USER MOD reduce.3.24.130724 H: found=0, std=0, add=994, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 988 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 89 GLN : amide:sc= 0 X(o=-0.32,f=-0.32) USER MOD Set 1.2: A 90 GLN : amide:sc= -0.322 K(o=-0.32,f=-3.9!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0184 X(o=-0.018,f=-0.033) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN :FLIP amide:sc= -0.161 F(o=-1.1,f=-0.16) USER MOD Single : A 18 SER OG : rot 180:sc= -0.185 USER MOD Single : A 20 SER OG : rot 42:sc= 0.419 USER MOD Single : A 21 LYS NZ :NH3+ -114:sc= -0.116 (180deg=-1.55!) USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.311 USER MOD Single : A 48 HIS : no HD1:sc= -0.0704 K(o=-0.07,f=-0.85) USER MOD Single : A 51 THR OG1 : rot 24:sc= 0.891 USER MOD Single : A 58 LYS NZ :NH3+ -167:sc= -1.48 (180deg=-2.2) USER MOD Single : A 64 ASN : amide:sc= -0.0293 X(o=-0.029,f=0) USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0942 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -113:sc= 0.113 (180deg=-0.12) USER MOD Single : A 76 LYS NZ :NH3+ -123:sc= 0.179 (180deg=-0.47) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 81:sc= 1.13 USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot 77:sc= 0.0786 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 GLN : amide:sc= -0.704 K(o=-0.7,f=-1.4) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 20:sc= 0.794 USER MOD Single : A 121 THR OG1 : rot 71:sc= 0.892 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.853 19.421 84.114 1.00 0.00 N ATOM 2 CA GLY A 1 17.108 19.837 82.747 1.00 0.00 C ATOM 3 C GLY A 1 18.196 20.888 82.655 1.00 0.00 C ATOM 4 O GLY A 1 17.940 22.076 82.852 1.00 0.00 O ATOM 0 H1 GLY A 1 16.102 18.702 84.124 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.721 19.020 84.523 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.553 20.243 84.677 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.395 18.969 82.154 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.189 20.231 82.313 1.00 0.00 H new ATOM 8 N SER A 2 19.415 20.451 82.356 1.00 0.00 N ATOM 9 CA SER A 2 20.548 21.362 82.244 1.00 0.00 C ATOM 10 C SER A 2 21.456 20.961 81.085 1.00 0.00 C ATOM 11 O SER A 2 22.585 20.509 81.275 1.00 0.00 O ATOM 12 CB SER A 2 21.346 21.381 83.549 1.00 0.00 C ATOM 13 OG SER A 2 22.278 22.448 83.561 1.00 0.00 O ATOM 0 H SER A 2 19.643 19.471 82.187 1.00 0.00 H new ATOM 0 HA SER A 2 20.160 22.362 82.049 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.665 21.480 84.394 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.871 20.434 83.672 1.00 0.00 H new ATOM 0 HG SER A 2 22.774 22.439 84.406 1.00 0.00 H new ATOM 19 N PRO A 3 20.951 21.128 79.854 1.00 0.00 N ATOM 20 CA PRO A 3 21.699 20.790 78.639 1.00 0.00 C ATOM 21 C PRO A 3 22.868 21.738 78.395 1.00 0.00 C ATOM 22 O PRO A 3 22.795 22.925 78.716 1.00 0.00 O ATOM 23 CB PRO A 3 20.655 20.932 77.529 1.00 0.00 C ATOM 24 CG PRO A 3 19.657 21.897 78.068 1.00 0.00 C ATOM 25 CD PRO A 3 19.612 21.661 79.552 1.00 0.00 C ATOM 0 HA PRO A 3 22.146 19.798 78.699 1.00 0.00 H new ATOM 0 HB2 PRO A 3 21.105 21.301 76.607 1.00 0.00 H new ATOM 0 HB3 PRO A 3 20.192 19.973 77.296 1.00 0.00 H new ATOM 0 HG2 PRO A 3 19.947 22.924 77.845 1.00 0.00 H new ATOM 0 HG3 PRO A 3 18.677 21.737 77.618 1.00 0.00 H new ATOM 0 HD2 PRO A 3 19.414 22.582 80.099 1.00 0.00 H new ATOM 0 HD3 PRO A 3 18.828 20.954 79.823 1.00 0.00 H new ATOM 33 N PHE A 4 23.945 21.208 77.825 1.00 0.00 N ATOM 34 CA PHE A 4 25.130 22.008 77.539 1.00 0.00 C ATOM 35 C PHE A 4 25.539 21.868 76.075 1.00 0.00 C ATOM 36 O PHE A 4 25.510 20.774 75.513 1.00 0.00 O ATOM 37 CB PHE A 4 26.288 21.586 78.446 1.00 0.00 C ATOM 38 CG PHE A 4 26.171 22.109 79.849 1.00 0.00 C ATOM 39 CD1 PHE A 4 26.382 23.451 80.122 1.00 0.00 C ATOM 40 CD2 PHE A 4 25.850 21.259 80.895 1.00 0.00 C ATOM 41 CE1 PHE A 4 26.275 23.936 81.412 1.00 0.00 C ATOM 42 CE2 PHE A 4 25.741 21.739 82.187 1.00 0.00 C ATOM 43 CZ PHE A 4 25.955 23.079 82.446 1.00 0.00 C ATOM 0 H PHE A 4 24.022 20.228 77.552 1.00 0.00 H new ATOM 0 HA PHE A 4 24.888 23.053 77.733 1.00 0.00 H new ATOM 0 HB2 PHE A 4 26.338 20.498 78.475 1.00 0.00 H new ATOM 0 HB3 PHE A 4 27.225 21.937 78.013 1.00 0.00 H new ATOM 0 HD1 PHE A 4 26.633 24.126 79.317 1.00 0.00 H new ATOM 0 HD2 PHE A 4 25.683 20.210 80.699 1.00 0.00 H new ATOM 0 HE1 PHE A 4 26.442 24.984 81.611 1.00 0.00 H new ATOM 0 HE2 PHE A 4 25.489 21.067 82.994 1.00 0.00 H new ATOM 0 HZ PHE A 4 25.872 23.455 83.455 1.00 0.00 H new ATOM 53 N ALA A 5 25.920 22.986 75.465 1.00 0.00 N ATOM 54 CA ALA A 5 26.337 22.989 74.068 1.00 0.00 C ATOM 55 C ALA A 5 27.059 24.284 73.713 1.00 0.00 C ATOM 56 O ALA A 5 26.501 25.374 73.848 1.00 0.00 O ATOM 57 CB ALA A 5 25.134 22.787 73.158 1.00 0.00 C ATOM 0 H ALA A 5 25.948 23.900 75.916 1.00 0.00 H new ATOM 0 HA ALA A 5 27.033 22.164 73.921 1.00 0.00 H new ATOM 0 HB1 ALA A 5 25.460 22.791 72.118 1.00 0.00 H new ATOM 0 HB2 ALA A 5 24.661 21.832 73.386 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.418 23.593 73.317 1.00 0.00 H new ATOM 63 N ASP A 6 28.301 24.159 73.261 1.00 0.00 N ATOM 64 CA ASP A 6 29.100 25.320 72.887 1.00 0.00 C ATOM 65 C ASP A 6 29.163 25.471 71.370 1.00 0.00 C ATOM 66 O ASP A 6 28.911 24.529 70.617 1.00 0.00 O ATOM 67 CB ASP A 6 30.513 25.201 73.459 1.00 0.00 C ATOM 68 CG ASP A 6 30.623 25.781 74.855 1.00 0.00 C ATOM 69 OD1 ASP A 6 30.323 26.981 75.024 1.00 0.00 O ATOM 70 OD2 ASP A 6 31.011 25.035 75.779 1.00 0.00 O ATOM 0 H ASP A 6 28.777 23.265 73.144 1.00 0.00 H new ATOM 0 HA ASP A 6 28.622 26.207 73.303 1.00 0.00 H new ATOM 0 HB2 ASP A 6 30.806 24.151 73.481 1.00 0.00 H new ATOM 0 HB3 ASP A 6 31.213 25.714 72.799 1.00 0.00 H new ATOM 75 N PRO A 7 29.506 26.682 70.909 1.00 0.00 N ATOM 76 CA PRO A 7 29.610 26.985 69.478 1.00 0.00 C ATOM 77 C PRO A 7 30.800 26.291 68.824 1.00 0.00 C ATOM 78 O PRO A 7 31.892 26.248 69.388 1.00 0.00 O ATOM 79 CB PRO A 7 29.794 28.504 69.449 1.00 0.00 C ATOM 80 CG PRO A 7 30.395 28.838 70.770 1.00 0.00 C ATOM 81 CD PRO A 7 29.819 27.851 71.748 1.00 0.00 C ATOM 0 HA PRO A 7 28.738 26.637 68.923 1.00 0.00 H new ATOM 0 HB2 PRO A 7 30.445 28.808 68.630 1.00 0.00 H new ATOM 0 HB3 PRO A 7 28.842 29.015 69.306 1.00 0.00 H new ATOM 0 HG2 PRO A 7 31.482 28.763 70.734 1.00 0.00 H new ATOM 0 HG3 PRO A 7 30.155 29.861 71.061 1.00 0.00 H new ATOM 0 HD2 PRO A 7 30.532 27.602 72.534 1.00 0.00 H new ATOM 0 HD3 PRO A 7 28.928 28.244 72.238 1.00 0.00 H new ATOM 89 N ASN A 8 30.580 25.749 67.630 1.00 0.00 N ATOM 90 CA ASN A 8 31.635 25.057 66.899 1.00 0.00 C ATOM 91 C ASN A 8 31.868 25.704 65.537 1.00 0.00 C ATOM 92 O ASN A 8 30.922 26.108 64.860 1.00 0.00 O ATOM 93 CB ASN A 8 31.277 23.581 66.720 1.00 0.00 C ATOM 94 CG ASN A 8 29.826 23.382 66.324 1.00 0.00 C ATOM 95 OD1 ASN A 8 29.411 23.765 65.230 1.00 0.00 O ATOM 96 ND2 ASN A 8 29.047 22.780 67.216 1.00 0.00 N ATOM 0 H ASN A 8 29.681 25.776 67.149 1.00 0.00 H new ATOM 0 HA ASN A 8 32.554 25.133 67.480 1.00 0.00 H new ATOM 0 HB2 ASN A 8 31.922 23.143 65.958 1.00 0.00 H new ATOM 0 HB3 ASN A 8 31.474 23.047 67.650 1.00 0.00 H new ATOM 0 HD21 ASN A 8 28.062 22.619 67.006 1.00 0.00 H new ATOM 0 HD22 ASN A 8 29.434 22.479 68.111 1.00 0.00 H new ATOM 103 N SER A 9 33.133 25.799 65.140 1.00 0.00 N ATOM 104 CA SER A 9 33.490 26.399 63.861 1.00 0.00 C ATOM 105 C SER A 9 34.834 25.870 63.369 1.00 0.00 C ATOM 106 O SER A 9 35.522 25.135 64.078 1.00 0.00 O ATOM 107 CB SER A 9 33.544 27.923 63.986 1.00 0.00 C ATOM 108 OG SER A 9 34.361 28.317 65.075 1.00 0.00 O ATOM 0 H SER A 9 33.928 25.468 65.687 1.00 0.00 H new ATOM 0 HA SER A 9 32.724 26.128 63.134 1.00 0.00 H new ATOM 0 HB2 SER A 9 33.931 28.353 63.062 1.00 0.00 H new ATOM 0 HB3 SER A 9 32.536 28.316 64.123 1.00 0.00 H new ATOM 0 HG SER A 9 34.380 29.295 65.132 1.00 0.00 H new ATOM 114 N LEU A 10 35.202 26.250 62.150 1.00 0.00 N ATOM 115 CA LEU A 10 36.463 25.814 61.561 1.00 0.00 C ATOM 116 C LEU A 10 37.000 26.860 60.588 1.00 0.00 C ATOM 117 O LEU A 10 36.233 27.536 59.904 1.00 0.00 O ATOM 118 CB LEU A 10 36.278 24.478 60.840 1.00 0.00 C ATOM 119 CG LEU A 10 35.819 23.305 61.708 1.00 0.00 C ATOM 120 CD1 LEU A 10 35.386 22.135 60.838 1.00 0.00 C ATOM 121 CD2 LEU A 10 36.926 22.882 62.662 1.00 0.00 C ATOM 0 H LEU A 10 34.645 26.859 61.551 1.00 0.00 H new ATOM 0 HA LEU A 10 37.187 25.688 62.366 1.00 0.00 H new ATOM 0 HB2 LEU A 10 35.552 24.618 60.039 1.00 0.00 H new ATOM 0 HB3 LEU A 10 37.223 24.208 60.369 1.00 0.00 H new ATOM 0 HG LEU A 10 34.962 23.628 62.299 1.00 0.00 H new ATOM 0 HD11 LEU A 10 35.063 21.310 61.473 1.00 0.00 H new ATOM 0 HD12 LEU A 10 34.561 22.444 60.197 1.00 0.00 H new ATOM 0 HD13 LEU A 10 36.224 21.811 60.220 1.00 0.00 H new ATOM 0 HD21 LEU A 10 36.582 22.047 63.271 1.00 0.00 H new ATOM 0 HD22 LEU A 10 37.802 22.577 62.090 1.00 0.00 H new ATOM 0 HD23 LEU A 10 37.188 23.719 63.309 1.00 0.00 H new ATOM 133 N ALA A 11 38.321 26.984 60.531 1.00 0.00 N ATOM 134 CA ALA A 11 38.960 27.944 59.639 1.00 0.00 C ATOM 135 C ALA A 11 40.190 27.338 58.971 1.00 0.00 C ATOM 136 O ALA A 11 41.001 26.678 59.622 1.00 0.00 O ATOM 137 CB ALA A 11 39.340 29.203 60.403 1.00 0.00 C ATOM 0 H ALA A 11 38.970 26.432 61.092 1.00 0.00 H new ATOM 0 HA ALA A 11 38.246 28.207 58.858 1.00 0.00 H new ATOM 0 HB1 ALA A 11 39.816 29.911 59.724 1.00 0.00 H new ATOM 0 HB2 ALA A 11 38.444 29.655 60.828 1.00 0.00 H new ATOM 0 HB3 ALA A 11 40.033 28.947 61.205 1.00 0.00 H new ATOM 143 N LEU A 12 40.322 27.565 57.669 1.00 0.00 N ATOM 144 CA LEU A 12 41.453 27.040 56.911 1.00 0.00 C ATOM 145 C LEU A 12 41.734 27.903 55.685 1.00 0.00 C ATOM 146 O LEU A 12 40.813 28.341 54.997 1.00 0.00 O ATOM 147 CB LEU A 12 41.179 25.598 56.482 1.00 0.00 C ATOM 148 CG LEU A 12 42.398 24.786 56.040 1.00 0.00 C ATOM 149 CD1 LEU A 12 43.279 24.453 57.233 1.00 0.00 C ATOM 150 CD2 LEU A 12 41.961 23.515 55.326 1.00 0.00 C ATOM 0 H LEU A 12 39.660 28.109 57.116 1.00 0.00 H new ATOM 0 HA LEU A 12 42.332 27.060 57.556 1.00 0.00 H new ATOM 0 HB2 LEU A 12 40.702 25.077 57.312 1.00 0.00 H new ATOM 0 HB3 LEU A 12 40.461 25.614 55.662 1.00 0.00 H new ATOM 0 HG LEU A 12 42.979 25.389 55.343 1.00 0.00 H new ATOM 0 HD11 LEU A 12 44.141 23.875 56.899 1.00 0.00 H new ATOM 0 HD12 LEU A 12 43.620 25.376 57.702 1.00 0.00 H new ATOM 0 HD13 LEU A 12 42.708 23.869 57.955 1.00 0.00 H new ATOM 0 HD21 LEU A 12 42.841 22.950 55.018 1.00 0.00 H new ATOM 0 HD22 LEU A 12 41.357 22.908 56.001 1.00 0.00 H new ATOM 0 HD23 LEU A 12 41.372 23.776 54.447 1.00 0.00 H new ATOM 162 N ALA A 13 43.014 28.141 55.417 1.00 0.00 N ATOM 163 CA ALA A 13 43.417 28.947 54.272 1.00 0.00 C ATOM 164 C ALA A 13 44.882 28.709 53.921 1.00 0.00 C ATOM 165 O ALA A 13 45.714 28.497 54.802 1.00 0.00 O ATOM 166 CB ALA A 13 43.173 30.423 54.553 1.00 0.00 C ATOM 0 H ALA A 13 43.789 27.787 55.978 1.00 0.00 H new ATOM 0 HA ALA A 13 42.812 28.646 53.417 1.00 0.00 H new ATOM 0 HB1 ALA A 13 43.479 31.013 53.689 1.00 0.00 H new ATOM 0 HB2 ALA A 13 42.113 30.586 54.747 1.00 0.00 H new ATOM 0 HB3 ALA A 13 43.753 30.728 55.424 1.00 0.00 H new ATOM 172 N ASN A 14 45.189 28.745 52.628 1.00 0.00 N ATOM 173 CA ASN A 14 46.554 28.531 52.161 1.00 0.00 C ATOM 174 C ASN A 14 46.930 29.555 51.094 1.00 0.00 C ATOM 175 O ASN A 14 46.230 29.711 50.094 1.00 0.00 O ATOM 176 CB ASN A 14 46.709 27.115 51.602 1.00 0.00 C ATOM 177 CG ASN A 14 46.438 26.049 52.646 1.00 0.00 C ATOM 178 OD1 ASN A 14 45.168 25.868 52.990 1.00 0.00 O flip ATOM 179 ND2 ASN A 14 47.359 25.396 53.136 1.00 0.00 N flip ATOM 0 H ASN A 14 44.512 28.920 51.886 1.00 0.00 H new ATOM 0 HA ASN A 14 47.226 28.654 53.011 1.00 0.00 H new ATOM 0 HB2 ASN A 14 46.025 26.981 50.764 1.00 0.00 H new ATOM 0 HB3 ASN A 14 47.719 26.990 51.212 1.00 0.00 H new ATOM 0 HD21 ASN A 14 48.320 25.569 52.841 1.00 0.00 H new ATOM 0 HD22 ASN A 14 47.161 24.682 53.837 1.00 0.00 H new ATOM 186 N VAL A 15 48.041 30.251 51.315 1.00 0.00 N ATOM 187 CA VAL A 15 48.512 31.258 50.372 1.00 0.00 C ATOM 188 C VAL A 15 48.977 30.618 49.069 1.00 0.00 C ATOM 189 O VAL A 15 49.379 29.455 49.029 1.00 0.00 O ATOM 190 CB VAL A 15 49.669 32.085 50.966 1.00 0.00 C ATOM 191 CG1 VAL A 15 49.158 33.008 52.062 1.00 0.00 C ATOM 192 CG2 VAL A 15 50.761 31.169 51.496 1.00 0.00 C ATOM 0 H VAL A 15 48.631 30.136 52.139 1.00 0.00 H new ATOM 0 HA VAL A 15 47.669 31.918 50.168 1.00 0.00 H new ATOM 0 HB VAL A 15 50.096 32.701 50.175 1.00 0.00 H new ATOM 0 HG11 VAL A 15 49.989 33.584 52.470 1.00 0.00 H new ATOM 0 HG12 VAL A 15 48.414 33.688 51.647 1.00 0.00 H new ATOM 0 HG13 VAL A 15 48.704 32.414 52.856 1.00 0.00 H new ATOM 0 HG21 VAL A 15 51.570 31.770 51.912 1.00 0.00 H new ATOM 0 HG22 VAL A 15 50.350 30.525 52.274 1.00 0.00 H new ATOM 0 HG23 VAL A 15 51.147 30.554 50.683 1.00 0.00 H new ATOM 202 N PRO A 16 48.922 31.393 47.976 1.00 0.00 N ATOM 203 CA PRO A 16 49.334 30.923 46.651 1.00 0.00 C ATOM 204 C PRO A 16 50.842 30.720 46.551 1.00 0.00 C ATOM 205 O PRO A 16 51.587 31.053 47.474 1.00 0.00 O ATOM 206 CB PRO A 16 48.884 32.050 45.718 1.00 0.00 C ATOM 207 CG PRO A 16 48.851 33.265 46.581 1.00 0.00 C ATOM 208 CD PRO A 16 48.454 32.789 47.951 1.00 0.00 C ATOM 0 HA PRO A 16 48.900 29.953 46.410 1.00 0.00 H new ATOM 0 HB2 PRO A 16 49.576 32.175 44.885 1.00 0.00 H new ATOM 0 HB3 PRO A 16 47.904 31.842 45.290 1.00 0.00 H new ATOM 0 HG2 PRO A 16 49.825 33.753 46.605 1.00 0.00 H new ATOM 0 HG3 PRO A 16 48.137 33.995 46.200 1.00 0.00 H new ATOM 0 HD2 PRO A 16 48.923 33.384 48.735 1.00 0.00 H new ATOM 0 HD3 PRO A 16 47.377 32.854 48.103 1.00 0.00 H new ATOM 216 N LEU A 17 51.287 30.171 45.425 1.00 0.00 N ATOM 217 CA LEU A 17 52.708 29.924 45.204 1.00 0.00 C ATOM 218 C LEU A 17 53.280 30.907 44.187 1.00 0.00 C ATOM 219 O LEU A 17 52.537 31.606 43.499 1.00 0.00 O ATOM 220 CB LEU A 17 52.927 28.489 44.723 1.00 0.00 C ATOM 221 CG LEU A 17 52.274 28.121 43.391 1.00 0.00 C ATOM 222 CD1 LEU A 17 53.176 28.506 42.229 1.00 0.00 C ATOM 223 CD2 LEU A 17 51.952 26.634 43.348 1.00 0.00 C ATOM 0 H LEU A 17 50.685 29.889 44.652 1.00 0.00 H new ATOM 0 HA LEU A 17 53.228 30.066 46.151 1.00 0.00 H new ATOM 0 HB2 LEU A 17 54.000 28.315 44.639 1.00 0.00 H new ATOM 0 HB3 LEU A 17 52.553 27.809 45.488 1.00 0.00 H new ATOM 0 HG LEU A 17 51.341 28.678 43.300 1.00 0.00 H new ATOM 0 HD11 LEU A 17 52.694 28.236 41.289 1.00 0.00 H new ATOM 0 HD12 LEU A 17 53.356 29.581 42.249 1.00 0.00 H new ATOM 0 HD13 LEU A 17 54.125 27.977 42.315 1.00 0.00 H new ATOM 0 HD21 LEU A 17 51.488 26.390 42.393 1.00 0.00 H new ATOM 0 HD22 LEU A 17 52.871 26.059 43.462 1.00 0.00 H new ATOM 0 HD23 LEU A 17 51.266 26.387 44.158 1.00 0.00 H new ATOM 235 N SER A 18 54.605 30.952 44.097 1.00 0.00 N ATOM 236 CA SER A 18 55.277 31.850 43.164 1.00 0.00 C ATOM 237 C SER A 18 56.600 31.253 42.694 1.00 0.00 C ATOM 238 O SER A 18 57.129 30.327 43.308 1.00 0.00 O ATOM 239 CB SER A 18 55.523 33.210 43.821 1.00 0.00 C ATOM 240 OG SER A 18 54.502 33.518 44.754 1.00 0.00 O ATOM 0 H SER A 18 55.234 30.378 44.658 1.00 0.00 H new ATOM 0 HA SER A 18 54.630 31.985 42.297 1.00 0.00 H new ATOM 0 HB2 SER A 18 56.490 33.205 44.324 1.00 0.00 H new ATOM 0 HB3 SER A 18 55.566 33.985 43.055 1.00 0.00 H new ATOM 0 HG SER A 18 54.683 34.391 45.161 1.00 0.00 H new ATOM 246 N ARG A 19 57.128 31.791 41.599 1.00 0.00 N ATOM 247 CA ARG A 19 58.388 31.312 41.044 1.00 0.00 C ATOM 248 C ARG A 19 59.136 32.440 40.339 1.00 0.00 C ATOM 249 O ARG A 19 58.533 33.256 39.641 1.00 0.00 O ATOM 250 CB ARG A 19 58.135 30.164 40.066 1.00 0.00 C ATOM 251 CG ARG A 19 57.836 28.838 40.747 1.00 0.00 C ATOM 252 CD ARG A 19 57.440 27.771 39.738 1.00 0.00 C ATOM 253 NE ARG A 19 56.942 26.562 40.389 1.00 0.00 N ATOM 254 CZ ARG A 19 57.730 25.640 40.928 1.00 0.00 C ATOM 255 NH1 ARG A 19 59.048 25.788 40.896 1.00 0.00 N ATOM 256 NH2 ARG A 19 57.202 24.566 41.502 1.00 0.00 N ATOM 0 H ARG A 19 56.703 32.559 41.079 1.00 0.00 H new ATOM 0 HA ARG A 19 59.004 30.950 41.867 1.00 0.00 H new ATOM 0 HB2 ARG A 19 57.298 30.427 39.419 1.00 0.00 H new ATOM 0 HB3 ARG A 19 59.009 30.045 39.425 1.00 0.00 H new ATOM 0 HG2 ARG A 19 58.713 28.507 41.303 1.00 0.00 H new ATOM 0 HG3 ARG A 19 57.032 28.972 41.471 1.00 0.00 H new ATOM 0 HD2 ARG A 19 56.673 28.167 39.073 1.00 0.00 H new ATOM 0 HD3 ARG A 19 58.301 27.521 39.118 1.00 0.00 H new ATOM 0 HE ARG A 19 55.933 26.418 40.432 1.00 0.00 H new ATOM 0 HH11 ARG A 19 59.458 26.612 40.456 1.00 0.00 H new ATOM 0 HH12 ARG A 19 59.651 25.078 41.311 1.00 0.00 H new ATOM 0 HH21 ARG A 19 56.189 24.448 41.529 1.00 0.00 H new ATOM 0 HH22 ARG A 19 57.809 23.858 41.916 1.00 0.00 H new ATOM 270 N SER A 20 60.451 32.480 40.527 1.00 0.00 N ATOM 271 CA SER A 20 61.280 33.511 39.912 1.00 0.00 C ATOM 272 C SER A 20 62.503 32.894 39.240 1.00 0.00 C ATOM 273 O SER A 20 63.445 32.467 39.907 1.00 0.00 O ATOM 274 CB SER A 20 61.722 34.532 40.962 1.00 0.00 C ATOM 275 OG SER A 20 62.335 33.894 42.069 1.00 0.00 O ATOM 0 H SER A 20 60.965 31.811 41.100 1.00 0.00 H new ATOM 0 HA SER A 20 60.685 34.017 39.151 1.00 0.00 H new ATOM 0 HB2 SER A 20 62.420 35.240 40.514 1.00 0.00 H new ATOM 0 HB3 SER A 20 60.860 35.106 41.301 1.00 0.00 H new ATOM 0 HG SER A 20 62.929 33.183 41.749 1.00 0.00 H new ATOM 281 N LYS A 21 62.481 32.852 37.912 1.00 0.00 N ATOM 282 CA LYS A 21 63.586 32.289 37.145 1.00 0.00 C ATOM 283 C LYS A 21 64.407 33.393 36.485 1.00 0.00 C ATOM 284 O LYS A 21 63.887 34.174 35.689 1.00 0.00 O ATOM 285 CB LYS A 21 63.058 31.326 36.081 1.00 0.00 C ATOM 286 CG LYS A 21 64.104 30.348 35.572 1.00 0.00 C ATOM 287 CD LYS A 21 63.588 29.546 34.389 1.00 0.00 C ATOM 288 CE LYS A 21 62.782 28.339 34.843 1.00 0.00 C ATOM 289 NZ LYS A 21 61.371 28.699 35.152 1.00 0.00 N ATOM 0 H LYS A 21 61.709 33.202 37.344 1.00 0.00 H new ATOM 0 HA LYS A 21 64.231 31.741 37.832 1.00 0.00 H new ATOM 0 HB2 LYS A 21 62.219 30.766 36.494 1.00 0.00 H new ATOM 0 HB3 LYS A 21 62.672 31.903 35.240 1.00 0.00 H new ATOM 0 HG2 LYS A 21 65.001 30.893 35.280 1.00 0.00 H new ATOM 0 HG3 LYS A 21 64.391 29.670 36.375 1.00 0.00 H new ATOM 0 HD2 LYS A 21 62.967 30.183 33.759 1.00 0.00 H new ATOM 0 HD3 LYS A 21 64.428 29.215 33.778 1.00 0.00 H new ATOM 0 HE2 LYS A 21 62.800 27.576 34.064 1.00 0.00 H new ATOM 0 HE3 LYS A 21 63.248 27.903 35.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 61.195 28.570 36.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 61.202 29.692 34.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 60.730 28.086 34.609 1.00 0.00 H new ATOM 303 N ARG A 22 65.692 33.449 36.820 1.00 0.00 N ATOM 304 CA ARG A 22 66.584 34.456 36.259 1.00 0.00 C ATOM 305 C ARG A 22 67.468 33.855 35.170 1.00 0.00 C ATOM 306 O ARG A 22 67.993 32.749 35.303 1.00 0.00 O ATOM 307 CB ARG A 22 67.456 35.066 37.359 1.00 0.00 C ATOM 308 CG ARG A 22 68.510 36.029 36.837 1.00 0.00 C ATOM 309 CD ARG A 22 69.496 36.418 37.927 1.00 0.00 C ATOM 310 NE ARG A 22 68.822 36.863 39.143 1.00 0.00 N ATOM 311 CZ ARG A 22 68.278 38.066 39.284 1.00 0.00 C ATOM 312 NH1 ARG A 22 68.330 38.941 38.290 1.00 0.00 N ATOM 313 NH2 ARG A 22 67.681 38.397 40.422 1.00 0.00 N ATOM 0 H ARG A 22 66.138 32.809 37.477 1.00 0.00 H new ATOM 0 HA ARG A 22 65.971 35.239 35.814 1.00 0.00 H new ATOM 0 HB2 ARG A 22 66.816 35.591 38.069 1.00 0.00 H new ATOM 0 HB3 ARG A 22 67.949 34.263 37.907 1.00 0.00 H new ATOM 0 HG2 ARG A 22 69.046 35.569 36.007 1.00 0.00 H new ATOM 0 HG3 ARG A 22 68.026 36.924 36.446 1.00 0.00 H new ATOM 0 HD2 ARG A 22 70.135 35.566 38.158 1.00 0.00 H new ATOM 0 HD3 ARG A 22 70.145 37.213 37.561 1.00 0.00 H new ATOM 0 HE ARG A 22 68.766 36.214 39.928 1.00 0.00 H new ATOM 0 HH11 ARG A 22 68.789 38.691 37.414 1.00 0.00 H new ATOM 0 HH12 ARG A 22 67.911 39.864 38.401 1.00 0.00 H new ATOM 0 HH21 ARG A 22 67.640 37.727 41.190 1.00 0.00 H new ATOM 0 HH22 ARG A 22 67.264 39.322 40.529 1.00 0.00 H new ATOM 327 N PRO A 23 67.636 34.598 34.066 1.00 0.00 N ATOM 328 CA PRO A 23 68.455 34.158 32.933 1.00 0.00 C ATOM 329 C PRO A 23 69.943 34.139 33.266 1.00 0.00 C ATOM 330 O PRO A 23 70.352 34.559 34.348 1.00 0.00 O ATOM 331 CB PRO A 23 68.161 35.205 31.856 1.00 0.00 C ATOM 332 CG PRO A 23 67.751 36.422 32.611 1.00 0.00 C ATOM 333 CD PRO A 23 67.040 35.926 33.840 1.00 0.00 C ATOM 0 HA PRO A 23 68.219 33.138 32.631 1.00 0.00 H new ATOM 0 HB2 PRO A 23 69.040 35.398 31.241 1.00 0.00 H new ATOM 0 HB3 PRO A 23 67.370 34.871 31.185 1.00 0.00 H new ATOM 0 HG2 PRO A 23 68.618 37.026 32.879 1.00 0.00 H new ATOM 0 HG3 PRO A 23 67.097 37.053 32.009 1.00 0.00 H new ATOM 0 HD2 PRO A 23 67.199 36.588 34.691 1.00 0.00 H new ATOM 0 HD3 PRO A 23 65.963 35.862 33.683 1.00 0.00 H new ATOM 341 N ASP A 24 70.747 33.651 32.328 1.00 0.00 N ATOM 342 CA ASP A 24 72.191 33.579 32.522 1.00 0.00 C ATOM 343 C ASP A 24 72.928 34.274 31.381 1.00 0.00 C ATOM 344 O ASP A 24 72.505 34.212 30.226 1.00 0.00 O ATOM 345 CB ASP A 24 72.641 32.120 32.623 1.00 0.00 C ATOM 346 CG ASP A 24 72.508 31.570 34.029 1.00 0.00 C ATOM 347 OD1 ASP A 24 72.942 32.255 34.978 1.00 0.00 O ATOM 348 OD2 ASP A 24 71.971 30.452 34.180 1.00 0.00 O ATOM 0 H ASP A 24 70.424 33.300 31.427 1.00 0.00 H new ATOM 0 HA ASP A 24 72.434 34.092 33.453 1.00 0.00 H new ATOM 0 HB2 ASP A 24 72.048 31.512 31.940 1.00 0.00 H new ATOM 0 HB3 ASP A 24 73.679 32.040 32.301 1.00 0.00 H new ATOM 353 N PHE A 25 74.031 34.936 31.712 1.00 0.00 N ATOM 354 CA PHE A 25 74.826 35.644 30.716 1.00 0.00 C ATOM 355 C PHE A 25 76.137 34.912 30.444 1.00 0.00 C ATOM 356 O PHE A 25 76.518 34.005 31.182 1.00 0.00 O ATOM 357 CB PHE A 25 75.114 37.072 31.184 1.00 0.00 C ATOM 358 CG PHE A 25 73.930 37.990 31.071 1.00 0.00 C ATOM 359 CD1 PHE A 25 72.774 37.743 31.792 1.00 0.00 C ATOM 360 CD2 PHE A 25 73.975 39.101 30.243 1.00 0.00 C ATOM 361 CE1 PHE A 25 71.683 38.586 31.691 1.00 0.00 C ATOM 362 CE2 PHE A 25 72.887 39.947 30.138 1.00 0.00 C ATOM 363 CZ PHE A 25 71.740 39.689 30.862 1.00 0.00 C ATOM 0 H PHE A 25 74.395 34.997 32.663 1.00 0.00 H new ATOM 0 HA PHE A 25 74.253 35.681 29.790 1.00 0.00 H new ATOM 0 HB2 PHE A 25 75.446 37.046 32.222 1.00 0.00 H new ATOM 0 HB3 PHE A 25 75.937 37.479 30.597 1.00 0.00 H new ATOM 0 HD1 PHE A 25 72.724 36.881 32.441 1.00 0.00 H new ATOM 0 HD2 PHE A 25 74.869 39.308 29.674 1.00 0.00 H new ATOM 0 HE1 PHE A 25 70.788 38.382 32.259 1.00 0.00 H new ATOM 0 HE2 PHE A 25 72.934 40.810 29.490 1.00 0.00 H new ATOM 0 HZ PHE A 25 70.889 40.349 30.780 1.00 0.00 H new ATOM 373 N GLY A 26 76.822 35.313 29.378 1.00 0.00 N ATOM 374 CA GLY A 26 78.082 34.685 29.026 1.00 0.00 C ATOM 375 C GLY A 26 78.557 35.075 27.640 1.00 0.00 C ATOM 376 O GLY A 26 78.030 36.009 27.037 1.00 0.00 O ATOM 0 H GLY A 26 76.527 36.062 28.751 1.00 0.00 H new ATOM 0 HA2 GLY A 26 78.840 34.963 29.758 1.00 0.00 H new ATOM 0 HA3 GLY A 26 77.971 33.602 29.077 1.00 0.00 H new ATOM 380 N GLN A 27 79.557 34.358 27.136 1.00 0.00 N ATOM 381 CA GLN A 27 80.104 34.637 25.814 1.00 0.00 C ATOM 382 C GLN A 27 79.556 33.659 24.780 1.00 0.00 C ATOM 383 O GLN A 27 78.962 32.639 25.131 1.00 0.00 O ATOM 384 CB GLN A 27 81.632 34.561 25.845 1.00 0.00 C ATOM 385 CG GLN A 27 82.270 35.535 26.823 1.00 0.00 C ATOM 386 CD GLN A 27 83.750 35.276 27.022 1.00 0.00 C ATOM 387 OE1 GLN A 27 84.288 34.278 26.542 1.00 0.00 O ATOM 388 NE2 GLN A 27 84.418 36.176 27.735 1.00 0.00 N ATOM 0 H GLN A 27 80.004 33.581 27.623 1.00 0.00 H new ATOM 0 HA GLN A 27 79.802 35.645 25.529 1.00 0.00 H new ATOM 0 HB2 GLN A 27 81.932 33.547 26.108 1.00 0.00 H new ATOM 0 HB3 GLN A 27 82.018 34.758 24.845 1.00 0.00 H new ATOM 0 HG2 GLN A 27 82.129 36.553 26.460 1.00 0.00 H new ATOM 0 HG3 GLN A 27 81.760 35.465 27.784 1.00 0.00 H new ATOM 0 HE21 GLN A 27 83.932 36.989 28.114 1.00 0.00 H new ATOM 0 HE22 GLN A 27 85.417 36.054 27.903 1.00 0.00 H new ATOM 397 N ARG A 28 79.758 33.977 23.506 1.00 0.00 N ATOM 398 CA ARG A 28 79.282 33.127 22.421 1.00 0.00 C ATOM 399 C ARG A 28 80.430 32.325 21.815 1.00 0.00 C ATOM 400 O ARG A 28 81.375 32.893 21.267 1.00 0.00 O ATOM 401 CB ARG A 28 78.609 33.973 21.339 1.00 0.00 C ATOM 402 CG ARG A 28 77.096 33.834 21.310 1.00 0.00 C ATOM 403 CD ARG A 28 76.470 34.292 22.618 1.00 0.00 C ATOM 404 NE ARG A 28 75.228 35.030 22.401 1.00 0.00 N ATOM 405 CZ ARG A 28 75.181 36.248 21.871 1.00 0.00 C ATOM 406 NH1 ARG A 28 76.299 36.860 21.506 1.00 0.00 N ATOM 407 NH2 ARG A 28 74.013 36.855 21.706 1.00 0.00 N ATOM 0 H ARG A 28 80.248 34.817 23.199 1.00 0.00 H new ATOM 0 HA ARG A 28 78.552 32.430 22.833 1.00 0.00 H new ATOM 0 HB2 ARG A 28 78.866 35.020 21.497 1.00 0.00 H new ATOM 0 HB3 ARG A 28 79.010 33.689 20.366 1.00 0.00 H new ATOM 0 HG2 ARG A 28 76.691 34.422 20.486 1.00 0.00 H new ATOM 0 HG3 ARG A 28 76.828 32.794 21.122 1.00 0.00 H new ATOM 0 HD2 ARG A 28 76.271 33.425 23.248 1.00 0.00 H new ATOM 0 HD3 ARG A 28 77.177 34.923 23.157 1.00 0.00 H new ATOM 0 HE ARG A 28 74.350 34.587 22.671 1.00 0.00 H new ATOM 0 HH11 ARG A 28 77.199 36.396 21.632 1.00 0.00 H new ATOM 0 HH12 ARG A 28 76.259 37.795 21.100 1.00 0.00 H new ATOM 0 HH21 ARG A 28 73.151 36.387 21.986 1.00 0.00 H new ATOM 0 HH22 ARG A 28 73.977 37.790 21.299 1.00 0.00 H new ATOM 421 N ARG A 29 80.341 31.003 21.918 1.00 0.00 N ATOM 422 CA ARG A 29 81.373 30.124 21.382 1.00 0.00 C ATOM 423 C ARG A 29 81.458 30.249 19.864 1.00 0.00 C ATOM 424 O ARG A 29 80.498 30.657 19.210 1.00 0.00 O ATOM 425 CB ARG A 29 81.088 28.672 21.769 1.00 0.00 C ATOM 426 CG ARG A 29 81.621 28.291 23.141 1.00 0.00 C ATOM 427 CD ARG A 29 82.183 26.878 23.148 1.00 0.00 C ATOM 428 NE ARG A 29 81.135 25.874 23.312 1.00 0.00 N ATOM 429 CZ ARG A 29 81.367 24.628 23.709 1.00 0.00 C ATOM 430 NH1 ARG A 29 82.604 24.235 23.982 1.00 0.00 N ATOM 431 NH2 ARG A 29 80.361 23.772 23.835 1.00 0.00 N ATOM 0 H ARG A 29 79.565 30.517 22.368 1.00 0.00 H new ATOM 0 HA ARG A 29 82.329 30.426 21.809 1.00 0.00 H new ATOM 0 HB2 ARG A 29 80.011 28.504 21.747 1.00 0.00 H new ATOM 0 HB3 ARG A 29 81.529 28.012 21.021 1.00 0.00 H new ATOM 0 HG2 ARG A 29 82.399 28.994 23.439 1.00 0.00 H new ATOM 0 HG3 ARG A 29 80.821 28.369 23.878 1.00 0.00 H new ATOM 0 HD2 ARG A 29 82.717 26.696 22.216 1.00 0.00 H new ATOM 0 HD3 ARG A 29 82.909 26.780 23.956 1.00 0.00 H new ATOM 0 HE ARG A 29 80.172 26.145 23.111 1.00 0.00 H new ATOM 0 HH11 ARG A 29 83.380 24.890 23.887 1.00 0.00 H new ATOM 0 HH12 ARG A 29 82.779 23.278 24.287 1.00 0.00 H new ATOM 0 HH21 ARG A 29 79.408 24.071 23.627 1.00 0.00 H new ATOM 0 HH22 ARG A 29 80.541 22.815 24.140 1.00 0.00 H new ATOM 445 N ILE A 30 82.613 29.895 19.310 1.00 0.00 N ATOM 446 CA ILE A 30 82.823 29.968 17.869 1.00 0.00 C ATOM 447 C ILE A 30 83.187 28.602 17.298 1.00 0.00 C ATOM 448 O ILE A 30 84.175 27.990 17.704 1.00 0.00 O ATOM 449 CB ILE A 30 83.933 30.973 17.512 1.00 0.00 C ATOM 450 CG1 ILE A 30 83.709 32.297 18.246 1.00 0.00 C ATOM 451 CG2 ILE A 30 83.981 31.198 16.008 1.00 0.00 C ATOM 452 CD1 ILE A 30 82.426 32.996 17.853 1.00 0.00 C ATOM 0 H ILE A 30 83.417 29.555 19.837 1.00 0.00 H new ATOM 0 HA ILE A 30 81.884 30.305 17.430 1.00 0.00 H new ATOM 0 HB ILE A 30 84.891 30.560 17.829 1.00 0.00 H new ATOM 0 HG12 ILE A 30 83.697 32.110 19.320 1.00 0.00 H new ATOM 0 HG13 ILE A 30 84.551 32.961 18.047 1.00 0.00 H new ATOM 0 HG21 ILE A 30 84.771 31.911 15.772 1.00 0.00 H new ATOM 0 HG22 ILE A 30 84.183 30.252 15.505 1.00 0.00 H new ATOM 0 HG23 ILE A 30 83.023 31.592 15.668 1.00 0.00 H new ATOM 0 HD11 ILE A 30 82.333 33.927 18.412 1.00 0.00 H new ATOM 0 HD12 ILE A 30 82.443 33.214 16.785 1.00 0.00 H new ATOM 0 HD13 ILE A 30 81.577 32.351 18.078 1.00 0.00 H new ATOM 464 N ARG A 31 82.383 28.129 16.351 1.00 0.00 N ATOM 465 CA ARG A 31 82.620 26.835 15.722 1.00 0.00 C ATOM 466 C ARG A 31 83.601 26.967 14.561 1.00 0.00 C ATOM 467 O ARG A 31 84.768 26.591 14.675 1.00 0.00 O ATOM 468 CB ARG A 31 81.303 26.236 15.226 1.00 0.00 C ATOM 469 CG ARG A 31 80.356 25.836 16.345 1.00 0.00 C ATOM 470 CD ARG A 31 80.682 24.451 16.882 1.00 0.00 C ATOM 471 NE ARG A 31 80.205 23.394 15.994 1.00 0.00 N ATOM 472 CZ ARG A 31 80.157 22.112 16.339 1.00 0.00 C ATOM 473 NH1 ARG A 31 80.553 21.730 17.545 1.00 0.00 N ATOM 474 NH2 ARG A 31 79.710 21.208 15.475 1.00 0.00 N ATOM 0 H ARG A 31 81.561 28.623 16.002 1.00 0.00 H new ATOM 0 HA ARG A 31 83.055 26.170 16.469 1.00 0.00 H new ATOM 0 HB2 ARG A 31 80.805 26.960 14.581 1.00 0.00 H new ATOM 0 HB3 ARG A 31 81.520 25.360 14.614 1.00 0.00 H new ATOM 0 HG2 ARG A 31 80.418 26.565 17.153 1.00 0.00 H new ATOM 0 HG3 ARG A 31 79.330 25.853 15.978 1.00 0.00 H new ATOM 0 HD2 ARG A 31 81.760 24.357 17.011 1.00 0.00 H new ATOM 0 HD3 ARG A 31 80.231 24.328 17.867 1.00 0.00 H new ATOM 0 HE ARG A 31 79.892 23.654 15.059 1.00 0.00 H new ATOM 0 HH11 ARG A 31 80.896 22.421 18.212 1.00 0.00 H new ATOM 0 HH12 ARG A 31 80.515 20.745 17.806 1.00 0.00 H new ATOM 0 HH21 ARG A 31 79.403 21.498 14.546 1.00 0.00 H new ATOM 0 HH22 ARG A 31 79.673 20.224 15.740 1.00 0.00 H new ATOM 488 N ARG A 32 83.119 27.503 13.444 1.00 0.00 N ATOM 489 CA ARG A 32 83.953 27.683 12.262 1.00 0.00 C ATOM 490 C ARG A 32 84.112 29.164 11.929 1.00 0.00 C ATOM 491 O ARG A 32 83.328 30.010 12.359 1.00 0.00 O ATOM 492 CB ARG A 32 83.347 26.944 11.067 1.00 0.00 C ATOM 493 CG ARG A 32 83.805 25.500 10.948 1.00 0.00 C ATOM 494 CD ARG A 32 82.785 24.651 10.206 1.00 0.00 C ATOM 495 NE ARG A 32 82.952 23.227 10.485 1.00 0.00 N ATOM 496 CZ ARG A 32 82.494 22.634 11.581 1.00 0.00 C ATOM 497 NH1 ARG A 32 81.844 23.338 12.498 1.00 0.00 N ATOM 498 NH2 ARG A 32 82.685 21.334 11.763 1.00 0.00 N ATOM 0 H ARG A 32 82.156 27.820 13.333 1.00 0.00 H new ATOM 0 HA ARG A 32 84.938 27.268 12.477 1.00 0.00 H new ATOM 0 HB2 ARG A 32 82.260 26.966 11.150 1.00 0.00 H new ATOM 0 HB3 ARG A 32 83.608 27.476 10.152 1.00 0.00 H new ATOM 0 HG2 ARG A 32 84.761 25.462 10.425 1.00 0.00 H new ATOM 0 HG3 ARG A 32 83.970 25.086 11.943 1.00 0.00 H new ATOM 0 HD2 ARG A 32 81.780 24.961 10.491 1.00 0.00 H new ATOM 0 HD3 ARG A 32 82.880 24.824 9.134 1.00 0.00 H new ATOM 0 HE ARG A 32 83.448 22.657 9.800 1.00 0.00 H new ATOM 0 HH11 ARG A 32 81.695 24.338 12.362 1.00 0.00 H new ATOM 0 HH12 ARG A 32 81.493 22.880 13.339 1.00 0.00 H new ATOM 0 HH21 ARG A 32 83.184 20.789 11.060 1.00 0.00 H new ATOM 0 HH22 ARG A 32 82.333 20.880 12.606 1.00 0.00 H new ATOM 512 N PRO A 33 85.153 29.486 11.146 1.00 0.00 N ATOM 513 CA PRO A 33 85.440 30.865 10.739 1.00 0.00 C ATOM 514 C PRO A 33 84.407 31.406 9.757 1.00 0.00 C ATOM 515 O PRO A 33 84.679 31.535 8.563 1.00 0.00 O ATOM 516 CB PRO A 33 86.812 30.758 10.068 1.00 0.00 C ATOM 517 CG PRO A 33 86.893 29.348 9.594 1.00 0.00 C ATOM 518 CD PRO A 33 86.128 28.529 10.598 1.00 0.00 C ATOM 0 HA PRO A 33 85.416 31.553 11.584 1.00 0.00 H new ATOM 0 HB2 PRO A 33 86.903 31.460 9.239 1.00 0.00 H new ATOM 0 HB3 PRO A 33 87.615 30.987 10.769 1.00 0.00 H new ATOM 0 HG2 PRO A 33 86.463 29.246 8.598 1.00 0.00 H new ATOM 0 HG3 PRO A 33 87.930 29.017 9.529 1.00 0.00 H new ATOM 0 HD2 PRO A 33 85.635 27.677 10.130 1.00 0.00 H new ATOM 0 HD3 PRO A 33 86.782 28.132 11.375 1.00 0.00 H new ATOM 526 N PHE A 34 83.222 31.722 10.266 1.00 0.00 N ATOM 527 CA PHE A 34 82.147 32.250 9.433 1.00 0.00 C ATOM 528 C PHE A 34 81.773 33.666 9.860 1.00 0.00 C ATOM 529 O PHE A 34 81.478 33.918 11.029 1.00 0.00 O ATOM 530 CB PHE A 34 80.919 31.340 9.511 1.00 0.00 C ATOM 531 CG PHE A 34 80.551 30.717 8.195 1.00 0.00 C ATOM 532 CD1 PHE A 34 81.532 30.254 7.333 1.00 0.00 C ATOM 533 CD2 PHE A 34 79.223 30.594 7.819 1.00 0.00 C ATOM 534 CE1 PHE A 34 81.197 29.680 6.122 1.00 0.00 C ATOM 535 CE2 PHE A 34 78.881 30.021 6.609 1.00 0.00 C ATOM 536 CZ PHE A 34 79.869 29.564 5.759 1.00 0.00 C ATOM 0 H PHE A 34 82.981 31.622 11.252 1.00 0.00 H new ATOM 0 HA PHE A 34 82.502 32.282 8.403 1.00 0.00 H new ATOM 0 HB2 PHE A 34 81.108 30.550 10.238 1.00 0.00 H new ATOM 0 HB3 PHE A 34 80.071 31.917 9.880 1.00 0.00 H new ATOM 0 HD1 PHE A 34 82.572 30.343 7.611 1.00 0.00 H new ATOM 0 HD2 PHE A 34 78.446 30.950 8.479 1.00 0.00 H new ATOM 0 HE1 PHE A 34 81.972 29.323 5.460 1.00 0.00 H new ATOM 0 HE2 PHE A 34 77.842 29.931 6.328 1.00 0.00 H new ATOM 0 HZ PHE A 34 79.604 29.117 4.812 1.00 0.00 H new ATOM 546 N THR A 35 81.787 34.590 8.904 1.00 0.00 N ATOM 547 CA THR A 35 81.451 35.981 9.180 1.00 0.00 C ATOM 548 C THR A 35 80.233 36.422 8.377 1.00 0.00 C ATOM 549 O THR A 35 79.823 35.748 7.431 1.00 0.00 O ATOM 550 CB THR A 35 82.630 36.918 8.859 1.00 0.00 C ATOM 551 OG1 THR A 35 82.258 38.278 9.109 1.00 0.00 O ATOM 552 CG2 THR A 35 83.064 36.764 7.409 1.00 0.00 C ATOM 0 H THR A 35 82.028 34.400 7.931 1.00 0.00 H new ATOM 0 HA THR A 35 81.224 36.046 10.244 1.00 0.00 H new ATOM 0 HB THR A 35 83.466 36.647 9.503 1.00 0.00 H new ATOM 0 HG1 THR A 35 83.014 38.867 8.904 1.00 0.00 H new ATOM 0 HG21 THR A 35 83.898 37.436 7.206 1.00 0.00 H new ATOM 0 HG22 THR A 35 83.375 35.735 7.230 1.00 0.00 H new ATOM 0 HG23 THR A 35 82.230 37.011 6.752 1.00 0.00 H new ATOM 560 N VAL A 36 79.658 37.558 8.758 1.00 0.00 N ATOM 561 CA VAL A 36 78.487 38.091 8.071 1.00 0.00 C ATOM 562 C VAL A 36 78.705 38.128 6.563 1.00 0.00 C ATOM 563 O VAL A 36 77.785 37.872 5.786 1.00 0.00 O ATOM 564 CB VAL A 36 78.144 39.509 8.565 1.00 0.00 C ATOM 565 CG1 VAL A 36 79.364 40.413 8.484 1.00 0.00 C ATOM 566 CG2 VAL A 36 76.988 40.086 7.762 1.00 0.00 C ATOM 0 H VAL A 36 79.984 38.127 9.539 1.00 0.00 H new ATOM 0 HA VAL A 36 77.655 37.424 8.298 1.00 0.00 H new ATOM 0 HB VAL A 36 77.837 39.447 9.609 1.00 0.00 H new ATOM 0 HG11 VAL A 36 79.102 41.410 8.837 1.00 0.00 H new ATOM 0 HG12 VAL A 36 80.161 40.005 9.106 1.00 0.00 H new ATOM 0 HG13 VAL A 36 79.705 40.472 7.450 1.00 0.00 H new ATOM 0 HG21 VAL A 36 76.758 41.088 8.124 1.00 0.00 H new ATOM 0 HG22 VAL A 36 77.265 40.135 6.709 1.00 0.00 H new ATOM 0 HG23 VAL A 36 76.111 39.449 7.877 1.00 0.00 H new ATOM 576 N ALA A 37 79.928 38.449 6.155 1.00 0.00 N ATOM 577 CA ALA A 37 80.268 38.518 4.739 1.00 0.00 C ATOM 578 C ALA A 37 80.245 37.133 4.101 1.00 0.00 C ATOM 579 O ALA A 37 79.615 36.927 3.065 1.00 0.00 O ATOM 580 CB ALA A 37 81.632 39.164 4.554 1.00 0.00 C ATOM 0 H ALA A 37 80.700 38.666 6.785 1.00 0.00 H new ATOM 0 HA ALA A 37 79.518 39.132 4.240 1.00 0.00 H new ATOM 0 HB1 ALA A 37 81.872 39.209 3.492 1.00 0.00 H new ATOM 0 HB2 ALA A 37 81.615 40.173 4.965 1.00 0.00 H new ATOM 0 HB3 ALA A 37 82.388 38.574 5.072 1.00 0.00 H new ATOM 586 N GLU A 38 80.938 36.187 4.728 1.00 0.00 N ATOM 587 CA GLU A 38 80.998 34.821 4.219 1.00 0.00 C ATOM 588 C GLU A 38 79.609 34.191 4.186 1.00 0.00 C ATOM 589 O GLU A 38 79.193 33.631 3.172 1.00 0.00 O ATOM 590 CB GLU A 38 81.935 33.973 5.082 1.00 0.00 C ATOM 591 CG GLU A 38 83.391 34.397 4.998 1.00 0.00 C ATOM 592 CD GLU A 38 84.261 33.706 6.030 1.00 0.00 C ATOM 593 OE1 GLU A 38 84.285 32.457 6.046 1.00 0.00 O ATOM 594 OE2 GLU A 38 84.918 34.414 6.822 1.00 0.00 O ATOM 0 H GLU A 38 81.465 36.341 5.588 1.00 0.00 H new ATOM 0 HA GLU A 38 81.386 34.856 3.201 1.00 0.00 H new ATOM 0 HB2 GLU A 38 81.609 34.029 6.120 1.00 0.00 H new ATOM 0 HB3 GLU A 38 81.851 32.930 4.777 1.00 0.00 H new ATOM 0 HG2 GLU A 38 83.772 34.177 4.001 1.00 0.00 H new ATOM 0 HG3 GLU A 38 83.460 35.476 5.135 1.00 0.00 H new ATOM 601 N VAL A 39 78.896 34.287 5.304 1.00 0.00 N ATOM 602 CA VAL A 39 77.553 33.727 5.404 1.00 0.00 C ATOM 603 C VAL A 39 76.620 34.351 4.373 1.00 0.00 C ATOM 604 O VAL A 39 75.752 33.676 3.819 1.00 0.00 O ATOM 605 CB VAL A 39 76.961 33.938 6.810 1.00 0.00 C ATOM 606 CG1 VAL A 39 75.660 33.165 6.963 1.00 0.00 C ATOM 607 CG2 VAL A 39 77.964 33.528 7.878 1.00 0.00 C ATOM 0 H VAL A 39 79.226 34.747 6.153 1.00 0.00 H new ATOM 0 HA VAL A 39 77.640 32.658 5.211 1.00 0.00 H new ATOM 0 HB VAL A 39 76.743 34.998 6.938 1.00 0.00 H new ATOM 0 HG11 VAL A 39 75.256 33.326 7.963 1.00 0.00 H new ATOM 0 HG12 VAL A 39 74.941 33.512 6.221 1.00 0.00 H new ATOM 0 HG13 VAL A 39 75.849 32.102 6.815 1.00 0.00 H new ATOM 0 HG21 VAL A 39 77.529 33.684 8.865 1.00 0.00 H new ATOM 0 HG22 VAL A 39 78.216 32.475 7.755 1.00 0.00 H new ATOM 0 HG23 VAL A 39 78.867 34.131 7.780 1.00 0.00 H new ATOM 617 N GLU A 40 76.804 35.643 4.119 1.00 0.00 N ATOM 618 CA GLU A 40 75.977 36.357 3.154 1.00 0.00 C ATOM 619 C GLU A 40 76.129 35.757 1.759 1.00 0.00 C ATOM 620 O GLU A 40 75.141 35.425 1.103 1.00 0.00 O ATOM 621 CB GLU A 40 76.352 37.840 3.127 1.00 0.00 C ATOM 622 CG GLU A 40 75.514 38.697 4.060 1.00 0.00 C ATOM 623 CD GLU A 40 76.014 40.126 4.148 1.00 0.00 C ATOM 624 OE1 GLU A 40 77.230 40.340 3.961 1.00 0.00 O ATOM 625 OE2 GLU A 40 75.191 41.029 4.405 1.00 0.00 O ATOM 0 H GLU A 40 77.518 36.216 4.568 1.00 0.00 H new ATOM 0 HA GLU A 40 74.936 36.258 3.462 1.00 0.00 H new ATOM 0 HB2 GLU A 40 77.403 37.945 3.397 1.00 0.00 H new ATOM 0 HB3 GLU A 40 76.245 38.215 2.109 1.00 0.00 H new ATOM 0 HG2 GLU A 40 74.480 38.699 3.715 1.00 0.00 H new ATOM 0 HG3 GLU A 40 75.517 38.253 5.056 1.00 0.00 H new ATOM 632 N LEU A 41 77.372 35.622 1.311 1.00 0.00 N ATOM 633 CA LEU A 41 77.655 35.063 -0.006 1.00 0.00 C ATOM 634 C LEU A 41 77.104 33.645 -0.125 1.00 0.00 C ATOM 635 O LEU A 41 76.565 33.263 -1.164 1.00 0.00 O ATOM 636 CB LEU A 41 79.162 35.061 -0.268 1.00 0.00 C ATOM 637 CG LEU A 41 79.857 36.421 -0.203 1.00 0.00 C ATOM 638 CD1 LEU A 41 81.334 36.251 0.116 1.00 0.00 C ATOM 639 CD2 LEU A 41 79.674 37.177 -1.511 1.00 0.00 C ATOM 0 H LEU A 41 78.201 35.892 1.841 1.00 0.00 H new ATOM 0 HA LEU A 41 77.164 35.688 -0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 41 79.635 34.399 0.457 1.00 0.00 H new ATOM 0 HB3 LEU A 41 79.338 34.632 -1.255 1.00 0.00 H new ATOM 0 HG LEU A 41 79.399 37.004 0.596 1.00 0.00 H new ATOM 0 HD11 LEU A 41 81.812 37.230 0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 41 81.443 35.752 1.079 1.00 0.00 H new ATOM 0 HD13 LEU A 41 81.807 35.649 -0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 41 80.175 38.143 -1.446 1.00 0.00 H new ATOM 0 HD22 LEU A 41 80.104 36.599 -2.329 1.00 0.00 H new ATOM 0 HD23 LEU A 41 78.611 37.332 -1.696 1.00 0.00 H new ATOM 651 N LEU A 42 77.242 32.871 0.945 1.00 0.00 N ATOM 652 CA LEU A 42 76.756 31.495 0.962 1.00 0.00 C ATOM 653 C LEU A 42 75.262 31.442 0.660 1.00 0.00 C ATOM 654 O LEU A 42 74.827 30.735 -0.249 1.00 0.00 O ATOM 655 CB LEU A 42 77.037 30.851 2.320 1.00 0.00 C ATOM 656 CG LEU A 42 76.029 29.800 2.786 1.00 0.00 C ATOM 657 CD1 LEU A 42 75.956 28.652 1.791 1.00 0.00 C ATOM 658 CD2 LEU A 42 76.395 29.286 4.170 1.00 0.00 C ATOM 0 H LEU A 42 77.686 33.172 1.812 1.00 0.00 H new ATOM 0 HA LEU A 42 77.284 30.939 0.187 1.00 0.00 H new ATOM 0 HB2 LEU A 42 78.023 30.388 2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 42 77.083 31.640 3.071 1.00 0.00 H new ATOM 0 HG LEU A 42 75.046 30.268 2.843 1.00 0.00 H new ATOM 0 HD11 LEU A 42 75.234 27.914 2.139 1.00 0.00 H new ATOM 0 HD12 LEU A 42 75.645 29.033 0.818 1.00 0.00 H new ATOM 0 HD13 LEU A 42 76.937 28.185 1.701 1.00 0.00 H new ATOM 0 HD21 LEU A 42 75.666 28.539 4.485 1.00 0.00 H new ATOM 0 HD22 LEU A 42 77.387 28.835 4.140 1.00 0.00 H new ATOM 0 HD23 LEU A 42 76.394 30.115 4.878 1.00 0.00 H new ATOM 670 N VAL A 43 74.481 32.196 1.427 1.00 0.00 N ATOM 671 CA VAL A 43 73.036 32.237 1.240 1.00 0.00 C ATOM 672 C VAL A 43 72.678 32.616 -0.193 1.00 0.00 C ATOM 673 O VAL A 43 71.798 32.012 -0.804 1.00 0.00 O ATOM 674 CB VAL A 43 72.373 33.237 2.205 1.00 0.00 C ATOM 675 CG1 VAL A 43 70.870 33.284 1.977 1.00 0.00 C ATOM 676 CG2 VAL A 43 72.691 32.875 3.648 1.00 0.00 C ATOM 0 H VAL A 43 74.825 32.787 2.184 1.00 0.00 H new ATOM 0 HA VAL A 43 72.661 31.236 1.453 1.00 0.00 H new ATOM 0 HB VAL A 43 72.777 34.230 2.006 1.00 0.00 H new ATOM 0 HG11 VAL A 43 70.419 33.996 2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 43 70.667 33.595 0.952 1.00 0.00 H new ATOM 0 HG13 VAL A 43 70.445 32.295 2.147 1.00 0.00 H new ATOM 0 HG21 VAL A 43 72.215 33.592 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 43 72.317 31.874 3.863 1.00 0.00 H new ATOM 0 HG23 VAL A 43 73.770 32.899 3.800 1.00 0.00 H new ATOM 686 N GLU A 44 73.367 33.622 -0.723 1.00 0.00 N ATOM 687 CA GLU A 44 73.121 34.082 -2.084 1.00 0.00 C ATOM 688 C GLU A 44 73.419 32.978 -3.094 1.00 0.00 C ATOM 689 O GLU A 44 72.782 32.894 -4.144 1.00 0.00 O ATOM 690 CB GLU A 44 73.976 35.314 -2.392 1.00 0.00 C ATOM 691 CG GLU A 44 73.893 35.765 -3.841 1.00 0.00 C ATOM 692 CD GLU A 44 72.516 36.280 -4.214 1.00 0.00 C ATOM 693 OE1 GLU A 44 71.907 36.994 -3.390 1.00 0.00 O ATOM 694 OE2 GLU A 44 72.048 35.968 -5.329 1.00 0.00 O ATOM 0 H GLU A 44 74.099 34.133 -0.231 1.00 0.00 H new ATOM 0 HA GLU A 44 72.067 34.350 -2.165 1.00 0.00 H new ATOM 0 HB2 GLU A 44 73.662 36.134 -1.746 1.00 0.00 H new ATOM 0 HB3 GLU A 44 75.015 35.095 -2.147 1.00 0.00 H new ATOM 0 HG2 GLU A 44 74.630 36.549 -4.016 1.00 0.00 H new ATOM 0 HG3 GLU A 44 74.154 34.931 -4.493 1.00 0.00 H new ATOM 701 N ALA A 45 74.392 32.133 -2.768 1.00 0.00 N ATOM 702 CA ALA A 45 74.773 31.033 -3.645 1.00 0.00 C ATOM 703 C ALA A 45 73.618 30.055 -3.834 1.00 0.00 C ATOM 704 O ALA A 45 73.265 29.706 -4.960 1.00 0.00 O ATOM 705 CB ALA A 45 75.992 30.312 -3.088 1.00 0.00 C ATOM 0 H ALA A 45 74.930 32.189 -1.903 1.00 0.00 H new ATOM 0 HA ALA A 45 75.025 31.449 -4.620 1.00 0.00 H new ATOM 0 HB1 ALA A 45 76.266 29.493 -3.753 1.00 0.00 H new ATOM 0 HB2 ALA A 45 76.825 31.011 -3.012 1.00 0.00 H new ATOM 0 HB3 ALA A 45 75.760 29.915 -2.100 1.00 0.00 H new ATOM 711 N VAL A 46 73.033 29.616 -2.724 1.00 0.00 N ATOM 712 CA VAL A 46 71.918 28.678 -2.768 1.00 0.00 C ATOM 713 C VAL A 46 70.617 29.388 -3.129 1.00 0.00 C ATOM 714 O VAL A 46 69.725 28.797 -3.735 1.00 0.00 O ATOM 715 CB VAL A 46 71.738 27.957 -1.419 1.00 0.00 C ATOM 716 CG1 VAL A 46 71.703 28.960 -0.276 1.00 0.00 C ATOM 717 CG2 VAL A 46 70.476 27.108 -1.433 1.00 0.00 C ATOM 0 H VAL A 46 73.313 29.895 -1.784 1.00 0.00 H new ATOM 0 HA VAL A 46 72.153 27.942 -3.537 1.00 0.00 H new ATOM 0 HB VAL A 46 72.591 27.297 -1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 46 71.575 28.431 0.668 1.00 0.00 H new ATOM 0 HG12 VAL A 46 72.638 29.520 -0.255 1.00 0.00 H new ATOM 0 HG13 VAL A 46 70.871 29.649 -0.422 1.00 0.00 H new ATOM 0 HG21 VAL A 46 70.365 26.606 -0.472 1.00 0.00 H new ATOM 0 HG22 VAL A 46 69.610 27.746 -1.612 1.00 0.00 H new ATOM 0 HG23 VAL A 46 70.547 26.363 -2.226 1.00 0.00 H new ATOM 727 N GLU A 47 70.519 30.659 -2.752 1.00 0.00 N ATOM 728 CA GLU A 47 69.327 31.449 -3.037 1.00 0.00 C ATOM 729 C GLU A 47 69.223 31.760 -4.528 1.00 0.00 C ATOM 730 O GLU A 47 68.161 31.609 -5.132 1.00 0.00 O ATOM 731 CB GLU A 47 69.347 32.751 -2.234 1.00 0.00 C ATOM 732 CG GLU A 47 68.126 33.626 -2.461 1.00 0.00 C ATOM 733 CD GLU A 47 68.362 35.072 -2.070 1.00 0.00 C ATOM 734 OE1 GLU A 47 69.515 35.537 -2.185 1.00 0.00 O ATOM 735 OE2 GLU A 47 67.393 35.737 -1.648 1.00 0.00 O ATOM 0 H GLU A 47 71.250 31.163 -2.249 1.00 0.00 H new ATOM 0 HA GLU A 47 68.456 30.863 -2.744 1.00 0.00 H new ATOM 0 HB2 GLU A 47 69.420 32.512 -1.173 1.00 0.00 H new ATOM 0 HB3 GLU A 47 70.242 33.316 -2.496 1.00 0.00 H new ATOM 0 HG2 GLU A 47 67.841 33.580 -3.512 1.00 0.00 H new ATOM 0 HG3 GLU A 47 67.289 33.230 -1.886 1.00 0.00 H new ATOM 742 N HIS A 48 70.334 32.196 -5.114 1.00 0.00 N ATOM 743 CA HIS A 48 70.369 32.528 -6.534 1.00 0.00 C ATOM 744 C HIS A 48 69.803 31.387 -7.373 1.00 0.00 C ATOM 745 O HIS A 48 69.296 31.604 -8.474 1.00 0.00 O ATOM 746 CB HIS A 48 71.801 32.838 -6.971 1.00 0.00 C ATOM 747 CG HIS A 48 71.889 33.479 -8.322 1.00 0.00 C ATOM 748 ND1 HIS A 48 71.729 32.779 -9.499 1.00 0.00 N ATOM 749 CD2 HIS A 48 72.120 34.764 -8.678 1.00 0.00 C ATOM 750 CE1 HIS A 48 71.860 33.606 -10.521 1.00 0.00 C ATOM 751 NE2 HIS A 48 72.098 34.817 -10.050 1.00 0.00 N ATOM 0 H HIS A 48 71.221 32.327 -4.628 1.00 0.00 H new ATOM 0 HA HIS A 48 69.750 33.411 -6.691 1.00 0.00 H new ATOM 0 HB2 HIS A 48 72.262 33.496 -6.235 1.00 0.00 H new ATOM 0 HB3 HIS A 48 72.378 31.913 -6.978 1.00 0.00 H new ATOM 0 HD2 HIS A 48 72.290 35.594 -8.008 1.00 0.00 H new ATOM 0 HE1 HIS A 48 71.785 33.338 -11.564 1.00 0.00 H new ATOM 0 HE2 HIS A 48 72.242 35.655 -10.614 1.00 0.00 H new ATOM 759 N LEU A 49 69.894 30.170 -6.847 1.00 0.00 N ATOM 760 CA LEU A 49 69.392 28.994 -7.548 1.00 0.00 C ATOM 761 C LEU A 49 68.109 28.481 -6.902 1.00 0.00 C ATOM 762 O LEU A 49 67.378 27.687 -7.493 1.00 0.00 O ATOM 763 CB LEU A 49 70.450 27.889 -7.554 1.00 0.00 C ATOM 764 CG LEU A 49 71.868 28.320 -7.929 1.00 0.00 C ATOM 765 CD1 LEU A 49 72.894 27.533 -7.130 1.00 0.00 C ATOM 766 CD2 LEU A 49 72.102 28.142 -9.423 1.00 0.00 C ATOM 0 H LEU A 49 70.311 29.972 -5.937 1.00 0.00 H new ATOM 0 HA LEU A 49 69.170 29.282 -8.576 1.00 0.00 H new ATOM 0 HB2 LEU A 49 70.479 27.436 -6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 49 70.132 27.113 -8.250 1.00 0.00 H new ATOM 0 HG LEU A 49 71.982 29.377 -7.687 1.00 0.00 H new ATOM 0 HD11 LEU A 49 73.897 27.854 -7.411 1.00 0.00 H new ATOM 0 HD12 LEU A 49 72.741 27.711 -6.066 1.00 0.00 H new ATOM 0 HD13 LEU A 49 72.781 26.469 -7.340 1.00 0.00 H new ATOM 0 HD21 LEU A 49 73.116 28.454 -9.672 1.00 0.00 H new ATOM 0 HD22 LEU A 49 71.969 27.094 -9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 49 71.389 28.751 -9.978 1.00 0.00 H new ATOM 778 N GLY A 50 67.840 28.943 -5.684 1.00 0.00 N ATOM 779 CA GLY A 50 66.643 28.522 -4.979 1.00 0.00 C ATOM 780 C GLY A 50 66.528 27.014 -4.882 1.00 0.00 C ATOM 781 O GLY A 50 65.854 26.381 -5.697 1.00 0.00 O ATOM 0 H GLY A 50 68.429 29.601 -5.174 1.00 0.00 H new ATOM 0 HA2 GLY A 50 66.647 28.948 -3.976 1.00 0.00 H new ATOM 0 HA3 GLY A 50 65.766 28.918 -5.490 1.00 0.00 H new ATOM 785 N THR A 51 67.187 26.433 -3.884 1.00 0.00 N ATOM 786 CA THR A 51 67.158 24.990 -3.686 1.00 0.00 C ATOM 787 C THR A 51 67.413 24.250 -4.994 1.00 0.00 C ATOM 788 O THR A 51 66.513 23.620 -5.548 1.00 0.00 O ATOM 789 CB THR A 51 65.808 24.530 -3.104 1.00 0.00 C ATOM 790 OG1 THR A 51 64.759 24.775 -4.047 1.00 0.00 O ATOM 791 CG2 THR A 51 65.505 25.255 -1.801 1.00 0.00 C ATOM 0 H THR A 51 67.748 26.941 -3.200 1.00 0.00 H new ATOM 0 HA THR A 51 67.951 24.752 -2.977 1.00 0.00 H new ATOM 0 HB THR A 51 65.871 23.461 -2.900 1.00 0.00 H new ATOM 0 HG1 THR A 51 65.134 24.810 -4.952 1.00 0.00 H new ATOM 0 HG21 THR A 51 64.547 24.914 -1.409 1.00 0.00 H new ATOM 0 HG22 THR A 51 66.290 25.043 -1.075 1.00 0.00 H new ATOM 0 HG23 THR A 51 65.460 26.329 -1.984 1.00 0.00 H new ATOM 799 N GLY A 52 68.647 24.330 -5.484 1.00 0.00 N ATOM 800 CA GLY A 52 68.998 23.662 -6.723 1.00 0.00 C ATOM 801 C GLY A 52 70.249 22.817 -6.592 1.00 0.00 C ATOM 802 O GLY A 52 70.560 22.319 -5.510 1.00 0.00 O ATOM 0 H GLY A 52 69.409 24.846 -5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 52 68.168 23.030 -7.039 1.00 0.00 H new ATOM 0 HA3 GLY A 52 69.147 24.407 -7.504 1.00 0.00 H new ATOM 806 N ARG A 53 70.969 22.652 -7.697 1.00 0.00 N ATOM 807 CA ARG A 53 72.192 21.859 -7.702 1.00 0.00 C ATOM 808 C ARG A 53 73.293 22.553 -6.906 1.00 0.00 C ATOM 809 O ARG A 53 73.529 23.750 -7.067 1.00 0.00 O ATOM 810 CB ARG A 53 72.662 21.615 -9.137 1.00 0.00 C ATOM 811 CG ARG A 53 71.546 21.196 -10.081 1.00 0.00 C ATOM 812 CD ARG A 53 72.071 20.329 -11.214 1.00 0.00 C ATOM 813 NE ARG A 53 71.003 19.895 -12.111 1.00 0.00 N ATOM 814 CZ ARG A 53 71.137 18.906 -12.988 1.00 0.00 C ATOM 815 NH1 ARG A 53 72.287 18.253 -13.085 1.00 0.00 N ATOM 816 NH2 ARG A 53 70.119 18.568 -13.769 1.00 0.00 N ATOM 0 H ARG A 53 70.726 23.057 -8.601 1.00 0.00 H new ATOM 0 HA ARG A 53 71.975 20.900 -7.230 1.00 0.00 H new ATOM 0 HB2 ARG A 53 73.126 22.525 -9.518 1.00 0.00 H new ATOM 0 HB3 ARG A 53 73.431 20.843 -9.132 1.00 0.00 H new ATOM 0 HG2 ARG A 53 70.784 20.649 -9.526 1.00 0.00 H new ATOM 0 HG3 ARG A 53 71.064 22.083 -10.493 1.00 0.00 H new ATOM 0 HD2 ARG A 53 72.817 20.886 -11.781 1.00 0.00 H new ATOM 0 HD3 ARG A 53 72.573 19.455 -10.799 1.00 0.00 H new ATOM 0 HE ARG A 53 70.106 20.377 -12.061 1.00 0.00 H new ATOM 0 HH11 ARG A 53 73.071 18.510 -12.485 1.00 0.00 H new ATOM 0 HH12 ARG A 53 72.387 17.494 -13.759 1.00 0.00 H new ATOM 0 HH21 ARG A 53 69.233 19.068 -13.696 1.00 0.00 H new ATOM 0 HH22 ARG A 53 70.223 17.809 -14.442 1.00 0.00 H new ATOM 830 N TRP A 54 73.962 21.793 -6.047 1.00 0.00 N ATOM 831 CA TRP A 54 75.038 22.335 -5.225 1.00 0.00 C ATOM 832 C TRP A 54 76.183 22.844 -6.093 1.00 0.00 C ATOM 833 O TRP A 54 76.837 23.832 -5.758 1.00 0.00 O ATOM 834 CB TRP A 54 75.553 21.270 -4.254 1.00 0.00 C ATOM 835 CG TRP A 54 74.456 20.524 -3.555 1.00 0.00 C ATOM 836 CD1 TRP A 54 73.234 21.014 -3.193 1.00 0.00 C ATOM 837 CD2 TRP A 54 74.485 19.157 -3.133 1.00 0.00 C ATOM 838 NE1 TRP A 54 72.500 20.032 -2.571 1.00 0.00 N ATOM 839 CE2 TRP A 54 73.245 18.884 -2.523 1.00 0.00 C ATOM 840 CE3 TRP A 54 75.435 18.136 -3.213 1.00 0.00 C ATOM 841 CZ2 TRP A 54 72.934 17.633 -1.995 1.00 0.00 C ATOM 842 CZ3 TRP A 54 75.126 16.895 -2.688 1.00 0.00 C ATOM 843 CH2 TRP A 54 73.884 16.652 -2.087 1.00 0.00 C ATOM 0 H TRP A 54 73.779 20.800 -5.901 1.00 0.00 H new ATOM 0 HA TRP A 54 74.638 23.174 -4.655 1.00 0.00 H new ATOM 0 HB2 TRP A 54 76.175 20.560 -4.800 1.00 0.00 H new ATOM 0 HB3 TRP A 54 76.191 21.746 -3.509 1.00 0.00 H new ATOM 0 HD1 TRP A 54 72.894 22.024 -3.369 1.00 0.00 H new ATOM 0 HE1 TRP A 54 71.554 20.141 -2.205 1.00 0.00 H new ATOM 0 HE3 TRP A 54 76.394 18.313 -3.677 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 71.978 17.444 -1.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 75.854 16.099 -2.742 1.00 0.00 H new ATOM 0 HH2 TRP A 54 73.672 15.671 -1.688 1.00 0.00 H new ATOM 854 N ARG A 55 76.421 22.164 -7.210 1.00 0.00 N ATOM 855 CA ARG A 55 77.489 22.548 -8.126 1.00 0.00 C ATOM 856 C ARG A 55 77.332 24.001 -8.564 1.00 0.00 C ATOM 857 O ARG A 55 78.299 24.763 -8.579 1.00 0.00 O ATOM 858 CB ARG A 55 77.492 21.632 -9.351 1.00 0.00 C ATOM 859 CG ARG A 55 76.145 21.541 -10.048 1.00 0.00 C ATOM 860 CD ARG A 55 76.122 20.419 -11.073 1.00 0.00 C ATOM 861 NE ARG A 55 76.832 20.781 -12.297 1.00 0.00 N ATOM 862 CZ ARG A 55 76.317 21.562 -13.241 1.00 0.00 C ATOM 863 NH1 ARG A 55 75.096 22.059 -13.102 1.00 0.00 N ATOM 864 NH2 ARG A 55 77.025 21.847 -14.327 1.00 0.00 N ATOM 0 H ARG A 55 75.889 21.344 -7.503 1.00 0.00 H new ATOM 0 HA ARG A 55 78.439 22.445 -7.602 1.00 0.00 H new ATOM 0 HB2 ARG A 55 78.235 21.993 -10.062 1.00 0.00 H new ATOM 0 HB3 ARG A 55 77.802 20.632 -9.046 1.00 0.00 H new ATOM 0 HG2 ARG A 55 75.362 21.375 -9.308 1.00 0.00 H new ATOM 0 HG3 ARG A 55 75.924 22.488 -10.539 1.00 0.00 H new ATOM 0 HD2 ARG A 55 76.574 19.525 -10.643 1.00 0.00 H new ATOM 0 HD3 ARG A 55 75.089 20.169 -11.314 1.00 0.00 H new ATOM 0 HE ARG A 55 77.774 20.415 -12.435 1.00 0.00 H new ATOM 0 HH11 ARG A 55 74.549 21.842 -12.269 1.00 0.00 H new ATOM 0 HH12 ARG A 55 74.704 22.658 -13.828 1.00 0.00 H new ATOM 0 HH21 ARG A 55 77.965 21.467 -14.437 1.00 0.00 H new ATOM 0 HH22 ARG A 55 76.629 22.446 -15.051 1.00 0.00 H new ATOM 878 N ASP A 56 76.109 24.377 -8.921 1.00 0.00 N ATOM 879 CA ASP A 56 75.826 25.738 -9.360 1.00 0.00 C ATOM 880 C ASP A 56 76.006 26.728 -8.213 1.00 0.00 C ATOM 881 O ASP A 56 76.381 27.881 -8.427 1.00 0.00 O ATOM 882 CB ASP A 56 74.402 25.833 -9.913 1.00 0.00 C ATOM 883 CG ASP A 56 74.300 26.783 -11.090 1.00 0.00 C ATOM 884 OD1 ASP A 56 75.152 27.691 -11.195 1.00 0.00 O ATOM 885 OD2 ASP A 56 73.370 26.618 -11.906 1.00 0.00 O ATOM 0 H ASP A 56 75.298 23.758 -8.915 1.00 0.00 H new ATOM 0 HA ASP A 56 76.532 25.992 -10.150 1.00 0.00 H new ATOM 0 HB2 ASP A 56 74.068 24.842 -10.220 1.00 0.00 H new ATOM 0 HB3 ASP A 56 73.730 26.166 -9.122 1.00 0.00 H new ATOM 890 N VAL A 57 75.735 26.270 -6.995 1.00 0.00 N ATOM 891 CA VAL A 57 75.867 27.114 -5.814 1.00 0.00 C ATOM 892 C VAL A 57 77.301 27.602 -5.644 1.00 0.00 C ATOM 893 O VAL A 57 77.548 28.798 -5.490 1.00 0.00 O ATOM 894 CB VAL A 57 75.437 26.366 -4.538 1.00 0.00 C ATOM 895 CG1 VAL A 57 75.558 27.271 -3.321 1.00 0.00 C ATOM 896 CG2 VAL A 57 74.017 25.839 -4.682 1.00 0.00 C ATOM 0 H VAL A 57 75.423 25.319 -6.801 1.00 0.00 H new ATOM 0 HA VAL A 57 75.210 27.971 -5.963 1.00 0.00 H new ATOM 0 HB VAL A 57 76.103 25.515 -4.395 1.00 0.00 H new ATOM 0 HG11 VAL A 57 75.250 26.725 -2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 57 76.593 27.594 -3.209 1.00 0.00 H new ATOM 0 HG13 VAL A 57 74.918 28.144 -3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 57 73.730 25.313 -3.771 1.00 0.00 H new ATOM 0 HG22 VAL A 57 73.335 26.672 -4.850 1.00 0.00 H new ATOM 0 HG23 VAL A 57 73.967 25.153 -5.528 1.00 0.00 H new ATOM 906 N LYS A 58 78.246 26.668 -5.675 1.00 0.00 N ATOM 907 CA LYS A 58 79.658 27.001 -5.527 1.00 0.00 C ATOM 908 C LYS A 58 80.152 27.814 -6.719 1.00 0.00 C ATOM 909 O LYS A 58 80.886 28.789 -6.556 1.00 0.00 O ATOM 910 CB LYS A 58 80.492 25.726 -5.384 1.00 0.00 C ATOM 911 CG LYS A 58 81.693 25.884 -4.468 1.00 0.00 C ATOM 912 CD LYS A 58 82.784 26.718 -5.118 1.00 0.00 C ATOM 913 CE LYS A 58 83.141 27.928 -4.269 1.00 0.00 C ATOM 914 NZ LYS A 58 81.949 28.770 -3.975 1.00 0.00 N ATOM 0 H LYS A 58 78.059 25.673 -5.801 1.00 0.00 H new ATOM 0 HA LYS A 58 79.771 27.604 -4.626 1.00 0.00 H new ATOM 0 HB2 LYS A 58 79.857 24.927 -5.001 1.00 0.00 H new ATOM 0 HB3 LYS A 58 80.836 25.415 -6.370 1.00 0.00 H new ATOM 0 HG2 LYS A 58 81.381 26.354 -3.535 1.00 0.00 H new ATOM 0 HG3 LYS A 58 82.089 24.901 -4.212 1.00 0.00 H new ATOM 0 HD2 LYS A 58 83.672 26.104 -5.269 1.00 0.00 H new ATOM 0 HD3 LYS A 58 82.453 27.048 -6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 58 83.590 27.595 -3.333 1.00 0.00 H new ATOM 0 HE3 LYS A 58 83.890 28.527 -4.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 82.257 29.686 -3.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 81.410 28.926 -4.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 81.346 28.287 -3.278 1.00 0.00 H new ATOM 928 N PHE A 59 79.746 27.407 -7.916 1.00 0.00 N ATOM 929 CA PHE A 59 80.147 28.098 -9.136 1.00 0.00 C ATOM 930 C PHE A 59 79.637 29.536 -9.140 1.00 0.00 C ATOM 931 O PHE A 59 80.366 30.464 -9.488 1.00 0.00 O ATOM 932 CB PHE A 59 79.621 27.355 -10.366 1.00 0.00 C ATOM 933 CG PHE A 59 79.843 28.096 -11.654 1.00 0.00 C ATOM 934 CD1 PHE A 59 78.914 29.019 -12.106 1.00 0.00 C ATOM 935 CD2 PHE A 59 80.979 27.868 -12.412 1.00 0.00 C ATOM 936 CE1 PHE A 59 79.114 29.702 -13.291 1.00 0.00 C ATOM 937 CE2 PHE A 59 81.186 28.548 -13.597 1.00 0.00 C ATOM 938 CZ PHE A 59 80.252 29.466 -14.038 1.00 0.00 C ATOM 0 H PHE A 59 79.139 26.601 -8.068 1.00 0.00 H new ATOM 0 HA PHE A 59 81.236 28.117 -9.170 1.00 0.00 H new ATOM 0 HB2 PHE A 59 80.107 26.381 -10.428 1.00 0.00 H new ATOM 0 HB3 PHE A 59 78.554 27.171 -10.241 1.00 0.00 H new ATOM 0 HD1 PHE A 59 78.023 29.207 -11.526 1.00 0.00 H new ATOM 0 HD2 PHE A 59 81.712 27.150 -12.073 1.00 0.00 H new ATOM 0 HE1 PHE A 59 78.382 30.419 -13.632 1.00 0.00 H new ATOM 0 HE2 PHE A 59 82.077 28.362 -14.178 1.00 0.00 H new ATOM 0 HZ PHE A 59 80.411 29.998 -14.964 1.00 0.00 H new ATOM 948 N ARG A 60 78.378 29.712 -8.750 1.00 0.00 N ATOM 949 CA ARG A 60 77.769 31.035 -8.710 1.00 0.00 C ATOM 950 C ARG A 60 78.288 31.837 -7.520 1.00 0.00 C ATOM 951 O ARG A 60 78.470 33.051 -7.608 1.00 0.00 O ATOM 952 CB ARG A 60 76.245 30.916 -8.633 1.00 0.00 C ATOM 953 CG ARG A 60 75.532 32.257 -8.578 1.00 0.00 C ATOM 954 CD ARG A 60 75.705 33.034 -9.874 1.00 0.00 C ATOM 955 NE ARG A 60 76.821 33.974 -9.804 1.00 0.00 N ATOM 956 CZ ARG A 60 76.753 35.150 -9.190 1.00 0.00 C ATOM 957 NH1 ARG A 60 75.629 35.528 -8.597 1.00 0.00 N ATOM 958 NH2 ARG A 60 77.810 35.951 -9.169 1.00 0.00 N ATOM 0 H ARG A 60 77.761 28.954 -8.457 1.00 0.00 H new ATOM 0 HA ARG A 60 78.040 31.560 -9.626 1.00 0.00 H new ATOM 0 HB2 ARG A 60 75.888 30.360 -9.500 1.00 0.00 H new ATOM 0 HB3 ARG A 60 75.978 30.336 -7.750 1.00 0.00 H new ATOM 0 HG2 ARG A 60 74.471 32.098 -8.387 1.00 0.00 H new ATOM 0 HG3 ARG A 60 75.922 32.844 -7.746 1.00 0.00 H new ATOM 0 HD2 ARG A 60 75.869 32.337 -10.695 1.00 0.00 H new ATOM 0 HD3 ARG A 60 74.787 33.577 -10.096 1.00 0.00 H new ATOM 0 HE ARG A 60 77.700 33.713 -10.251 1.00 0.00 H new ATOM 0 HH11 ARG A 60 74.814 34.915 -8.612 1.00 0.00 H new ATOM 0 HH12 ARG A 60 75.580 36.432 -8.126 1.00 0.00 H new ATOM 0 HH21 ARG A 60 78.676 35.664 -9.625 1.00 0.00 H new ATOM 0 HH22 ARG A 60 77.756 36.854 -8.697 1.00 0.00 H new ATOM 972 N ALA A 61 78.523 31.150 -6.407 1.00 0.00 N ATOM 973 CA ALA A 61 79.022 31.797 -5.200 1.00 0.00 C ATOM 974 C ALA A 61 80.260 32.636 -5.499 1.00 0.00 C ATOM 975 O ALA A 61 80.188 33.863 -5.572 1.00 0.00 O ATOM 976 CB ALA A 61 79.332 30.758 -4.133 1.00 0.00 C ATOM 0 H ALA A 61 78.376 30.145 -6.316 1.00 0.00 H new ATOM 0 HA ALA A 61 78.244 32.463 -4.827 1.00 0.00 H new ATOM 0 HB1 ALA A 61 79.704 31.256 -3.237 1.00 0.00 H new ATOM 0 HB2 ALA A 61 78.425 30.204 -3.890 1.00 0.00 H new ATOM 0 HB3 ALA A 61 80.090 30.069 -4.506 1.00 0.00 H new ATOM 982 N PHE A 62 81.395 31.967 -5.671 1.00 0.00 N ATOM 983 CA PHE A 62 82.650 32.652 -5.961 1.00 0.00 C ATOM 984 C PHE A 62 83.516 31.823 -6.905 1.00 0.00 C ATOM 985 O PHE A 62 84.131 32.357 -7.828 1.00 0.00 O ATOM 986 CB PHE A 62 83.413 32.932 -4.665 1.00 0.00 C ATOM 987 CG PHE A 62 83.741 34.384 -4.465 1.00 0.00 C ATOM 988 CD1 PHE A 62 82.757 35.286 -4.095 1.00 0.00 C ATOM 989 CD2 PHE A 62 85.035 34.847 -4.647 1.00 0.00 C ATOM 990 CE1 PHE A 62 83.055 36.623 -3.910 1.00 0.00 C ATOM 991 CE2 PHE A 62 85.339 36.183 -4.462 1.00 0.00 C ATOM 992 CZ PHE A 62 84.348 37.072 -4.095 1.00 0.00 C ATOM 0 H PHE A 62 81.472 30.951 -5.615 1.00 0.00 H new ATOM 0 HA PHE A 62 82.415 33.598 -6.448 1.00 0.00 H new ATOM 0 HB2 PHE A 62 82.820 32.582 -3.820 1.00 0.00 H new ATOM 0 HB3 PHE A 62 84.338 32.355 -4.665 1.00 0.00 H new ATOM 0 HD1 PHE A 62 81.744 34.940 -3.949 1.00 0.00 H new ATOM 0 HD2 PHE A 62 85.814 34.157 -4.936 1.00 0.00 H new ATOM 0 HE1 PHE A 62 82.278 37.315 -3.621 1.00 0.00 H new ATOM 0 HE2 PHE A 62 86.351 36.531 -4.604 1.00 0.00 H new ATOM 0 HZ PHE A 62 84.584 38.116 -3.953 1.00 0.00 H new ATOM 1002 N GLU A 63 83.559 30.516 -6.666 1.00 0.00 N ATOM 1003 CA GLU A 63 84.351 29.614 -7.495 1.00 0.00 C ATOM 1004 C GLU A 63 85.802 30.079 -7.571 1.00 0.00 C ATOM 1005 O GLU A 63 86.426 30.030 -8.630 1.00 0.00 O ATOM 1006 CB GLU A 63 83.757 29.526 -8.903 1.00 0.00 C ATOM 1007 CG GLU A 63 84.282 28.352 -9.711 1.00 0.00 C ATOM 1008 CD GLU A 63 84.213 28.596 -11.206 1.00 0.00 C ATOM 1009 OE1 GLU A 63 83.345 29.384 -11.639 1.00 0.00 O ATOM 1010 OE2 GLU A 63 85.025 27.999 -11.944 1.00 0.00 O ATOM 0 H GLU A 63 83.055 30.058 -5.906 1.00 0.00 H new ATOM 0 HA GLU A 63 84.328 28.625 -7.037 1.00 0.00 H new ATOM 0 HB2 GLU A 63 82.672 29.448 -8.827 1.00 0.00 H new ATOM 0 HB3 GLU A 63 83.973 30.451 -9.438 1.00 0.00 H new ATOM 0 HG2 GLU A 63 85.315 28.153 -9.426 1.00 0.00 H new ATOM 0 HG3 GLU A 63 83.706 27.460 -9.465 1.00 0.00 H new ATOM 1017 N ASN A 64 86.333 30.530 -6.439 1.00 0.00 N ATOM 1018 CA ASN A 64 87.710 31.005 -6.377 1.00 0.00 C ATOM 1019 C ASN A 64 88.273 30.859 -4.966 1.00 0.00 C ATOM 1020 O ASN A 64 89.428 30.473 -4.784 1.00 0.00 O ATOM 1021 CB ASN A 64 87.788 32.468 -6.820 1.00 0.00 C ATOM 1022 CG ASN A 64 89.071 32.779 -7.566 1.00 0.00 C ATOM 1023 OD1 ASN A 64 89.914 33.537 -7.085 1.00 0.00 O ATOM 1024 ND2 ASN A 64 89.225 32.193 -8.747 1.00 0.00 N ATOM 0 H ASN A 64 85.830 30.576 -5.553 1.00 0.00 H new ATOM 0 HA ASN A 64 88.309 30.395 -7.053 1.00 0.00 H new ATOM 0 HB2 ASN A 64 86.935 32.697 -7.459 1.00 0.00 H new ATOM 0 HB3 ASN A 64 87.714 33.114 -5.945 1.00 0.00 H new ATOM 0 HD21 ASN A 64 90.068 32.364 -9.295 1.00 0.00 H new ATOM 0 HD22 ASN A 64 88.500 31.572 -9.107 1.00 0.00 H new ATOM 1031 N VAL A 65 87.449 31.170 -3.971 1.00 0.00 N ATOM 1032 CA VAL A 65 87.863 31.071 -2.576 1.00 0.00 C ATOM 1033 C VAL A 65 88.467 29.704 -2.278 1.00 0.00 C ATOM 1034 O VAL A 65 88.398 28.789 -3.100 1.00 0.00 O ATOM 1035 CB VAL A 65 86.680 31.318 -1.621 1.00 0.00 C ATOM 1036 CG1 VAL A 65 86.026 32.659 -1.916 1.00 0.00 C ATOM 1037 CG2 VAL A 65 85.668 30.187 -1.725 1.00 0.00 C ATOM 0 H VAL A 65 86.491 31.493 -4.105 1.00 0.00 H new ATOM 0 HA VAL A 65 88.617 31.841 -2.414 1.00 0.00 H new ATOM 0 HB VAL A 65 87.059 31.344 -0.599 1.00 0.00 H new ATOM 0 HG11 VAL A 65 85.192 32.816 -1.231 1.00 0.00 H new ATOM 0 HG12 VAL A 65 86.757 33.457 -1.786 1.00 0.00 H new ATOM 0 HG13 VAL A 65 85.659 32.667 -2.942 1.00 0.00 H new ATOM 0 HG21 VAL A 65 84.839 30.377 -1.044 1.00 0.00 H new ATOM 0 HG22 VAL A 65 85.292 30.128 -2.746 1.00 0.00 H new ATOM 0 HG23 VAL A 65 86.147 29.245 -1.459 1.00 0.00 H new ATOM 1047 N HIS A 66 89.060 29.570 -1.095 1.00 0.00 N ATOM 1048 CA HIS A 66 89.676 28.313 -0.687 1.00 0.00 C ATOM 1049 C HIS A 66 88.977 27.739 0.541 1.00 0.00 C ATOM 1050 O HIS A 66 88.268 28.451 1.254 1.00 0.00 O ATOM 1051 CB HIS A 66 91.162 28.521 -0.391 1.00 0.00 C ATOM 1052 CG HIS A 66 92.004 28.657 -1.622 1.00 0.00 C ATOM 1053 ND1 HIS A 66 92.368 27.584 -2.407 1.00 0.00 N ATOM 1054 CD2 HIS A 66 92.553 29.750 -2.203 1.00 0.00 C ATOM 1055 CE1 HIS A 66 93.106 28.010 -3.417 1.00 0.00 C ATOM 1056 NE2 HIS A 66 93.233 29.321 -3.316 1.00 0.00 N ATOM 0 H HIS A 66 89.127 30.316 -0.403 1.00 0.00 H new ATOM 0 HA HIS A 66 89.572 27.603 -1.508 1.00 0.00 H new ATOM 0 HB2 HIS A 66 91.281 29.415 0.221 1.00 0.00 H new ATOM 0 HB3 HIS A 66 91.528 27.680 0.199 1.00 0.00 H new ATOM 0 HD2 HIS A 66 92.471 30.769 -1.856 1.00 0.00 H new ATOM 0 HE1 HIS A 66 93.533 27.392 -4.193 1.00 0.00 H new ATOM 0 HE2 HIS A 66 93.752 29.918 -3.960 1.00 0.00 H new ATOM 1064 N HIS A 67 89.180 26.448 0.783 1.00 0.00 N ATOM 1065 CA HIS A 67 88.568 25.778 1.925 1.00 0.00 C ATOM 1066 C HIS A 67 87.049 25.905 1.880 1.00 0.00 C ATOM 1067 O HIS A 67 86.454 26.641 2.667 1.00 0.00 O ATOM 1068 CB HIS A 67 89.102 26.365 3.233 1.00 0.00 C ATOM 1069 CG HIS A 67 90.481 25.897 3.581 1.00 0.00 C ATOM 1070 ND1 HIS A 67 91.572 26.739 3.628 1.00 0.00 N ATOM 1071 CD2 HIS A 67 90.944 24.666 3.901 1.00 0.00 C ATOM 1072 CE1 HIS A 67 92.647 26.046 3.960 1.00 0.00 C ATOM 1073 NE2 HIS A 67 92.292 24.785 4.132 1.00 0.00 N ATOM 0 H HIS A 67 89.764 25.845 0.203 1.00 0.00 H new ATOM 0 HA HIS A 67 88.828 24.721 1.876 1.00 0.00 H new ATOM 0 HB2 HIS A 67 89.104 27.453 3.159 1.00 0.00 H new ATOM 0 HB3 HIS A 67 88.423 26.102 4.044 1.00 0.00 H new ATOM 0 HD2 HIS A 67 90.361 23.759 3.963 1.00 0.00 H new ATOM 0 HE1 HIS A 67 93.645 26.443 4.072 1.00 0.00 H new ATOM 0 HE2 HIS A 67 92.918 24.023 4.394 1.00 0.00 H new ATOM 1081 N ARG A 68 86.427 25.184 0.953 1.00 0.00 N ATOM 1082 CA ARG A 68 84.977 25.217 0.803 1.00 0.00 C ATOM 1083 C ARG A 68 84.515 24.211 -0.246 1.00 0.00 C ATOM 1084 O ARG A 68 85.291 23.796 -1.109 1.00 0.00 O ATOM 1085 CB ARG A 68 84.516 26.623 0.415 1.00 0.00 C ATOM 1086 CG ARG A 68 84.627 26.912 -1.073 1.00 0.00 C ATOM 1087 CD ARG A 68 86.065 26.801 -1.556 1.00 0.00 C ATOM 1088 NE ARG A 68 86.198 27.160 -2.965 1.00 0.00 N ATOM 1089 CZ ARG A 68 85.940 26.323 -3.964 1.00 0.00 C ATOM 1090 NH1 ARG A 68 85.537 25.086 -3.710 1.00 0.00 N ATOM 1091 NH2 ARG A 68 86.085 26.724 -5.221 1.00 0.00 N ATOM 0 H ARG A 68 86.905 24.569 0.294 1.00 0.00 H new ATOM 0 HA ARG A 68 84.532 24.947 1.760 1.00 0.00 H new ATOM 0 HB2 ARG A 68 83.480 26.755 0.726 1.00 0.00 H new ATOM 0 HB3 ARG A 68 85.109 27.355 0.964 1.00 0.00 H new ATOM 0 HG2 ARG A 68 84.001 26.214 -1.628 1.00 0.00 H new ATOM 0 HG3 ARG A 68 84.249 27.913 -1.280 1.00 0.00 H new ATOM 0 HD2 ARG A 68 86.701 27.451 -0.955 1.00 0.00 H new ATOM 0 HD3 ARG A 68 86.420 25.781 -1.407 1.00 0.00 H new ATOM 0 HE ARG A 68 86.506 28.105 -3.195 1.00 0.00 H new ATOM 0 HH11 ARG A 68 85.424 24.774 -2.745 1.00 0.00 H new ATOM 0 HH12 ARG A 68 85.340 24.446 -4.479 1.00 0.00 H new ATOM 0 HH21 ARG A 68 86.395 27.675 -5.420 1.00 0.00 H new ATOM 0 HH22 ARG A 68 85.887 26.081 -5.988 1.00 0.00 H new ATOM 1105 N THR A 69 83.247 23.821 -0.167 1.00 0.00 N ATOM 1106 CA THR A 69 82.682 22.863 -1.109 1.00 0.00 C ATOM 1107 C THR A 69 81.188 23.097 -1.302 1.00 0.00 C ATOM 1108 O THR A 69 80.491 23.520 -0.379 1.00 0.00 O ATOM 1109 CB THR A 69 82.905 21.413 -0.637 1.00 0.00 C ATOM 1110 OG1 THR A 69 84.275 21.225 -0.265 1.00 0.00 O ATOM 1111 CG2 THR A 69 82.531 20.424 -1.730 1.00 0.00 C ATOM 0 H THR A 69 82.591 24.154 0.540 1.00 0.00 H new ATOM 0 HA THR A 69 83.196 23.013 -2.058 1.00 0.00 H new ATOM 0 HB THR A 69 82.266 21.233 0.227 1.00 0.00 H new ATOM 0 HG1 THR A 69 84.409 20.302 0.035 1.00 0.00 H new ATOM 0 HG21 THR A 69 82.697 19.407 -1.373 1.00 0.00 H new ATOM 0 HG22 THR A 69 81.480 20.550 -1.991 1.00 0.00 H new ATOM 0 HG23 THR A 69 83.147 20.605 -2.611 1.00 0.00 H new ATOM 1119 N TYR A 70 80.701 22.820 -2.507 1.00 0.00 N ATOM 1120 CA TYR A 70 79.290 23.002 -2.821 1.00 0.00 C ATOM 1121 C TYR A 70 78.406 22.378 -1.745 1.00 0.00 C ATOM 1122 O TYR A 70 77.405 22.962 -1.332 1.00 0.00 O ATOM 1123 CB TYR A 70 78.965 22.386 -4.183 1.00 0.00 C ATOM 1124 CG TYR A 70 79.488 20.977 -4.350 1.00 0.00 C ATOM 1125 CD1 TYR A 70 78.720 19.881 -3.974 1.00 0.00 C ATOM 1126 CD2 TYR A 70 80.749 20.741 -4.883 1.00 0.00 C ATOM 1127 CE1 TYR A 70 79.194 18.592 -4.124 1.00 0.00 C ATOM 1128 CE2 TYR A 70 81.230 19.456 -5.038 1.00 0.00 C ATOM 1129 CZ TYR A 70 80.449 18.385 -4.657 1.00 0.00 C ATOM 1130 OH TYR A 70 80.925 17.102 -4.808 1.00 0.00 O ATOM 0 H TYR A 70 81.264 22.469 -3.282 1.00 0.00 H new ATOM 0 HA TYR A 70 79.088 24.073 -2.856 1.00 0.00 H new ATOM 0 HB2 TYR A 70 77.884 22.382 -4.322 1.00 0.00 H new ATOM 0 HB3 TYR A 70 79.385 23.016 -4.967 1.00 0.00 H new ATOM 0 HD1 TYR A 70 77.736 20.040 -3.558 1.00 0.00 H new ATOM 0 HD2 TYR A 70 81.364 21.577 -5.181 1.00 0.00 H new ATOM 0 HE1 TYR A 70 78.585 17.751 -3.826 1.00 0.00 H new ATOM 0 HE2 TYR A 70 82.212 19.291 -5.455 1.00 0.00 H new ATOM 0 HH TYR A 70 81.823 17.130 -5.198 1.00 0.00 H new ATOM 1140 N VAL A 71 78.786 21.187 -1.294 1.00 0.00 N ATOM 1141 CA VAL A 71 78.032 20.483 -0.265 1.00 0.00 C ATOM 1142 C VAL A 71 78.061 21.244 1.056 1.00 0.00 C ATOM 1143 O VAL A 71 77.065 21.294 1.778 1.00 0.00 O ATOM 1144 CB VAL A 71 78.582 19.062 -0.038 1.00 0.00 C ATOM 1145 CG1 VAL A 71 80.050 19.115 0.357 1.00 0.00 C ATOM 1146 CG2 VAL A 71 77.763 18.337 1.019 1.00 0.00 C ATOM 0 H VAL A 71 79.612 20.689 -1.626 1.00 0.00 H new ATOM 0 HA VAL A 71 77.003 20.414 -0.619 1.00 0.00 H new ATOM 0 HB VAL A 71 78.501 18.506 -0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 71 80.422 18.102 0.513 1.00 0.00 H new ATOM 0 HG12 VAL A 71 80.623 19.593 -0.437 1.00 0.00 H new ATOM 0 HG13 VAL A 71 80.158 19.687 1.278 1.00 0.00 H new ATOM 0 HG21 VAL A 71 78.165 17.335 1.167 1.00 0.00 H new ATOM 0 HG22 VAL A 71 77.810 18.889 1.958 1.00 0.00 H new ATOM 0 HG23 VAL A 71 76.726 18.267 0.691 1.00 0.00 H new ATOM 1156 N ASP A 72 79.209 21.837 1.365 1.00 0.00 N ATOM 1157 CA ASP A 72 79.368 22.598 2.599 1.00 0.00 C ATOM 1158 C ASP A 72 78.438 23.807 2.615 1.00 0.00 C ATOM 1159 O ASP A 72 77.931 24.200 3.667 1.00 0.00 O ATOM 1160 CB ASP A 72 80.819 23.054 2.758 1.00 0.00 C ATOM 1161 CG ASP A 72 81.785 21.889 2.848 1.00 0.00 C ATOM 1162 OD1 ASP A 72 81.317 20.734 2.930 1.00 0.00 O ATOM 1163 OD2 ASP A 72 83.010 22.132 2.834 1.00 0.00 O ATOM 0 H ASP A 72 80.043 21.805 0.778 1.00 0.00 H new ATOM 0 HA ASP A 72 79.105 21.949 3.434 1.00 0.00 H new ATOM 0 HB2 ASP A 72 81.093 23.685 1.913 1.00 0.00 H new ATOM 0 HB3 ASP A 72 80.908 23.666 3.655 1.00 0.00 H new ATOM 1168 N LEU A 73 78.218 24.394 1.444 1.00 0.00 N ATOM 1169 CA LEU A 73 77.349 25.559 1.323 1.00 0.00 C ATOM 1170 C LEU A 73 75.892 25.180 1.567 1.00 0.00 C ATOM 1171 O LEU A 73 75.222 25.763 2.420 1.00 0.00 O ATOM 1172 CB LEU A 73 77.498 26.190 -0.063 1.00 0.00 C ATOM 1173 CG LEU A 73 78.930 26.455 -0.529 1.00 0.00 C ATOM 1174 CD1 LEU A 73 78.931 27.250 -1.825 1.00 0.00 C ATOM 1175 CD2 LEU A 73 79.715 27.188 0.550 1.00 0.00 C ATOM 0 H LEU A 73 78.630 24.082 0.564 1.00 0.00 H new ATOM 0 HA LEU A 73 77.648 26.284 2.080 1.00 0.00 H new ATOM 0 HB2 LEU A 73 77.015 25.538 -0.791 1.00 0.00 H new ATOM 0 HB3 LEU A 73 76.954 27.134 -0.071 1.00 0.00 H new ATOM 0 HG LEU A 73 79.415 25.497 -0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 73 79.959 27.429 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 73 78.406 26.687 -2.597 1.00 0.00 H new ATOM 0 HD13 LEU A 73 78.429 28.204 -1.667 1.00 0.00 H new ATOM 0 HD21 LEU A 73 80.732 27.368 0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 73 79.232 28.141 0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 73 79.744 26.581 1.455 1.00 0.00 H new ATOM 1187 N LYS A 74 75.407 24.198 0.814 1.00 0.00 N ATOM 1188 CA LYS A 74 74.031 23.737 0.950 1.00 0.00 C ATOM 1189 C LYS A 74 73.773 23.198 2.354 1.00 0.00 C ATOM 1190 O LYS A 74 72.759 23.516 2.974 1.00 0.00 O ATOM 1191 CB LYS A 74 73.730 22.653 -0.087 1.00 0.00 C ATOM 1192 CG LYS A 74 72.266 22.251 -0.139 1.00 0.00 C ATOM 1193 CD LYS A 74 71.484 23.119 -1.110 1.00 0.00 C ATOM 1194 CE LYS A 74 70.130 22.509 -1.438 1.00 0.00 C ATOM 1195 NZ LYS A 74 69.184 22.610 -0.292 1.00 0.00 N ATOM 0 H LYS A 74 75.948 23.706 0.103 1.00 0.00 H new ATOM 0 HA LYS A 74 73.371 24.588 0.780 1.00 0.00 H new ATOM 0 HB2 LYS A 74 74.036 23.008 -1.071 1.00 0.00 H new ATOM 0 HB3 LYS A 74 74.332 21.772 0.135 1.00 0.00 H new ATOM 0 HG2 LYS A 74 72.185 21.206 -0.437 1.00 0.00 H new ATOM 0 HG3 LYS A 74 71.830 22.333 0.856 1.00 0.00 H new ATOM 0 HD2 LYS A 74 71.343 24.111 -0.680 1.00 0.00 H new ATOM 0 HD3 LYS A 74 72.058 23.248 -2.028 1.00 0.00 H new ATOM 0 HE2 LYS A 74 69.705 23.014 -2.305 1.00 0.00 H new ATOM 0 HE3 LYS A 74 70.260 21.462 -1.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 68.980 21.658 0.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 69.611 23.186 0.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 68.300 23.056 -0.610 1.00 0.00 H new ATOM 1209 N ASP A 75 74.699 22.384 2.849 1.00 0.00 N ATOM 1210 CA ASP A 75 74.573 21.803 4.180 1.00 0.00 C ATOM 1211 C ASP A 75 74.573 22.891 5.250 1.00 0.00 C ATOM 1212 O ASP A 75 73.848 22.803 6.241 1.00 0.00 O ATOM 1213 CB ASP A 75 75.712 20.816 4.439 1.00 0.00 C ATOM 1214 CG ASP A 75 75.428 19.899 5.613 1.00 0.00 C ATOM 1215 OD1 ASP A 75 74.619 18.962 5.451 1.00 0.00 O ATOM 1216 OD2 ASP A 75 76.017 20.117 6.692 1.00 0.00 O ATOM 0 H ASP A 75 75.545 22.112 2.348 1.00 0.00 H new ATOM 0 HA ASP A 75 73.623 21.270 4.229 1.00 0.00 H new ATOM 0 HB2 ASP A 75 75.879 20.215 3.545 1.00 0.00 H new ATOM 0 HB3 ASP A 75 76.632 21.369 4.628 1.00 0.00 H new ATOM 1221 N LYS A 76 75.392 23.917 5.043 1.00 0.00 N ATOM 1222 CA LYS A 76 75.487 25.023 5.988 1.00 0.00 C ATOM 1223 C LYS A 76 74.169 25.786 6.067 1.00 0.00 C ATOM 1224 O LYS A 76 73.746 26.203 7.145 1.00 0.00 O ATOM 1225 CB LYS A 76 76.615 25.973 5.580 1.00 0.00 C ATOM 1226 CG LYS A 76 77.960 25.618 6.191 1.00 0.00 C ATOM 1227 CD LYS A 76 77.922 25.700 7.708 1.00 0.00 C ATOM 1228 CE LYS A 76 78.731 26.880 8.223 1.00 0.00 C ATOM 1229 NZ LYS A 76 80.175 26.756 7.880 1.00 0.00 N ATOM 0 H LYS A 76 76.000 24.005 4.229 1.00 0.00 H new ATOM 0 HA LYS A 76 75.706 24.609 6.972 1.00 0.00 H new ATOM 0 HB2 LYS A 76 76.707 25.970 4.494 1.00 0.00 H new ATOM 0 HB3 LYS A 76 76.348 26.988 5.874 1.00 0.00 H new ATOM 0 HG2 LYS A 76 78.244 24.611 5.887 1.00 0.00 H new ATOM 0 HG3 LYS A 76 78.724 26.294 5.808 1.00 0.00 H new ATOM 0 HD2 LYS A 76 76.889 25.792 8.043 1.00 0.00 H new ATOM 0 HD3 LYS A 76 78.313 24.776 8.133 1.00 0.00 H new ATOM 0 HE2 LYS A 76 78.335 27.803 7.800 1.00 0.00 H new ATOM 0 HE3 LYS A 76 78.620 26.952 9.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 80.743 26.792 8.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 80.340 25.851 7.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 80.452 27.539 7.254 1.00 0.00 H new ATOM 1243 N TRP A 77 73.524 25.963 4.920 1.00 0.00 N ATOM 1244 CA TRP A 77 72.252 26.675 4.861 1.00 0.00 C ATOM 1245 C TRP A 77 71.174 25.931 5.641 1.00 0.00 C ATOM 1246 O TRP A 77 70.416 26.533 6.401 1.00 0.00 O ATOM 1247 CB TRP A 77 71.813 26.857 3.407 1.00 0.00 C ATOM 1248 CG TRP A 77 70.326 26.948 3.242 1.00 0.00 C ATOM 1249 CD1 TRP A 77 69.564 28.080 3.290 1.00 0.00 C ATOM 1250 CD2 TRP A 77 69.422 25.864 3.005 1.00 0.00 C ATOM 1251 NE1 TRP A 77 68.241 27.765 3.097 1.00 0.00 N ATOM 1252 CE2 TRP A 77 68.127 26.412 2.919 1.00 0.00 C ATOM 1253 CE3 TRP A 77 69.580 24.483 2.854 1.00 0.00 C ATOM 1254 CZ2 TRP A 77 67.000 25.626 2.691 1.00 0.00 C ATOM 1255 CZ3 TRP A 77 68.461 23.705 2.628 1.00 0.00 C ATOM 1256 CH2 TRP A 77 67.185 24.278 2.547 1.00 0.00 C ATOM 0 H TRP A 77 73.860 25.624 4.019 1.00 0.00 H new ATOM 0 HA TRP A 77 72.392 27.655 5.317 1.00 0.00 H new ATOM 0 HB2 TRP A 77 72.272 27.761 3.007 1.00 0.00 H new ATOM 0 HB3 TRP A 77 72.187 26.021 2.815 1.00 0.00 H new ATOM 0 HD1 TRP A 77 69.945 29.077 3.455 1.00 0.00 H new ATOM 0 HE1 TRP A 77 67.469 28.431 3.088 1.00 0.00 H new ATOM 0 HE3 TRP A 77 70.560 24.032 2.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 66.015 26.065 2.630 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 68.572 22.637 2.512 1.00 0.00 H new ATOM 0 HH2 TRP A 77 66.330 23.643 2.367 1.00 0.00 H new ATOM 1267 N LYS A 78 71.112 24.618 5.449 1.00 0.00 N ATOM 1268 CA LYS A 78 70.127 23.790 6.135 1.00 0.00 C ATOM 1269 C LYS A 78 70.331 23.842 7.646 1.00 0.00 C ATOM 1270 O LYS A 78 69.369 23.899 8.412 1.00 0.00 O ATOM 1271 CB LYS A 78 70.219 22.342 5.648 1.00 0.00 C ATOM 1272 CG LYS A 78 69.326 21.383 6.416 1.00 0.00 C ATOM 1273 CD LYS A 78 67.856 21.723 6.234 1.00 0.00 C ATOM 1274 CE LYS A 78 66.960 20.719 6.944 1.00 0.00 C ATOM 1275 NZ LYS A 78 66.674 21.126 8.347 1.00 0.00 N ATOM 0 H LYS A 78 71.733 24.104 4.824 1.00 0.00 H new ATOM 0 HA LYS A 78 69.136 24.182 5.905 1.00 0.00 H new ATOM 0 HB2 LYS A 78 69.953 22.305 4.592 1.00 0.00 H new ATOM 0 HB3 LYS A 78 71.253 22.006 5.728 1.00 0.00 H new ATOM 0 HG2 LYS A 78 69.509 20.363 6.077 1.00 0.00 H new ATOM 0 HG3 LYS A 78 69.580 21.417 7.475 1.00 0.00 H new ATOM 0 HD2 LYS A 78 67.662 22.723 6.621 1.00 0.00 H new ATOM 0 HD3 LYS A 78 67.614 21.740 5.171 1.00 0.00 H new ATOM 0 HE2 LYS A 78 66.023 20.618 6.397 1.00 0.00 H new ATOM 0 HE3 LYS A 78 67.438 19.739 6.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 66.061 20.416 8.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 67.566 21.198 8.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 66.195 22.049 8.350 1.00 0.00 H new ATOM 1289 N THR A 79 71.592 23.823 8.070 1.00 0.00 N ATOM 1290 CA THR A 79 71.922 23.869 9.488 1.00 0.00 C ATOM 1291 C THR A 79 71.649 25.250 10.072 1.00 0.00 C ATOM 1292 O THR A 79 70.968 25.382 11.091 1.00 0.00 O ATOM 1293 CB THR A 79 73.398 23.503 9.734 1.00 0.00 C ATOM 1294 OG1 THR A 79 73.809 22.484 8.816 1.00 0.00 O ATOM 1295 CG2 THR A 79 73.606 23.021 11.161 1.00 0.00 C ATOM 0 H THR A 79 72.401 23.776 7.450 1.00 0.00 H new ATOM 0 HA THR A 79 71.286 23.136 9.984 1.00 0.00 H new ATOM 0 HB THR A 79 74.002 24.397 9.578 1.00 0.00 H new ATOM 0 HG1 THR A 79 74.034 22.892 7.954 1.00 0.00 H new ATOM 0 HG21 THR A 79 74.656 22.769 11.310 1.00 0.00 H new ATOM 0 HG22 THR A 79 73.320 23.810 11.857 1.00 0.00 H new ATOM 0 HG23 THR A 79 72.992 22.139 11.340 1.00 0.00 H new ATOM 1303 N LEU A 80 72.182 26.279 9.421 1.00 0.00 N ATOM 1304 CA LEU A 80 71.994 27.652 9.876 1.00 0.00 C ATOM 1305 C LEU A 80 70.514 28.021 9.898 1.00 0.00 C ATOM 1306 O LEU A 80 70.065 28.776 10.760 1.00 0.00 O ATOM 1307 CB LEU A 80 72.760 28.619 8.970 1.00 0.00 C ATOM 1308 CG LEU A 80 71.931 29.344 7.910 1.00 0.00 C ATOM 1309 CD1 LEU A 80 71.236 30.556 8.512 1.00 0.00 C ATOM 1310 CD2 LEU A 80 72.808 29.758 6.738 1.00 0.00 C ATOM 0 H LEU A 80 72.747 26.188 8.577 1.00 0.00 H new ATOM 0 HA LEU A 80 72.383 27.729 10.891 1.00 0.00 H new ATOM 0 HB2 LEU A 80 73.245 29.367 9.598 1.00 0.00 H new ATOM 0 HB3 LEU A 80 73.552 28.064 8.467 1.00 0.00 H new ATOM 0 HG LEU A 80 71.168 28.658 7.542 1.00 0.00 H new ATOM 0 HD11 LEU A 80 70.651 31.059 7.742 1.00 0.00 H new ATOM 0 HD12 LEU A 80 70.576 30.234 9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 80 71.983 31.244 8.908 1.00 0.00 H new ATOM 0 HD21 LEU A 80 72.201 30.273 5.993 1.00 0.00 H new ATOM 0 HD22 LEU A 80 73.594 30.426 7.090 1.00 0.00 H new ATOM 0 HD23 LEU A 80 73.258 28.872 6.290 1.00 0.00 H new ATOM 1322 N VAL A 81 69.761 27.483 8.944 1.00 0.00 N ATOM 1323 CA VAL A 81 68.331 27.753 8.855 1.00 0.00 C ATOM 1324 C VAL A 81 67.581 27.136 10.030 1.00 0.00 C ATOM 1325 O VAL A 81 66.744 27.785 10.656 1.00 0.00 O ATOM 1326 CB VAL A 81 67.738 27.212 7.540 1.00 0.00 C ATOM 1327 CG1 VAL A 81 66.240 26.990 7.682 1.00 0.00 C ATOM 1328 CG2 VAL A 81 68.039 28.161 6.390 1.00 0.00 C ATOM 0 H VAL A 81 70.118 26.857 8.222 1.00 0.00 H new ATOM 0 HA VAL A 81 68.211 28.836 8.880 1.00 0.00 H new ATOM 0 HB VAL A 81 68.204 26.252 7.319 1.00 0.00 H new ATOM 0 HG11 VAL A 81 65.838 26.608 6.744 1.00 0.00 H new ATOM 0 HG12 VAL A 81 66.053 26.269 8.477 1.00 0.00 H new ATOM 0 HG13 VAL A 81 65.754 27.934 7.927 1.00 0.00 H new ATOM 0 HG21 VAL A 81 67.613 27.763 5.469 1.00 0.00 H new ATOM 0 HG22 VAL A 81 67.602 29.137 6.600 1.00 0.00 H new ATOM 0 HG23 VAL A 81 69.118 28.263 6.276 1.00 0.00 H new ATOM 1338 N HIS A 82 67.888 25.876 10.325 1.00 0.00 N ATOM 1339 CA HIS A 82 67.244 25.170 11.426 1.00 0.00 C ATOM 1340 C HIS A 82 67.504 25.879 12.752 1.00 0.00 C ATOM 1341 O HIS A 82 66.628 25.946 13.615 1.00 0.00 O ATOM 1342 CB HIS A 82 67.745 23.728 11.499 1.00 0.00 C ATOM 1343 CG HIS A 82 67.049 22.902 12.536 1.00 0.00 C ATOM 1344 ND1 HIS A 82 67.693 21.951 13.299 1.00 0.00 N ATOM 1345 CD2 HIS A 82 65.756 22.891 12.937 1.00 0.00 C ATOM 1346 CE1 HIS A 82 66.827 21.389 14.123 1.00 0.00 C ATOM 1347 NE2 HIS A 82 65.644 21.942 13.924 1.00 0.00 N ATOM 0 H HIS A 82 68.579 25.324 9.817 1.00 0.00 H new ATOM 0 HA HIS A 82 66.170 25.164 11.241 1.00 0.00 H new ATOM 0 HB2 HIS A 82 67.615 23.257 10.524 1.00 0.00 H new ATOM 0 HB3 HIS A 82 68.814 23.734 11.710 1.00 0.00 H new ATOM 0 HD2 HIS A 82 64.961 23.512 12.553 1.00 0.00 H new ATOM 0 HE1 HIS A 82 67.048 20.610 14.838 1.00 0.00 H new ATOM 0 HE2 HIS A 82 64.787 21.703 14.422 1.00 0.00 H new ATOM 1355 N THR A 83 68.715 26.406 12.908 1.00 0.00 N ATOM 1356 CA THR A 83 69.091 27.107 14.129 1.00 0.00 C ATOM 1357 C THR A 83 68.422 28.474 14.206 1.00 0.00 C ATOM 1358 O THR A 83 68.141 28.978 15.293 1.00 0.00 O ATOM 1359 CB THR A 83 70.618 27.289 14.224 1.00 0.00 C ATOM 1360 OG1 THR A 83 71.265 26.012 14.216 1.00 0.00 O ATOM 1361 CG2 THR A 83 70.995 28.046 15.489 1.00 0.00 C ATOM 0 H THR A 83 69.452 26.360 12.204 1.00 0.00 H new ATOM 0 HA THR A 83 68.753 26.493 14.964 1.00 0.00 H new ATOM 0 HB THR A 83 70.947 27.868 13.361 1.00 0.00 H new ATOM 0 HG1 THR A 83 71.280 25.659 13.302 1.00 0.00 H new ATOM 0 HG21 THR A 83 72.078 28.162 15.534 1.00 0.00 H new ATOM 0 HG22 THR A 83 70.524 29.029 15.479 1.00 0.00 H new ATOM 0 HG23 THR A 83 70.653 27.489 16.362 1.00 0.00 H new ATOM 1369 N ALA A 84 68.169 29.071 13.046 1.00 0.00 N ATOM 1370 CA ALA A 84 67.529 30.379 12.983 1.00 0.00 C ATOM 1371 C ALA A 84 66.010 30.249 13.004 1.00 0.00 C ATOM 1372 O ALA A 84 65.293 31.248 13.071 1.00 0.00 O ATOM 1373 CB ALA A 84 67.980 31.127 11.737 1.00 0.00 C ATOM 0 H ALA A 84 68.398 28.669 12.137 1.00 0.00 H new ATOM 0 HA ALA A 84 67.830 30.947 13.863 1.00 0.00 H new ATOM 0 HB1 ALA A 84 67.494 32.102 11.702 1.00 0.00 H new ATOM 0 HB2 ALA A 84 69.061 31.261 11.764 1.00 0.00 H new ATOM 0 HB3 ALA A 84 67.708 30.554 10.850 1.00 0.00 H new ATOM 1379 N SER A 85 65.525 29.013 12.945 1.00 0.00 N ATOM 1380 CA SER A 85 64.091 28.753 12.953 1.00 0.00 C ATOM 1381 C SER A 85 63.647 28.192 14.300 1.00 0.00 C ATOM 1382 O SER A 85 62.543 28.470 14.768 1.00 0.00 O ATOM 1383 CB SER A 85 63.722 27.777 11.834 1.00 0.00 C ATOM 1384 OG SER A 85 62.322 27.563 11.785 1.00 0.00 O ATOM 0 H SER A 85 66.105 28.176 12.891 1.00 0.00 H new ATOM 0 HA SER A 85 63.575 29.698 12.786 1.00 0.00 H new ATOM 0 HB2 SER A 85 64.067 28.169 10.877 1.00 0.00 H new ATOM 0 HB3 SER A 85 64.233 26.827 11.992 1.00 0.00 H new ATOM 0 HG SER A 85 62.112 26.937 11.061 1.00 0.00 H new ATOM 1390 N ILE A 86 64.517 27.399 14.919 1.00 0.00 N ATOM 1391 CA ILE A 86 64.216 26.799 16.213 1.00 0.00 C ATOM 1392 C ILE A 86 63.757 27.853 17.214 1.00 0.00 C ATOM 1393 O ILE A 86 63.833 29.052 16.948 1.00 0.00 O ATOM 1394 CB ILE A 86 65.438 26.059 16.787 1.00 0.00 C ATOM 1395 CG1 ILE A 86 66.684 26.944 16.703 1.00 0.00 C ATOM 1396 CG2 ILE A 86 65.662 24.749 16.046 1.00 0.00 C ATOM 1397 CD1 ILE A 86 67.863 26.403 17.481 1.00 0.00 C ATOM 0 H ILE A 86 65.435 27.158 14.545 1.00 0.00 H new ATOM 0 HA ILE A 86 63.411 26.082 16.050 1.00 0.00 H new ATOM 0 HB ILE A 86 65.246 25.832 17.836 1.00 0.00 H new ATOM 0 HG12 ILE A 86 66.970 27.057 15.657 1.00 0.00 H new ATOM 0 HG13 ILE A 86 66.439 27.939 17.075 1.00 0.00 H new ATOM 0 HG21 ILE A 86 66.530 24.238 16.464 1.00 0.00 H new ATOM 0 HG22 ILE A 86 64.782 24.115 16.153 1.00 0.00 H new ATOM 0 HG23 ILE A 86 65.836 24.954 14.990 1.00 0.00 H new ATOM 0 HD11 ILE A 86 68.710 27.081 17.376 1.00 0.00 H new ATOM 0 HD12 ILE A 86 67.595 26.317 18.534 1.00 0.00 H new ATOM 0 HD13 ILE A 86 68.135 25.421 17.094 1.00 0.00 H new ATOM 1409 N ALA A 87 63.281 27.397 18.368 1.00 0.00 N ATOM 1410 CA ALA A 87 62.813 28.301 19.412 1.00 0.00 C ATOM 1411 C ALA A 87 63.956 29.153 19.953 1.00 0.00 C ATOM 1412 O ALA A 87 65.133 28.817 19.816 1.00 0.00 O ATOM 1413 CB ALA A 87 62.161 27.513 20.538 1.00 0.00 C ATOM 0 H ALA A 87 63.209 26.407 18.604 1.00 0.00 H new ATOM 0 HA ALA A 87 62.072 28.970 18.974 1.00 0.00 H new ATOM 0 HB1 ALA A 87 61.816 28.200 21.311 1.00 0.00 H new ATOM 0 HB2 ALA A 87 61.312 26.952 20.146 1.00 0.00 H new ATOM 0 HB3 ALA A 87 62.887 26.821 20.965 1.00 0.00 H new ATOM 1419 N PRO A 88 63.605 30.284 20.583 1.00 0.00 N ATOM 1420 CA PRO A 88 64.587 31.208 21.158 1.00 0.00 C ATOM 1421 C PRO A 88 65.284 30.626 22.383 1.00 0.00 C ATOM 1422 O PRO A 88 66.411 31.002 22.704 1.00 0.00 O ATOM 1423 CB PRO A 88 63.744 32.424 21.549 1.00 0.00 C ATOM 1424 CG PRO A 88 62.372 31.882 21.759 1.00 0.00 C ATOM 1425 CD PRO A 88 62.222 30.747 20.784 1.00 0.00 C ATOM 0 HA PRO A 88 65.390 31.437 20.457 1.00 0.00 H new ATOM 0 HB2 PRO A 88 64.126 32.896 22.454 1.00 0.00 H new ATOM 0 HB3 PRO A 88 63.755 33.182 20.765 1.00 0.00 H new ATOM 0 HG2 PRO A 88 62.242 31.536 22.784 1.00 0.00 H new ATOM 0 HG3 PRO A 88 61.618 32.649 21.584 1.00 0.00 H new ATOM 0 HD2 PRO A 88 61.588 29.956 21.183 1.00 0.00 H new ATOM 0 HD3 PRO A 88 61.769 31.078 19.849 1.00 0.00 H new ATOM 1433 N GLN A 89 64.605 29.707 23.063 1.00 0.00 N ATOM 1434 CA GLN A 89 65.160 29.074 24.253 1.00 0.00 C ATOM 1435 C GLN A 89 66.529 28.470 23.960 1.00 0.00 C ATOM 1436 O GLN A 89 67.365 28.341 24.855 1.00 0.00 O ATOM 1437 CB GLN A 89 64.211 27.990 24.769 1.00 0.00 C ATOM 1438 CG GLN A 89 64.142 26.765 23.872 1.00 0.00 C ATOM 1439 CD GLN A 89 63.275 25.665 24.452 1.00 0.00 C ATOM 1440 OE1 GLN A 89 63.771 24.750 25.110 1.00 0.00 O ATOM 1441 NE2 GLN A 89 61.972 25.749 24.212 1.00 0.00 N ATOM 0 H GLN A 89 63.671 29.385 22.810 1.00 0.00 H new ATOM 0 HA GLN A 89 65.278 29.840 25.020 1.00 0.00 H new ATOM 0 HB2 GLN A 89 64.530 27.683 25.765 1.00 0.00 H new ATOM 0 HB3 GLN A 89 63.211 28.412 24.871 1.00 0.00 H new ATOM 0 HG2 GLN A 89 63.750 27.055 22.897 1.00 0.00 H new ATOM 0 HG3 GLN A 89 65.149 26.381 23.710 1.00 0.00 H new ATOM 0 HE21 GLN A 89 61.604 26.525 23.662 1.00 0.00 H new ATOM 0 HE22 GLN A 89 61.339 25.038 24.578 1.00 0.00 H new ATOM 1450 N GLN A 90 66.752 28.102 22.703 1.00 0.00 N ATOM 1451 CA GLN A 90 68.021 27.511 22.294 1.00 0.00 C ATOM 1452 C GLN A 90 68.997 28.586 21.829 1.00 0.00 C ATOM 1453 O GLN A 90 70.081 28.740 22.392 1.00 0.00 O ATOM 1454 CB GLN A 90 67.795 26.492 21.175 1.00 0.00 C ATOM 1455 CG GLN A 90 66.700 25.483 21.483 1.00 0.00 C ATOM 1456 CD GLN A 90 67.112 24.480 22.542 1.00 0.00 C ATOM 1457 OE1 GLN A 90 66.727 24.595 23.706 1.00 0.00 O ATOM 1458 NE2 GLN A 90 67.898 23.487 22.142 1.00 0.00 N ATOM 0 H GLN A 90 66.071 28.202 21.950 1.00 0.00 H new ATOM 0 HA GLN A 90 68.452 27.004 23.157 1.00 0.00 H new ATOM 0 HB2 GLN A 90 67.541 27.023 20.257 1.00 0.00 H new ATOM 0 HB3 GLN A 90 68.727 25.959 20.987 1.00 0.00 H new ATOM 0 HG2 GLN A 90 65.807 26.012 21.817 1.00 0.00 H new ATOM 0 HG3 GLN A 90 66.433 24.952 20.569 1.00 0.00 H new ATOM 0 HE21 GLN A 90 68.193 23.431 21.167 1.00 0.00 H new ATOM 0 HE22 GLN A 90 68.207 22.780 22.810 1.00 0.00 H new ATOM 1467 N ARG A 91 68.606 29.327 20.797 1.00 0.00 N ATOM 1468 CA ARG A 91 69.448 30.387 20.255 1.00 0.00 C ATOM 1469 C ARG A 91 70.915 29.968 20.252 1.00 0.00 C ATOM 1470 O ARG A 91 71.797 30.757 20.592 1.00 0.00 O ATOM 1471 CB ARG A 91 69.275 31.671 21.069 1.00 0.00 C ATOM 1472 CG ARG A 91 69.720 31.539 22.516 1.00 0.00 C ATOM 1473 CD ARG A 91 69.967 32.900 23.150 1.00 0.00 C ATOM 1474 NE ARG A 91 69.777 32.872 24.597 1.00 0.00 N ATOM 1475 CZ ARG A 91 70.195 33.835 25.412 1.00 0.00 C ATOM 1476 NH1 ARG A 91 70.822 34.896 24.923 1.00 0.00 N ATOM 1477 NH2 ARG A 91 69.985 33.738 26.718 1.00 0.00 N ATOM 0 H ARG A 91 67.712 29.213 20.320 1.00 0.00 H new ATOM 0 HA ARG A 91 69.139 30.572 19.226 1.00 0.00 H new ATOM 0 HB2 ARG A 91 69.843 32.471 20.595 1.00 0.00 H new ATOM 0 HB3 ARG A 91 68.226 31.967 21.046 1.00 0.00 H new ATOM 0 HG2 ARG A 91 68.959 31.004 23.084 1.00 0.00 H new ATOM 0 HG3 ARG A 91 70.631 30.943 22.565 1.00 0.00 H new ATOM 0 HD2 ARG A 91 70.982 33.226 22.924 1.00 0.00 H new ATOM 0 HD3 ARG A 91 69.291 33.633 22.710 1.00 0.00 H new ATOM 0 HE ARG A 91 69.297 32.070 25.005 1.00 0.00 H new ATOM 0 HH11 ARG A 91 70.985 34.975 23.919 1.00 0.00 H new ATOM 0 HH12 ARG A 91 71.142 35.634 25.551 1.00 0.00 H new ATOM 0 HH21 ARG A 91 69.502 32.924 27.098 1.00 0.00 H new ATOM 0 HH22 ARG A 91 70.306 34.478 27.343 1.00 0.00 H new ATOM 1491 N ARG A 92 71.168 28.722 19.866 1.00 0.00 N ATOM 1492 CA ARG A 92 72.528 28.197 19.820 1.00 0.00 C ATOM 1493 C ARG A 92 73.165 28.457 18.458 1.00 0.00 C ATOM 1494 O ARG A 92 73.018 27.662 17.531 1.00 0.00 O ATOM 1495 CB ARG A 92 72.529 26.697 20.118 1.00 0.00 C ATOM 1496 CG ARG A 92 73.778 26.220 20.840 1.00 0.00 C ATOM 1497 CD ARG A 92 73.489 25.009 21.713 1.00 0.00 C ATOM 1498 NE ARG A 92 73.350 23.787 20.926 1.00 0.00 N ATOM 1499 CZ ARG A 92 73.351 22.568 21.455 1.00 0.00 C ATOM 1500 NH1 ARG A 92 73.483 22.410 22.765 1.00 0.00 N ATOM 1501 NH2 ARG A 92 73.219 21.504 20.673 1.00 0.00 N ATOM 0 H ARG A 92 70.449 28.057 19.581 1.00 0.00 H new ATOM 0 HA ARG A 92 73.115 28.711 20.581 1.00 0.00 H new ATOM 0 HB2 ARG A 92 71.655 26.455 20.723 1.00 0.00 H new ATOM 0 HB3 ARG A 92 72.430 26.149 19.181 1.00 0.00 H new ATOM 0 HG2 ARG A 92 74.548 25.968 20.110 1.00 0.00 H new ATOM 0 HG3 ARG A 92 74.174 27.027 21.456 1.00 0.00 H new ATOM 0 HD2 ARG A 92 74.294 24.884 22.437 1.00 0.00 H new ATOM 0 HD3 ARG A 92 72.574 25.181 22.280 1.00 0.00 H new ATOM 0 HE ARG A 92 73.246 23.874 19.915 1.00 0.00 H new ATOM 0 HH11 ARG A 92 73.584 23.225 23.369 1.00 0.00 H new ATOM 0 HH12 ARG A 92 73.483 21.473 23.168 1.00 0.00 H new ATOM 0 HH21 ARG A 92 73.117 21.621 19.665 1.00 0.00 H new ATOM 0 HH22 ARG A 92 73.220 20.569 21.080 1.00 0.00 H new ATOM 1515 N GLY A 93 73.874 29.576 18.346 1.00 0.00 N ATOM 1516 CA GLY A 93 74.522 29.921 17.094 1.00 0.00 C ATOM 1517 C GLY A 93 75.623 30.947 17.275 1.00 0.00 C ATOM 1518 O GLY A 93 75.642 31.680 18.263 1.00 0.00 O ATOM 0 H GLY A 93 74.011 30.250 19.100 1.00 0.00 H new ATOM 0 HA2 GLY A 93 74.939 29.020 16.644 1.00 0.00 H new ATOM 0 HA3 GLY A 93 73.778 30.310 16.398 1.00 0.00 H new ATOM 1522 N ALA A 94 76.545 30.998 16.318 1.00 0.00 N ATOM 1523 CA ALA A 94 77.654 31.942 16.376 1.00 0.00 C ATOM 1524 C ALA A 94 77.149 33.376 16.498 1.00 0.00 C ATOM 1525 O ALA A 94 75.993 33.679 16.204 1.00 0.00 O ATOM 1526 CB ALA A 94 78.538 31.794 15.147 1.00 0.00 C ATOM 0 H ALA A 94 76.545 30.397 15.494 1.00 0.00 H new ATOM 0 HA ALA A 94 78.245 31.716 17.264 1.00 0.00 H new ATOM 0 HB1 ALA A 94 79.362 32.505 15.204 1.00 0.00 H new ATOM 0 HB2 ALA A 94 78.936 30.780 15.105 1.00 0.00 H new ATOM 0 HB3 ALA A 94 77.950 31.991 14.250 1.00 0.00 H new ATOM 1532 N PRO A 95 78.035 34.280 16.942 1.00 0.00 N ATOM 1533 CA PRO A 95 77.702 35.697 17.113 1.00 0.00 C ATOM 1534 C PRO A 95 77.495 36.409 15.780 1.00 0.00 C ATOM 1535 O PRO A 95 78.376 37.125 15.304 1.00 0.00 O ATOM 1536 CB PRO A 95 78.924 36.264 17.838 1.00 0.00 C ATOM 1537 CG PRO A 95 80.042 35.354 17.465 1.00 0.00 C ATOM 1538 CD PRO A 95 79.431 33.989 17.311 1.00 0.00 C ATOM 0 HA PRO A 95 76.767 35.833 17.656 1.00 0.00 H new ATOM 0 HB2 PRO A 95 79.128 37.289 17.528 1.00 0.00 H new ATOM 0 HB3 PRO A 95 78.771 36.282 18.917 1.00 0.00 H new ATOM 0 HG2 PRO A 95 80.515 35.677 16.538 1.00 0.00 H new ATOM 0 HG3 PRO A 95 80.815 35.351 18.233 1.00 0.00 H new ATOM 0 HD2 PRO A 95 79.937 33.407 16.541 1.00 0.00 H new ATOM 0 HD3 PRO A 95 79.491 33.415 18.236 1.00 0.00 H new ATOM 1546 N VAL A 96 76.325 36.208 15.182 1.00 0.00 N ATOM 1547 CA VAL A 96 76.002 36.832 13.905 1.00 0.00 C ATOM 1548 C VAL A 96 74.777 37.731 14.026 1.00 0.00 C ATOM 1549 O VAL A 96 73.943 37.569 14.918 1.00 0.00 O ATOM 1550 CB VAL A 96 75.744 35.776 12.814 1.00 0.00 C ATOM 1551 CG1 VAL A 96 77.059 35.244 12.264 1.00 0.00 C ATOM 1552 CG2 VAL A 96 74.888 34.644 13.360 1.00 0.00 C ATOM 0 H VAL A 96 75.585 35.618 15.562 1.00 0.00 H new ATOM 0 HA VAL A 96 76.864 37.435 13.621 1.00 0.00 H new ATOM 0 HB VAL A 96 75.201 36.249 11.996 1.00 0.00 H new ATOM 0 HG11 VAL A 96 76.857 34.499 11.494 1.00 0.00 H new ATOM 0 HG12 VAL A 96 77.632 36.065 11.833 1.00 0.00 H new ATOM 0 HG13 VAL A 96 77.632 34.786 13.070 1.00 0.00 H new ATOM 0 HG21 VAL A 96 74.716 33.907 12.576 1.00 0.00 H new ATOM 0 HG22 VAL A 96 75.402 34.170 14.196 1.00 0.00 H new ATOM 0 HG23 VAL A 96 73.932 35.042 13.700 1.00 0.00 H new ATOM 1562 N PRO A 97 74.662 38.702 13.108 1.00 0.00 N ATOM 1563 CA PRO A 97 73.541 39.646 13.090 1.00 0.00 C ATOM 1564 C PRO A 97 72.228 38.980 12.692 1.00 0.00 C ATOM 1565 O PRO A 97 72.222 37.989 11.963 1.00 0.00 O ATOM 1566 CB PRO A 97 73.960 40.675 12.037 1.00 0.00 C ATOM 1567 CG PRO A 97 74.896 39.940 11.141 1.00 0.00 C ATOM 1568 CD PRO A 97 75.618 38.953 12.017 1.00 0.00 C ATOM 0 HA PRO A 97 73.354 40.075 14.074 1.00 0.00 H new ATOM 0 HB2 PRO A 97 73.098 41.051 11.486 1.00 0.00 H new ATOM 0 HB3 PRO A 97 74.446 41.536 12.496 1.00 0.00 H new ATOM 0 HG2 PRO A 97 74.354 39.431 10.344 1.00 0.00 H new ATOM 0 HG3 PRO A 97 75.597 40.624 10.663 1.00 0.00 H new ATOM 0 HD2 PRO A 97 75.860 38.038 11.476 1.00 0.00 H new ATOM 0 HD3 PRO A 97 76.557 39.360 12.391 1.00 0.00 H new ATOM 1576 N GLN A 98 71.120 39.531 13.175 1.00 0.00 N ATOM 1577 CA GLN A 98 69.801 38.989 12.869 1.00 0.00 C ATOM 1578 C GLN A 98 69.565 38.951 11.363 1.00 0.00 C ATOM 1579 O GLN A 98 68.809 38.117 10.865 1.00 0.00 O ATOM 1580 CB GLN A 98 68.713 39.823 13.547 1.00 0.00 C ATOM 1581 CG GLN A 98 68.900 39.963 15.049 1.00 0.00 C ATOM 1582 CD GLN A 98 67.641 40.428 15.753 1.00 0.00 C ATOM 1583 OE1 GLN A 98 66.771 39.625 16.089 1.00 0.00 O ATOM 1584 NE2 GLN A 98 67.538 41.732 15.982 1.00 0.00 N ATOM 0 H GLN A 98 71.109 40.352 13.780 1.00 0.00 H new ATOM 0 HA GLN A 98 69.757 37.969 13.251 1.00 0.00 H new ATOM 0 HB2 GLN A 98 68.695 40.816 13.098 1.00 0.00 H new ATOM 0 HB3 GLN A 98 67.743 39.367 13.351 1.00 0.00 H new ATOM 0 HG2 GLN A 98 69.210 39.004 15.464 1.00 0.00 H new ATOM 0 HG3 GLN A 98 69.705 40.671 15.247 1.00 0.00 H new ATOM 0 HE21 GLN A 98 68.284 42.362 15.686 1.00 0.00 H new ATOM 0 HE22 GLN A 98 66.713 42.103 16.454 1.00 0.00 H new ATOM 1593 N GLU A 99 70.217 39.859 10.643 1.00 0.00 N ATOM 1594 CA GLU A 99 70.076 39.929 9.193 1.00 0.00 C ATOM 1595 C GLU A 99 70.312 38.562 8.557 1.00 0.00 C ATOM 1596 O GLU A 99 69.577 38.147 7.660 1.00 0.00 O ATOM 1597 CB GLU A 99 71.056 40.950 8.612 1.00 0.00 C ATOM 1598 CG GLU A 99 72.508 40.668 8.962 1.00 0.00 C ATOM 1599 CD GLU A 99 73.306 41.935 9.200 1.00 0.00 C ATOM 1600 OE1 GLU A 99 72.851 42.784 9.995 1.00 0.00 O ATOM 1601 OE2 GLU A 99 74.388 42.077 8.591 1.00 0.00 O ATOM 0 H GLU A 99 70.847 40.556 11.040 1.00 0.00 H new ATOM 0 HA GLU A 99 69.057 40.245 8.967 1.00 0.00 H new ATOM 0 HB2 GLU A 99 70.949 40.967 7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 99 70.790 41.943 8.974 1.00 0.00 H new ATOM 0 HG2 GLU A 99 72.548 40.044 9.855 1.00 0.00 H new ATOM 0 HG3 GLU A 99 72.969 40.099 8.155 1.00 0.00 H new ATOM 1608 N LEU A 100 71.342 37.867 9.028 1.00 0.00 N ATOM 1609 CA LEU A 100 71.677 36.547 8.505 1.00 0.00 C ATOM 1610 C LEU A 100 70.487 35.599 8.618 1.00 0.00 C ATOM 1611 O LEU A 100 70.188 34.848 7.689 1.00 0.00 O ATOM 1612 CB LEU A 100 72.877 35.968 9.257 1.00 0.00 C ATOM 1613 CG LEU A 100 74.155 36.808 9.229 1.00 0.00 C ATOM 1614 CD1 LEU A 100 75.373 35.934 9.483 1.00 0.00 C ATOM 1615 CD2 LEU A 100 74.286 37.535 7.898 1.00 0.00 C ATOM 0 H LEU A 100 71.959 38.195 9.771 1.00 0.00 H new ATOM 0 HA LEU A 100 71.934 36.655 7.451 1.00 0.00 H new ATOM 0 HB2 LEU A 100 72.589 35.815 10.297 1.00 0.00 H new ATOM 0 HB3 LEU A 100 73.102 34.986 8.841 1.00 0.00 H new ATOM 0 HG LEU A 100 74.096 37.553 10.023 1.00 0.00 H new ATOM 0 HD11 LEU A 100 76.273 36.548 9.459 1.00 0.00 H new ATOM 0 HD12 LEU A 100 75.283 35.460 10.460 1.00 0.00 H new ATOM 0 HD13 LEU A 100 75.437 35.167 8.712 1.00 0.00 H new ATOM 0 HD21 LEU A 100 75.201 38.128 7.896 1.00 0.00 H new ATOM 0 HD22 LEU A 100 74.323 36.807 7.088 1.00 0.00 H new ATOM 0 HD23 LEU A 100 73.428 38.192 7.756 1.00 0.00 H new ATOM 1627 N LEU A 101 69.810 35.641 9.760 1.00 0.00 N ATOM 1628 CA LEU A 101 68.650 34.788 9.994 1.00 0.00 C ATOM 1629 C LEU A 101 67.444 35.278 9.199 1.00 0.00 C ATOM 1630 O LEU A 101 66.554 34.498 8.859 1.00 0.00 O ATOM 1631 CB LEU A 101 68.311 34.751 11.485 1.00 0.00 C ATOM 1632 CG LEU A 101 69.420 34.255 12.414 1.00 0.00 C ATOM 1633 CD1 LEU A 101 70.402 33.379 11.651 1.00 0.00 C ATOM 1634 CD2 LEU A 101 70.140 35.429 13.061 1.00 0.00 C ATOM 0 H LEU A 101 70.044 36.257 10.539 1.00 0.00 H new ATOM 0 HA LEU A 101 68.898 33.781 9.659 1.00 0.00 H new ATOM 0 HB2 LEU A 101 68.025 35.756 11.797 1.00 0.00 H new ATOM 0 HB3 LEU A 101 67.437 34.114 11.623 1.00 0.00 H new ATOM 0 HG LEU A 101 68.966 33.655 13.203 1.00 0.00 H new ATOM 0 HD11 LEU A 101 71.184 33.035 12.328 1.00 0.00 H new ATOM 0 HD12 LEU A 101 69.876 32.519 11.237 1.00 0.00 H new ATOM 0 HD13 LEU A 101 70.850 33.955 10.841 1.00 0.00 H new ATOM 0 HD21 LEU A 101 70.926 35.056 13.718 1.00 0.00 H new ATOM 0 HD22 LEU A 101 70.582 36.056 12.287 1.00 0.00 H new ATOM 0 HD23 LEU A 101 69.429 36.016 13.642 1.00 0.00 H new ATOM 1646 N ASP A 102 67.424 36.573 8.904 1.00 0.00 N ATOM 1647 CA ASP A 102 66.329 37.167 8.145 1.00 0.00 C ATOM 1648 C ASP A 102 66.446 36.824 6.663 1.00 0.00 C ATOM 1649 O ASP A 102 65.451 36.524 6.005 1.00 0.00 O ATOM 1650 CB ASP A 102 66.316 38.685 8.331 1.00 0.00 C ATOM 1651 CG ASP A 102 64.991 39.305 7.935 1.00 0.00 C ATOM 1652 OD1 ASP A 102 63.943 38.831 8.423 1.00 0.00 O ATOM 1653 OD2 ASP A 102 65.001 40.266 7.137 1.00 0.00 O ATOM 0 H ASP A 102 68.153 37.231 9.179 1.00 0.00 H new ATOM 0 HA ASP A 102 65.393 36.755 8.522 1.00 0.00 H new ATOM 0 HB2 ASP A 102 66.528 38.922 9.374 1.00 0.00 H new ATOM 0 HB3 ASP A 102 67.114 39.128 7.735 1.00 0.00 H new ATOM 1658 N ARG A 103 67.669 36.874 6.145 1.00 0.00 N ATOM 1659 CA ARG A 103 67.916 36.571 4.740 1.00 0.00 C ATOM 1660 C ARG A 103 67.692 35.089 4.455 1.00 0.00 C ATOM 1661 O ARG A 103 67.066 34.725 3.459 1.00 0.00 O ATOM 1662 CB ARG A 103 69.343 36.966 4.355 1.00 0.00 C ATOM 1663 CG ARG A 103 70.410 36.307 5.214 1.00 0.00 C ATOM 1664 CD ARG A 103 71.800 36.816 4.864 1.00 0.00 C ATOM 1665 NE ARG A 103 72.152 36.532 3.476 1.00 0.00 N ATOM 1666 CZ ARG A 103 71.924 37.373 2.473 1.00 0.00 C ATOM 1667 NH1 ARG A 103 71.347 38.544 2.704 1.00 0.00 N ATOM 1668 NH2 ARG A 103 72.274 37.044 1.236 1.00 0.00 N ATOM 0 H ARG A 103 68.504 37.121 6.677 1.00 0.00 H new ATOM 0 HA ARG A 103 67.212 37.148 4.141 1.00 0.00 H new ATOM 0 HB2 ARG A 103 69.515 36.703 3.311 1.00 0.00 H new ATOM 0 HB3 ARG A 103 69.444 38.049 4.431 1.00 0.00 H new ATOM 0 HG2 ARG A 103 70.204 36.503 6.266 1.00 0.00 H new ATOM 0 HG3 ARG A 103 70.372 35.226 5.078 1.00 0.00 H new ATOM 0 HD2 ARG A 103 71.847 37.891 5.037 1.00 0.00 H new ATOM 0 HD3 ARG A 103 72.533 36.354 5.526 1.00 0.00 H new ATOM 0 HE ARG A 103 72.597 35.639 3.265 1.00 0.00 H new ATOM 0 HH11 ARG A 103 71.077 38.801 3.653 1.00 0.00 H new ATOM 0 HH12 ARG A 103 71.173 39.188 1.932 1.00 0.00 H new ATOM 0 HH21 ARG A 103 72.719 36.144 1.054 1.00 0.00 H new ATOM 0 HH22 ARG A 103 72.098 37.691 0.467 1.00 0.00 H new ATOM 1682 N VAL A 104 68.208 34.238 5.336 1.00 0.00 N ATOM 1683 CA VAL A 104 68.064 32.795 5.180 1.00 0.00 C ATOM 1684 C VAL A 104 66.608 32.369 5.330 1.00 0.00 C ATOM 1685 O VAL A 104 66.123 31.506 4.596 1.00 0.00 O ATOM 1686 CB VAL A 104 68.919 32.032 6.208 1.00 0.00 C ATOM 1687 CG1 VAL A 104 70.396 32.330 6.001 1.00 0.00 C ATOM 1688 CG2 VAL A 104 68.490 32.383 7.625 1.00 0.00 C ATOM 0 H VAL A 104 68.729 34.523 6.165 1.00 0.00 H new ATOM 0 HA VAL A 104 68.410 32.549 4.176 1.00 0.00 H new ATOM 0 HB VAL A 104 68.764 30.963 6.060 1.00 0.00 H new ATOM 0 HG11 VAL A 104 70.984 31.782 6.737 1.00 0.00 H new ATOM 0 HG12 VAL A 104 70.692 32.023 4.998 1.00 0.00 H new ATOM 0 HG13 VAL A 104 70.572 33.399 6.120 1.00 0.00 H new ATOM 0 HG21 VAL A 104 69.105 31.834 8.338 1.00 0.00 H new ATOM 0 HG22 VAL A 104 68.613 33.454 7.788 1.00 0.00 H new ATOM 0 HG23 VAL A 104 67.443 32.113 7.766 1.00 0.00 H new ATOM 1698 N LEU A 105 65.914 32.979 6.284 1.00 0.00 N ATOM 1699 CA LEU A 105 64.511 32.664 6.531 1.00 0.00 C ATOM 1700 C LEU A 105 63.635 33.135 5.374 1.00 0.00 C ATOM 1701 O LEU A 105 62.866 32.358 4.809 1.00 0.00 O ATOM 1702 CB LEU A 105 64.044 33.311 7.836 1.00 0.00 C ATOM 1703 CG LEU A 105 64.409 32.570 9.122 1.00 0.00 C ATOM 1704 CD1 LEU A 105 63.918 33.338 10.339 1.00 0.00 C ATOM 1705 CD2 LEU A 105 63.832 31.162 9.108 1.00 0.00 C ATOM 0 H LEU A 105 66.300 33.695 6.900 1.00 0.00 H new ATOM 0 HA LEU A 105 64.417 31.581 6.616 1.00 0.00 H new ATOM 0 HB2 LEU A 105 64.462 34.316 7.889 1.00 0.00 H new ATOM 0 HB3 LEU A 105 62.960 33.418 7.797 1.00 0.00 H new ATOM 0 HG LEU A 105 65.495 32.495 9.180 1.00 0.00 H new ATOM 0 HD11 LEU A 105 64.187 32.795 11.245 1.00 0.00 H new ATOM 0 HD12 LEU A 105 64.380 34.325 10.357 1.00 0.00 H new ATOM 0 HD13 LEU A 105 62.834 33.445 10.289 1.00 0.00 H new ATOM 0 HD21 LEU A 105 64.102 30.649 10.031 1.00 0.00 H new ATOM 0 HD22 LEU A 105 62.746 31.214 9.026 1.00 0.00 H new ATOM 0 HD23 LEU A 105 64.234 30.612 8.257 1.00 0.00 H new ATOM 1717 N ALA A 106 63.761 34.411 5.026 1.00 0.00 N ATOM 1718 CA ALA A 106 62.984 34.984 3.933 1.00 0.00 C ATOM 1719 C ALA A 106 63.198 34.205 2.640 1.00 0.00 C ATOM 1720 O ALA A 106 62.245 33.895 1.926 1.00 0.00 O ATOM 1721 CB ALA A 106 63.350 36.448 3.737 1.00 0.00 C ATOM 0 H ALA A 106 64.393 35.067 5.484 1.00 0.00 H new ATOM 0 HA ALA A 106 61.928 34.917 4.196 1.00 0.00 H new ATOM 0 HB1 ALA A 106 62.763 36.863 2.918 1.00 0.00 H new ATOM 0 HB2 ALA A 106 63.139 37.001 4.652 1.00 0.00 H new ATOM 0 HB3 ALA A 106 64.411 36.529 3.500 1.00 0.00 H new ATOM 1727 N ALA A 107 64.456 33.893 2.344 1.00 0.00 N ATOM 1728 CA ALA A 107 64.794 33.150 1.137 1.00 0.00 C ATOM 1729 C ALA A 107 64.173 31.757 1.158 1.00 0.00 C ATOM 1730 O ALA A 107 63.656 31.284 0.146 1.00 0.00 O ATOM 1731 CB ALA A 107 66.305 33.054 0.983 1.00 0.00 C ATOM 0 H ALA A 107 65.257 34.143 2.924 1.00 0.00 H new ATOM 0 HA ALA A 107 64.386 33.688 0.282 1.00 0.00 H new ATOM 0 HB1 ALA A 107 66.544 32.496 0.077 1.00 0.00 H new ATOM 0 HB2 ALA A 107 66.728 34.056 0.914 1.00 0.00 H new ATOM 0 HB3 ALA A 107 66.727 32.540 1.847 1.00 0.00 H new ATOM 1737 N GLN A 108 64.229 31.106 2.315 1.00 0.00 N ATOM 1738 CA GLN A 108 63.673 29.767 2.466 1.00 0.00 C ATOM 1739 C GLN A 108 62.214 29.731 2.024 1.00 0.00 C ATOM 1740 O GLN A 108 61.806 28.851 1.267 1.00 0.00 O ATOM 1741 CB GLN A 108 63.790 29.304 3.919 1.00 0.00 C ATOM 1742 CG GLN A 108 63.851 27.793 4.073 1.00 0.00 C ATOM 1743 CD GLN A 108 62.548 27.115 3.697 1.00 0.00 C ATOM 1744 OE1 GLN A 108 61.465 27.587 4.047 1.00 0.00 O ATOM 1745 NE2 GLN A 108 62.645 26.002 2.980 1.00 0.00 N ATOM 0 H GLN A 108 64.654 31.484 3.162 1.00 0.00 H new ATOM 0 HA GLN A 108 64.243 29.090 1.830 1.00 0.00 H new ATOM 0 HB2 GLN A 108 64.685 29.742 4.360 1.00 0.00 H new ATOM 0 HB3 GLN A 108 62.938 29.684 4.482 1.00 0.00 H new ATOM 0 HG2 GLN A 108 64.654 27.400 3.449 1.00 0.00 H new ATOM 0 HG3 GLN A 108 64.100 27.547 5.105 1.00 0.00 H new ATOM 0 HE21 GLN A 108 63.563 25.646 2.712 1.00 0.00 H new ATOM 0 HE22 GLN A 108 61.802 25.502 2.697 1.00 0.00 H new ATOM 1754 N ALA A 109 61.432 30.693 2.502 1.00 0.00 N ATOM 1755 CA ALA A 109 60.018 30.772 2.155 1.00 0.00 C ATOM 1756 C ALA A 109 59.830 31.298 0.737 1.00 0.00 C ATOM 1757 O ALA A 109 58.848 30.974 0.069 1.00 0.00 O ATOM 1758 CB ALA A 109 59.279 31.654 3.150 1.00 0.00 C ATOM 0 H ALA A 109 61.754 31.429 3.131 1.00 0.00 H new ATOM 0 HA ALA A 109 59.601 29.766 2.199 1.00 0.00 H new ATOM 0 HB1 ALA A 109 58.224 31.704 2.879 1.00 0.00 H new ATOM 0 HB2 ALA A 109 59.377 31.234 4.151 1.00 0.00 H new ATOM 0 HB3 ALA A 109 59.706 32.657 3.134 1.00 0.00 H new ATOM 1764 N TYR A 110 60.776 32.113 0.283 1.00 0.00 N ATOM 1765 CA TYR A 110 60.712 32.687 -1.056 1.00 0.00 C ATOM 1766 C TYR A 110 60.719 31.592 -2.119 1.00 0.00 C ATOM 1767 O TYR A 110 59.943 31.634 -3.073 1.00 0.00 O ATOM 1768 CB TYR A 110 61.888 33.639 -1.282 1.00 0.00 C ATOM 1769 CG TYR A 110 61.580 35.076 -0.924 1.00 0.00 C ATOM 1770 CD1 TYR A 110 60.384 35.668 -1.310 1.00 0.00 C ATOM 1771 CD2 TYR A 110 62.485 35.841 -0.199 1.00 0.00 C ATOM 1772 CE1 TYR A 110 60.099 36.980 -0.987 1.00 0.00 C ATOM 1773 CE2 TYR A 110 62.209 37.154 0.131 1.00 0.00 C ATOM 1774 CZ TYR A 110 61.015 37.719 -0.266 1.00 0.00 C ATOM 1775 OH TYR A 110 60.734 39.026 0.060 1.00 0.00 O ATOM 0 H TYR A 110 61.596 32.391 0.822 1.00 0.00 H new ATOM 0 HA TYR A 110 59.779 33.245 -1.140 1.00 0.00 H new ATOM 0 HB2 TYR A 110 62.738 33.300 -0.690 1.00 0.00 H new ATOM 0 HB3 TYR A 110 62.188 33.590 -2.329 1.00 0.00 H new ATOM 0 HD1 TYR A 110 59.664 35.092 -1.873 1.00 0.00 H new ATOM 0 HD2 TYR A 110 63.421 35.402 0.112 1.00 0.00 H new ATOM 0 HE1 TYR A 110 59.165 37.425 -1.297 1.00 0.00 H new ATOM 0 HE2 TYR A 110 62.924 37.734 0.696 1.00 0.00 H new ATOM 0 HH TYR A 110 61.481 39.404 0.569 1.00 0.00 H new ATOM 1785 N TRP A 111 61.600 30.614 -1.946 1.00 0.00 N ATOM 1786 CA TRP A 111 61.709 29.507 -2.889 1.00 0.00 C ATOM 1787 C TRP A 111 60.474 28.615 -2.826 1.00 0.00 C ATOM 1788 O TRP A 111 60.196 27.857 -3.755 1.00 0.00 O ATOM 1789 CB TRP A 111 62.964 28.683 -2.598 1.00 0.00 C ATOM 1790 CG TRP A 111 64.178 29.522 -2.337 1.00 0.00 C ATOM 1791 CD1 TRP A 111 64.569 30.634 -3.026 1.00 0.00 C ATOM 1792 CD2 TRP A 111 65.161 29.313 -1.317 1.00 0.00 C ATOM 1793 NE1 TRP A 111 65.735 31.130 -2.495 1.00 0.00 N ATOM 1794 CE2 TRP A 111 66.118 30.338 -1.445 1.00 0.00 C ATOM 1795 CE3 TRP A 111 65.324 28.362 -0.307 1.00 0.00 C ATOM 1796 CZ2 TRP A 111 67.221 30.436 -0.601 1.00 0.00 C ATOM 1797 CZ3 TRP A 111 66.419 28.460 0.530 1.00 0.00 C ATOM 1798 CH2 TRP A 111 67.356 29.491 0.379 1.00 0.00 C ATOM 0 H TRP A 111 62.250 30.565 -1.161 1.00 0.00 H new ATOM 0 HA TRP A 111 61.782 29.924 -3.893 1.00 0.00 H new ATOM 0 HB2 TRP A 111 62.779 28.046 -1.733 1.00 0.00 H new ATOM 0 HB3 TRP A 111 63.161 28.024 -3.444 1.00 0.00 H new ATOM 0 HD1 TRP A 111 64.040 31.061 -3.865 1.00 0.00 H new ATOM 0 HE1 TRP A 111 66.235 31.954 -2.829 1.00 0.00 H new ATOM 0 HE3 TRP A 111 64.607 27.564 -0.182 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 67.944 31.230 -0.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 66.555 27.730 1.314 1.00 0.00 H new ATOM 0 HH2 TRP A 111 68.201 29.541 1.049 1.00 0.00 H new ATOM 1809 N SER A 112 59.735 28.712 -1.725 1.00 0.00 N ATOM 1810 CA SER A 112 58.531 27.910 -1.540 1.00 0.00 C ATOM 1811 C SER A 112 57.393 28.430 -2.414 1.00 0.00 C ATOM 1812 O SER A 112 56.930 29.558 -2.245 1.00 0.00 O ATOM 1813 CB SER A 112 58.106 27.922 -0.070 1.00 0.00 C ATOM 1814 OG SER A 112 57.375 26.753 0.258 1.00 0.00 O ATOM 0 H SER A 112 59.949 29.338 -0.948 1.00 0.00 H new ATOM 0 HA SER A 112 58.756 26.886 -1.838 1.00 0.00 H new ATOM 0 HB2 SER A 112 58.988 27.994 0.566 1.00 0.00 H new ATOM 0 HB3 SER A 112 57.497 28.804 0.129 1.00 0.00 H new ATOM 0 HG SER A 112 57.116 26.783 1.203 1.00 0.00 H new ATOM 1820 N VAL A 113 56.947 27.597 -3.350 1.00 0.00 N ATOM 1821 CA VAL A 113 55.863 27.970 -4.250 1.00 0.00 C ATOM 1822 C VAL A 113 54.552 27.314 -3.834 1.00 0.00 C ATOM 1823 O VAL A 113 53.471 27.852 -4.076 1.00 0.00 O ATOM 1824 CB VAL A 113 56.182 27.577 -5.705 1.00 0.00 C ATOM 1825 CG1 VAL A 113 54.926 27.635 -6.562 1.00 0.00 C ATOM 1826 CG2 VAL A 113 57.268 28.477 -6.274 1.00 0.00 C ATOM 0 H VAL A 113 57.320 26.660 -3.504 1.00 0.00 H new ATOM 0 HA VAL A 113 55.759 29.053 -4.188 1.00 0.00 H new ATOM 0 HB VAL A 113 56.551 26.551 -5.713 1.00 0.00 H new ATOM 0 HG11 VAL A 113 55.171 27.354 -7.586 1.00 0.00 H new ATOM 0 HG12 VAL A 113 54.182 26.944 -6.165 1.00 0.00 H new ATOM 0 HG13 VAL A 113 54.524 28.648 -6.550 1.00 0.00 H new ATOM 0 HG21 VAL A 113 57.481 28.185 -7.302 1.00 0.00 H new ATOM 0 HG22 VAL A 113 56.930 29.513 -6.253 1.00 0.00 H new ATOM 0 HG23 VAL A 113 58.173 28.379 -5.675 1.00 0.00 H new ATOM 1836 N ASP A 114 54.654 26.148 -3.205 1.00 0.00 N ATOM 1837 CA ASP A 114 53.476 25.418 -2.752 1.00 0.00 C ATOM 1838 C ASP A 114 52.666 24.904 -3.938 1.00 0.00 C ATOM 1839 O ASP A 114 51.459 25.129 -4.023 1.00 0.00 O ATOM 1840 CB ASP A 114 52.602 26.312 -1.871 1.00 0.00 C ATOM 1841 CG ASP A 114 51.613 25.518 -1.040 1.00 0.00 C ATOM 1842 OD1 ASP A 114 51.389 24.332 -1.359 1.00 0.00 O ATOM 1843 OD2 ASP A 114 51.063 26.084 -0.072 1.00 0.00 O ATOM 0 H ASP A 114 55.541 25.688 -2.997 1.00 0.00 H new ATOM 0 HA ASP A 114 53.813 24.563 -2.166 1.00 0.00 H new ATOM 0 HB2 ASP A 114 53.239 26.899 -1.209 1.00 0.00 H new ATOM 0 HB3 ASP A 114 52.059 27.018 -2.500 1.00 0.00 H new ATOM 1848 N SER A 115 53.339 24.212 -4.853 1.00 0.00 N ATOM 1849 CA SER A 115 52.683 23.671 -6.037 1.00 0.00 C ATOM 1850 C SER A 115 51.600 22.668 -5.647 1.00 0.00 C ATOM 1851 O SER A 115 50.412 22.905 -5.866 1.00 0.00 O ATOM 1852 CB SER A 115 53.709 23.000 -6.952 1.00 0.00 C ATOM 1853 OG SER A 115 53.074 22.157 -7.899 1.00 0.00 O ATOM 0 H SER A 115 54.338 24.013 -4.796 1.00 0.00 H new ATOM 0 HA SER A 115 52.214 24.497 -6.572 1.00 0.00 H new ATOM 0 HB2 SER A 115 54.291 23.762 -7.471 1.00 0.00 H new ATOM 0 HB3 SER A 115 54.409 22.417 -6.353 1.00 0.00 H new ATOM 0 HG SER A 115 53.751 21.741 -8.473 1.00 0.00 H new ATOM 1859 N SER A 116 52.020 21.548 -5.069 1.00 0.00 N ATOM 1860 CA SER A 116 51.088 20.507 -4.652 1.00 0.00 C ATOM 1861 C SER A 116 51.706 19.627 -3.569 1.00 0.00 C ATOM 1862 O SER A 116 52.904 19.700 -3.302 1.00 0.00 O ATOM 1863 CB SER A 116 50.680 19.648 -5.851 1.00 0.00 C ATOM 1864 OG SER A 116 49.670 20.285 -6.613 1.00 0.00 O ATOM 0 H SER A 116 53.000 21.338 -4.879 1.00 0.00 H new ATOM 0 HA SER A 116 50.201 20.990 -4.242 1.00 0.00 H new ATOM 0 HB2 SER A 116 51.550 19.459 -6.480 1.00 0.00 H new ATOM 0 HB3 SER A 116 50.321 18.679 -5.503 1.00 0.00 H new ATOM 0 HG SER A 116 49.665 21.244 -6.413 1.00 0.00 H new ATOM 1870 N GLY A 117 50.876 18.795 -2.947 1.00 0.00 N ATOM 1871 CA GLY A 117 51.357 17.912 -1.900 1.00 0.00 C ATOM 1872 C GLY A 117 50.434 16.732 -1.667 1.00 0.00 C ATOM 1873 O GLY A 117 49.793 16.635 -0.621 1.00 0.00 O ATOM 0 H GLY A 117 49.879 18.717 -3.149 1.00 0.00 H new ATOM 0 HA2 GLY A 117 52.349 17.546 -2.165 1.00 0.00 H new ATOM 0 HA3 GLY A 117 51.462 18.476 -0.973 1.00 0.00 H new ATOM 1877 N ARG A 118 50.366 15.835 -2.645 1.00 0.00 N ATOM 1878 CA ARG A 118 49.513 14.657 -2.542 1.00 0.00 C ATOM 1879 C ARG A 118 49.961 13.759 -1.393 1.00 0.00 C ATOM 1880 O ARG A 118 50.992 14.005 -0.766 1.00 0.00 O ATOM 1881 CB ARG A 118 49.532 13.871 -3.855 1.00 0.00 C ATOM 1882 CG ARG A 118 48.223 13.162 -4.160 1.00 0.00 C ATOM 1883 CD ARG A 118 47.935 13.142 -5.653 1.00 0.00 C ATOM 1884 NE ARG A 118 46.842 12.233 -5.987 1.00 0.00 N ATOM 1885 CZ ARG A 118 46.614 11.777 -7.214 1.00 0.00 C ATOM 1886 NH1 ARG A 118 47.400 12.143 -8.217 1.00 0.00 N ATOM 1887 NH2 ARG A 118 45.599 10.952 -7.439 1.00 0.00 N ATOM 0 H ARG A 118 50.891 15.901 -3.517 1.00 0.00 H new ATOM 0 HA ARG A 118 48.496 14.993 -2.342 1.00 0.00 H new ATOM 0 HB2 ARG A 118 49.765 14.552 -4.673 1.00 0.00 H new ATOM 0 HB3 ARG A 118 50.334 13.134 -3.816 1.00 0.00 H new ATOM 0 HG2 ARG A 118 48.265 12.140 -3.783 1.00 0.00 H new ATOM 0 HG3 ARG A 118 47.407 13.661 -3.638 1.00 0.00 H new ATOM 0 HD2 ARG A 118 47.684 14.149 -5.987 1.00 0.00 H new ATOM 0 HD3 ARG A 118 48.834 12.842 -6.192 1.00 0.00 H new ATOM 0 HE ARG A 118 46.219 11.932 -5.237 1.00 0.00 H new ATOM 0 HH11 ARG A 118 48.182 12.776 -8.048 1.00 0.00 H new ATOM 0 HH12 ARG A 118 47.223 11.792 -9.158 1.00 0.00 H new ATOM 0 HH21 ARG A 118 44.993 10.667 -6.670 1.00 0.00 H new ATOM 0 HH22 ARG A 118 45.425 10.603 -8.381 1.00 0.00 H new ATOM 1901 N ILE A 119 49.180 12.719 -1.122 1.00 0.00 N ATOM 1902 CA ILE A 119 49.497 11.785 -0.049 1.00 0.00 C ATOM 1903 C ILE A 119 50.433 10.685 -0.536 1.00 0.00 C ATOM 1904 O ILE A 119 50.127 9.498 -0.422 1.00 0.00 O ATOM 1905 CB ILE A 119 48.224 11.141 0.531 1.00 0.00 C ATOM 1906 CG1 ILE A 119 47.408 10.480 -0.582 1.00 0.00 C ATOM 1907 CG2 ILE A 119 47.389 12.182 1.261 1.00 0.00 C ATOM 1908 CD1 ILE A 119 46.595 9.294 -0.112 1.00 0.00 C ATOM 0 H ILE A 119 48.323 12.502 -1.631 1.00 0.00 H new ATOM 0 HA ILE A 119 49.992 12.360 0.733 1.00 0.00 H new ATOM 0 HB ILE A 119 48.517 10.372 1.246 1.00 0.00 H new ATOM 0 HG12 ILE A 119 46.737 11.220 -1.018 1.00 0.00 H new ATOM 0 HG13 ILE A 119 48.084 10.156 -1.374 1.00 0.00 H new ATOM 0 HG21 ILE A 119 46.493 11.711 1.665 1.00 0.00 H new ATOM 0 HG22 ILE A 119 47.973 12.611 2.076 1.00 0.00 H new ATOM 0 HG23 ILE A 119 47.102 12.971 0.566 1.00 0.00 H new ATOM 0 HD11 ILE A 119 46.042 8.875 -0.953 1.00 0.00 H new ATOM 0 HD12 ILE A 119 47.262 8.535 0.298 1.00 0.00 H new ATOM 0 HD13 ILE A 119 45.894 9.616 0.659 1.00 0.00 H new ATOM 1920 N VAL A 120 51.578 11.087 -1.079 1.00 0.00 N ATOM 1921 CA VAL A 120 52.562 10.136 -1.582 1.00 0.00 C ATOM 1922 C VAL A 120 52.884 9.074 -0.536 1.00 0.00 C ATOM 1923 O VAL A 120 53.390 9.384 0.544 1.00 0.00 O ATOM 1924 CB VAL A 120 53.865 10.843 -1.998 1.00 0.00 C ATOM 1925 CG1 VAL A 120 54.845 9.847 -2.600 1.00 0.00 C ATOM 1926 CG2 VAL A 120 53.570 11.970 -2.976 1.00 0.00 C ATOM 0 H VAL A 120 51.847 12.066 -1.182 1.00 0.00 H new ATOM 0 HA VAL A 120 52.122 9.658 -2.457 1.00 0.00 H new ATOM 0 HB VAL A 120 54.324 11.275 -1.108 1.00 0.00 H new ATOM 0 HG11 VAL A 120 55.760 10.365 -2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 120 55.080 9.078 -1.864 1.00 0.00 H new ATOM 0 HG13 VAL A 120 54.398 9.383 -3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 120 54.502 12.459 -3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 120 53.088 11.563 -3.865 1.00 0.00 H new ATOM 0 HG23 VAL A 120 52.908 12.697 -2.505 1.00 0.00 H new ATOM 1936 N THR A 121 52.589 7.820 -0.863 1.00 0.00 N ATOM 1937 CA THR A 121 52.847 6.712 0.048 1.00 0.00 C ATOM 1938 C THR A 121 53.094 5.417 -0.717 1.00 0.00 C ATOM 1939 O THR A 121 52.234 4.535 -0.760 1.00 0.00 O ATOM 1940 CB THR A 121 51.673 6.503 1.024 1.00 0.00 C ATOM 1941 OG1 THR A 121 51.178 7.769 1.474 1.00 0.00 O ATOM 1942 CG2 THR A 121 52.106 5.668 2.220 1.00 0.00 C ATOM 0 H THR A 121 52.171 7.546 -1.752 1.00 0.00 H new ATOM 0 HA THR A 121 53.741 6.971 0.616 1.00 0.00 H new ATOM 0 HB THR A 121 50.881 5.971 0.496 1.00 0.00 H new ATOM 0 HG1 THR A 121 50.711 8.218 0.739 1.00 0.00 H new ATOM 0 HG21 THR A 121 51.261 5.534 2.895 1.00 0.00 H new ATOM 0 HG22 THR A 121 52.455 4.694 1.877 1.00 0.00 H new ATOM 0 HG23 THR A 121 52.913 6.177 2.746 1.00 0.00 H new ATOM 1950 N LEU A 122 54.272 5.307 -1.320 1.00 0.00 N ATOM 1951 CA LEU A 122 54.633 4.118 -2.084 1.00 0.00 C ATOM 1952 C LEU A 122 54.508 2.862 -1.228 1.00 0.00 C ATOM 1953 O LEU A 122 54.449 2.938 -0.001 1.00 0.00 O ATOM 1954 CB LEU A 122 56.061 4.245 -2.618 1.00 0.00 C ATOM 1955 CG LEU A 122 56.380 3.440 -3.878 1.00 0.00 C ATOM 1956 CD1 LEU A 122 57.539 4.070 -4.635 1.00 0.00 C ATOM 1957 CD2 LEU A 122 56.697 1.995 -3.522 1.00 0.00 C ATOM 0 H LEU A 122 54.994 6.027 -1.295 1.00 0.00 H new ATOM 0 HA LEU A 122 53.944 4.033 -2.924 1.00 0.00 H new ATOM 0 HB2 LEU A 122 56.259 5.297 -2.823 1.00 0.00 H new ATOM 0 HB3 LEU A 122 56.750 3.939 -1.831 1.00 0.00 H new ATOM 0 HG LEU A 122 55.502 3.450 -4.524 1.00 0.00 H new ATOM 0 HD11 LEU A 122 57.752 3.483 -5.529 1.00 0.00 H new ATOM 0 HD12 LEU A 122 57.275 5.088 -4.923 1.00 0.00 H new ATOM 0 HD13 LEU A 122 58.422 4.091 -3.996 1.00 0.00 H new ATOM 0 HD21 LEU A 122 56.922 1.437 -4.431 1.00 0.00 H new ATOM 0 HD22 LEU A 122 57.559 1.965 -2.856 1.00 0.00 H new ATOM 0 HD23 LEU A 122 55.838 1.546 -3.024 1.00 0.00 H new TER 1969 LEU A 122