5.043 1.00 54.12 H new ATOM 0 HD13 ILE A 76 2.822 19.022 6.137 1.00 54.12 H new ATOM 1168 N LEU A 77 -1.912 19.683 10.004 1.00 3.23 N ATOM 1169 CA LEU A 77 -2.922 20.678 10.347 1.00 52.12 C ATOM 1170 C LEU A 77 -2.312 22.075 10.409 1.00 73.31 C ATOM 1171 O LEU A 77 -1.836 22.509 11.458 1.00 42.55 O ATOM 1172 CB LEU A 77 -3.572 20.333 11.688 1.00 72.23 C ATOM 1173 CG LEU A 77 -4.419 19.060 11.715 1.00 30.02 C ATOM 1174 CD1 LEU A 77 -3.734 17.981 12.539 1.00 63.44 C ATOM 1175 CD2 LEU A 77 -5.806 19.354 12.267 1.00 13.20 C ATOM 0 H LEU A 77 -1.442 19.266 10.807 1.00 3.23 H new ATOM 0 HA LEU A 77 -3.684 20.669 9.568 1.00 52.12 H new ATOM 0 HB2 LEU A 77 -2.785 20.238 12.437 1.00 72.23 H new ATOM 0 HB3 LEU A 77 -4.201 21.170 11.991 1.00 72.23 H new ATOM 0 HG LEU A 77 -4.526 18.696 10.693 1.00 30.02 H new ATOM 0 HD11 LEU A 77 -4.351 17.083 12.547 1.00 63.44 H new ATOM 0 HD12 LEU A 77 -2.763 17.750 12.101 1.00 63.44 H new ATOM 0 HD13 LEU A 77 -3.596 18.336 13.560 1.00 63.44 H new ATOM 0 HD21 LEU A 77 -6.395 18.437 12.279 1.00 13.20 H new ATOM 0 HD22 LEU A 77 -5.719 19.742 13.282 1.00 13.20 H new ATOM 0 HD23 LEU A 77 -6.299 20.094 11.636 1.00 13.20 H new ATOM 1187 N VAL A 78 -2.332 22.775 9.279 1.00 74.40 N ATOM 1188 CA VAL A 78 -1.784 24.124 9.205 1.00 35.35 C ATOM 1189 C VAL A 78 -2.831 25.164 9.590 1.00 22.54 C ATOM 1190 O VAL A 78 -3.991 24.832 9.828 1.00 14.22 O ATOM 1191 CB VAL A 78 -1.258 24.440 7.793 1.00 72.42 C ATOM 1192 CG1 VAL A 78 -0.117 23.504 7.426 1.00 25.35 C ATOM 1193 CG2 VAL A 78 -2.383 24.347 6.773 1.00 61.24 C ATOM 0 H VAL A 78 -2.722 22.430 8.402 1.00 74.40 H new ATOM 0 HA VAL A 78 -0.955 24.168 9.911 1.00 35.35 H new ATOM 0 HB VAL A 78 -0.875 25.461 7.787 1.00 72.42 H new ATOM 0 HG11 VAL A 78 0.242 23.743 6.425 1.00 25.35 H new ATOM 0 HG12 VAL A 78 0.697 23.624 8.141 1.00 25.35 H new ATOM 0 HG13 VAL A 78 -0.470 22.473 7.449 1.00 25.35 H new ATOM 0 HG21 VAL A 78 -1.994 24.573 5.780 1.00 61.24 H new ATOM 0 HG22 VAL A 78 -2.797 23.339 6.779 1.00 61.24 H new ATOM 0 HG23 VAL A 78 -3.165 25.062 7.028 1.00 61.24 H new ATOM 1203 N ASN A 79 -2.411 26.423 9.649 1.00 15.41 N ATOM 1204 CA ASN A 79 -3.313 27.513 10.005 1.00 1.14 C ATOM 1205 C ASN A 79 -3.435 28.514 8.861 1.00 41.43 C ATOM 1206 O ASN A 79 -3.579 29.715 9.085 1.00 14.33 O ATOM 1207 CB ASN A 79 -2.816 28.222 11.267 1.00 31.21 C ATOM 1208 CG ASN A 79 -2.912 27.343 12.499 1.00 4.14 C ATOM 1209 OD1 ASN A 79 -1.939 26.699 12.893 1.00 11.11 O ATOM 1210 ND2 ASN A 79 -4.088 27.313 13.115 1.00 71.15 N ATOM 0 H ASN A 79 -1.453 26.714 9.455 1.00 15.41 H new ATOM 0 HA ASN A 79 -4.298 27.088 10.199 1.00 1.14 H new ATOM 0 HB2 ASN A 79 -1.780 28.530 11.124 1.00 31.21 H new ATOM 0 HB3 ASN A 79 -3.399 29.129 11.425 1.00 31.21 H new ATOM 0 HD21 ASN A 79 -4.212 26.740 13.950 1.00 71.15 H new ATOM 0 HD22 ASN A 79 -4.867 27.863 12.753 1.00 71.15 H new ATOM 1217 N GLY A 80 -3.376 28.010 7.632 1.00 50.43 N ATOM 1218 CA GLY A 80 -3.482 28.874 6.470 1.00 21.30 C ATOM 1219 C GLY A 80 -2.545 28.460 5.353 1.00 45.11 C ATOM 1220 O GLY A 80 -1.399 28.907 5.297 1.00 32.14 O ATOM 0 H GLY A 80 -3.257 27.019 7.420 1.00 50.43 H new ATOM 0 HA2 GLY A 80 -4.508 28.860 6.103 1.00 21.30 H new ATOM 0 HA3 GLY A 80 -3.262 29.901 6.763 1.00 21.30 H new ATOM 1224 N ALA A 81 -3.031 27.603 4.461 1.00 22.24 N ATOM 1225 CA ALA A 81 -2.228 27.129 3.340 1.00 15.25 C ATOM 1226 C ALA A 81 -2.871 27.502 2.009 1.00 75.21 C ATOM 1227 O ALA A 81 -3.988 28.018 1.972 1.00 61.11 O ATOM 1228 CB ALA A 81 -2.032 25.623 3.431 1.00 53.11 C ATOM 0 H ALA A 81 -3.977 27.223 4.493 1.00 22.24 H new ATOM 0 HA ALA A 81 -1.253 27.614 3.391 1.00 15.25 H new ATOM 0 HB1 ALA A 81 -1.431 25.283 2.588 1.00 53.11 H new ATOM 0 HB2 ALA A 81 -1.522 25.378 4.363 1.00 53.11 H new ATOM 0 HB3 ALA A 81 -3.003 25.128 3.408 1.00 53.11 H new ATOM 1234 N GLU A 82 -2.159 27.237 0.918 1.00 1.32 N ATOM 1235 CA GLU A 82 -2.661 27.547 -0.415 1.00 51.12 C ATOM 1236 C GLU A 82 -1.970 26.688 -1.470 1.00 73.41 C ATOM 1237 O GLU A 82 -0.778 26.398 -1.367 1.00 12.05 O ATOM 1238 CB GLU A 82 -2.451 29.029 -0.732 1.00 12.31 C ATOM 1239 CG GLU A 82 -3.746 29.812 -0.866 1.00 14.55 C ATOM 1240 CD GLU A 82 -4.465 29.532 -2.171 1.00 15.42 C ATOM 1241 OE1 GLU A 82 -3.840 29.693 -3.240 1.00 31.44 O ATOM 1242 OE2 GLU A 82 -5.654 29.153 -2.123 1.00 33.42 O ATOM 0 H GLU A 82 -1.233 26.809 0.931 1.00 1.32 H new ATOM 0 HA GLU A 82 -3.728 27.327 -0.433 1.00 51.12 H new ATOM 0 HB2 GLU A 82 -1.845 29.478 0.055 1.00 12.31 H new ATOM 0 HB3 GLU A 82 -1.885 29.117 -1.660 1.00 12.31 H new ATOM 0 HG2 GLU A 82 -4.404 29.564 -0.033 1.00 14.55 H new ATOM 0 HG3 GLU A 82 -3.530 30.878 -0.796 1.00 14.55 H new ATOM 1249 N ARG A 83 -2.728 26.283 -2.484 1.00 31.30 N ATOM 1250 CA ARG A 83 -2.190 25.455 -3.557 1.00 32.01 C ATOM 1251 C ARG A 83 -1.720 26.317 -4.725 1.00 23.03 C ATOM 1252 O ARG A 83 -2.402 27.257 -5.130 1.00 71.23 O ATOM 1253 CB ARG A 83 -3.245 24.457 -4.038 1.00 54.41 C ATOM 1254 CG ARG A 83 -2.792 23.008 -3.964 1.00 53.42 C ATOM 1255 CD ARG A 83 -3.912 22.098 -3.483 1.00 4.50 C ATOM 1256 NE ARG A 83 -3.847 20.777 -4.102 1.00 11.22 N ATOM 1257 CZ ARG A 83 -4.145 20.547 -5.376 1.00 32.14 C ATOM 1258 NH1 ARG A 83 -4.526 21.544 -6.162 1.00 0.54 N ATOM 1259 NH2 ARG A 83 -4.062 19.317 -5.866 1.00 33.43 N ATOM 0 H ARG A 83 -3.716 26.515 -2.585 1.00 31.30 H new ATOM 0 HA ARG A 83 -1.334 24.907 -3.164 1.00 32.01 H new ATOM 0 HB2 ARG A 83 -4.147 24.578 -3.438 1.00 54.41 H new ATOM 0 HB3 ARG A 83 -3.513 24.693 -5.068 1.00 54.41 H new ATOM 0 HG2 ARG A 83 -2.453 22.681 -4.947 1.00 53.42 H new ATOM 0 HG3 ARG A 83 -1.940 22.926 -3.289 1.00 53.42 H new ATOM 0 HD2 ARG A 83 -3.855 21.994 -2.399 1.00 4.50 H new ATOM 0 HD3 ARG A 83 -4.874 22.557 -3.709 1.00 4.50 H new ATOM 0 HE ARG A 83 -3.557 19.988 -3.525 1.00 11.22 H new ATOM 0 HH11 ARG A 83 -4.591 22.491 -5.789 1.00 0.54 H new ATOM 0 HH12 ARG A 83 -4.754 21.364 -7.140 1.00 0.54 H new ATOM 0 HH21 ARG A 83 -3.769 18.547 -5.264 1.00 33.43 H new ATOM 0 HH22 ARG A 83 -4.291 19.141 -6.844 1.00 33.43 H new ATOM 1273 N GLY A 84 -0.548 25.990 -5.261 1.00 23.21 N ATOM 1274 CA GLY A 84 -0.006 26.744 -6.376 1.00 63.10 C ATOM 1275 C GLY A 84 -0.885 26.669 -7.609 1.00 23.34 C ATOM 1276 O GLY A 84 -0.772 27.499 -8.511 1.00 74.40 O ATOM 0 H GLY A 84 0.036 25.216 -4.943 1.00 23.21 H new ATOM 0 HA2 GLY A 84 0.113 27.787 -6.082 1.00 63.10 H new ATOM 0 HA3 GLY A 84 0.987 26.365 -6.618 1.00 63.10 H new ATOM 1280 N ASP A 85 -1.761 25.671 -7.648 1.00 63.25 N ATOM 1281 CA ASP A 85 -2.662 25.490 -8.780 1.00 73.33 C ATOM 1282 C ASP A 85 -3.918 26.341 -8.617 1.00 5.12 C ATOM 1283 O ASP A 85 -4.560 26.715 -9.599 1.00 10.13 O ATOM 1284 CB ASP A 85 -3.046 24.016 -8.923 1.00 62.05 C ATOM 1285 CG ASP A 85 -2.636 23.439 -10.264 1.00 73.13 C ATOM 1286 OD1 ASP A 85 -3.125 23.938 -11.300 1.00 0.13 O ATOM 1287 OD2 ASP A 85 -1.827 22.489 -10.278 1.00 64.43 O ATOM 0 H ASP A 85 -1.866 24.976 -6.909 1.00 63.25 H new ATOM 0 HA ASP A 85 -2.141 25.812 -9.682 1.00 73.33 H new ATOM 0 HB2 ASP A 85 -2.576 23.442 -8.125 1.00 62.05 H new ATOM 0 HB3 ASP A 85 -4.124 23.911 -8.799 1.00 62.05 H new ATOM 1292 N THR A 86 -4.263 26.644 -7.369 1.00 61.12 N ATOM 1293 CA THR A 86 -5.442 27.449 -7.077 1.00 31.15 C ATOM 1294 C THR A 86 -5.077 28.920 -6.911 1.00 64.51 C ATOM 1295 O THR A 86 -5.667 29.627 -6.094 1.00 42.22 O ATOM 1296 CB THR A 86 -6.152 26.961 -5.800 1.00 13.34 C ATOM 1297 OG1 THR A 86 -5.988 25.546 -5.658 1.00 23.05 O ATOM 1298 CG2 THR A 86 -7.634 27.303 -5.841 1.00 11.14 C ATOM 0 H THR A 86 -3.742 26.344 -6.545 1.00 61.12 H new ATOM 0 HA THR A 86 -6.118 27.339 -7.925 1.00 31.15 H new ATOM 0 HB THR A 86 -5.702 27.466 -4.945 1.00 13.34 H new ATOM 0 HG1 THR A 86 -6.441 25.244 -4.843 1.00 23.05 H new ATOM 0 HG21 THR A 86 -8.115 26.949 -4.929 1.00 11.14 H new ATOM 0 HG22 THR A 86 -7.756 28.383 -5.919 1.00 11.14 H new ATOM 0 HG23 THR A 86 -8.095 26.822 -6.704 1.00 11.14 H new ATOM 1306 N ILE A 87 -4.101 29.373 -7.691 1.00 13.30 N ATOM 1307 CA ILE A 87 -3.659 30.761 -7.631 1.00 72.02 C ATOM 1308 C ILE A 87 -4.253 31.577 -8.775 1.00 25.31 C ATOM 1309 O ILE A 87 -4.353 31.099 -9.905 1.00 62.20 O ATOM 1310 CB ILE A 87 -2.123 30.865 -7.684 1.00 15.30 C ATOM 1311 CG1 ILE A 87 -1.606 30.412 -9.051 1.00 34.23 C ATOM 1312 CG2 ILE A 87 -1.498 30.036 -6.573 1.00 22.51 C ATOM 1313 CD1 ILE A 87 -0.102 30.499 -9.187 1.00 54.42 C ATOM 0 H ILE A 87 -3.602 28.800 -8.371 1.00 13.30 H new ATOM 0 HA ILE A 87 -4.010 31.164 -6.681 1.00 72.02 H new ATOM 0 HB ILE A 87 -1.838 31.907 -7.537 1.00 15.30 H new ATOM 0 HG12 ILE A 87 -1.920 29.383 -9.226 1.00 34.23 H new ATOM 0 HG13 ILE A 87 -2.069 31.023 -9.826 1.00 34.23 H new ATOM 0 HG21 ILE A 87 -0.412 30.119 -6.623 1.00 22.51 H new ATOM 0 HG22 ILE A 87 -1.846 30.402 -5.607 1.00 22.51 H new ATOM 0 HG23 ILE A 87 -1.787 28.992 -6.691 1.00 22.51 H new ATOM 0 HD11 ILE A 87 0.194 30.162 -10.181 1.00 54.42 H new ATOM 0 HD12 ILE A 87 0.217 31.531 -9.044 1.00 54.42 H new ATOM 0 HD13 ILE A 87 0.369 29.866 -8.435 1.00 54.42 H new ATOM 1325 N ASP A 88 -4.643 32.810 -8.474 1.00 4.31 N ATOM 1326 CA ASP A 88 -5.224 33.695 -9.477 1.00 64.34 C ATOM 1327 C ASP A 88 -4.438 34.999 -9.572 1.00 53.10 C ATOM 1328 O ASP A 88 -3.695 35.372 -8.664 1.00 14.41 O ATOM 1329 CB ASP A 88 -6.687 33.989 -9.143 1.00 22.00 C ATOM 1330 CG ASP A 88 -7.637 32.989 -9.772 1.00 22.10 C ATOM 1331 OD1 ASP A 88 -7.627 31.814 -9.349 1.00 62.53 O ATOM 1332 OD2 ASP A 88 -8.391 33.382 -10.686 1.00 60.43 O ATOM 0 H ASP A 88 -4.567 33.220 -7.543 1.00 4.31 H new ATOM 0 HA ASP A 88 -5.175 33.191 -10.442 1.00 64.34 H new ATOM 0 HB2 ASP A 88 -6.819 33.980 -8.061 1.00 22.00 H new ATOM 0 HB3 ASP A 88 -6.940 34.992 -9.486 1.00 22.00 H new ATOM 1337 N PRO A 89 -4.604 35.710 -10.698 1.00 31.35 N ATOM 1338 CA PRO A 89 -3.919 36.983 -10.938 1.00 64.00 C ATOM 1339 C PRO A 89 -4.439 38.100 -10.040 1.00 2.12 C ATOM 1340 O PRO A 89 -3.661 38.885 -9.498 1.00 12.01 O ATOM 1341 CB PRO A 89 -4.236 37.285 -12.405 1.00 25.12 C ATOM 1342 CG PRO A 89 -5.512 36.564 -12.673 1.00 5.22 C ATOM 1343 CD PRO A 89 -5.474 35.325 -11.822 1.00 1.13 C ATOM 0 HA PRO A 89 -2.853 36.919 -10.722 1.00 64.00 H new ATOM 0 HB2 PRO A 89 -4.344 38.356 -12.574 1.00 25.12 H new ATOM 0 HB3 PRO A 89 -3.439 36.937 -13.062 1.00 25.12 H new ATOM 0 HG2 PRO A 89 -6.372 37.185 -12.420 1.00 5.22 H new ATOM 0 HG3 PRO A 89 -5.602 36.310 -13.729 1.00 5.22 H new ATOM 0 HD2 PRO A 89 -6.470 35.041 -11.481 1.00 1.13 H new ATOM 0 HD3 PRO A 89 -5.070 34.474 -12.370 1.00 1.13 H new ATOM 1351 N GLN A 90 -5.757 38.165 -9.887 1.00 35.52 N ATOM 1352 CA GLN A 90 -6.380 39.186 -9.054 1.00 13.52 C ATOM 1353 C GLN A 90 -6.144 38.901 -7.574 1.00 52.14 C ATOM 1354 O GLN A 90 -6.034 39.822 -6.765 1.00 73.25 O ATOM 1355 CB GLN A 90 -7.881 39.261 -9.338 1.00 35.21 C ATOM 1356 CG GLN A 90 -8.359 40.651 -9.725 1.00 14.13 C ATOM 1357 CD GLN A 90 -8.559 40.805 -11.220 1.00 33.54 C ATOM 1358 OE1 GLN A 90 -9.277 40.024 -11.845 1.00 70.51 O ATOM 1359 NE2 GLN A 90 -7.924 41.815 -11.801 1.00 51.14 N ATOM 0 H GLN A 90 -6.414 37.523 -10.329 1.00 35.52 H new ATOM 0 HA GLN A 90 -5.923 40.145 -9.298 1.00 13.52 H new ATOM 0 HB2 GLN A 90 -8.125 38.565 -10.141 1.00 35.21 H new ATOM 0 HB3 GLN A 90 -8.426 38.932 -8.454 1.00 35.21 H new ATOM 0 HG2 GLN A 90 -9.297 40.864 -9.213 1.00 14.13 H new ATOM 0 HG3 GLN A 90 -7.634 41.389 -9.381 1.00 14.13 H new ATOM 0 HE21 GLN A 90 -7.339 42.438 -11.244 1.00 51.14 H new ATOM 0 HE22 GLN A 90 -8.021 41.969 -12.805 1.00 51.14 H new ATOM 1368 N GLU A 91 -6.068 37.620 -7.229 1.00 21.24 N ATOM 1369 CA GLU A 91 -5.846 37.214 -5.846 1.00 11.44 C ATOM 1370 C GLU A 91 -4.445 37.603 -5.383 1.00 21.03 C ATOM 1371 O GLU A 91 -4.280 38.280 -4.368 1.00 53.14 O ATOM 1372 CB GLU A 91 -6.044 35.705 -5.695 1.00 74.43 C ATOM 1373 CG GLU A 91 -7.414 35.321 -5.160 1.00 62.12 C ATOM 1374 CD GLU A 91 -7.519 33.844 -4.832 1.00 0.21 C ATOM 1375 OE1 GLU A 91 -6.778 33.047 -5.444 1.00 62.21 O ATOM 1376 OE2 GLU A 91 -8.342 33.486 -3.964 1.00 22.12 O ATOM 0 H GLU A 91 -6.157 36.846 -7.887 1.00 21.24 H new ATOM 0 HA GLU A 91 -6.574 37.732 -5.222 1.00 11.44 H new ATOM 0 HB2 GLU A 91 -5.895 35.229 -6.664 1.00 74.43 H new ATOM 0 HB3 GLU A 91 -5.279 35.312 -5.026 1.00 74.43 H new ATOM 0 HG2 GLU A 91 -7.627 35.904 -4.264 1.00 62.12 H new ATOM 0 HG3 GLU A 91 -8.174 35.581 -5.897 1.00 62.12 H new ATOM 1383 N ALA A 92 -3.438 37.169 -6.134 1.00 33.51 N ATOM 1384 CA ALA A 92 -2.052 37.471 -5.802 1.00 44.55 C ATOM 1385 C ALA A 92 -1.821 38.977 -5.729 1.00 50.11 C ATOM 1386 O ALA A 92 -1.211 39.475 -4.783 1.00 60.33 O ATOM 1387 CB ALA A 92 -1.115 36.841 -6.823 1.00 13.22 C ATOM 0 H ALA A 92 -3.557 36.607 -6.977 1.00 33.51 H new ATOM 0 HA ALA A 92 -1.839 37.048 -4.820 1.00 44.55 H new ATOM 0 HB1 ALA A 92 -0.083 37.075 -6.562 1.00 13.22 H new ATOM 0 HB2 ALA A 92 -1.253 35.760 -6.825 1.00 13.22 H new ATOM 0 HB3 ALA A 92 -1.338 37.237 -7.814 1.00 13.22 H new ATOM 1393 N GLN A 93 -2.312 39.696 -6.733 1.00 71.15 N ATOM 1394 CA GLN A 93 -2.157 41.145 -6.782 1.00 74.13 C ATOM 1395 C GLN A 93 -2.858 41.807 -5.601 1.00 10.25 C ATOM 1396 O GLN A 93 -2.365 42.789 -5.046 1.00 51.34 O ATOM 1397 CB GLN A 93 -2.717 41.695 -8.096 1.00 22.25 C ATOM 1398 CG GLN A 93 -1.648 41.992 -9.135 1.00 71.30 C ATOM 1399 CD GLN A 93 -2.141 41.787 -10.554 1.00 13.31 C ATOM 1400 OE1 GLN A 93 -2.945 42.569 -11.063 1.00 11.23 O ATOM 1401 NE2 GLN A 93 -1.661 40.732 -11.202 1.00 12.34 N ATOM 0 H GLN A 93 -2.820 39.299 -7.523 1.00 71.15 H new ATOM 0 HA GLN A 93 -1.093 41.374 -6.725 1.00 74.13 H new ATOM 0 HB2 GLN A 93 -3.424 40.976 -8.509 1.00 22.25 H new ATOM 0 HB3 GLN A 93 -3.275 42.608 -7.890 1.00 22.25 H new ATOM 0 HG2 GLN A 93 -1.308 43.021 -9.017 1.00 71.30 H new ATOM 0 HG3 GLN A 93 -0.786 41.349 -8.958 1.00 71.30 H new ATOM 0 HE21 GLN A 93 -0.996 40.110 -10.742 1.00 12.34 H new ATOM 0 HE22 GLN A 93 -1.957 40.544 -12.160 1.00 12.34 H new ATOM 1410 N GLN A 94 -4.010 41.263 -5.221 1.00 42.10 N ATOM 1411 CA GLN A 94 -4.778 41.803 -4.106 1.00 31.25 C ATOM 1412 C GLN A 94 -4.021 41.636 -2.792 1.00 13.20 C ATOM 1413 O GLN A 94 -3.894 42.580 -2.012 1.00 13.45 O ATOM 1414 CB GLN A 94 -6.140 41.111 -4.015 1.00 4.34 C ATOM 1415 CG GLN A 94 -7.263 41.890 -4.681 1.00 21.55 C ATOM 1416 CD GLN A 94 -8.475 41.028 -4.975 1.00 12.15 C ATOM 1417 OE1 GLN A 94 -8.976 40.322 -4.099 1.00 73.21 O ATOM 1418 NE2 GLN A 94 -8.954 41.082 -6.212 1.00 21.11 N ATOM 0 H GLN A 94 -4.431 40.449 -5.669 1.00 42.10 H new ATOM 0 HA GLN A 94 -4.930 42.868 -4.284 1.00 31.25 H new ATOM 0 HB2 GLN A 94 -6.069 40.126 -4.476 1.00 4.34 H new ATOM 0 HB3 GLN A 94 -6.390 40.955 -2.966 1.00 4.34 H new ATOM 0 HG2 GLN A 94 -7.558 42.718 -4.036 1.00 21.55 H new ATOM 0 HG3 GLN A 94 -6.897 42.325 -5.611 1.00 21.55 H new ATOM 0 HE21 GLN A 94 -8.507 41.681 -6.906 1.00 21.11 H new ATOM 0 HE22 GLN A 94 -9.769 40.524 -6.468 1.00 21.11 H new ATOM 1427 N THR A 95 -3.520 40.428 -2.553 1.00 4.53 N ATOM 1428 CA THR A 95 -2.777 40.137 -1.333 1.00 44.42 C ATOM 1429 C THR A 95 -1.587 41.078 -1.176 1.00 71.34 C ATOM 1430 O THR A 95 -1.233 41.468 -0.063 1.00 34.32 O ATOM 1431 CB THR A 95 -2.272 38.682 -1.317 1.00 2.23 C ATOM 1432 OG1 THR A 95 -3.280 37.808 -1.836 1.00 31.01 O ATOM 1433 CG2 THR A 95 -1.900 38.254 0.095 1.00 12.20 C ATOM 0 H THR A 95 -3.615 39.636 -3.188 1.00 4.53 H new ATOM 0 HA THR A 95 -3.465 40.284 -0.501 1.00 44.42 H new ATOM 0 HB THR A 95 -1.382 38.622 -1.944 1.00 2.23 H new ATOM 0 HG1 THR A 95 -3.421 37.999 -2.787 1.00 31.01 H new ATOM 0 HG21 THR A 95 -1.546 37.223 0.081 1.00 12.20 H new ATOM 0 HG22 THR A 95 -1.112 38.903 0.476 1.00 12.20 H new ATOM 0 HG23 THR A 95 -2.775 38.329 0.740 1.00 12.20 H new ATOM 1441 N LEU A 96 -0.973 41.439 -2.298 1.00 12.45 N ATOM 1442 CA LEU A 96 0.178 42.336 -2.285 1.00 35.03 C ATOM 1443 C LEU A 96 -0.247 43.762 -1.949 1.00 41.11 C ATOM 1444 O LEU A 96 0.487 44.499 -1.291 1.00 55.01 O ATOM 1445 CB LEU A 96 0.886 42.308 -3.640 1.00 52.12 C ATOM 1446 CG LEU A 96 2.293 42.904 -3.674 1.00 45.24 C ATOM 1447 CD1 LEU A 96 3.320 41.874 -3.231 1.00 23.11 C ATOM 1448 CD2 LEU A 96 2.620 43.420 -5.068 1.00 45.12 C ATOM 0 H LEU A 96 -1.253 41.125 -3.227 1.00 12.45 H new ATOM 0 HA LEU A 96 0.868 41.991 -1.515 1.00 35.03 H new ATOM 0 HB2 LEU A 96 0.943 41.273 -3.976 1.00 52.12 H new ATOM 0 HB3 LEU A 96 0.269 42.844 -4.361 1.00 52.12 H new ATOM 0 HG LEU A 96 2.328 43.744 -2.980 1.00 45.24 H new ATOM 0 HD11 LEU A 96 4.316 42.316 -3.262 1.00 23.11 H new ATOM 0 HD12 LEU A 96 3.097 41.552 -2.214 1.00 23.11 H new ATOM 0 HD13 LEU A 96 3.284 41.014 -3.900 1.00 23.11 H new ATOM 0 HD21 LEU A 96 3.625 43.841 -5.074 1.00 45.12 H new ATOM 0 HD22 LEU A 96 2.567 42.598 -5.782 1.00 45.12 H new ATOM 0 HD23 LEU A 96 1.902 44.191 -5.348 1.00 45.12 H new ATOM 1460 N GLU A 97 -1.436 44.143 -2.404 1.00 75.35 N ATOM 1461 CA GLU A 97 -1.958 45.480 -2.151 1.00 15.42 C ATOM 1462 C GLU A 97 -2.361 45.639 -0.687 1.00 62.13 C ATOM 1463 O GLU A 97 -1.962 46.596 -0.023 1.00 52.45 O ATOM 1464 CB GLU A 97 -3.160 45.763 -3.055 1.00 11.11 C ATOM 1465 CG GLU A 97 -3.021 47.037 -3.871 1.00 54.11 C ATOM 1466 CD GLU A 97 -3.993 48.117 -3.437 1.00 0.15 C ATOM 1467 OE1 GLU A 97 -4.012 48.449 -2.233 1.00 55.20 O ATOM 1468 OE2 GLU A 97 -4.734 48.630 -4.301 1.00 41.51 O ATOM 0 H GLU A 97 -2.056 43.544 -2.950 1.00 75.35 H new ATOM 0 HA GLU A 97 -1.168 46.198 -2.373 1.00 15.42 H new ATOM 0 HB2 GLU A 97 -3.300 44.921 -3.733 1.00 11.11 H new ATOM 0 HB3 GLU A 97 -4.058 45.831 -2.441 1.00 11.11 H new ATOM 0 HG2 GLU A 97 -2.002 47.413 -3.780 1.00 54.11 H new ATOM 0 HG3 GLU A 97 -3.184 46.809 -4.924 1.00 54.11 H new ATOM 1475 N ILE A 98 -3.153 44.694 -0.192 1.00 2.10 N ATOM 1476 CA ILE A 98 -3.609 44.728 1.192 1.00 3.31 C ATOM 1477 C ILE A 98 -2.430 44.724 2.159 1.00 21.04 C ATOM 1478 O ILE A 98 -2.459 45.392 3.192 1.00 11.14 O ATOM 1479 CB ILE A 98 -4.526 43.533 1.512 1.00 25.05 C ATOM 1480 CG1 ILE A 98 -4.961 43.575 2.979 1.00 54.24 C ATOM 1481 CG2 ILE A 98 -3.816 42.223 1.203 1.00 51.33 C ATOM 1482 CD1 ILE A 98 -5.935 42.479 3.351 1.00 1.13 C ATOM 0 H ILE A 98 -3.492 43.896 -0.729 1.00 2.10 H new ATOM 0 HA ILE A 98 -4.174 45.652 1.316 1.00 3.31 H new ATOM 0 HB ILE A 98 -5.416 43.599 0.886 1.00 25.05 H new ATOM 0 HG12 ILE A 98 -4.078 43.497 3.614 1.00 54.24 H new ATOM 0 HG13 ILE A 98 -5.418 44.542 3.187 1.00 54.24 H new ATOM 0 HG21 ILE A 98 -4.477 41.388 1.434 1.00 51.33 H new ATOM 0 HG22 ILE A 98 -3.550 42.194 0.146 1.00 51.33 H new ATOM 0 HG23 ILE A 98 -2.912 42.148 1.807 1.00 51.33 H new ATOM 0 HD11 ILE A 98 -6.200 42.570 4.404 1.00 1.13 H new ATOM 0 HD12 ILE A 98 -6.834 42.569 2.742 1.00 1.13 H new ATOM 0 HD13 ILE A 98 -5.474 41.507 3.175 1.00 1.13 H new ATOM 1494 N ALA A 99 -1.393 43.967 1.816 1.00 5.50 N ATOM 1495 CA ALA A 99 -0.202 43.879 2.652 1.00 44.22 C ATOM 1496 C ALA A 99 0.500 45.229 2.752 1.00 12.55 C ATOM 1497 O ALA A 99 0.772 45.717 3.849 1.00 31.10 O ATOM 1498 CB ALA A 99 0.751 42.827 2.104 1.00 40.04 C ATOM 0 H ALA A 99 -1.354 43.406 0.965 1.00 5.50 H new ATOM 0 HA ALA A 99 -0.513 43.585 3.654 1.00 44.22 H new ATOM 0 HB1 ALA A 99 1.636 42.772 2.738 1.00 40.04 H new ATOM 0 HB2 ALA A 99 0.254 41.857 2.090 1.00 40.04 H new ATOM 0 HB3 ALA A 99 1.047 43.097 1.090 1.00 40.04 H new ATOM 1504 N GLU A 100 0.790 45.828 1.601 1.00 20.24 N ATOM 1505 CA GLU A 100 1.462 47.122 1.562 1.00 75.43 C ATOM 1506 C GLU A 100 0.607 48.199 2.223 1.00 34.31 C ATOM 1507 O GLU A 100 1.120 49.067 2.928 1.00 54.31 O ATOM 1508 CB GLU A 100 1.771 47.517 0.116 1.00 33.52 C ATOM 1509 CG GLU A 100 3.206 47.966 -0.098 1.00 41.42 C ATOM 1510 CD GLU A 100 3.428 49.415 0.293 1.00 22.51 C ATOM 1511 OE1 GLU A 100 3.048 50.307 -0.493 1.00 11.11 O ATOM 1512 OE2 GLU A 100 3.982 49.655 1.386 1.00 25.32 O ATOM 0 H GLU A 100 0.570 45.438 0.684 1.00 20.24 H new ATOM 0 HA GLU A 100 2.397 47.034 2.115 1.00 75.43 H new ATOM 0 HB2 GLU A 100 1.564 46.668 -0.536 1.00 33.52 H new ATOM 0 HB3 GLU A 100 1.099 48.321 -0.184 1.00 33.52 H new ATOM 0 HG2 GLU A 100 3.873 47.330 0.485 1.00 41.42 H new ATOM 0 HG3 GLU A 100 3.473 47.831 -1.146 1.00 41.42 H new ATOM 1519 N ALA A 101 -0.700 48.135 1.990 1.00 72.15 N ATOM 1520 CA ALA A 101 -1.627 49.103 2.563 1.00 22.10 C ATOM 1521 C ALA A 101 -1.672 48.986 4.083 1.00 41.12 C ATOM 1522 O ALA A 101 -1.576 49.985 4.794 1.00 31.15 O ATOM 1523 CB ALA A 101 -3.018 48.914 1.976 1.00 43.13 C ATOM 0 H ALA A 101 -1.141 47.423 1.408 1.00 72.15 H new ATOM 0 HA ALA A 101 -1.272 50.102 2.311 1.00 22.10 H new ATOM 0 HB1 ALA A 101 -3.700 49.644 2.413 1.00 43.13 H new ATOM 0 HB2 ALA A 101 -2.979 49.055 0.896 1.00 43.13 H new ATOM 0 HB3 ALA A 101 -3.373 47.908 2.198 1.00 43.13 H new ATOM 1529 N ASN A 102 -1.819 47.760 4.573 1.00 32.42 N ATOM 1530 CA ASN A 102 -1.878 47.513 6.009 1.00 34.34 C ATOM 1531 C ASN A 102 -0.565 47.901 6.683 1.00 75.24 C ATOM 1532 O ASN A 102 -0.560 48.563 7.721 1.00 25.23 O ATOM 1533 CB ASN A 102 -2.189 46.040 6.282 1.00 24.53 C ATOM 1534 CG ASN A 102 -3.661 45.718 6.116 1.00 13.32 C ATOM 1535 OD1 ASN A 102 -4.515 46.601 6.206 1.00 4.23 O ATOM 1536 ND2 ASN A 102 -3.966 44.449 5.872 1.00 10.04 N ATOM 0 H ASN A 102 -1.899 46.922 3.997 1.00 32.42 H new ATOM 0 HA ASN A 102 -2.675 48.129 6.426 1.00 34.34 H new ATOM 0 HB2 ASN A 102 -1.605 45.417 5.604 1.00 24.53 H new ATOM 0 HB3 ASN A 102 -1.877 45.788 7.295 1.00 24.53 H new ATOM 0 HD21 ASN A 102 -4.940 44.173 5.751 1.00 10.04 H new ATOM 0 HD22 ASN A 102 -3.226 43.750 5.806 1.00 10.04 H new ATOM 1543 N LEU A 103 0.545 47.485 6.084 1.00 2.11 N ATOM 1544 CA LEU A 103 1.866 47.789 6.625 1.00 55.43 C ATOM 1545 C LEU A 103 2.135 49.290 6.590 1.00 3.34 C ATOM 1546 O LEU A 103 2.910 49.810 7.393 1.00 4.22 O ATOM 1547 CB LEU A 103 2.945 47.047 5.835 1.00 42.51 C ATOM 1548 CG LEU A 103 4.116 46.498 6.651 1.00 34.11 C ATOM 1549 CD1 LEU A 103 5.098 45.767 5.750 1.00 61.43 C ATOM 1550 CD2 LEU A 103 4.814 47.621 7.404 1.00 21.45 C ATOM 0 H LEU A 103 0.557 46.937 5.224 1.00 2.11 H new ATOM 0 HA LEU A 103 1.892 47.458 7.663 1.00 55.43 H new ATOM 0 HB2 LEU A 103 2.475 46.217 5.308 1.00 42.51 H new ATOM 0 HB3 LEU A 103 3.341 47.723 5.077 1.00 42.51 H new ATOM 0 HG LEU A 103 3.725 45.787 7.379 1.00 34.11 H new ATOM 0 HD11 LEU A 103 5.924 45.383 6.348 1.00 61.43 H new ATOM 0 HD12 LEU A 103 4.591 44.937 5.257 1.00 61.43 H new ATOM 0 HD13 LEU A 103 5.483 46.455 4.998 1.00 61.43 H new ATOM 0 HD21 LEU A 103 5.645 47.212 7.979 1.00 21.45 H new ATOM 0 HD22 LEU A 103 5.192 48.356 6.693 1.00 21.45 H new ATOM 0 HD23 LEU A 103 4.106 48.101 8.080 1.00 21.45 H new ATOM 1562 N ARG A 104 1.489 49.981 5.657 1.00 10.31 N ATOM 1563 CA ARG A 104 1.658 51.423 5.519 1.00 64.30 C ATOM 1564 C ARG A 104 1.365 52.133 6.837 1.00 1.31 C ATOM 1565 O ARG A 104 2.241 52.776 7.417 1.00 53.22 O ATOM 1566 CB ARG A 104 0.740 51.963 4.421 1.00 64.31 C ATOM 1567 CG ARG A 104 1.250 53.241 3.775 1.00 72.20 C ATOM 1568 CD ARG A 104 1.841 52.973 2.400 1.00 62.41 C ATOM 1569 NE ARG A 104 2.325 54.195 1.764 1.00 5.25 N ATOM 1570 CZ ARG A 104 1.529 55.089 1.189 1.00 3.30 C ATOM 1571 NH1 ARG A 104 0.217 54.899 1.170 1.00 64.53 N ATOM 1572 NH2 ARG A 104 2.045 56.177 0.632 1.00 42.43 N ATOM 0 H ARG A 104 0.844 49.566 4.985 1.00 10.31 H new ATOM 0 HA ARG A 104 2.695 51.617 5.244 1.00 64.30 H new ATOM 0 HB2 ARG A 104 0.620 51.200 3.652 1.00 64.31 H new ATOM 0 HB3 ARG A 104 -0.248 52.148 4.843 1.00 64.31 H new ATOM 0 HG2 ARG A 104 0.433 53.957 3.688 1.00 72.20 H new ATOM 0 HG3 ARG A 104 2.006 53.697 4.415 1.00 72.20 H new ATOM 0 HD2 ARG A 104 2.662 52.262 2.491 1.00 62.41 H new ATOM 0 HD3 ARG A 104 1.086 52.509 1.765 1.00 62.41 H new ATOM 0 HE ARG A 104 3.330 54.372 1.761 1.00 5.25 H new ATOM 0 HH11 ARG A 104 -0.184 54.064 1.598 1.00 64.53 H new ATOM 0 HH12 ARG A 104 -0.392 55.588 0.728 1.00 64.53 H new ATOM 0 HH21 ARG A 104 3.054 56.327 0.645 1.00 42.43 H new ATOM 0 HH22 ARG A 104 1.433 56.863 0.191 1.00 42.43 H new ATOM 1586 N LYS A 105 0.127 52.014 7.305 1.00 24.31 N ATOM 1587 CA LYS A 105 -0.283 52.643 8.555 1.00 42.13 C ATOM 1588 C LYS A 105 0.161 51.812 9.754 1.00 25.10 C ATOM 1589 O LYS A 105 0.594 52.354 10.771 1.00 55.02 O ATOM 1590 CB LYS A 105 -1.802 52.827 8.583 1.00 61.34 C ATOM 1591 CG LYS A 105 -2.274 54.097 7.896 1.00 22.31 C ATOM 1592 CD LYS A 105 -2.520 55.213 8.897 1.00 45.30 C ATOM 1593 CE LYS A 105 -1.595 56.396 8.651 1.00 70.21 C ATOM 1594 NZ LYS A 105 -1.574 57.333 9.808 1.00 50.54 N ATOM 0 H LYS A 105 -0.610 51.487 6.837 1.00 24.31 H new ATOM 0 HA LYS A 105 0.197 53.620 8.615 1.00 42.13 H new ATOM 0 HB2 LYS A 105 -2.272 51.968 8.104 1.00 61.34 H new ATOM 0 HB3 LYS A 105 -2.139 52.838 9.619 1.00 61.34 H new ATOM 0 HG2 LYS A 105 -1.528 54.417 7.169 1.00 22.31 H new ATOM 0 HG3 LYS A 105 -3.191 53.894 7.343 1.00 22.31 H new ATOM 0 HD2 LYS A 105 -3.557 55.541 8.830 1.00 45.30 H new ATOM 0 HD3 LYS A 105 -2.369 54.836 9.908 1.00 45.30 H new ATOM 0 HE2 LYS A 105 -0.585 56.034 8.459 1.00 70.21 H new ATOM 0 HE3 LYS A 105 -1.918 56.930 7.757 1.00 70.21 H new ATOM 0 HZ1 LYS A 105 -0.933 58.125 9.602 1.00 50.54 H new ATOM 0 HZ2 LYS A 105 -2.533 57.699 9.976 1.00 50.54 H new ATOM 0 HZ3 LYS A 105 -1.242 56.830 10.656 1.00 50.54 H new ATOM 1608 N ALA A 106 0.053 50.493 9.627 1.00 5.41 N ATOM 1609 CA ALA A 106 0.448 49.588 10.699 1.00 35.03 C ATOM 1610 C ALA A 106 1.921 49.211 10.586 1.00 52.20 C ATOM 1611 O ALA A 106 2.334 48.569 9.621 1.00 53.53 O ATOM 1612 CB ALA A 106 -0.421 48.339 10.682 1.00 55.24 C ATOM 0 H ALA A 106 -0.305 50.028 8.793 1.00 5.41 H new ATOM 0 HA ALA A 106 0.305 50.105 11.648 1.00 35.03 H new ATOM 0 HB1 ALA A 106 -0.115 47.672 11.488 1.00 55.24 H new ATOM 0 HB2 ALA A 106 -1.465 48.620 10.820 1.00 55.24 H new ATOM 0 HB3 ALA A 106 -0.306 47.829 9.726 1.00 55.24 H new ATOM 1618 N GLU A 107 2.708 49.615 11.578 1.00 43.20 N ATOM 1619 CA GLU A 107 4.136 49.320 11.587 1.00 3.42 C ATOM 1620 C GLU A 107 4.450 48.179 12.551 1.00 41.43 C ATOM 1621 O GLU A 107 4.809 48.408 13.705 1.00 32.00 O ATOM 1622 CB GLU A 107 4.934 50.566 11.978 1.00 43.24 C ATOM 1623 CG GLU A 107 4.487 51.826 11.256 1.00 2.30 C ATOM 1624 CD GLU A 107 3.773 52.801 12.172 1.00 3.13 C ATOM 1625 OE1 GLU A 107 2.808 52.385 12.846 1.00 22.32 O ATOM 1626 OE2 GLU A 107 4.181 53.981 12.215 1.00 33.01 O ATOM 0 H GLU A 107 2.381 50.147 12.385 1.00 43.20 H new ATOM 0 HA GLU A 107 4.424 49.013 10.582 1.00 3.42 H new ATOM 0 HB2 GLU A 107 4.844 50.722 13.053 1.00 43.24 H new ATOM 0 HB3 GLU A 107 5.989 50.392 11.768 1.00 43.24 H new ATOM 0 HG2 GLU A 107 5.356 52.316 10.816 1.00 2.30 H new ATOM 0 HG3 GLU A 107 3.825 51.554 10.434 1.00 2.30 H new ATOM 1633 N GLY A 108 4.311 46.949 12.067 1.00 63.33 N ATOM 1634 CA GLY A 108 4.583 45.790 12.897 1.00 33.03 C ATOM 1635 C GLY A 108 4.676 44.509 12.093 1.00 71.25 C ATOM 1636 O GLY A 108 3.838 44.248 11.230 1.00 61.42 O ATOM 0 H GLY A 108 4.015 46.734 11.115 1.00 63.33 H new ATOM 0 HA2 GLY A 108 5.517 45.945 13.437 1.00 33.03 H new ATOM 0 HA3 GLY A 108 3.796 45.690 13.644 1.00 33.03 H new ATOM 1640 N ALA A 109 5.699 43.708 12.374 1.00 53.22 N ATOM 1641 CA ALA A 109 5.898 42.448 11.670 1.00 61.51 C ATOM 1642 C ALA A 109 4.759 41.474 11.953 1.00 14.52 C ATOM 1643 O ALA A 109 4.338 40.723 11.073 1.00 11.41 O ATOM 1644 CB ALA A 109 7.232 41.830 12.062 1.00 61.44 C ATOM 0 H ALA A 109 6.402 43.910 13.084 1.00 53.22 H new ATOM 0 HA ALA A 109 5.906 42.656 10.600 1.00 61.51 H new ATOM 0 HB1 ALA A 109 7.368 40.889 11.529 1.00 61.44 H new ATOM 0 HB2 ALA A 109 8.040 42.514 11.803 1.00 61.44 H new ATOM 0 HB3 ALA A 109 7.245 41.644 13.136 1.00 61.44 H new ATOM 1650 N ARG A 110 4.264 41.493 13.187 1.00 60.34 N ATOM 1651 CA ARG A 110 3.174 40.610 13.586 1.00 44.21 C ATOM 1652 C ARG A 110 1.928 40.870 12.744 1.00 24.41 C ATOM 1653 O ARG A 110 1.227 39.937 12.353 1.00 24.31 O ATOM 1654 CB ARG A 110 2.850 40.803 15.068 1.00 5.35 C ATOM 1655 CG ARG A 110 2.701 39.499 15.834 1.00 31.22 C ATOM 1656 CD ARG A 110 3.304 39.598 17.227 1.00 72.03 C ATOM 1657 NE ARG A 110 2.657 38.689 18.169 1.00 14.43 N ATOM 1658 CZ ARG A 110 1.425 38.868 18.634 1.00 21.42 C ATOM 1659 NH1 ARG A 110 0.711 39.915 18.245 1.00 3.03 N ATOM 1660 NH2 ARG A 110 0.905 37.997 19.490 1.00 60.34 N ATOM 0 H ARG A 110 4.600 42.110 13.927 1.00 60.34 H new ATOM 0 HA ARG A 110 3.494 39.581 13.422 1.00 44.21 H new ATOM 0 HB2 ARG A 110 3.639 41.397 15.529 1.00 5.35 H new ATOM 0 HB3 ARG A 110 1.926 41.375 15.158 1.00 5.35 H new ATOM 0 HG2 ARG A 110 1.645 39.240 15.911 1.00 31.22 H new ATOM 0 HG3 ARG A 110 3.187 38.694 15.282 1.00 31.22 H new ATOM 0 HD2 ARG A 110 4.369 39.371 17.178 1.00 72.03 H new ATOM 0 HD3 ARG A 110 3.212 40.622 17.590 1.00 72.03 H new ATOM 0 HE ARG A 110 3.179 37.872 18.487 1.00 14.43 H new ATOM 0 HH11 ARG A 110 1.107 40.586 17.587 1.00 3.03 H new ATOM 0 HH12 ARG A 110 -0.234 40.049 18.604 1.00 3.03 H new ATOM 0 HH21 ARG A 110 1.451 37.190 19.791 1.00 60.34 H new ATOM 0 HH22 ARG A 110 -0.041 38.135 19.847 1.00 60.34 H new ATOM 1674 N GLN A 111 1.660 42.142 12.470 1.00 0.11 N ATOM 1675 CA GLN A 111 0.498 42.523 11.676 1.00 1.40 C ATOM 1676 C GLN A 111 0.559 41.897 10.287 1.00 74.50 C ATOM 1677 O GLN A 111 -0.464 41.495 9.730 1.00 45.51 O ATOM 1678 CB GLN A 111 0.412 44.046 11.558 1.00 0.10 C ATOM 1679 CG GLN A 111 0.231 44.750 12.893 1.00 43.50 C ATOM 1680 CD GLN A 111 -1.225 44.866 13.300 1.00 65.52 C ATOM 1681 OE1 GLN A 111 -1.926 43.862 13.431 1.00 25.21 O ATOM 1682 NE2 GLN A 111 -1.688 46.093 13.502 1.00 3.51 N ATOM 0 H GLN A 111 2.231 42.926 12.786 1.00 0.11 H new ATOM 0 HA GLN A 111 -0.394 42.153 12.182 1.00 1.40 H new ATOM 0 HB2 GLN A 111 1.319 44.417 11.081 1.00 0.10 H new ATOM 0 HB3 GLN A 111 -0.421 44.305 10.904 1.00 0.10 H new ATOM 0 HG2 GLN A 111 0.777 44.206 13.663 1.00 43.50 H new ATOM 0 HG3 GLN A 111 0.669 45.747 12.836 1.00 43.50 H new ATOM 0 HE21 GLN A 111 -1.072 46.897 13.382 1.00 3.51 H new ATOM 0 HE22 GLN A 111 -2.660 46.232 13.777 1.00 3.51 H new ATOM 1691 N LYS A 112 1.763 41.815 9.732 1.00 40.30 N ATOM 1692 CA LYS A 112 1.958 41.237 8.408 1.00 25.40 C ATOM 1693 C LYS A 112 1.621 39.749 8.409 1.00 23.03 C ATOM 1694 O LYS A 112 0.790 39.291 7.624 1.00 24.15 O ATOM 1695 CB LYS A 112 3.403 41.443 7.947 1.00 61.50 C ATOM 1696 CG LYS A 112 3.625 41.119 6.480 1.00 64.32 C ATOM 1697 CD LYS A 112 3.672 42.379 5.631 1.00 35.55 C ATOM 1698 CE LYS A 112 2.276 42.830 5.227 1.00 64.50 C ATOM 1699 NZ LYS A 112 1.769 43.918 6.107 1.00 53.53 N ATOM 0 H LYS A 112 2.619 42.142 10.179 1.00 40.30 H new ATOM 0 HA LYS A 112 1.286 41.743 7.715 1.00 25.40 H new ATOM 0 HB2 LYS A 112 3.690 42.479 8.129 1.00 61.50 H new ATOM 0 HB3 LYS A 112 4.061 40.819 8.552 1.00 61.50 H new ATOM 0 HG2 LYS A 112 4.558 40.567 6.366 1.00 64.32 H new ATOM 0 HG3 LYS A 112 2.825 40.470 6.125 1.00 64.32 H new ATOM 0 HD2 LYS A 112 4.166 43.176 6.187 1.00 35.55 H new ATOM 0 HD3 LYS A 112 4.269 42.195 4.738 1.00 35.55 H new ATOM 0 HE2 LYS A 112 2.291 43.176 4.193 1.00 64.50 H new ATOM 0 HE3 LYS A 112 1.594 41.981 5.269 1.00 64.50 H new ATOM 0 HZ1 LYS A 112 1.291 44.638 5.528 1.00 53.53 H new ATOM 0 HZ2 LYS A 112 1.096 43.523 6.794 1.00 53.53 H new ATOM 0 HZ3 LYS A 112 2.566 44.354 6.614 1.00 53.53 H new ATOM 1713 N ILE A 113 2.270 39.001 9.295 1.00 33.25 N ATOM 1714 CA ILE A 113 2.036 37.566 9.400 1.00 71.13 C ATOM 1715 C ILE A 113 0.562 37.266 9.653 1.00 64.14 C ATOM 1716 O ILE A 113 0.017 36.298 9.124 1.00 32.22 O ATOM 1717 CB ILE A 113 2.877 36.939 10.528 1.00 72.15 C ATOM 1718 CG1 ILE A 113 4.365 37.199 10.288 1.00 25.03 C ATOM 1719 CG2 ILE A 113 2.603 35.445 10.624 1.00 3.55 C ATOM 1720 CD1 ILE A 113 5.075 37.794 11.485 1.00 72.33 C ATOM 0 H ILE A 113 2.962 39.365 9.950 1.00 33.25 H new ATOM 0 HA ILE A 113 2.335 37.127 8.448 1.00 71.13 H new ATOM 0 HB ILE A 113 2.594 37.402 11.473 1.00 72.15 H new ATOM 0 HG12 ILE A 113 4.850 36.261 10.017 1.00 25.03 H new ATOM 0 HG13 ILE A 113 4.476 37.873 9.438 1.00 25.03 H new ATOM 0 HG21 ILE A 113 3.204 35.016 11.425 1.00 3.55 H new ATOM 0 HG22 ILE A 113 1.546 35.282 10.836 1.00 3.55 H new ATOM 0 HG23 ILE A 113 2.862 34.966 9.680 1.00 3.55 H new ATOM 0 HD11 ILE A 113 6.126 37.952 11.243 1.00 72.33 H new ATOM 0 HD12 ILE A 113 4.615 38.748 11.744 1.00 72.33 H new ATOM 0 HD13 ILE A 113 4.996 37.112 12.331 1.00 72.33 H new ATOM 1732 N GLU A 114 -0.076 38.104 10.463 1.00 51.51 N ATOM 1733 CA GLU A 114 -1.487 37.929 10.785 1.00 75.14 C ATOM 1734 C GLU A 114 -2.353 38.085 9.538 1.00 52.03 C ATOM 1735 O GLU A 114 -3.316 37.345 9.341 1.00 34.34 O ATOM 1736 CB GLU A 114 -1.920 38.939 11.849 1.00 12.31 C ATOM 1737 CG GLU A 114 -2.734 38.325 12.976 1.00 4.21 C ATOM 1738 CD GLU A 114 -3.196 39.354 13.990 1.00 42.04 C ATOM 1739 OE1 GLU A 114 -2.360 39.807 14.799 1.00 33.04 O ATOM 1740 OE2 GLU A 114 -4.394 39.706 13.972 1.00 0.33 O ATOM 0 H GLU A 114 0.362 38.911 10.908 1.00 51.51 H new ATOM 0 HA GLU A 114 -1.621 36.920 11.176 1.00 75.14 H new ATOM 0 HB2 GLU A 114 -1.033 39.414 12.269 1.00 12.31 H new ATOM 0 HB3 GLU A 114 -2.507 39.725 11.374 1.00 12.31 H new ATOM 0 HG2 GLU A 114 -3.603 37.818 12.557 1.00 4.21 H new ATOM 0 HG3 GLU A 114 -2.135 37.567 13.480 1.00 4.21 H new ATOM 1747 N ALA A 115 -2.003 39.054 8.699 1.00 43.33 N ATOM 1748 CA ALA A 115 -2.746 39.307 7.471 1.00 42.44 C ATOM 1749 C ALA A 115 -2.473 38.226 6.431 1.00 21.40 C ATOM 1750 O ALA A 115 -3.324 37.928 5.594 1.00 65.33 O ATOM 1751 CB ALA A 115 -2.393 40.679 6.913 1.00 31.44 C ATOM 0 H ALA A 115 -1.209 39.677 8.847 1.00 43.33 H new ATOM 0 HA ALA A 115 -3.809 39.286 7.709 1.00 42.44 H new ATOM 0 HB1 ALA A 115 -2.955 40.854 5.996 1.00 31.44 H new ATOM 0 HB2 ALA A 115 -2.645 41.446 7.646 1.00 31.44 H new ATOM 0 HB3 ALA A 115 -1.325 40.720 6.698 1.00 31.44 H new ATOM 1757 N ASN A 116 -1.280 37.642 6.491 1.00 75.45 N ATOM 1758 CA ASN A 116 -0.895 36.593 5.553 1.00 53.23 C ATOM 1759 C ASN A 116 -1.723 35.331 5.778 1.00 44.24 C ATOM 1760 O ASN A 116 -2.384 34.838 4.863 1.00 13.21 O ATOM 1761 CB ASN A 116 0.594 36.273 5.697 1.00 32.21 C ATOM 1762 CG ASN A 116 1.389 36.653 4.463 1.00 24.32 C ATOM 1763 OD1 ASN A 116 2.145 35.844 3.925 1.00 23.30 O ATOM 1764 ND2 ASN A 116 1.222 37.889 4.009 1.00 1.42 N ATOM 0 H ASN A 116 -0.564 37.877 7.178 1.00 75.45 H new ATOM 0 HA ASN A 116 -1.086 36.955 4.543 1.00 53.23 H new ATOM 0 HB2 ASN A 116 0.995 36.803 6.561 1.00 32.21 H new ATOM 0 HB3 ASN A 116 0.717 35.207 5.891 1.00 32.21 H new ATOM 0 HD21 ASN A 116 1.731 38.202 3.182 1.00 1.42 H new ATOM 0 HD22 ASN A 116 0.585 38.526 4.487 1.00 1.42 H new ATOM 1771 N LEU A 117 -1.681 34.813 7.000 1.00 0.52 N ATOM 1772 CA LEU A 117 -2.427 33.609 7.347 1.00 73.23 C ATOM 1773 C LEU A 117 -3.927 33.830 7.177 1.00 20.40 C ATOM 1774 O LEU A 117 -4.659 32.917 6.795 1.00 14.34 O ATOM 1775 CB LEU A 117 -2.121 33.192 8.786 1.00 13.04 C ATOM 1776 CG LEU A 117 -2.686 34.097 9.882 1.00 51.33 C ATOM 1777 CD1 LEU A 117 -4.013 33.556 10.391 1.00 61.55 C ATOM 1778 CD2 LEU A 117 -1.691 34.236 11.025 1.00 50.14 C ATOM 0 H LEU A 117 -1.138 35.208 7.768 1.00 0.52 H new ATOM 0 HA LEU A 117 -2.117 32.812 6.671 1.00 73.23 H new ATOM 0 HB2 LEU A 117 -2.506 32.184 8.941 1.00 13.04 H new ATOM 0 HB3 LEU A 117 -1.039 33.142 8.906 1.00 13.04 H new ATOM 0 HG LEU A 117 -2.860 35.085 9.456 1.00 51.33 H new ATOM 0 HD11 LEU A 117 -4.399 34.213 11.170 1.00 61.55 H new ATOM 0 HD12 LEU A 117 -4.727 33.510 9.568 1.00 61.55 H new ATOM 0 HD13 LEU A 117 -3.866 32.556 10.800 1.00 61.55 H new ATOM 0 HD21 LEU A 117 -2.110 34.883 11.795 1.00 50.14 H new ATOM 0 HD22 LEU A 117 -1.485 33.253 11.449 1.00 50.14 H new ATOM 0 HD23 LEU A 117 -0.765 34.671 10.650 1.00 50.14 H new ATOM 1790 N ALA A 118 -4.376 35.048 7.461 1.00 34.42 N ATOM 1791 CA ALA A 118 -5.788 35.390 7.336 1.00 62.41 C ATOM 1792 C ALA A 118 -6.284 35.160 5.912 1.00 31.35 C ATOM 1793 O ALA A 118 -7.312 34.515 5.699 1.00 65.23 O ATOM 1794 CB ALA A 118 -6.019 36.835 7.751 1.00 75.02 C ATOM 0 H ALA A 118 -3.783 35.814 7.779 1.00 34.42 H new ATOM 0 HA ALA A 118 -6.355 34.738 8.000 1.00 62.41 H new ATOM 0 HB1 ALA A 118 -7.077 37.077 7.653 1.00 75.02 H new ATOM 0 HB2 ALA A 118 -5.711 36.970 8.788 1.00 75.02 H new ATOM 0 HB3 ALA A 118 -5.435 37.495 7.110 1.00 75.02 H new ATOM 1800 N LEU A 119 -5.549 35.691 4.942 1.00 53.42 N ATOM 1801 CA LEU A 119 -5.915 35.545 3.537 1.00 34.43 C ATOM 1802 C LEU A 119 -5.843 34.084 3.105 1.00 30.55 C ATOM 1803 O LEU A 119 -6.790 33.549 2.529 1.00 72.22 O ATOM 1804 CB LEU A 119 -4.995 36.394 2.659 1.00 54.13 C ATOM 1805 CG LEU A 119 -5.669 37.518 1.871 1.00 75.12 C ATOM 1806 CD1 LEU A 119 -4.694 38.660 1.629 1.00 35.24 C ATOM 1807 CD2 LEU A 119 -6.214 36.992 0.551 1.00 35.51 C ATOM 0 H LEU A 119 -4.696 36.227 5.102 1.00 53.42 H new ATOM 0 HA LEU A 119 -6.942 35.890 3.417 1.00 34.43 H new ATOM 0 HB2 LEU A 119 -4.225 36.833 3.293 1.00 54.13 H new ATOM 0 HB3 LEU A 119 -4.490 35.735 1.953 1.00 54.13 H new ATOM 0 HG LEU A 119 -6.503 37.898 2.460 1.00 75.12 H new ATOM 0 HD11 LEU A 119 -5.192 39.450 1.067 1.00 35.24 H new ATOM 0 HD12 LEU A 119 -4.352 39.055 2.585 1.00 35.24 H new ATOM 0 HD13 LEU A 119 -3.839 38.294 1.061 1.00 35.24 H new ATOM 0 HD21 LEU A 119 -6.690 37.806 0.004 1.00 35.51 H new ATOM 0 HD22 LEU A 119 -5.396 36.584 -0.044 1.00 35.51 H new ATOM 0 HD23 LEU A 119 -6.946 36.209 0.746 1.00 35.51 H new ATOM 1819 N ARG A 120 -4.714 33.443 3.390 1.00 20.13 N ATOM 1820 CA ARG A 120 -4.519 32.043 3.032 1.00 4.23 C ATOM 1821 C ARG A 120 -5.671 31.185 3.546 1.00 63.30 C ATOM 1822 O ARG A 120 -6.052 30.198 2.916 1.00 42.23 O ATOM 1823 CB ARG A 120 -3.194 31.530 3.599 1.00 23.24 C ATOM 1824 CG ARG A 120 -2.330 30.813 2.575 1.00 44.23 C ATOM 1825 CD ARG A 120 -1.476 31.792 1.783 1.00 12.14 C ATOM 1826 NE ARG A 120 -0.196 31.209 1.390 1.00 35.20 N ATOM 1827 CZ ARG A 120 0.617 31.757 0.494 1.00 74.00 C ATOM 1828 NH1 ARG A 120 0.285 32.896 -0.098 1.00 12.11 N ATOM 1829 NH2 ARG A 120 1.765 31.166 0.189 1.00 73.12 N ATOM 0 H ARG A 120 -3.921 33.871 3.868 1.00 20.13 H new ATOM 0 HA ARG A 120 -4.493 31.972 1.945 1.00 4.23 H new ATOM 0 HB2 ARG A 120 -2.634 32.371 4.009 1.00 23.24 H new ATOM 0 HB3 ARG A 120 -3.401 30.851 4.426 1.00 23.24 H new ATOM 0 HG2 ARG A 120 -1.686 30.093 3.081 1.00 44.23 H new ATOM 0 HG3 ARG A 120 -2.965 30.248 1.893 1.00 44.23 H new ATOM 0 HD2 ARG A 120 -2.019 32.108 0.892 1.00 12.14 H new ATOM 0 HD3 ARG A 120 -1.299 32.685 2.382 1.00 12.14 H new ATOM 0 HE ARG A 120 0.089 30.333 1.828 1.00 35.20 H new ATOM 0 HH11 ARG A 120 -0.597 33.353 0.134 1.00 12.11 H new ATOM 0 HH12 ARG A 120 0.911 33.315 -0.786 1.00 12.11 H new ATOM 0 HH21 ARG A 120 2.024 30.290 0.643 1.00 73.12 H new ATOM 0 HH22 ARG A 120 2.389 31.588 -0.499 1.00 73.12 H new ATOM 1843 N ARG A 121 -6.221 31.567 4.694 1.00 65.20 N ATOM 1844 CA ARG A 121 -7.328 30.831 5.293 1.00 4.31 C ATOM 1845 C ARG A 121 -8.600 30.995 4.466 1.00 25.51 C ATOM 1846 O ARG A 121 -9.198 30.012 4.030 1.00 72.03 O ATOM 1847 CB ARG A 121 -7.572 31.312 6.725 1.00 50.24 C ATOM 1848 CG ARG A 121 -8.745 30.626 7.406 1.00 41.23 C ATOM 1849 CD ARG A 121 -9.136 31.337 8.692 1.00 43.11 C ATOM 1850 NE ARG A 121 -8.067 31.295 9.687 1.00 75.01 N ATOM 1851 CZ ARG A 121 -8.095 31.981 10.824 1.00 21.00 C ATOM 1852 NH1 ARG A 121 -9.131 32.757 11.109 1.00 52.41 N ATOM 1853 NH2 ARG A 121 -7.084 31.891 11.679 1.00 35.44 N ATOM 0 H ARG A 121 -5.918 32.382 5.228 1.00 65.20 H new ATOM 0 HA ARG A 121 -7.061 29.774 5.312 1.00 4.31 H new ATOM 0 HB2 ARG A 121 -6.671 31.143 7.315 1.00 50.24 H new ATOM 0 HB3 ARG A 121 -7.748 32.388 6.713 1.00 50.24 H new ATOM 0 HG2 ARG A 121 -9.598 30.603 6.728 1.00 41.23 H new ATOM 0 HG3 ARG A 121 -8.485 29.591 7.626 1.00 41.23 H new ATOM 0 HD2 ARG A 121 -9.385 32.375 8.471 1.00 43.11 H new ATOM 0 HD3 ARG A 121 -10.033 30.874 9.104 1.00 43.11 H new ATOM 0 HE ARG A 121 -7.255 30.707 9.498 1.00 75.01 H new ATOM 0 HH11 ARG A 121 -9.910 32.829 10.454 1.00 52.41 H new ATOM 0 HH12 ARG A 121 -9.149 33.282 11.983 1.00 52.41 H new ATOM 0 HH21 ARG A 121 -6.285 31.295 11.463 1.00 35.44 H new ATOM 0 HH22 ARG A 121 -7.106 32.418 12.552 1.00 35.44 H new ATOM 1867 N ALA A 122 -9.006 32.242 4.256 1.00 52.14 N ATOM 1868 CA ALA A 122 -10.205 32.534 3.480 1.00 15.12 C ATOM 1869 C ALA A 122 -10.128 31.908 2.092 1.00 22.31 C ATOM 1870 O ALA A 122 -11.118 31.384 1.581 1.00 42.33 O ATOM 1871 CB ALA A 122 -10.411 34.038 3.372 1.00 20.21 C ATOM 0 H ALA A 122 -8.523 33.067 4.612 1.00 52.14 H new ATOM 0 HA ALA A 122 -11.058 32.098 3.999 1.00 15.12 H new ATOM 0 HB1 ALA A 122 -11.310 34.241 2.790 1.00 20.21 H new ATOM 0 HB2 ALA A 122 -10.521 34.463 4.370 1.00 20.21 H new ATOM 0 HB3 ALA A 122 -9.550 34.489 2.879 1.00 20.21 H new ATOM 1877 N ARG A 123 -8.946 31.965 1.487 1.00 2.33 N ATOM 1878 CA ARG A 123 -8.740 31.405 0.157 1.00 11.11 C ATOM 1879 C ARG A 123 -9.107 29.924 0.128 1.00 11.31 C ATOM 1880 O ARG A 123 -9.925 29.492 -0.684 1.00 75.41 O ATOM 1881 CB ARG A 123 -7.285 31.589 -0.278 1.00 10.53 C ATOM 1882 CG ARG A 123 -7.110 32.588 -1.410 1.00 63.34 C ATOM 1883 CD ARG A 123 -5.785 33.326 -1.302 1.00 43.11 C ATOM 1884 NE ARG A 123 -4.885 33.001 -2.406 1.00 31.13 N ATOM 1885 CZ ARG A 123 -3.582 33.260 -2.393 1.00 13.14 C ATOM 1886 NH1 ARG A 123 -3.030 33.844 -1.339 1.00 2.55 N ATOM 1887 NH2 ARG A 123 -2.829 32.934 -3.435 1.00 73.13 N ATOM 0 H ARG A 123 -8.116 32.394 1.897 1.00 2.33 H new ATOM 0 HA ARG A 123 -9.390 31.937 -0.538 1.00 11.11 H new ATOM 0 HB2 ARG A 123 -6.697 31.917 0.579 1.00 10.53 H new ATOM 0 HB3 ARG A 123 -6.883 30.625 -0.590 1.00 10.53 H new ATOM 0 HG2 ARG A 123 -7.161 32.068 -2.367 1.00 63.34 H new ATOM 0 HG3 ARG A 123 -7.930 33.306 -1.393 1.00 63.34 H new ATOM 0 HD2 ARG A 123 -5.969 34.400 -1.288 1.00 43.11 H new ATOM 0 HD3 ARG A 123 -5.305 33.073 -0.357 1.00 43.11 H new ATOM 0 HE ARG A 123 -5.279 32.551 -3.232 1.00 31.13 H new ATOM 0 HH11 ARG A 123 -3.606 34.096 -0.536 1.00 2.55 H new ATOM 0 HH12 ARG A 123 -2.029 34.042 -1.331 1.00 2.55 H new ATOM 0 HH21 ARG A 123 -3.250 32.484 -4.248 1.00 73.13 H new ATOM 0 HH22 ARG A 123 -1.829 33.133 -3.424 1.00 73.13 H new ATOM 1901 N THR A 124 -8.496 29.151 1.020 1.00 63.31 N ATOM 1902 CA THR A 124 -8.756 27.719 1.096 1.00 73.33 C ATOM 1903 C THR A 124 -10.233 27.441 1.353 1.00 51.44 C ATOM 1904 O THR A 124 -10.793 26.478 0.830 1.00 33.44 O ATOM 1905 CB THR A 124 -7.920 27.054 2.205 1.00 31.42 C ATOM 1906 OG1 THR A 124 -7.592 28.015 3.215 1.00 74.13 O ATOM 1907 CG2 THR A 124 -6.644 26.454 1.635 1.00 5.10 C ATOM 0 H THR A 124 -7.817 29.493 1.700 1.00 63.31 H new ATOM 0 HA THR A 124 -8.471 27.295 0.133 1.00 73.33 H new ATOM 0 HB THR A 124 -8.514 26.253 2.646 1.00 31.42 H new ATOM 0 HG1 THR A 124 -8.403 28.492 3.488 1.00 74.13 H new ATOM 0 HG21 THR A 124 -6.070 25.990 2.437 1.00 5.10 H new ATOM 0 HG22 THR A 124 -6.898 25.702 0.888 1.00 5.10 H new ATOM 0 HG23 THR A 124 -6.048 27.240 1.170 1.00 5.10 H new ATOM 1915 N ARG A 125 -10.859 28.292 2.159 1.00 5.44 N ATOM 1916 CA ARG A 125 -12.271 28.138 2.486 1.00 50.03 C ATOM 1917 C ARG A 125 -13.140 28.340 1.248 1.00 72.11 C ATOM 1918 O ARG A 125 -14.161 27.673 1.077 1.00 23.23 O ATOM 1919 CB ARG A 125 -12.677 29.133 3.575 1.00 45.14 C ATOM 1920 CG ARG A 125 -14.154 29.082 3.927 1.00 53.04 C ATOM 1921 CD ARG A 125 -14.886 30.324 3.442 1.00 5.45 C ATOM 1922 NE ARG A 125 -16.330 30.217 3.630 1.00 2.44 N ATOM 1923 CZ ARG A 125 -16.927 30.321 4.812 1.00 2.15 C ATOM 1924 NH1 ARG A 125 -16.208 30.534 5.906 1.00 65.42 N ATOM 1925 NH2 ARG A 125 -18.246 30.213 4.903 1.00 72.54 N ATOM 0 H ARG A 125 -10.410 29.096 2.598 1.00 5.44 H new ATOM 0 HA ARG A 125 -12.424 27.124 2.856 1.00 50.03 H new ATOM 0 HB2 ARG A 125 -12.091 28.935 4.473 1.00 45.14 H new ATOM 0 HB3 ARG A 125 -12.425 30.141 3.246 1.00 45.14 H new ATOM 0 HG2 ARG A 125 -14.605 28.195 3.481 1.00 53.04 H new ATOM 0 HG3 ARG A 125 -14.269 28.989 5.007 1.00 53.04 H new ATOM 0 HD2 ARG A 125 -14.514 31.197 3.979 1.00 5.45 H new ATOM 0 HD3 ARG A 125 -14.669 30.483 2.386 1.00 5.45 H new ATOM 0 HE ARG A 125 -16.912 30.053 2.809 1.00 2.44 H new ATOM 0 HH11 ARG A 125 -15.194 30.618 5.841 1.00 65.42 H new ATOM 0 HH12 ARG A 125 -16.670 30.613 6.812 1.00 65.42 H new ATOM 0 HH21 ARG A 125 -18.803 30.050 4.065 1.00 72.54 H new ATOM 0 HH22 ARG A 125 -18.703 30.293 5.811 1.00 72.54 H new ATOM 1939 N VAL A 126 -12.729 29.265 0.387 1.00 43.23 N ATOM 1940 CA VAL A 126 -13.469 29.555 -0.836 1.00 22.04 C ATOM 1941 C VAL A 126 -13.512 28.339 -1.754 1.00 24.44 C ATOM 1942 O VAL A 126 -14.584 27.899 -2.167 1.00 22.30 O ATOM 1943 CB VAL A 126 -12.848 30.740 -1.600 1.00 35.31 C ATOM 1944 CG1 VAL A 126 -13.624 31.015 -2.879 1.00 51.00 C ATOM 1945 CG2 VAL A 126 -12.803 31.978 -0.717 1.00 73.30 C ATOM 0 H VAL A 126 -11.887 29.827 0.514 1.00 43.23 H new ATOM 0 HA VAL A 126 -14.484 29.817 -0.537 1.00 22.04 H new ATOM 0 HB VAL A 126 -11.825 30.479 -1.872 1.00 35.31 H new ATOM 0 HG11 VAL A 126 -13.171 31.855 -3.406 1.00 51.00 H new ATOM 0 HG12 VAL A 126 -13.600 30.131 -3.517 1.00 51.00 H new ATOM 0 HG13 VAL A 126 -14.658 31.256 -2.633 1.00 51.00 H new ATOM 0 HG21 VAL A 126 -12.361 32.805 -1.273 1.00 73.30 H new ATOM 0 HG22 VAL A 126 -13.815 32.245 -0.412 1.00 73.30 H new ATOM 0 HG23 VAL A 126 -12.200 31.772 0.168 1.00 73.30 H new ATOM 1955 N GLU A 127 -12.338 27.800 -2.068 1.00 23.40 N ATOM 1956 CA GLU A 127 -12.242 26.633 -2.938 1.00 1.31 C ATOM 1957 C GLU A 127 -12.947 25.431 -2.316 1.00 4.21 C ATOM 1958 O GLU A 127 -13.488 24.582 -3.023 1.00 31.33 O ATOM 1959 CB GLU A 127 -10.776 26.293 -3.212 1.00 45.12 C ATOM 1960 CG GLU A 127 -10.584 25.287 -4.335 1.00 23.05 C ATOM 1961 CD GLU A 127 -9.886 24.023 -3.872 1.00 23.21 C ATOM 1962 OE1 GLU A 127 -10.525 23.219 -3.161 1.00 1.43 O ATOM 1963 OE2 GLU A 127 -8.701 23.837 -4.220 1.00 52.04 O ATOM 0 H GLU A 127 -11.441 28.152 -1.733 1.00 23.40 H new ATOM 0 HA GLU A 127 -12.734 26.873 -3.881 1.00 1.31 H new ATOM 0 HB2 GLU A 127 -10.240 27.209 -3.460 1.00 45.12 H new ATOM 0 HB3 GLU A 127 -10.327 25.898 -2.301 1.00 45.12 H new ATOM 0 HG2 GLU A 127 -11.556 25.028 -4.756 1.00 23.05 H new ATOM 0 HG3 GLU A 127 -10.003 25.747 -5.134 1.00 23.05 H new ATOM 1970 N ALA A 128 -12.934 25.367 -0.989 1.00 13.25 N ATOM 1971 CA ALA A 128 -13.573 24.271 -0.271 1.00 2.04 C ATOM 1972 C ALA A 128 -15.092 24.367 -0.360 1.00 50.14 C ATOM 1973 O ALA A 128 -15.773 23.371 -0.601 1.00 74.42 O ATOM 1974 CB ALA A 128 -13.128 24.263 1.184 1.00 24.33 C ATOM 0 H ALA A 128 -12.488 26.061 -0.389 1.00 13.25 H new ATOM 0 HA ALA A 128 -13.266 23.336 -0.739 1.00 2.04 H new ATOM 0 HB1 ALA A 128 -13.613 23.440 1.708 1.00 24.33 H new ATOM 0 HB2 ALA A 128 -12.046 24.138 1.233 1.00 24.33 H new ATOM 0 HB3 ALA A 128 -13.406 25.206 1.655 1.00 24.33 H new ATOM 1980 N SER A 129 -15.617 25.573 -0.165 1.00 23.44 N ATOM 1981 CA SER A 129 -17.056 25.798 -0.219 1.00 75.41 C ATOM 1982 C SER A 129 -17.582 25.613 -1.639 1.00 62.15 C ATOM 1983 O SER A 129 -18.735 25.235 -1.842 1.00 63.31 O ATOM 1984 CB SER A 129 -17.394 27.203 0.283 1.00 63.11 C ATOM 1985 OG SER A 129 -18.430 27.165 1.248 1.00 32.54 O ATOM 0 H SER A 129 -15.067 26.409 0.032 1.00 23.44 H new ATOM 0 HA SER A 129 -17.537 25.064 0.427 1.00 75.41 H new ATOM 0 HB2 SER A 129 -16.505 27.661 0.717 1.00 63.11 H new ATOM 0 HB3 SER A 129 -17.697 27.829 -0.556 1.00 63.11 H new ATOM 0 HG SER A 129 -18.626 28.075 1.554 1.00 32.54 H new ATOM 1991 N ASN A 130 -16.726 25.883 -2.620 1.00 11.31 N ATOM 1992 CA ASN A 130 -17.103 25.748 -4.022 1.00 70.13 C ATOM 1993 C ASN A 130 -16.150 24.807 -4.753 1.00 50.23 C ATOM 1994 O ASN A 130 -15.679 25.111 -5.850 1.00 22.21 O ATOM 1995 CB ASN A 130 -17.109 27.117 -4.705 1.00 11.33 C ATOM 1996 CG ASN A 130 -17.760 27.078 -6.074 1.00 63.00 C ATOM 1997 OD1 ASN A 130 -18.664 26.280 -6.321 1.00 61.12 O ATOM 1998 ND2 ASN A 130 -17.301 27.942 -6.972 1.00 3.00 N ATOM 0 H ASN A 130 -15.767 26.196 -2.469 1.00 11.31 H new ATOM 0 HA ASN A 130 -18.107 25.325 -4.063 1.00 70.13 H new ATOM 0 HB2 ASN A 130 -17.638 27.832 -4.075 1.00 11.33 H new ATOM 0 HB3 ASN A 130 -16.084 27.475 -4.803 1.00 11.33 H new ATOM 0 HD21 ASN A 130 -17.700 27.962 -7.911 1.00 3.00 H new ATOM 0 HD22 ASN A 130 -16.550 28.586 -6.723 1.00 3.00 H new ATOM 2005 N THR A 131 -15.870 23.662 -4.139 1.00 11.03 N ATOM 2006 CA THR A 131 -14.973 22.677 -4.730 1.00 34.34 C ATOM 2007 C THR A 131 -15.456 22.254 -6.112 1.00 62.14 C ATOM 2008 O THR A 131 -14.652 22.008 -7.012 1.00 23.51 O ATOM 2009 CB THR A 131 -14.846 21.427 -3.838 1.00 74.23 C ATOM 2010 OG1 THR A 131 -15.596 21.607 -2.632 1.00 14.11 O ATOM 2011 CG2 THR A 131 -13.390 21.150 -3.499 1.00 64.11 C ATOM 0 H THR A 131 -16.252 23.394 -3.232 1.00 11.03 H new ATOM 0 HA THR A 131 -13.996 23.152 -4.819 1.00 34.34 H new ATOM 0 HB THR A 131 -15.243 20.574 -4.388 1.00 74.23 H new ATOM 0 HG1 THR A 131 -15.213 22.347 -2.116 1.00 14.11 H new ATOM 0 HG21 THR A 131 -13.326 20.263 -2.869 1.00 64.11 H new ATOM 0 HG22 THR A 131 -12.828 20.984 -4.418 1.00 64.11 H new ATOM 0 HG23 THR A 131 -12.971 22.004 -2.967 1.00 64.11 H new ATOM 2019 N ILE A 132 -16.772 22.172 -6.275 1.00 40.45 N ATOM 2020 CA ILE A 132 -17.361 21.781 -7.550 1.00 65.12 C ATOM 2021 C ILE A 132 -18.884 21.780 -7.475 1.00 64.32 C ATOM 2022 O ILE A 132 -19.483 20.922 -6.827 1.00 63.32 O ATOM 2023 CB ILE A 132 -16.878 20.385 -7.988 1.00 52.41 C ATOM 2024 CG1 ILE A 132 -17.634 19.929 -9.238 1.00 12.42 C ATOM 2025 CG2 ILE A 132 -17.060 19.384 -6.858 1.00 25.53 C ATOM 2026 CD1 ILE A 132 -16.832 19.005 -10.126 1.00 25.42 C ATOM 0 H ILE A 132 -17.451 22.371 -5.540 1.00 40.45 H new ATOM 0 HA ILE A 132 -17.037 22.516 -8.286 1.00 65.12 H new ATOM 0 HB ILE A 132 -15.817 20.443 -8.229 1.00 52.41 H new ATOM 0 HG12 ILE A 132 -18.550 19.423 -8.934 1.00 12.42 H new ATOM 0 HG13 ILE A 132 -17.930 20.806 -9.814 1.00 12.42 H new ATOM 0 HG21 ILE A 132 -16.714 18.402 -7.182 1.00 25.53 H new ATOM 0 HG22 ILE A 132 -16.482 19.704 -5.991 1.00 25.53 H new ATOM 0 HG23 ILE A 132 -18.115 19.327 -6.589 1.00 25.53 H new ATOM 0 HD11 ILE A 132 -17.431 18.723 -10.992 1.00 25.42 H new ATOM 0 HD12 ILE A 132 -15.928 19.515 -10.460 1.00 25.42 H new ATOM 0 HD13 ILE A 132 -16.558 18.110 -9.567 1.00 25.42 H new ATOM 2038 N SER A 133 -19.504 22.746 -8.144 1.00 53.13 N ATOM 2039 CA SER A 133 -20.958 22.858 -8.152 1.00 52.12 C ATOM 2040 C SER A 133 -21.546 22.212 -9.403 1.00 31.21 C ATOM 2041 O SER A 133 -21.003 22.349 -10.499 1.00 73.52 O ATOM 2042 CB SER A 133 -21.378 24.327 -8.078 1.00 50.42 C ATOM 2043 OG SER A 133 -21.086 24.878 -6.805 1.00 74.42 O ATOM 0 H SER A 133 -19.023 23.462 -8.688 1.00 53.13 H new ATOM 0 HA SER A 133 -21.343 22.333 -7.278 1.00 52.12 H new ATOM 0 HB2 SER A 133 -20.861 24.896 -8.851 1.00 50.42 H new ATOM 0 HB3 SER A 133 -22.446 24.414 -8.279 1.00 50.42 H new ATOM 0 HG SER A 133 -20.211 25.319 -6.832 1.00 74.42 H new ATOM 2049 N SER A 134 -22.660 21.507 -9.230 1.00 4.15 N ATOM 2050 CA SER A 134 -23.320 20.836 -10.343 1.00 34.44 C ATOM 2051 C SER A 134 -24.789 20.574 -10.025 1.00 15.35 C ATOM 2052 O SER A 134 -25.167 20.427 -8.863 1.00 45.31 O ATOM 2053 CB SER A 134 -22.614 19.517 -10.662 1.00 43.05 C ATOM 2054 OG SER A 134 -23.221 18.868 -11.766 1.00 62.31 O ATOM 0 H SER A 134 -23.124 21.386 -8.330 1.00 4.15 H new ATOM 0 HA SER A 134 -23.265 21.490 -11.213 1.00 34.44 H new ATOM 0 HB2 SER A 134 -21.563 19.707 -10.880 1.00 43.05 H new ATOM 0 HB3 SER A 134 -22.645 18.864 -9.790 1.00 43.05 H new ATOM 0 HG SER A 134 -22.751 18.028 -11.951 1.00 62.31 H new TER 2060 SER A 134