USER MOD reduce.3.24.130724 H: found=0, std=0, add=994, rem=0, adj=19 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 66 HIS : no HE2:sc= -0.685 K(o=-0.68,f=-6.4!) USER MOD Set 1.2: A 67 HIS : no HD1:sc= 0 X(o=-0.68,f=-0.68) USER MOD Set 2.1: A 51 THR OG1 : rot -51:sc= 0.865 USER MOD Set 2.2: A 74 LYS NZ :NH3+ 180:sc= -0.0123 (180deg=-0.0123) 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 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.101 K(o=-0.1,f=-2.1!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.529 K(o=-0.53,f=-2.6) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.817 USER MOD Single : A 48 HIS : no HD1:sc= -0.374 X(o=-0.37,f=-0.0024) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 158:sc= -0.234 (180deg=-0.826) USER MOD Single : A 78 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0365) USER MOD Single : A 79 THR OG1 : rot 80:sc= 0.436 USER MOD Single : A 82 HIS : no HD1:sc= -0.173 X(o=-0.17,f=0) USER MOD Single : A 83 THR OG1 : rot 71:sc= 0.0174 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 GLN : amide:sc= -0.13 K(o=-0.13,f=-2.7!) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 108 GLN : amide:sc= -1.69 K(o=-1.7,f=-2.2) 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 48:sc= 1.06 USER MOD Single : A 116 SER OG : rot 89:sc= 1.25 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.187 33.347 2.286 1.00 0.00 N ATOM 2 CA GLY A 1 1.011 32.529 2.303 1.00 0.00 C ATOM 3 C GLY A 1 1.078 31.575 1.127 1.00 0.00 C ATOM 4 O GLY A 1 0.445 30.519 1.139 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.186 33.982 3.110 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.209 33.912 1.413 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.026 32.734 2.323 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.889 33.175 2.293 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.045 31.959 3.232 1.00 0.00 H new ATOM 8 N SER A 2 1.846 31.947 0.108 1.00 0.00 N ATOM 9 CA SER A 2 1.989 31.119 -1.084 1.00 0.00 C ATOM 10 C SER A 2 3.440 31.088 -1.553 1.00 0.00 C ATOM 11 O SER A 2 3.797 31.651 -2.588 1.00 0.00 O ATOM 12 CB SER A 2 1.089 31.642 -2.205 1.00 0.00 C ATOM 13 OG SER A 2 0.902 30.660 -3.209 1.00 0.00 O ATOM 0 H SER A 2 2.379 32.816 0.084 1.00 0.00 H new ATOM 0 HA SER A 2 1.686 30.103 -0.829 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.123 31.934 -1.793 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.532 32.536 -2.644 1.00 0.00 H new ATOM 0 HG SER A 2 0.322 31.018 -3.913 1.00 0.00 H new ATOM 19 N PRO A 3 4.299 30.414 -0.773 1.00 0.00 N ATOM 20 CA PRO A 3 5.725 30.292 -1.087 1.00 0.00 C ATOM 21 C PRO A 3 5.977 29.404 -2.301 1.00 0.00 C ATOM 22 O PRO A 3 5.515 28.264 -2.355 1.00 0.00 O ATOM 23 CB PRO A 3 6.313 29.654 0.174 1.00 0.00 C ATOM 24 CG PRO A 3 5.175 28.917 0.791 1.00 0.00 C ATOM 25 CD PRO A 3 3.943 29.719 0.475 1.00 0.00 C ATOM 0 HA PRO A 3 6.170 31.254 -1.341 1.00 0.00 H new ATOM 0 HB2 PRO A 3 7.135 28.981 -0.069 1.00 0.00 H new ATOM 0 HB3 PRO A 3 6.710 30.410 0.852 1.00 0.00 H new ATOM 0 HG2 PRO A 3 5.098 27.908 0.386 1.00 0.00 H new ATOM 0 HG3 PRO A 3 5.311 28.819 1.868 1.00 0.00 H new ATOM 0 HD2 PRO A 3 3.070 29.080 0.344 1.00 0.00 H new ATOM 0 HD3 PRO A 3 3.706 30.422 1.273 1.00 0.00 H new ATOM 33 N PHE A 4 6.714 29.932 -3.273 1.00 0.00 N ATOM 34 CA PHE A 4 7.027 29.187 -4.486 1.00 0.00 C ATOM 35 C PHE A 4 7.732 27.876 -4.152 1.00 0.00 C ATOM 36 O PHE A 4 8.470 27.787 -3.172 1.00 0.00 O ATOM 37 CB PHE A 4 7.905 30.029 -5.415 1.00 0.00 C ATOM 38 CG PHE A 4 9.251 30.355 -4.835 1.00 0.00 C ATOM 39 CD1 PHE A 4 9.436 31.503 -4.082 1.00 0.00 C ATOM 40 CD2 PHE A 4 10.332 29.513 -5.042 1.00 0.00 C ATOM 41 CE1 PHE A 4 10.673 31.806 -3.546 1.00 0.00 C ATOM 42 CE2 PHE A 4 11.572 29.811 -4.509 1.00 0.00 C ATOM 43 CZ PHE A 4 11.743 30.959 -3.761 1.00 0.00 C ATOM 0 H PHE A 4 7.106 30.873 -3.244 1.00 0.00 H new ATOM 0 HA PHE A 4 6.090 28.957 -4.993 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.043 29.494 -6.355 1.00 0.00 H new ATOM 0 HB3 PHE A 4 7.385 30.958 -5.650 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.603 32.169 -3.912 1.00 0.00 H new ATOM 0 HD2 PHE A 4 10.204 28.614 -5.626 1.00 0.00 H new ATOM 0 HE1 PHE A 4 10.803 32.704 -2.960 1.00 0.00 H new ATOM 0 HE2 PHE A 4 12.407 29.146 -4.677 1.00 0.00 H new ATOM 0 HZ PHE A 4 12.711 31.194 -3.345 1.00 0.00 H new ATOM 53 N ALA A 5 7.498 26.859 -4.976 1.00 0.00 N ATOM 54 CA ALA A 5 8.111 25.552 -4.770 1.00 0.00 C ATOM 55 C ALA A 5 9.019 25.181 -5.937 1.00 0.00 C ATOM 56 O ALA A 5 8.661 24.354 -6.776 1.00 0.00 O ATOM 57 CB ALA A 5 7.038 24.491 -4.574 1.00 0.00 C ATOM 0 H ALA A 5 6.889 26.915 -5.792 1.00 0.00 H new ATOM 0 HA ALA A 5 8.724 25.603 -3.870 1.00 0.00 H new ATOM 0 HB1 ALA A 5 7.510 23.520 -4.421 1.00 0.00 H new ATOM 0 HB2 ALA A 5 6.433 24.742 -3.702 1.00 0.00 H new ATOM 0 HB3 ALA A 5 6.401 24.450 -5.458 1.00 0.00 H new ATOM 63 N ASP A 6 10.194 25.799 -5.986 1.00 0.00 N ATOM 64 CA ASP A 6 11.153 25.533 -7.052 1.00 0.00 C ATOM 65 C ASP A 6 12.246 24.582 -6.574 1.00 0.00 C ATOM 66 O ASP A 6 12.473 24.410 -5.376 1.00 0.00 O ATOM 67 CB ASP A 6 11.776 26.840 -7.544 1.00 0.00 C ATOM 68 CG ASP A 6 10.978 27.476 -8.665 1.00 0.00 C ATOM 69 OD1 ASP A 6 10.894 26.868 -9.752 1.00 0.00 O ATOM 70 OD2 ASP A 6 10.438 28.583 -8.456 1.00 0.00 O ATOM 0 H ASP A 6 10.505 26.487 -5.300 1.00 0.00 H new ATOM 0 HA ASP A 6 10.620 25.060 -7.877 1.00 0.00 H new ATOM 0 HB2 ASP A 6 11.849 27.540 -6.712 1.00 0.00 H new ATOM 0 HB3 ASP A 6 12.792 26.648 -7.889 1.00 0.00 H new ATOM 75 N PRO A 7 12.940 23.949 -7.531 1.00 0.00 N ATOM 76 CA PRO A 7 14.021 23.005 -7.232 1.00 0.00 C ATOM 77 C PRO A 7 15.253 23.696 -6.660 1.00 0.00 C ATOM 78 O PRO A 7 15.249 24.905 -6.433 1.00 0.00 O ATOM 79 CB PRO A 7 14.339 22.387 -8.596 1.00 0.00 C ATOM 80 CG PRO A 7 13.913 23.415 -9.587 1.00 0.00 C ATOM 81 CD PRO A 7 12.724 24.106 -8.979 1.00 0.00 C ATOM 0 HA PRO A 7 13.728 22.276 -6.476 1.00 0.00 H new ATOM 0 HB2 PRO A 7 15.401 22.162 -8.691 1.00 0.00 H new ATOM 0 HB3 PRO A 7 13.801 21.450 -8.741 1.00 0.00 H new ATOM 0 HG2 PRO A 7 14.717 24.123 -9.785 1.00 0.00 H new ATOM 0 HG3 PRO A 7 13.652 22.954 -10.540 1.00 0.00 H new ATOM 0 HD2 PRO A 7 12.679 25.156 -9.267 1.00 0.00 H new ATOM 0 HD3 PRO A 7 11.787 23.648 -9.297 1.00 0.00 H new ATOM 89 N ASN A 8 16.308 22.921 -6.429 1.00 0.00 N ATOM 90 CA ASN A 8 17.548 23.460 -5.883 1.00 0.00 C ATOM 91 C ASN A 8 17.283 24.240 -4.599 1.00 0.00 C ATOM 92 O ASN A 8 17.758 25.364 -4.435 1.00 0.00 O ATOM 93 CB ASN A 8 18.232 24.363 -6.911 1.00 0.00 C ATOM 94 CG ASN A 8 18.222 23.765 -8.304 1.00 0.00 C ATOM 95 OD1 ASN A 8 17.454 24.189 -9.168 1.00 0.00 O ATOM 96 ND2 ASN A 8 19.077 22.774 -8.529 1.00 0.00 N ATOM 0 H ASN A 8 16.329 21.918 -6.612 1.00 0.00 H new ATOM 0 HA ASN A 8 18.207 22.624 -5.649 1.00 0.00 H new ATOM 0 HB2 ASN A 8 17.731 25.331 -6.931 1.00 0.00 H new ATOM 0 HB3 ASN A 8 19.262 24.543 -6.604 1.00 0.00 H new ATOM 0 HD21 ASN A 8 19.115 22.332 -9.448 1.00 0.00 H new ATOM 0 HD22 ASN A 8 19.695 22.455 -7.783 1.00 0.00 H new ATOM 103 N SER A 9 16.521 23.637 -3.693 1.00 0.00 N ATOM 104 CA SER A 9 16.190 24.276 -2.425 1.00 0.00 C ATOM 105 C SER A 9 17.389 24.263 -1.480 1.00 0.00 C ATOM 106 O SER A 9 17.550 25.159 -0.650 1.00 0.00 O ATOM 107 CB SER A 9 15.002 23.570 -1.768 1.00 0.00 C ATOM 108 OG SER A 9 15.391 22.324 -1.216 1.00 0.00 O ATOM 0 H SER A 9 16.121 22.706 -3.813 1.00 0.00 H new ATOM 0 HA SER A 9 15.921 25.312 -2.629 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.586 24.204 -0.985 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.214 23.415 -2.505 1.00 0.00 H new ATOM 0 HG SER A 9 14.615 21.894 -0.801 1.00 0.00 H new ATOM 114 N LEU A 10 18.227 23.242 -1.613 1.00 0.00 N ATOM 115 CA LEU A 10 19.412 23.110 -0.773 1.00 0.00 C ATOM 116 C LEU A 10 20.430 24.202 -1.091 1.00 0.00 C ATOM 117 O LEU A 10 20.922 24.296 -2.215 1.00 0.00 O ATOM 118 CB LEU A 10 20.049 21.733 -0.966 1.00 0.00 C ATOM 119 CG LEU A 10 21.343 21.477 -0.192 1.00 0.00 C ATOM 120 CD1 LEU A 10 21.068 21.410 1.302 1.00 0.00 C ATOM 121 CD2 LEU A 10 22.006 20.194 -0.673 1.00 0.00 C ATOM 0 H LEU A 10 18.108 22.493 -2.295 1.00 0.00 H new ATOM 0 HA LEU A 10 19.103 23.218 0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 10 19.321 20.975 -0.678 1.00 0.00 H new ATOM 0 HB3 LEU A 10 20.251 21.594 -2.028 1.00 0.00 H new ATOM 0 HG LEU A 10 22.025 22.307 -0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 10 22.001 21.227 1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 10 20.638 22.354 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 10 20.368 20.600 1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 10 22.925 20.027 -0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 10 21.329 19.354 -0.518 1.00 0.00 H new ATOM 0 HD23 LEU A 10 22.239 20.281 -1.734 1.00 0.00 H new ATOM 133 N ALA A 11 20.741 25.022 -0.093 1.00 0.00 N ATOM 134 CA ALA A 11 21.702 26.104 -0.266 1.00 0.00 C ATOM 135 C ALA A 11 22.778 26.060 0.815 1.00 0.00 C ATOM 136 O ALA A 11 23.970 25.981 0.516 1.00 0.00 O ATOM 137 CB ALA A 11 20.992 27.449 -0.251 1.00 0.00 C ATOM 0 H ALA A 11 20.342 24.958 0.843 1.00 0.00 H new ATOM 0 HA ALA A 11 22.188 25.973 -1.233 1.00 0.00 H new ATOM 0 HB1 ALA A 11 21.722 28.247 -0.381 1.00 0.00 H new ATOM 0 HB2 ALA A 11 20.265 27.486 -1.063 1.00 0.00 H new ATOM 0 HB3 ALA A 11 20.479 27.579 0.702 1.00 0.00 H new ATOM 143 N LEU A 12 22.350 26.113 2.071 1.00 0.00 N ATOM 144 CA LEU A 12 23.276 26.080 3.197 1.00 0.00 C ATOM 145 C LEU A 12 23.820 24.671 3.414 1.00 0.00 C ATOM 146 O LEU A 12 23.123 23.800 3.935 1.00 0.00 O ATOM 147 CB LEU A 12 22.583 26.573 4.469 1.00 0.00 C ATOM 148 CG LEU A 12 23.498 27.139 5.555 1.00 0.00 C ATOM 149 CD1 LEU A 12 22.751 28.155 6.405 1.00 0.00 C ATOM 150 CD2 LEU A 12 24.052 26.019 6.423 1.00 0.00 C ATOM 0 H LEU A 12 21.367 26.179 2.335 1.00 0.00 H new ATOM 0 HA LEU A 12 24.112 26.741 2.967 1.00 0.00 H new ATOM 0 HB2 LEU A 12 21.863 27.343 4.191 1.00 0.00 H new ATOM 0 HB3 LEU A 12 22.016 25.745 4.895 1.00 0.00 H new ATOM 0 HG LEU A 12 24.334 27.644 5.072 1.00 0.00 H new ATOM 0 HD11 LEU A 12 23.418 28.547 7.173 1.00 0.00 H new ATOM 0 HD12 LEU A 12 22.404 28.973 5.773 1.00 0.00 H new ATOM 0 HD13 LEU A 12 21.895 27.674 6.879 1.00 0.00 H new ATOM 0 HD21 LEU A 12 24.701 26.441 7.190 1.00 0.00 H new ATOM 0 HD22 LEU A 12 23.229 25.485 6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 12 24.624 25.328 5.804 1.00 0.00 H new ATOM 162 N ALA A 13 25.068 24.455 3.013 1.00 0.00 N ATOM 163 CA ALA A 13 25.706 23.154 3.168 1.00 0.00 C ATOM 164 C ALA A 13 27.164 23.304 3.589 1.00 0.00 C ATOM 165 O ALA A 13 27.879 24.169 3.087 1.00 0.00 O ATOM 166 CB ALA A 13 25.608 22.361 1.873 1.00 0.00 C ATOM 0 H ALA A 13 25.658 25.165 2.578 1.00 0.00 H new ATOM 0 HA ALA A 13 25.182 22.611 3.955 1.00 0.00 H new ATOM 0 HB1 ALA A 13 26.089 21.391 2.003 1.00 0.00 H new ATOM 0 HB2 ALA A 13 24.559 22.215 1.615 1.00 0.00 H new ATOM 0 HB3 ALA A 13 26.106 22.908 1.073 1.00 0.00 H new ATOM 172 N ASN A 14 27.597 22.455 4.516 1.00 0.00 N ATOM 173 CA ASN A 14 28.970 22.494 5.006 1.00 0.00 C ATOM 174 C ASN A 14 29.946 22.034 3.928 1.00 0.00 C ATOM 175 O ASN A 14 29.729 21.014 3.273 1.00 0.00 O ATOM 176 CB ASN A 14 29.115 21.615 6.250 1.00 0.00 C ATOM 177 CG ASN A 14 28.991 20.138 5.931 1.00 0.00 C ATOM 178 OD1 ASN A 14 27.961 19.682 5.436 1.00 0.00 O ATOM 179 ND2 ASN A 14 30.045 19.381 6.215 1.00 0.00 N ATOM 0 H ASN A 14 27.017 21.732 4.942 1.00 0.00 H new ATOM 0 HA ASN A 14 29.206 23.525 5.268 1.00 0.00 H new ATOM 0 HB2 ASN A 14 30.083 21.804 6.714 1.00 0.00 H new ATOM 0 HB3 ASN A 14 28.353 21.892 6.978 1.00 0.00 H new ATOM 0 HD21 ASN A 14 30.020 18.380 6.023 1.00 0.00 H new ATOM 0 HD22 ASN A 14 30.879 19.801 6.625 1.00 0.00 H new ATOM 186 N VAL A 15 31.023 22.792 3.749 1.00 0.00 N ATOM 187 CA VAL A 15 32.034 22.461 2.752 1.00 0.00 C ATOM 188 C VAL A 15 33.383 22.184 3.407 1.00 0.00 C ATOM 189 O VAL A 15 33.679 22.663 4.502 1.00 0.00 O ATOM 190 CB VAL A 15 32.199 23.595 1.723 1.00 0.00 C ATOM 191 CG1 VAL A 15 31.027 23.612 0.754 1.00 0.00 C ATOM 192 CG2 VAL A 15 32.339 24.937 2.427 1.00 0.00 C ATOM 0 H VAL A 15 31.218 23.640 4.282 1.00 0.00 H new ATOM 0 HA VAL A 15 31.691 21.562 2.240 1.00 0.00 H new ATOM 0 HB VAL A 15 33.109 23.414 1.151 1.00 0.00 H new ATOM 0 HG11 VAL A 15 31.161 24.420 0.035 1.00 0.00 H new ATOM 0 HG12 VAL A 15 30.978 22.660 0.226 1.00 0.00 H new ATOM 0 HG13 VAL A 15 30.100 23.768 1.306 1.00 0.00 H new ATOM 0 HG21 VAL A 15 32.455 25.727 1.685 1.00 0.00 H new ATOM 0 HG22 VAL A 15 31.448 25.129 3.025 1.00 0.00 H new ATOM 0 HG23 VAL A 15 33.215 24.918 3.076 1.00 0.00 H new ATOM 202 N PRO A 16 34.222 21.393 2.722 1.00 0.00 N ATOM 203 CA PRO A 16 35.554 21.035 3.218 1.00 0.00 C ATOM 204 C PRO A 16 36.512 22.220 3.213 1.00 0.00 C ATOM 205 O PRO A 16 37.151 22.511 2.201 1.00 0.00 O ATOM 206 CB PRO A 16 36.023 19.963 2.231 1.00 0.00 C ATOM 207 CG PRO A 16 35.269 20.245 0.978 1.00 0.00 C ATOM 208 CD PRO A 16 33.934 20.787 1.411 1.00 0.00 C ATOM 0 HA PRO A 16 35.526 20.697 4.254 1.00 0.00 H new ATOM 0 HB2 PRO A 16 37.099 20.020 2.067 1.00 0.00 H new ATOM 0 HB3 PRO A 16 35.810 18.961 2.604 1.00 0.00 H new ATOM 0 HG2 PRO A 16 35.800 20.966 0.357 1.00 0.00 H new ATOM 0 HG3 PRO A 16 35.148 19.340 0.383 1.00 0.00 H new ATOM 0 HD2 PRO A 16 33.550 21.522 0.704 1.00 0.00 H new ATOM 0 HD3 PRO A 16 33.186 19.998 1.488 1.00 0.00 H new ATOM 216 N LEU A 17 36.609 22.902 4.349 1.00 0.00 N ATOM 217 CA LEU A 17 37.491 24.057 4.476 1.00 0.00 C ATOM 218 C LEU A 17 38.188 24.064 5.832 1.00 0.00 C ATOM 219 O LEU A 17 37.564 24.327 6.860 1.00 0.00 O ATOM 220 CB LEU A 17 36.698 25.352 4.290 1.00 0.00 C ATOM 221 CG LEU A 17 37.525 26.622 4.088 1.00 0.00 C ATOM 222 CD1 LEU A 17 37.904 26.785 2.624 1.00 0.00 C ATOM 223 CD2 LEU A 17 36.759 27.841 4.581 1.00 0.00 C ATOM 0 H LEU A 17 36.087 22.675 5.196 1.00 0.00 H new ATOM 0 HA LEU A 17 38.252 23.989 3.698 1.00 0.00 H new ATOM 0 HB2 LEU A 17 36.039 25.231 3.430 1.00 0.00 H new ATOM 0 HB3 LEU A 17 36.060 25.493 5.163 1.00 0.00 H new ATOM 0 HG LEU A 17 38.441 26.533 4.672 1.00 0.00 H new ATOM 0 HD11 LEU A 17 38.492 27.694 2.499 1.00 0.00 H new ATOM 0 HD12 LEU A 17 38.492 25.925 2.303 1.00 0.00 H new ATOM 0 HD13 LEU A 17 37.000 26.852 2.019 1.00 0.00 H new ATOM 0 HD21 LEU A 17 37.363 28.736 4.429 1.00 0.00 H new ATOM 0 HD22 LEU A 17 35.826 27.934 4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 17 36.539 27.727 5.642 1.00 0.00 H new ATOM 235 N SER A 18 39.485 23.775 5.827 1.00 0.00 N ATOM 236 CA SER A 18 40.267 23.747 7.058 1.00 0.00 C ATOM 237 C SER A 18 41.760 23.688 6.752 1.00 0.00 C ATOM 238 O SER A 18 42.163 23.422 5.619 1.00 0.00 O ATOM 239 CB SER A 18 39.863 22.546 7.916 1.00 0.00 C ATOM 240 OG SER A 18 39.463 21.453 7.108 1.00 0.00 O ATOM 0 H SER A 18 40.017 23.557 4.984 1.00 0.00 H new ATOM 0 HA SER A 18 40.063 24.665 7.610 1.00 0.00 H new ATOM 0 HB2 SER A 18 40.700 22.248 8.547 1.00 0.00 H new ATOM 0 HB3 SER A 18 39.047 22.828 8.581 1.00 0.00 H new ATOM 0 HG SER A 18 39.212 20.698 7.680 1.00 0.00 H new ATOM 246 N ARG A 19 42.577 23.938 7.770 1.00 0.00 N ATOM 247 CA ARG A 19 44.026 23.915 7.611 1.00 0.00 C ATOM 248 C ARG A 19 44.711 23.539 8.921 1.00 0.00 C ATOM 249 O ARG A 19 44.347 24.035 9.988 1.00 0.00 O ATOM 250 CB ARG A 19 44.529 25.278 7.132 1.00 0.00 C ATOM 251 CG ARG A 19 44.015 25.668 5.756 1.00 0.00 C ATOM 252 CD ARG A 19 44.655 26.958 5.267 1.00 0.00 C ATOM 253 NE ARG A 19 44.007 27.468 4.062 1.00 0.00 N ATOM 254 CZ ARG A 19 44.187 26.947 2.853 1.00 0.00 C ATOM 255 NH1 ARG A 19 44.991 25.906 2.690 1.00 0.00 N ATOM 256 NH2 ARG A 19 43.561 27.467 1.805 1.00 0.00 N ATOM 0 H ARG A 19 42.260 24.159 8.714 1.00 0.00 H new ATOM 0 HA ARG A 19 44.273 23.161 6.863 1.00 0.00 H new ATOM 0 HB2 ARG A 19 44.229 26.040 7.852 1.00 0.00 H new ATOM 0 HB3 ARG A 19 45.619 25.268 7.114 1.00 0.00 H new ATOM 0 HG2 ARG A 19 44.223 24.866 5.048 1.00 0.00 H new ATOM 0 HG3 ARG A 19 42.932 25.788 5.792 1.00 0.00 H new ATOM 0 HD2 ARG A 19 44.601 27.710 6.054 1.00 0.00 H new ATOM 0 HD3 ARG A 19 45.712 26.784 5.064 1.00 0.00 H new ATOM 0 HE ARG A 19 43.382 28.269 4.153 1.00 0.00 H new ATOM 0 HH11 ARG A 19 45.473 25.503 3.494 1.00 0.00 H new ATOM 0 HH12 ARG A 19 45.128 25.508 1.761 1.00 0.00 H new ATOM 0 HH21 ARG A 19 42.941 28.268 1.927 1.00 0.00 H new ATOM 0 HH22 ARG A 19 43.700 27.066 0.877 1.00 0.00 H new ATOM 270 N SER A 20 45.705 22.661 8.833 1.00 0.00 N ATOM 271 CA SER A 20 46.438 22.215 10.012 1.00 0.00 C ATOM 272 C SER A 20 47.802 21.654 9.624 1.00 0.00 C ATOM 273 O SER A 20 47.951 21.018 8.580 1.00 0.00 O ATOM 274 CB SER A 20 45.634 21.156 10.769 1.00 0.00 C ATOM 275 OG SER A 20 46.171 20.936 12.062 1.00 0.00 O ATOM 0 H SER A 20 46.021 22.244 7.957 1.00 0.00 H new ATOM 0 HA SER A 20 46.591 23.077 10.661 1.00 0.00 H new ATOM 0 HB2 SER A 20 44.595 21.475 10.853 1.00 0.00 H new ATOM 0 HB3 SER A 20 45.637 20.222 10.207 1.00 0.00 H new ATOM 0 HG SER A 20 45.639 20.256 12.526 1.00 0.00 H new ATOM 281 N LYS A 21 48.797 21.894 10.471 1.00 0.00 N ATOM 282 CA LYS A 21 50.150 21.412 10.219 1.00 0.00 C ATOM 283 C LYS A 21 51.041 21.633 11.438 1.00 0.00 C ATOM 284 O LYS A 21 50.642 22.288 12.400 1.00 0.00 O ATOM 285 CB LYS A 21 50.748 22.121 9.002 1.00 0.00 C ATOM 286 CG LYS A 21 50.979 23.607 9.216 1.00 0.00 C ATOM 287 CD LYS A 21 52.420 23.898 9.600 1.00 0.00 C ATOM 288 CE LYS A 21 52.504 24.673 10.905 1.00 0.00 C ATOM 289 NZ LYS A 21 52.397 26.142 10.686 1.00 0.00 N ATOM 0 H LYS A 21 48.692 22.420 11.339 1.00 0.00 H new ATOM 0 HA LYS A 21 50.097 20.342 10.018 1.00 0.00 H new ATOM 0 HB2 LYS A 21 51.696 21.648 8.746 1.00 0.00 H new ATOM 0 HB3 LYS A 21 50.083 21.984 8.149 1.00 0.00 H new ATOM 0 HG2 LYS A 21 50.728 24.150 8.305 1.00 0.00 H new ATOM 0 HG3 LYS A 21 50.313 23.971 9.998 1.00 0.00 H new ATOM 0 HD2 LYS A 21 52.968 22.961 9.696 1.00 0.00 H new ATOM 0 HD3 LYS A 21 52.901 24.468 8.805 1.00 0.00 H new ATOM 0 HE2 LYS A 21 51.707 24.347 11.573 1.00 0.00 H new ATOM 0 HE3 LYS A 21 53.448 24.448 11.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 52.459 26.635 11.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 53.172 26.458 10.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 51.485 26.360 10.236 1.00 0.00 H new ATOM 303 N ARG A 22 52.250 21.083 11.388 1.00 0.00 N ATOM 304 CA ARG A 22 53.198 21.221 12.487 1.00 0.00 C ATOM 305 C ARG A 22 54.634 21.102 11.985 1.00 0.00 C ATOM 306 O ARG A 22 54.903 20.532 10.928 1.00 0.00 O ATOM 307 CB ARG A 22 52.930 20.158 13.555 1.00 0.00 C ATOM 308 CG ARG A 22 52.615 18.786 12.983 1.00 0.00 C ATOM 309 CD ARG A 22 51.118 18.591 12.797 1.00 0.00 C ATOM 310 NE ARG A 22 50.741 17.180 12.834 1.00 0.00 N ATOM 311 CZ ARG A 22 50.960 16.334 11.834 1.00 0.00 C ATOM 312 NH1 ARG A 22 51.552 16.753 10.724 1.00 0.00 N ATOM 313 NH2 ARG A 22 50.588 15.065 11.943 1.00 0.00 N ATOM 0 H ARG A 22 52.596 20.538 10.598 1.00 0.00 H new ATOM 0 HA ARG A 22 53.066 22.210 12.926 1.00 0.00 H new ATOM 0 HB2 ARG A 22 53.802 20.080 14.205 1.00 0.00 H new ATOM 0 HB3 ARG A 22 52.096 20.483 14.178 1.00 0.00 H new ATOM 0 HG2 ARG A 22 53.121 18.665 12.025 1.00 0.00 H new ATOM 0 HG3 ARG A 22 53.004 18.015 13.648 1.00 0.00 H new ATOM 0 HD2 ARG A 22 50.582 19.130 13.578 1.00 0.00 H new ATOM 0 HD3 ARG A 22 50.812 19.023 11.844 1.00 0.00 H new ATOM 0 HE ARG A 22 50.284 16.825 13.674 1.00 0.00 H new ATOM 0 HH11 ARG A 22 51.841 17.727 10.637 1.00 0.00 H new ATOM 0 HH12 ARG A 22 51.719 16.101 9.958 1.00 0.00 H new ATOM 0 HH21 ARG A 22 50.133 14.738 12.796 1.00 0.00 H new ATOM 0 HH22 ARG A 22 50.757 14.416 11.174 1.00 0.00 H new ATOM 327 N PRO A 23 55.579 21.654 12.761 1.00 0.00 N ATOM 328 CA PRO A 23 57.004 21.623 12.415 1.00 0.00 C ATOM 329 C PRO A 23 57.596 20.222 12.521 1.00 0.00 C ATOM 330 O PRO A 23 57.248 19.457 13.421 1.00 0.00 O ATOM 331 CB PRO A 23 57.640 22.552 13.452 1.00 0.00 C ATOM 332 CG PRO A 23 56.708 22.519 14.613 1.00 0.00 C ATOM 333 CD PRO A 23 55.331 22.349 14.034 1.00 0.00 C ATOM 0 HA PRO A 23 57.180 21.928 11.384 1.00 0.00 H new ATOM 0 HB2 PRO A 23 58.635 22.208 13.734 1.00 0.00 H new ATOM 0 HB3 PRO A 23 57.751 23.564 13.062 1.00 0.00 H new ATOM 0 HG2 PRO A 23 56.952 21.697 15.286 1.00 0.00 H new ATOM 0 HG3 PRO A 23 56.776 23.439 15.194 1.00 0.00 H new ATOM 0 HD2 PRO A 23 54.688 21.765 14.692 1.00 0.00 H new ATOM 0 HD3 PRO A 23 54.839 23.309 13.878 1.00 0.00 H new ATOM 341 N ASP A 24 58.492 19.892 11.597 1.00 0.00 N ATOM 342 CA ASP A 24 59.134 18.583 11.588 1.00 0.00 C ATOM 343 C ASP A 24 60.221 18.518 10.520 1.00 0.00 C ATOM 344 O ASP A 24 60.465 19.492 9.808 1.00 0.00 O ATOM 345 CB ASP A 24 58.097 17.484 11.345 1.00 0.00 C ATOM 346 CG ASP A 24 57.144 17.827 10.217 1.00 0.00 C ATOM 347 OD1 ASP A 24 57.587 18.466 9.239 1.00 0.00 O ATOM 348 OD2 ASP A 24 55.956 17.455 10.311 1.00 0.00 O ATOM 0 H ASP A 24 58.790 20.513 10.845 1.00 0.00 H new ATOM 0 HA ASP A 24 59.597 18.426 12.562 1.00 0.00 H new ATOM 0 HB2 ASP A 24 58.609 16.550 11.113 1.00 0.00 H new ATOM 0 HB3 ASP A 24 57.528 17.317 12.259 1.00 0.00 H new ATOM 353 N PHE A 25 60.872 17.364 10.415 1.00 0.00 N ATOM 354 CA PHE A 25 61.935 17.173 9.435 1.00 0.00 C ATOM 355 C PHE A 25 63.049 18.198 9.634 1.00 0.00 C ATOM 356 O PHE A 25 63.446 18.888 8.696 1.00 0.00 O ATOM 357 CB PHE A 25 61.375 17.281 8.015 1.00 0.00 C ATOM 358 CG PHE A 25 60.695 16.028 7.543 1.00 0.00 C ATOM 359 CD1 PHE A 25 61.408 14.847 7.405 1.00 0.00 C ATOM 360 CD2 PHE A 25 59.344 16.030 7.237 1.00 0.00 C ATOM 361 CE1 PHE A 25 60.785 13.693 6.969 1.00 0.00 C ATOM 362 CE2 PHE A 25 58.715 14.879 6.801 1.00 0.00 C ATOM 363 CZ PHE A 25 59.437 13.709 6.668 1.00 0.00 C ATOM 0 H PHE A 25 60.682 16.548 10.996 1.00 0.00 H new ATOM 0 HA PHE A 25 62.352 16.176 9.578 1.00 0.00 H new ATOM 0 HB2 PHE A 25 60.665 18.107 7.975 1.00 0.00 H new ATOM 0 HB3 PHE A 25 62.187 17.524 7.330 1.00 0.00 H new ATOM 0 HD1 PHE A 25 62.462 14.829 7.641 1.00 0.00 H new ATOM 0 HD2 PHE A 25 58.775 16.942 7.340 1.00 0.00 H new ATOM 0 HE1 PHE A 25 61.352 12.780 6.864 1.00 0.00 H new ATOM 0 HE2 PHE A 25 57.661 14.894 6.565 1.00 0.00 H new ATOM 0 HZ PHE A 25 58.948 12.808 6.329 1.00 0.00 H new ATOM 373 N GLY A 26 63.547 18.291 10.863 1.00 0.00 N ATOM 374 CA GLY A 26 64.609 19.233 11.164 1.00 0.00 C ATOM 375 C GLY A 26 65.533 18.736 12.257 1.00 0.00 C ATOM 376 O GLY A 26 65.088 18.102 13.213 1.00 0.00 O ATOM 0 H GLY A 26 63.234 17.731 11.656 1.00 0.00 H new ATOM 0 HA2 GLY A 26 65.189 19.422 10.261 1.00 0.00 H new ATOM 0 HA3 GLY A 26 64.171 20.184 11.467 1.00 0.00 H new ATOM 380 N GLN A 27 66.823 19.023 12.115 1.00 0.00 N ATOM 381 CA GLN A 27 67.812 18.598 13.099 1.00 0.00 C ATOM 382 C GLN A 27 68.922 19.635 13.237 1.00 0.00 C ATOM 383 O GLN A 27 69.401 20.183 12.244 1.00 0.00 O ATOM 384 CB GLN A 27 68.408 17.246 12.703 1.00 0.00 C ATOM 385 CG GLN A 27 67.426 16.091 12.818 1.00 0.00 C ATOM 386 CD GLN A 27 66.990 15.836 14.247 1.00 0.00 C ATOM 387 OE1 GLN A 27 67.489 16.463 15.182 1.00 0.00 O ATOM 388 NE2 GLN A 27 66.053 14.912 14.425 1.00 0.00 N ATOM 0 H GLN A 27 67.208 19.547 11.329 1.00 0.00 H new ATOM 0 HA GLN A 27 67.311 18.498 14.062 1.00 0.00 H new ATOM 0 HB2 GLN A 27 68.769 17.304 11.676 1.00 0.00 H new ATOM 0 HB3 GLN A 27 69.273 17.041 13.334 1.00 0.00 H new ATOM 0 HG2 GLN A 27 66.549 16.303 12.207 1.00 0.00 H new ATOM 0 HG3 GLN A 27 67.884 15.188 12.415 1.00 0.00 H new ATOM 0 HE21 GLN A 27 65.667 14.416 13.622 1.00 0.00 H new ATOM 0 HE22 GLN A 27 65.720 14.698 15.365 1.00 0.00 H new ATOM 397 N ARG A 28 69.327 19.899 14.475 1.00 0.00 N ATOM 398 CA ARG A 28 70.380 20.871 14.744 1.00 0.00 C ATOM 399 C ARG A 28 71.741 20.188 14.835 1.00 0.00 C ATOM 400 O ARG A 28 71.862 19.095 15.389 1.00 0.00 O ATOM 401 CB ARG A 28 70.088 21.625 16.043 1.00 0.00 C ATOM 402 CG ARG A 28 70.090 20.737 17.276 1.00 0.00 C ATOM 403 CD ARG A 28 69.433 21.428 18.461 1.00 0.00 C ATOM 404 NE ARG A 28 67.978 21.303 18.429 1.00 0.00 N ATOM 405 CZ ARG A 28 67.198 21.537 19.478 1.00 0.00 C ATOM 406 NH1 ARG A 28 67.729 21.907 20.635 1.00 0.00 N ATOM 407 NH2 ARG A 28 65.882 21.402 19.371 1.00 0.00 N ATOM 0 H ARG A 28 68.942 19.453 15.308 1.00 0.00 H new ATOM 0 HA ARG A 28 70.404 21.581 13.917 1.00 0.00 H new ATOM 0 HB2 ARG A 28 70.831 22.412 16.171 1.00 0.00 H new ATOM 0 HB3 ARG A 28 69.117 22.114 15.959 1.00 0.00 H new ATOM 0 HG2 ARG A 28 69.564 19.808 17.057 1.00 0.00 H new ATOM 0 HG3 ARG A 28 71.115 20.470 17.532 1.00 0.00 H new ATOM 0 HD2 ARG A 28 69.814 20.999 19.388 1.00 0.00 H new ATOM 0 HD3 ARG A 28 69.706 22.483 18.463 1.00 0.00 H new ATOM 0 HE ARG A 28 67.537 21.021 17.554 1.00 0.00 H new ATOM 0 HH11 ARG A 28 68.740 22.013 20.722 1.00 0.00 H new ATOM 0 HH12 ARG A 28 67.127 22.086 21.439 1.00 0.00 H new ATOM 0 HH21 ARG A 28 65.469 21.118 18.483 1.00 0.00 H new ATOM 0 HH22 ARG A 28 65.284 21.582 20.177 1.00 0.00 H new ATOM 421 N ARG A 29 72.762 20.839 14.287 1.00 0.00 N ATOM 422 CA ARG A 29 74.114 20.293 14.305 1.00 0.00 C ATOM 423 C ARG A 29 75.113 21.296 13.736 1.00 0.00 C ATOM 424 O ARG A 29 75.018 21.688 12.572 1.00 0.00 O ATOM 425 CB ARG A 29 74.171 18.990 13.506 1.00 0.00 C ATOM 426 CG ARG A 29 73.464 19.067 12.163 1.00 0.00 C ATOM 427 CD ARG A 29 73.921 17.959 11.227 1.00 0.00 C ATOM 428 NE ARG A 29 73.630 18.267 9.830 1.00 0.00 N ATOM 429 CZ ARG A 29 73.850 17.421 8.830 1.00 0.00 C ATOM 430 NH1 ARG A 29 74.359 16.221 9.071 1.00 0.00 N ATOM 431 NH2 ARG A 29 73.559 17.775 7.584 1.00 0.00 N ATOM 0 H ARG A 29 72.679 21.745 13.825 1.00 0.00 H new ATOM 0 HA ARG A 29 74.382 20.088 15.341 1.00 0.00 H new ATOM 0 HB2 ARG A 29 75.214 18.719 13.343 1.00 0.00 H new ATOM 0 HB3 ARG A 29 73.723 18.191 14.097 1.00 0.00 H new ATOM 0 HG2 ARG A 29 72.387 18.996 12.313 1.00 0.00 H new ATOM 0 HG3 ARG A 29 73.659 20.036 11.703 1.00 0.00 H new ATOM 0 HD2 ARG A 29 74.993 17.802 11.348 1.00 0.00 H new ATOM 0 HD3 ARG A 29 73.429 17.026 11.502 1.00 0.00 H new ATOM 0 HE ARG A 29 73.236 19.182 9.610 1.00 0.00 H new ATOM 0 HH11 ARG A 29 74.583 15.945 10.027 1.00 0.00 H new ATOM 0 HH12 ARG A 29 74.527 15.574 8.300 1.00 0.00 H new ATOM 0 HH21 ARG A 29 73.166 18.697 7.394 1.00 0.00 H new ATOM 0 HH22 ARG A 29 73.728 17.125 6.816 1.00 0.00 H new ATOM 445 N ILE A 30 76.067 21.708 14.563 1.00 0.00 N ATOM 446 CA ILE A 30 77.083 22.664 14.142 1.00 0.00 C ATOM 447 C ILE A 30 78.480 22.186 14.522 1.00 0.00 C ATOM 448 O ILE A 30 78.841 22.165 15.699 1.00 0.00 O ATOM 449 CB ILE A 30 76.841 24.053 14.763 1.00 0.00 C ATOM 450 CG1 ILE A 30 75.388 24.484 14.551 1.00 0.00 C ATOM 451 CG2 ILE A 30 77.795 25.075 14.164 1.00 0.00 C ATOM 452 CD1 ILE A 30 75.017 24.661 13.096 1.00 0.00 C ATOM 0 H ILE A 30 76.158 21.394 15.529 1.00 0.00 H new ATOM 0 HA ILE A 30 77.012 22.742 13.057 1.00 0.00 H new ATOM 0 HB ILE A 30 77.030 23.993 15.835 1.00 0.00 H new ATOM 0 HG12 ILE A 30 74.728 23.741 14.998 1.00 0.00 H new ATOM 0 HG13 ILE A 30 75.215 25.422 15.078 1.00 0.00 H new ATOM 0 HG21 ILE A 30 77.611 26.051 14.613 1.00 0.00 H new ATOM 0 HG22 ILE A 30 78.823 24.772 14.362 1.00 0.00 H new ATOM 0 HG23 ILE A 30 77.635 25.135 13.087 1.00 0.00 H new ATOM 0 HD11 ILE A 30 73.973 24.967 13.021 1.00 0.00 H new ATOM 0 HD12 ILE A 30 75.652 25.426 12.649 1.00 0.00 H new ATOM 0 HD13 ILE A 30 75.158 23.718 12.567 1.00 0.00 H new ATOM 464 N ARG A 31 79.263 21.804 13.518 1.00 0.00 N ATOM 465 CA ARG A 31 80.621 21.327 13.747 1.00 0.00 C ATOM 466 C ARG A 31 81.613 22.486 13.740 1.00 0.00 C ATOM 467 O ARG A 31 82.127 22.883 14.786 1.00 0.00 O ATOM 468 CB ARG A 31 81.010 20.302 12.681 1.00 0.00 C ATOM 469 CG ARG A 31 82.495 19.976 12.662 1.00 0.00 C ATOM 470 CD ARG A 31 82.948 19.366 13.979 1.00 0.00 C ATOM 471 NE ARG A 31 84.184 18.602 13.832 1.00 0.00 N ATOM 472 CZ ARG A 31 85.373 19.159 13.633 1.00 0.00 C ATOM 473 NH1 ARG A 31 85.487 20.478 13.559 1.00 0.00 N ATOM 474 NH2 ARG A 31 86.452 18.396 13.509 1.00 0.00 N ATOM 0 H ARG A 31 78.980 21.816 12.538 1.00 0.00 H new ATOM 0 HA ARG A 31 80.652 20.851 14.727 1.00 0.00 H new ATOM 0 HB2 ARG A 31 80.447 19.384 12.850 1.00 0.00 H new ATOM 0 HB3 ARG A 31 80.717 20.680 11.702 1.00 0.00 H new ATOM 0 HG2 ARG A 31 82.706 19.283 11.847 1.00 0.00 H new ATOM 0 HG3 ARG A 31 83.065 20.884 12.465 1.00 0.00 H new ATOM 0 HD2 ARG A 31 83.097 20.158 14.713 1.00 0.00 H new ATOM 0 HD3 ARG A 31 82.164 18.716 14.366 1.00 0.00 H new ATOM 0 HE ARG A 31 84.131 17.585 13.885 1.00 0.00 H new ATOM 0 HH11 ARG A 31 84.660 21.068 13.655 1.00 0.00 H new ATOM 0 HH12 ARG A 31 86.402 20.903 13.406 1.00 0.00 H new ATOM 0 HH21 ARG A 31 86.368 17.381 13.567 1.00 0.00 H new ATOM 0 HH22 ARG A 31 87.365 18.825 13.356 1.00 0.00 H new ATOM 488 N ARG A 32 81.878 23.024 12.554 1.00 0.00 N ATOM 489 CA ARG A 32 82.809 24.136 12.410 1.00 0.00 C ATOM 490 C ARG A 32 82.062 25.463 12.319 1.00 0.00 C ATOM 491 O ARG A 32 81.055 25.590 11.621 1.00 0.00 O ATOM 492 CB ARG A 32 83.680 23.943 11.167 1.00 0.00 C ATOM 493 CG ARG A 32 84.682 25.064 10.945 1.00 0.00 C ATOM 494 CD ARG A 32 86.028 24.741 11.576 1.00 0.00 C ATOM 495 NE ARG A 32 86.850 23.900 10.710 1.00 0.00 N ATOM 496 CZ ARG A 32 88.003 23.360 11.090 1.00 0.00 C ATOM 497 NH1 ARG A 32 88.467 23.573 12.314 1.00 0.00 N ATOM 498 NH2 ARG A 32 88.695 22.606 10.245 1.00 0.00 N ATOM 0 H ARG A 32 81.461 22.707 11.679 1.00 0.00 H new ATOM 0 HA ARG A 32 83.448 24.158 13.293 1.00 0.00 H new ATOM 0 HB2 ARG A 32 84.217 22.999 11.253 1.00 0.00 H new ATOM 0 HB3 ARG A 32 83.036 23.864 10.291 1.00 0.00 H new ATOM 0 HG2 ARG A 32 84.811 25.232 9.876 1.00 0.00 H new ATOM 0 HG3 ARG A 32 84.293 25.990 11.368 1.00 0.00 H new ATOM 0 HD2 ARG A 32 86.559 25.668 11.792 1.00 0.00 H new ATOM 0 HD3 ARG A 32 85.870 24.235 12.529 1.00 0.00 H new ATOM 0 HE ARG A 32 86.521 23.717 9.762 1.00 0.00 H new ATOM 0 HH11 ARG A 32 87.938 24.152 12.966 1.00 0.00 H new ATOM 0 HH12 ARG A 32 89.352 23.157 12.603 1.00 0.00 H new ATOM 0 HH21 ARG A 32 88.342 22.440 9.303 1.00 0.00 H new ATOM 0 HH22 ARG A 32 89.580 22.192 10.538 1.00 0.00 H new ATOM 512 N PRO A 33 82.564 26.476 13.041 1.00 0.00 N ATOM 513 CA PRO A 33 81.959 27.812 13.058 1.00 0.00 C ATOM 514 C PRO A 33 82.130 28.543 11.731 1.00 0.00 C ATOM 515 O PRO A 33 83.069 28.276 10.980 1.00 0.00 O ATOM 516 CB PRO A 33 82.725 28.533 14.170 1.00 0.00 C ATOM 517 CG PRO A 33 84.038 27.833 14.241 1.00 0.00 C ATOM 518 CD PRO A 33 83.760 26.396 13.895 1.00 0.00 C ATOM 0 HA PRO A 33 80.882 27.770 13.221 1.00 0.00 H new ATOM 0 HB2 PRO A 33 82.852 29.591 13.941 1.00 0.00 H new ATOM 0 HB3 PRO A 33 82.193 28.474 15.120 1.00 0.00 H new ATOM 0 HG2 PRO A 33 84.752 28.271 13.544 1.00 0.00 H new ATOM 0 HG3 PRO A 33 84.472 27.918 15.237 1.00 0.00 H new ATOM 0 HD2 PRO A 33 84.599 25.940 13.370 1.00 0.00 H new ATOM 0 HD3 PRO A 33 83.578 25.796 14.787 1.00 0.00 H new ATOM 526 N PHE A 34 81.219 29.468 11.449 1.00 0.00 N ATOM 527 CA PHE A 34 81.269 30.238 10.211 1.00 0.00 C ATOM 528 C PHE A 34 81.470 31.722 10.502 1.00 0.00 C ATOM 529 O PHE A 34 81.291 32.176 11.633 1.00 0.00 O ATOM 530 CB PHE A 34 79.985 30.034 9.406 1.00 0.00 C ATOM 531 CG PHE A 34 78.755 29.909 10.260 1.00 0.00 C ATOM 532 CD1 PHE A 34 78.451 30.875 11.205 1.00 0.00 C ATOM 533 CD2 PHE A 34 77.904 28.825 10.117 1.00 0.00 C ATOM 534 CE1 PHE A 34 77.321 30.764 11.992 1.00 0.00 C ATOM 535 CE2 PHE A 34 76.771 28.709 10.901 1.00 0.00 C ATOM 536 CZ PHE A 34 76.480 29.679 11.841 1.00 0.00 C ATOM 0 H PHE A 34 80.437 29.703 12.061 1.00 0.00 H new ATOM 0 HA PHE A 34 82.117 29.882 9.625 1.00 0.00 H new ATOM 0 HB2 PHE A 34 79.858 30.872 8.721 1.00 0.00 H new ATOM 0 HB3 PHE A 34 80.087 29.136 8.796 1.00 0.00 H new ATOM 0 HD1 PHE A 34 79.105 31.725 11.328 1.00 0.00 H new ATOM 0 HD2 PHE A 34 78.128 28.063 9.386 1.00 0.00 H new ATOM 0 HE1 PHE A 34 77.096 31.525 12.725 1.00 0.00 H new ATOM 0 HE2 PHE A 34 76.114 27.861 10.779 1.00 0.00 H new ATOM 0 HZ PHE A 34 75.597 29.589 12.456 1.00 0.00 H new ATOM 546 N THR A 35 81.845 32.476 9.473 1.00 0.00 N ATOM 547 CA THR A 35 82.072 33.908 9.617 1.00 0.00 C ATOM 548 C THR A 35 80.841 34.705 9.200 1.00 0.00 C ATOM 549 O THR A 35 79.926 34.170 8.573 1.00 0.00 O ATOM 550 CB THR A 35 83.278 34.372 8.778 1.00 0.00 C ATOM 551 OG1 THR A 35 84.216 33.300 8.633 1.00 0.00 O ATOM 552 CG2 THR A 35 83.961 35.566 9.428 1.00 0.00 C ATOM 0 H THR A 35 81.998 32.118 8.530 1.00 0.00 H new ATOM 0 HA THR A 35 82.279 34.091 10.671 1.00 0.00 H new ATOM 0 HB THR A 35 82.915 34.671 7.795 1.00 0.00 H new ATOM 0 HG1 THR A 35 84.979 33.603 8.097 1.00 0.00 H new ATOM 0 HG21 THR A 35 84.810 35.876 8.818 1.00 0.00 H new ATOM 0 HG22 THR A 35 83.252 36.390 9.510 1.00 0.00 H new ATOM 0 HG23 THR A 35 84.311 35.288 10.422 1.00 0.00 H new ATOM 560 N VAL A 36 80.824 35.986 9.552 1.00 0.00 N ATOM 561 CA VAL A 36 79.706 36.858 9.212 1.00 0.00 C ATOM 562 C VAL A 36 79.526 36.958 7.701 1.00 0.00 C ATOM 563 O VAL A 36 78.426 36.770 7.183 1.00 0.00 O ATOM 564 CB VAL A 36 79.900 38.272 9.790 1.00 0.00 C ATOM 565 CG1 VAL A 36 78.630 39.093 9.632 1.00 0.00 C ATOM 566 CG2 VAL A 36 80.318 38.197 11.251 1.00 0.00 C ATOM 0 H VAL A 36 81.572 36.444 10.073 1.00 0.00 H new ATOM 0 HA VAL A 36 78.813 36.414 9.652 1.00 0.00 H new ATOM 0 HB VAL A 36 80.695 38.767 9.233 1.00 0.00 H new ATOM 0 HG11 VAL A 36 78.787 40.089 10.046 1.00 0.00 H new ATOM 0 HG12 VAL A 36 78.379 39.175 8.574 1.00 0.00 H new ATOM 0 HG13 VAL A 36 77.812 38.604 10.162 1.00 0.00 H new ATOM 0 HG21 VAL A 36 80.451 39.205 11.644 1.00 0.00 H new ATOM 0 HG22 VAL A 36 79.546 37.683 11.824 1.00 0.00 H new ATOM 0 HG23 VAL A 36 81.257 37.649 11.333 1.00 0.00 H new ATOM 576 N ALA A 37 80.616 37.256 7.000 1.00 0.00 N ATOM 577 CA ALA A 37 80.579 37.379 5.548 1.00 0.00 C ATOM 578 C ALA A 37 80.482 36.010 4.884 1.00 0.00 C ATOM 579 O ALA A 37 79.848 35.861 3.839 1.00 0.00 O ATOM 580 CB ALA A 37 81.810 38.122 5.051 1.00 0.00 C ATOM 0 H ALA A 37 81.534 37.416 7.414 1.00 0.00 H new ATOM 0 HA ALA A 37 79.690 37.949 5.278 1.00 0.00 H new ATOM 0 HB1 ALA A 37 81.770 38.207 3.965 1.00 0.00 H new ATOM 0 HB2 ALA A 37 81.836 39.118 5.492 1.00 0.00 H new ATOM 0 HB3 ALA A 37 82.707 37.574 5.339 1.00 0.00 H new ATOM 586 N GLU A 38 81.113 35.013 5.496 1.00 0.00 N ATOM 587 CA GLU A 38 81.098 33.657 4.961 1.00 0.00 C ATOM 588 C GLU A 38 79.668 33.141 4.828 1.00 0.00 C ATOM 589 O GLU A 38 79.312 32.517 3.828 1.00 0.00 O ATOM 590 CB GLU A 38 81.908 32.721 5.861 1.00 0.00 C ATOM 591 CG GLU A 38 83.409 32.817 5.645 1.00 0.00 C ATOM 592 CD GLU A 38 84.168 31.687 6.312 1.00 0.00 C ATOM 593 OE1 GLU A 38 83.514 30.740 6.797 1.00 0.00 O ATOM 594 OE2 GLU A 38 85.414 31.749 6.349 1.00 0.00 O ATOM 0 H GLU A 38 81.641 35.119 6.362 1.00 0.00 H new ATOM 0 HA GLU A 38 81.552 33.679 3.970 1.00 0.00 H new ATOM 0 HB2 GLU A 38 81.684 32.949 6.903 1.00 0.00 H new ATOM 0 HB3 GLU A 38 81.589 31.694 5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 38 83.620 32.809 4.576 1.00 0.00 H new ATOM 0 HG3 GLU A 38 83.768 33.770 6.034 1.00 0.00 H new ATOM 601 N VAL A 39 78.853 33.405 5.844 1.00 0.00 N ATOM 602 CA VAL A 39 77.462 32.968 5.841 1.00 0.00 C ATOM 603 C VAL A 39 76.612 33.847 4.931 1.00 0.00 C ATOM 604 O VAL A 39 75.776 33.351 4.176 1.00 0.00 O ATOM 605 CB VAL A 39 76.864 32.989 7.261 1.00 0.00 C ATOM 606 CG1 VAL A 39 75.384 32.641 7.222 1.00 0.00 C ATOM 607 CG2 VAL A 39 77.621 32.034 8.171 1.00 0.00 C ATOM 0 H VAL A 39 79.132 33.919 6.680 1.00 0.00 H new ATOM 0 HA VAL A 39 77.452 31.945 5.466 1.00 0.00 H new ATOM 0 HB VAL A 39 76.965 33.996 7.665 1.00 0.00 H new ATOM 0 HG11 VAL A 39 74.979 32.661 8.234 1.00 0.00 H new ATOM 0 HG12 VAL A 39 74.855 33.368 6.605 1.00 0.00 H new ATOM 0 HG13 VAL A 39 75.256 31.645 6.799 1.00 0.00 H new ATOM 0 HG21 VAL A 39 77.186 32.061 9.170 1.00 0.00 H new ATOM 0 HG22 VAL A 39 77.553 31.022 7.773 1.00 0.00 H new ATOM 0 HG23 VAL A 39 78.668 32.334 8.223 1.00 0.00 H new ATOM 617 N GLU A 40 76.831 35.156 5.007 1.00 0.00 N ATOM 618 CA GLU A 40 76.085 36.105 4.190 1.00 0.00 C ATOM 619 C GLU A 40 76.253 35.795 2.705 1.00 0.00 C ATOM 620 O GLU A 40 75.312 35.922 1.921 1.00 0.00 O ATOM 621 CB GLU A 40 76.546 37.535 4.479 1.00 0.00 C ATOM 622 CG GLU A 40 77.467 38.105 3.413 1.00 0.00 C ATOM 623 CD GLU A 40 77.973 39.491 3.760 1.00 0.00 C ATOM 624 OE1 GLU A 40 77.206 40.266 4.370 1.00 0.00 O ATOM 625 OE2 GLU A 40 79.133 39.802 3.420 1.00 0.00 O ATOM 0 H GLU A 40 77.519 35.583 5.627 1.00 0.00 H new ATOM 0 HA GLU A 40 75.029 36.013 4.446 1.00 0.00 H new ATOM 0 HB2 GLU A 40 75.671 38.178 4.573 1.00 0.00 H new ATOM 0 HB3 GLU A 40 77.060 37.555 5.440 1.00 0.00 H new ATOM 0 HG2 GLU A 40 78.316 37.436 3.276 1.00 0.00 H new ATOM 0 HG3 GLU A 40 76.936 38.144 2.462 1.00 0.00 H new ATOM 632 N LEU A 41 77.459 35.387 2.326 1.00 0.00 N ATOM 633 CA LEU A 41 77.754 35.058 0.935 1.00 0.00 C ATOM 634 C LEU A 41 77.189 33.690 0.568 1.00 0.00 C ATOM 635 O LEU A 41 76.523 33.535 -0.457 1.00 0.00 O ATOM 636 CB LEU A 41 79.264 35.082 0.693 1.00 0.00 C ATOM 637 CG LEU A 41 79.972 36.403 0.996 1.00 0.00 C ATOM 638 CD1 LEU A 41 81.404 36.152 1.442 1.00 0.00 C ATOM 639 CD2 LEU A 41 79.943 37.314 -0.223 1.00 0.00 C ATOM 0 H LEU A 41 78.249 35.276 2.962 1.00 0.00 H new ATOM 0 HA LEU A 41 77.280 35.808 0.302 1.00 0.00 H new ATOM 0 HB2 LEU A 41 79.721 34.300 1.300 1.00 0.00 H new ATOM 0 HB3 LEU A 41 79.449 34.825 -0.350 1.00 0.00 H new ATOM 0 HG LEU A 41 79.442 36.899 1.809 1.00 0.00 H new ATOM 0 HD11 LEU A 41 81.891 37.104 1.653 1.00 0.00 H new ATOM 0 HD12 LEU A 41 81.402 35.538 2.342 1.00 0.00 H new ATOM 0 HD13 LEU A 41 81.946 35.634 0.651 1.00 0.00 H new ATOM 0 HD21 LEU A 41 80.451 38.250 0.010 1.00 0.00 H new ATOM 0 HD22 LEU A 41 80.448 36.824 -1.055 1.00 0.00 H new ATOM 0 HD23 LEU A 41 78.909 37.521 -0.498 1.00 0.00 H new ATOM 651 N LEU A 42 77.458 32.699 1.412 1.00 0.00 N ATOM 652 CA LEU A 42 76.975 31.343 1.178 1.00 0.00 C ATOM 653 C LEU A 42 75.452 31.311 1.112 1.00 0.00 C ATOM 654 O LEU A 42 74.868 30.516 0.375 1.00 0.00 O ATOM 655 CB LEU A 42 77.469 30.407 2.282 1.00 0.00 C ATOM 656 CG LEU A 42 76.588 29.192 2.577 1.00 0.00 C ATOM 657 CD1 LEU A 42 76.496 28.291 1.355 1.00 0.00 C ATOM 658 CD2 LEU A 42 77.127 28.420 3.772 1.00 0.00 C ATOM 0 H LEU A 42 78.008 32.810 2.264 1.00 0.00 H new ATOM 0 HA LEU A 42 77.369 31.004 0.220 1.00 0.00 H new ATOM 0 HB2 LEU A 42 78.464 30.052 2.012 1.00 0.00 H new ATOM 0 HB3 LEU A 42 77.575 30.985 3.200 1.00 0.00 H new ATOM 0 HG LEU A 42 75.585 29.544 2.820 1.00 0.00 H new ATOM 0 HD11 LEU A 42 75.865 27.432 1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 42 76.063 28.848 0.524 1.00 0.00 H new ATOM 0 HD13 LEU A 42 77.493 27.947 1.081 1.00 0.00 H new ATOM 0 HD21 LEU A 42 76.488 27.559 3.967 1.00 0.00 H new ATOM 0 HD22 LEU A 42 78.140 28.079 3.558 1.00 0.00 H new ATOM 0 HD23 LEU A 42 77.140 29.068 4.648 1.00 0.00 H new ATOM 670 N VAL A 43 74.813 32.182 1.886 1.00 0.00 N ATOM 671 CA VAL A 43 73.357 32.256 1.914 1.00 0.00 C ATOM 672 C VAL A 43 72.816 32.917 0.651 1.00 0.00 C ATOM 673 O VAL A 43 71.887 32.411 0.023 1.00 0.00 O ATOM 674 CB VAL A 43 72.858 33.037 3.144 1.00 0.00 C ATOM 675 CG1 VAL A 43 71.380 33.368 3.003 1.00 0.00 C ATOM 676 CG2 VAL A 43 73.116 32.247 4.418 1.00 0.00 C ATOM 0 H VAL A 43 75.281 32.847 2.502 1.00 0.00 H new ATOM 0 HA VAL A 43 72.989 31.232 1.970 1.00 0.00 H new ATOM 0 HB VAL A 43 73.412 33.974 3.206 1.00 0.00 H new ATOM 0 HG11 VAL A 43 71.045 33.920 3.881 1.00 0.00 H new ATOM 0 HG12 VAL A 43 71.227 33.977 2.112 1.00 0.00 H new ATOM 0 HG13 VAL A 43 70.807 32.445 2.914 1.00 0.00 H new ATOM 0 HG21 VAL A 43 72.757 32.814 5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 43 72.590 31.293 4.368 1.00 0.00 H new ATOM 0 HG23 VAL A 43 74.186 32.067 4.524 1.00 0.00 H new ATOM 686 N GLU A 44 73.405 34.052 0.286 1.00 0.00 N ATOM 687 CA GLU A 44 72.981 34.783 -0.903 1.00 0.00 C ATOM 688 C GLU A 44 73.289 33.989 -2.169 1.00 0.00 C ATOM 689 O GLU A 44 72.657 34.185 -3.206 1.00 0.00 O ATOM 690 CB GLU A 44 73.672 36.147 -0.963 1.00 0.00 C ATOM 691 CG GLU A 44 73.359 36.933 -2.225 1.00 0.00 C ATOM 692 CD GLU A 44 74.140 38.230 -2.313 1.00 0.00 C ATOM 693 OE1 GLU A 44 75.286 38.199 -2.808 1.00 0.00 O ATOM 694 OE2 GLU A 44 73.605 39.275 -1.888 1.00 0.00 O ATOM 0 H GLU A 44 74.176 34.484 0.795 1.00 0.00 H new ATOM 0 HA GLU A 44 71.903 34.932 -0.842 1.00 0.00 H new ATOM 0 HB2 GLU A 44 73.373 36.735 -0.095 1.00 0.00 H new ATOM 0 HB3 GLU A 44 74.750 36.002 -0.893 1.00 0.00 H new ATOM 0 HG2 GLU A 44 73.584 36.318 -3.097 1.00 0.00 H new ATOM 0 HG3 GLU A 44 72.292 37.153 -2.256 1.00 0.00 H new ATOM 701 N ALA A 45 74.265 33.092 -2.075 1.00 0.00 N ATOM 702 CA ALA A 45 74.656 32.266 -3.211 1.00 0.00 C ATOM 703 C ALA A 45 73.642 31.155 -3.457 1.00 0.00 C ATOM 704 O ALA A 45 73.170 30.968 -4.579 1.00 0.00 O ATOM 705 CB ALA A 45 76.041 31.679 -2.984 1.00 0.00 C ATOM 0 H ALA A 45 74.800 32.919 -1.224 1.00 0.00 H new ATOM 0 HA ALA A 45 74.683 32.900 -4.097 1.00 0.00 H new ATOM 0 HB1 ALA A 45 76.320 31.064 -3.840 1.00 0.00 H new ATOM 0 HB2 ALA A 45 76.764 32.487 -2.866 1.00 0.00 H new ATOM 0 HB3 ALA A 45 76.033 31.065 -2.084 1.00 0.00 H new ATOM 711 N VAL A 46 73.310 30.418 -2.401 1.00 0.00 N ATOM 712 CA VAL A 46 72.351 29.325 -2.503 1.00 0.00 C ATOM 713 C VAL A 46 70.925 29.853 -2.612 1.00 0.00 C ATOM 714 O VAL A 46 70.069 29.230 -3.239 1.00 0.00 O ATOM 715 CB VAL A 46 72.445 28.381 -1.290 1.00 0.00 C ATOM 716 CG1 VAL A 46 72.330 29.165 0.008 1.00 0.00 C ATOM 717 CG2 VAL A 46 71.374 27.304 -1.368 1.00 0.00 C ATOM 0 H VAL A 46 73.691 30.559 -1.465 1.00 0.00 H new ATOM 0 HA VAL A 46 72.600 28.769 -3.407 1.00 0.00 H new ATOM 0 HB VAL A 46 73.420 27.894 -1.307 1.00 0.00 H new ATOM 0 HG11 VAL A 46 72.399 28.481 0.854 1.00 0.00 H new ATOM 0 HG12 VAL A 46 73.138 29.895 0.065 1.00 0.00 H new ATOM 0 HG13 VAL A 46 71.371 29.682 0.037 1.00 0.00 H new ATOM 0 HG21 VAL A 46 71.456 26.646 -0.503 1.00 0.00 H new ATOM 0 HG22 VAL A 46 70.389 27.770 -1.377 1.00 0.00 H new ATOM 0 HG23 VAL A 46 71.509 26.722 -2.280 1.00 0.00 H new ATOM 727 N GLU A 47 70.678 31.006 -1.998 1.00 0.00 N ATOM 728 CA GLU A 47 69.355 31.618 -2.026 1.00 0.00 C ATOM 729 C GLU A 47 69.036 32.161 -3.416 1.00 0.00 C ATOM 730 O GLU A 47 67.927 31.989 -3.923 1.00 0.00 O ATOM 731 CB GLU A 47 69.267 32.743 -0.994 1.00 0.00 C ATOM 732 CG GLU A 47 67.962 33.521 -1.051 1.00 0.00 C ATOM 733 CD GLU A 47 67.721 34.348 0.197 1.00 0.00 C ATOM 734 OE1 GLU A 47 68.412 34.111 1.210 1.00 0.00 O ATOM 735 OE2 GLU A 47 66.841 35.233 0.161 1.00 0.00 O ATOM 0 H GLU A 47 71.376 31.535 -1.475 1.00 0.00 H new ATOM 0 HA GLU A 47 68.622 30.850 -1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 47 69.385 32.320 0.004 1.00 0.00 H new ATOM 0 HB3 GLU A 47 70.098 33.432 -1.148 1.00 0.00 H new ATOM 0 HG2 GLU A 47 67.972 34.178 -1.921 1.00 0.00 H new ATOM 0 HG3 GLU A 47 67.134 32.825 -1.187 1.00 0.00 H new ATOM 742 N HIS A 48 70.017 32.818 -4.027 1.00 0.00 N ATOM 743 CA HIS A 48 69.842 33.388 -5.358 1.00 0.00 C ATOM 744 C HIS A 48 69.429 32.313 -6.359 1.00 0.00 C ATOM 745 O HIS A 48 68.714 32.589 -7.323 1.00 0.00 O ATOM 746 CB HIS A 48 71.134 34.062 -5.821 1.00 0.00 C ATOM 747 CG HIS A 48 70.979 34.849 -7.086 1.00 0.00 C ATOM 748 ND1 HIS A 48 72.050 35.320 -7.815 1.00 0.00 N ATOM 749 CD2 HIS A 48 69.869 35.246 -7.751 1.00 0.00 C ATOM 750 CE1 HIS A 48 71.605 35.974 -8.874 1.00 0.00 C ATOM 751 NE2 HIS A 48 70.285 35.943 -8.859 1.00 0.00 N ATOM 0 H HIS A 48 70.941 32.969 -3.622 1.00 0.00 H new ATOM 0 HA HIS A 48 69.050 34.135 -5.305 1.00 0.00 H new ATOM 0 HB2 HIS A 48 71.491 34.724 -5.032 1.00 0.00 H new ATOM 0 HB3 HIS A 48 71.899 33.300 -5.968 1.00 0.00 H new ATOM 0 HD2 HIS A 48 68.846 35.051 -7.464 1.00 0.00 H new ATOM 0 HE1 HIS A 48 72.217 36.452 -9.624 1.00 0.00 H new ATOM 0 HE2 HIS A 48 69.674 36.368 -9.557 1.00 0.00 H new ATOM 759 N LEU A 49 69.884 31.087 -6.125 1.00 0.00 N ATOM 760 CA LEU A 49 69.563 29.970 -7.006 1.00 0.00 C ATOM 761 C LEU A 49 68.551 29.034 -6.352 1.00 0.00 C ATOM 762 O LEU A 49 68.161 28.022 -6.932 1.00 0.00 O ATOM 763 CB LEU A 49 70.832 29.196 -7.365 1.00 0.00 C ATOM 764 CG LEU A 49 72.042 30.040 -7.768 1.00 0.00 C ATOM 765 CD1 LEU A 49 73.335 29.340 -7.380 1.00 0.00 C ATOM 766 CD2 LEU A 49 72.017 30.328 -9.262 1.00 0.00 C ATOM 0 H LEU A 49 70.477 30.841 -5.332 1.00 0.00 H new ATOM 0 HA LEU A 49 69.121 30.374 -7.917 1.00 0.00 H new ATOM 0 HB2 LEU A 49 71.112 28.580 -6.510 1.00 0.00 H new ATOM 0 HB3 LEU A 49 70.599 28.516 -8.185 1.00 0.00 H new ATOM 0 HG LEU A 49 71.993 30.989 -7.234 1.00 0.00 H new ATOM 0 HD11 LEU A 49 74.185 29.956 -7.675 1.00 0.00 H new ATOM 0 HD12 LEU A 49 73.356 29.186 -6.301 1.00 0.00 H new ATOM 0 HD13 LEU A 49 73.393 28.376 -7.886 1.00 0.00 H new ATOM 0 HD21 LEU A 49 72.885 30.930 -9.531 1.00 0.00 H new ATOM 0 HD22 LEU A 49 72.041 29.388 -9.814 1.00 0.00 H new ATOM 0 HD23 LEU A 49 71.107 30.873 -9.512 1.00 0.00 H new ATOM 778 N GLY A 50 68.127 29.382 -5.140 1.00 0.00 N ATOM 779 CA GLY A 50 67.163 28.564 -4.429 1.00 0.00 C ATOM 780 C GLY A 50 67.586 27.111 -4.343 1.00 0.00 C ATOM 781 O GLY A 50 68.622 26.791 -3.759 1.00 0.00 O ATOM 0 H GLY A 50 68.434 30.216 -4.639 1.00 0.00 H new ATOM 0 HA2 GLY A 50 67.028 28.960 -3.422 1.00 0.00 H new ATOM 0 HA3 GLY A 50 66.197 28.629 -4.930 1.00 0.00 H new ATOM 785 N THR A 51 66.782 26.226 -4.925 1.00 0.00 N ATOM 786 CA THR A 51 67.077 24.799 -4.909 1.00 0.00 C ATOM 787 C THR A 51 67.341 24.277 -6.317 1.00 0.00 C ATOM 788 O THR A 51 66.879 23.199 -6.687 1.00 0.00 O ATOM 789 CB THR A 51 65.922 23.994 -4.284 1.00 0.00 C ATOM 790 OG1 THR A 51 66.277 22.609 -4.206 1.00 0.00 O ATOM 791 CG2 THR A 51 64.648 24.151 -5.101 1.00 0.00 C ATOM 0 H THR A 51 65.921 26.473 -5.413 1.00 0.00 H new ATOM 0 HA THR A 51 67.972 24.668 -4.301 1.00 0.00 H new ATOM 0 HB THR A 51 65.741 24.380 -3.281 1.00 0.00 H new ATOM 0 HG1 THR A 51 66.594 22.303 -5.081 1.00 0.00 H new ATOM 0 HG21 THR A 51 63.847 23.574 -4.640 1.00 0.00 H new ATOM 0 HG22 THR A 51 64.364 25.203 -5.134 1.00 0.00 H new ATOM 0 HG23 THR A 51 64.819 23.789 -6.115 1.00 0.00 H new ATOM 799 N GLY A 52 68.090 25.049 -7.099 1.00 0.00 N ATOM 800 CA GLY A 52 68.404 24.647 -8.457 1.00 0.00 C ATOM 801 C GLY A 52 69.612 23.734 -8.527 1.00 0.00 C ATOM 802 O GLY A 52 69.475 22.526 -8.721 1.00 0.00 O ATOM 0 H GLY A 52 68.485 25.946 -6.816 1.00 0.00 H new ATOM 0 HA2 GLY A 52 67.543 24.139 -8.890 1.00 0.00 H new ATOM 0 HA3 GLY A 52 68.588 25.535 -9.062 1.00 0.00 H new ATOM 806 N ARG A 53 70.798 24.312 -8.370 1.00 0.00 N ATOM 807 CA ARG A 53 72.036 23.543 -8.419 1.00 0.00 C ATOM 808 C ARG A 53 73.007 24.006 -7.338 1.00 0.00 C ATOM 809 O ARG A 53 73.163 25.204 -7.102 1.00 0.00 O ATOM 810 CB ARG A 53 72.688 23.674 -9.797 1.00 0.00 C ATOM 811 CG ARG A 53 71.922 22.968 -10.904 1.00 0.00 C ATOM 812 CD ARG A 53 72.413 23.392 -12.279 1.00 0.00 C ATOM 813 NE ARG A 53 71.529 22.926 -13.344 1.00 0.00 N ATOM 814 CZ ARG A 53 71.720 23.197 -14.630 1.00 0.00 C ATOM 815 NH1 ARG A 53 72.760 23.928 -15.009 1.00 0.00 N ATOM 816 NH2 ARG A 53 70.872 22.737 -15.540 1.00 0.00 N ATOM 0 H ARG A 53 70.928 25.311 -8.208 1.00 0.00 H new ATOM 0 HA ARG A 53 71.792 22.496 -8.238 1.00 0.00 H new ATOM 0 HB2 ARG A 53 72.779 24.731 -10.047 1.00 0.00 H new ATOM 0 HB3 ARG A 53 73.699 23.269 -9.751 1.00 0.00 H new ATOM 0 HG2 ARG A 53 72.033 21.889 -10.794 1.00 0.00 H new ATOM 0 HG3 ARG A 53 70.859 23.191 -10.811 1.00 0.00 H new ATOM 0 HD2 ARG A 53 72.486 24.479 -12.318 1.00 0.00 H new ATOM 0 HD3 ARG A 53 73.416 22.999 -12.443 1.00 0.00 H new ATOM 0 HE ARG A 53 70.720 22.361 -13.086 1.00 0.00 H new ATOM 0 HH11 ARG A 53 73.415 24.283 -14.312 1.00 0.00 H new ATOM 0 HH12 ARG A 53 72.905 24.135 -15.997 1.00 0.00 H new ATOM 0 HH21 ARG A 53 70.071 22.174 -15.253 1.00 0.00 H new ATOM 0 HH22 ARG A 53 71.020 22.946 -16.527 1.00 0.00 H new ATOM 830 N TRP A 54 73.657 23.050 -6.685 1.00 0.00 N ATOM 831 CA TRP A 54 74.614 23.360 -5.629 1.00 0.00 C ATOM 832 C TRP A 54 75.884 23.973 -6.207 1.00 0.00 C ATOM 833 O TRP A 54 76.380 24.983 -5.707 1.00 0.00 O ATOM 834 CB TRP A 54 74.956 22.097 -4.836 1.00 0.00 C ATOM 835 CG TRP A 54 73.754 21.279 -4.474 1.00 0.00 C ATOM 836 CD1 TRP A 54 72.647 21.703 -3.796 1.00 0.00 C ATOM 837 CD2 TRP A 54 73.540 19.894 -4.770 1.00 0.00 C ATOM 838 NE1 TRP A 54 71.757 20.666 -3.653 1.00 0.00 N ATOM 839 CE2 TRP A 54 72.281 19.546 -4.242 1.00 0.00 C ATOM 840 CE3 TRP A 54 74.287 18.916 -5.431 1.00 0.00 C ATOM 841 CZ2 TRP A 54 71.757 18.261 -4.355 1.00 0.00 C ATOM 842 CZ3 TRP A 54 73.766 17.641 -5.542 1.00 0.00 C ATOM 843 CH2 TRP A 54 72.510 17.323 -5.007 1.00 0.00 C ATOM 0 H TRP A 54 73.539 22.054 -6.868 1.00 0.00 H new ATOM 0 HA TRP A 54 74.155 24.088 -4.959 1.00 0.00 H new ATOM 0 HB2 TRP A 54 75.641 21.484 -5.421 1.00 0.00 H new ATOM 0 HB3 TRP A 54 75.482 22.380 -3.924 1.00 0.00 H new ATOM 0 HD1 TRP A 54 72.494 22.706 -3.426 1.00 0.00 H new ATOM 0 HE1 TRP A 54 70.853 20.721 -3.184 1.00 0.00 H new ATOM 0 HE3 TRP A 54 75.255 19.152 -5.848 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 70.790 18.013 -3.942 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 74.336 16.877 -6.049 1.00 0.00 H new ATOM 0 HH2 TRP A 54 72.129 16.318 -5.112 1.00 0.00 H new ATOM 854 N ARG A 55 76.407 23.356 -7.262 1.00 0.00 N ATOM 855 CA ARG A 55 77.621 23.841 -7.907 1.00 0.00 C ATOM 856 C ARG A 55 77.459 25.292 -8.348 1.00 0.00 C ATOM 857 O ARG A 55 78.441 26.022 -8.487 1.00 0.00 O ATOM 858 CB ARG A 55 77.967 22.966 -9.113 1.00 0.00 C ATOM 859 CG ARG A 55 76.939 23.033 -10.230 1.00 0.00 C ATOM 860 CD ARG A 55 77.077 21.859 -11.186 1.00 0.00 C ATOM 861 NE ARG A 55 76.167 21.969 -12.323 1.00 0.00 N ATOM 862 CZ ARG A 55 76.103 21.073 -13.302 1.00 0.00 C ATOM 863 NH1 ARG A 55 76.890 20.006 -13.282 1.00 0.00 N ATOM 864 NH2 ARG A 55 75.249 21.243 -14.303 1.00 0.00 N ATOM 0 H ARG A 55 76.009 22.519 -7.688 1.00 0.00 H new ATOM 0 HA ARG A 55 78.434 23.788 -7.183 1.00 0.00 H new ATOM 0 HB2 ARG A 55 78.937 23.270 -9.505 1.00 0.00 H new ATOM 0 HB3 ARG A 55 78.066 21.932 -8.784 1.00 0.00 H new ATOM 0 HG2 ARG A 55 75.936 23.040 -9.803 1.00 0.00 H new ATOM 0 HG3 ARG A 55 77.058 23.967 -10.780 1.00 0.00 H new ATOM 0 HD2 ARG A 55 78.104 21.805 -11.548 1.00 0.00 H new ATOM 0 HD3 ARG A 55 76.878 20.930 -10.651 1.00 0.00 H new ATOM 0 HE ARG A 55 75.547 22.778 -12.368 1.00 0.00 H new ATOM 0 HH11 ARG A 55 77.547 19.871 -12.513 1.00 0.00 H new ATOM 0 HH12 ARG A 55 76.838 19.320 -14.035 1.00 0.00 H new ATOM 0 HH21 ARG A 55 74.641 22.062 -14.321 1.00 0.00 H new ATOM 0 HH22 ARG A 55 75.200 20.555 -15.054 1.00 0.00 H new ATOM 878 N ASP A 56 76.215 25.704 -8.567 1.00 0.00 N ATOM 879 CA ASP A 56 75.925 27.068 -8.992 1.00 0.00 C ATOM 880 C ASP A 56 76.093 28.046 -7.833 1.00 0.00 C ATOM 881 O ASP A 56 76.503 29.190 -8.027 1.00 0.00 O ATOM 882 CB ASP A 56 74.503 27.160 -9.550 1.00 0.00 C ATOM 883 CG ASP A 56 74.272 28.434 -10.337 1.00 0.00 C ATOM 884 OD1 ASP A 56 75.076 29.378 -10.189 1.00 0.00 O ATOM 885 OD2 ASP A 56 73.286 28.487 -11.102 1.00 0.00 O ATOM 0 H ASP A 56 75.391 25.113 -8.457 1.00 0.00 H new ATOM 0 HA ASP A 56 76.633 27.336 -9.776 1.00 0.00 H new ATOM 0 HB2 ASP A 56 74.311 26.300 -10.192 1.00 0.00 H new ATOM 0 HB3 ASP A 56 73.789 27.110 -8.728 1.00 0.00 H new ATOM 890 N VAL A 57 75.774 27.587 -6.627 1.00 0.00 N ATOM 891 CA VAL A 57 75.890 28.420 -5.436 1.00 0.00 C ATOM 892 C VAL A 57 77.348 28.595 -5.028 1.00 0.00 C ATOM 893 O VAL A 57 77.746 29.655 -4.543 1.00 0.00 O ATOM 894 CB VAL A 57 75.105 27.822 -4.254 1.00 0.00 C ATOM 895 CG1 VAL A 57 73.936 26.987 -4.756 1.00 0.00 C ATOM 896 CG2 VAL A 57 76.024 26.991 -3.371 1.00 0.00 C ATOM 0 H VAL A 57 75.433 26.642 -6.449 1.00 0.00 H new ATOM 0 HA VAL A 57 75.467 29.393 -5.688 1.00 0.00 H new ATOM 0 HB VAL A 57 74.705 28.640 -3.655 1.00 0.00 H new ATOM 0 HG11 VAL A 57 73.393 26.573 -3.906 1.00 0.00 H new ATOM 0 HG12 VAL A 57 73.266 27.615 -5.343 1.00 0.00 H new ATOM 0 HG13 VAL A 57 74.310 26.174 -5.379 1.00 0.00 H new ATOM 0 HG21 VAL A 57 75.453 26.576 -2.541 1.00 0.00 H new ATOM 0 HG22 VAL A 57 76.455 26.179 -3.957 1.00 0.00 H new ATOM 0 HG23 VAL A 57 76.823 27.622 -2.982 1.00 0.00 H new ATOM 906 N LYS A 58 78.142 27.548 -5.227 1.00 0.00 N ATOM 907 CA LYS A 58 79.558 27.585 -4.881 1.00 0.00 C ATOM 908 C LYS A 58 80.348 28.392 -5.907 1.00 0.00 C ATOM 909 O LYS A 58 81.327 29.057 -5.568 1.00 0.00 O ATOM 910 CB LYS A 58 80.119 26.164 -4.793 1.00 0.00 C ATOM 911 CG LYS A 58 80.390 25.532 -6.147 1.00 0.00 C ATOM 912 CD LYS A 58 81.118 24.205 -6.007 1.00 0.00 C ATOM 913 CE LYS A 58 81.205 23.474 -7.338 1.00 0.00 C ATOM 914 NZ LYS A 58 82.514 23.699 -8.011 1.00 0.00 N ATOM 0 H LYS A 58 77.829 26.663 -5.626 1.00 0.00 H new ATOM 0 HA LYS A 58 79.657 28.069 -3.910 1.00 0.00 H new ATOM 0 HB2 LYS A 58 81.045 26.183 -4.218 1.00 0.00 H new ATOM 0 HB3 LYS A 58 79.416 25.538 -4.244 1.00 0.00 H new ATOM 0 HG2 LYS A 58 79.448 25.377 -6.673 1.00 0.00 H new ATOM 0 HG3 LYS A 58 80.986 26.213 -6.755 1.00 0.00 H new ATOM 0 HD2 LYS A 58 82.122 24.379 -5.620 1.00 0.00 H new ATOM 0 HD3 LYS A 58 80.600 23.579 -5.280 1.00 0.00 H new ATOM 0 HE2 LYS A 58 81.059 22.406 -7.176 1.00 0.00 H new ATOM 0 HE3 LYS A 58 80.399 23.810 -7.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 82.533 23.184 -8.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 82.643 24.716 -8.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 83.282 23.355 -7.400 1.00 0.00 H new ATOM 928 N PHE A 59 79.915 28.330 -7.162 1.00 0.00 N ATOM 929 CA PHE A 59 80.581 29.056 -8.237 1.00 0.00 C ATOM 930 C PHE A 59 80.127 30.512 -8.273 1.00 0.00 C ATOM 931 O PHE A 59 80.867 31.393 -8.711 1.00 0.00 O ATOM 932 CB PHE A 59 80.297 28.388 -9.584 1.00 0.00 C ATOM 933 CG PHE A 59 80.850 29.146 -10.757 1.00 0.00 C ATOM 934 CD1 PHE A 59 82.190 29.496 -10.803 1.00 0.00 C ATOM 935 CD2 PHE A 59 80.030 29.507 -11.814 1.00 0.00 C ATOM 936 CE1 PHE A 59 82.701 30.194 -11.881 1.00 0.00 C ATOM 937 CE2 PHE A 59 80.536 30.205 -12.895 1.00 0.00 C ATOM 938 CZ PHE A 59 81.873 30.548 -12.929 1.00 0.00 C ATOM 0 H PHE A 59 79.106 27.785 -7.459 1.00 0.00 H new ATOM 0 HA PHE A 59 81.654 29.033 -8.047 1.00 0.00 H new ATOM 0 HB2 PHE A 59 80.720 27.383 -9.579 1.00 0.00 H new ATOM 0 HB3 PHE A 59 79.219 28.280 -9.707 1.00 0.00 H new ATOM 0 HD1 PHE A 59 82.842 29.220 -9.988 1.00 0.00 H new ATOM 0 HD2 PHE A 59 78.984 29.240 -11.793 1.00 0.00 H new ATOM 0 HE1 PHE A 59 83.747 30.463 -11.904 1.00 0.00 H new ATOM 0 HE2 PHE A 59 79.886 30.482 -13.712 1.00 0.00 H new ATOM 0 HZ PHE A 59 82.271 31.092 -13.773 1.00 0.00 H new ATOM 948 N ARG A 60 78.905 30.756 -7.810 1.00 0.00 N ATOM 949 CA ARG A 60 78.351 32.105 -7.791 1.00 0.00 C ATOM 950 C ARG A 60 78.609 32.779 -6.447 1.00 0.00 C ATOM 951 O ARG A 60 77.839 33.637 -6.014 1.00 0.00 O ATOM 952 CB ARG A 60 76.848 32.065 -8.074 1.00 0.00 C ATOM 953 CG ARG A 60 76.263 33.418 -8.447 1.00 0.00 C ATOM 954 CD ARG A 60 75.740 33.424 -9.875 1.00 0.00 C ATOM 955 NE ARG A 60 74.287 33.284 -9.926 1.00 0.00 N ATOM 956 CZ ARG A 60 73.559 33.572 -10.999 1.00 0.00 C ATOM 957 NH1 ARG A 60 74.145 34.012 -12.104 1.00 0.00 N ATOM 958 NH2 ARG A 60 72.241 33.418 -10.968 1.00 0.00 N ATOM 0 H ARG A 60 78.280 30.038 -7.443 1.00 0.00 H new ATOM 0 HA ARG A 60 78.845 32.686 -8.570 1.00 0.00 H new ATOM 0 HB2 ARG A 60 76.658 31.361 -8.884 1.00 0.00 H new ATOM 0 HB3 ARG A 60 76.331 31.685 -7.193 1.00 0.00 H new ATOM 0 HG2 ARG A 60 75.454 33.667 -7.761 1.00 0.00 H new ATOM 0 HG3 ARG A 60 77.025 34.189 -8.334 1.00 0.00 H new ATOM 0 HD2 ARG A 60 76.032 34.353 -10.364 1.00 0.00 H new ATOM 0 HD3 ARG A 60 76.202 32.610 -10.434 1.00 0.00 H new ATOM 0 HE ARG A 60 73.805 32.947 -9.093 1.00 0.00 H new ATOM 0 HH11 ARG A 60 75.158 34.130 -12.132 1.00 0.00 H new ATOM 0 HH12 ARG A 60 73.583 34.232 -12.926 1.00 0.00 H new ATOM 0 HH21 ARG A 60 71.787 33.078 -10.120 1.00 0.00 H new ATOM 0 HH22 ARG A 60 71.682 33.639 -11.792 1.00 0.00 H new ATOM 972 N ALA A 61 79.696 32.385 -5.791 1.00 0.00 N ATOM 973 CA ALA A 61 80.055 32.952 -4.498 1.00 0.00 C ATOM 974 C ALA A 61 81.569 33.015 -4.328 1.00 0.00 C ATOM 975 O ALA A 61 82.172 34.083 -4.431 1.00 0.00 O ATOM 976 CB ALA A 61 79.429 32.141 -3.373 1.00 0.00 C ATOM 0 H ALA A 61 80.343 31.675 -6.135 1.00 0.00 H new ATOM 0 HA ALA A 61 79.668 33.970 -4.456 1.00 0.00 H new ATOM 0 HB1 ALA A 61 79.706 32.576 -2.413 1.00 0.00 H new ATOM 0 HB2 ALA A 61 78.344 32.152 -3.477 1.00 0.00 H new ATOM 0 HB3 ALA A 61 79.788 31.113 -3.422 1.00 0.00 H new ATOM 982 N PHE A 62 82.179 31.863 -4.065 1.00 0.00 N ATOM 983 CA PHE A 62 83.623 31.788 -3.879 1.00 0.00 C ATOM 984 C PHE A 62 84.135 30.378 -4.161 1.00 0.00 C ATOM 985 O PHE A 62 83.992 29.478 -3.334 1.00 0.00 O ATOM 986 CB PHE A 62 83.997 32.203 -2.454 1.00 0.00 C ATOM 987 CG PHE A 62 84.334 33.661 -2.324 1.00 0.00 C ATOM 988 CD1 PHE A 62 85.498 34.168 -2.877 1.00 0.00 C ATOM 989 CD2 PHE A 62 83.486 34.523 -1.648 1.00 0.00 C ATOM 990 CE1 PHE A 62 85.811 35.509 -2.758 1.00 0.00 C ATOM 991 CE2 PHE A 62 83.793 35.865 -1.526 1.00 0.00 C ATOM 992 CZ PHE A 62 84.957 36.359 -2.082 1.00 0.00 C ATOM 0 H PHE A 62 81.695 30.969 -3.976 1.00 0.00 H new ATOM 0 HA PHE A 62 84.092 32.474 -4.585 1.00 0.00 H new ATOM 0 HB2 PHE A 62 83.168 31.969 -1.786 1.00 0.00 H new ATOM 0 HB3 PHE A 62 84.850 31.610 -2.123 1.00 0.00 H new ATOM 0 HD1 PHE A 62 86.169 33.508 -3.407 1.00 0.00 H new ATOM 0 HD2 PHE A 62 82.575 34.142 -1.211 1.00 0.00 H new ATOM 0 HE1 PHE A 62 86.722 35.892 -3.193 1.00 0.00 H new ATOM 0 HE2 PHE A 62 83.124 36.527 -0.997 1.00 0.00 H new ATOM 0 HZ PHE A 62 85.199 37.407 -1.988 1.00 0.00 H new ATOM 1002 N GLU A 63 84.731 30.195 -5.335 1.00 0.00 N ATOM 1003 CA GLU A 63 85.262 28.895 -5.727 1.00 0.00 C ATOM 1004 C GLU A 63 86.677 28.702 -5.190 1.00 0.00 C ATOM 1005 O GLU A 63 87.340 27.712 -5.498 1.00 0.00 O ATOM 1006 CB GLU A 63 85.259 28.756 -7.251 1.00 0.00 C ATOM 1007 CG GLU A 63 86.022 29.860 -7.964 1.00 0.00 C ATOM 1008 CD GLU A 63 86.308 29.527 -9.415 1.00 0.00 C ATOM 1009 OE1 GLU A 63 87.046 28.551 -9.665 1.00 0.00 O ATOM 1010 OE2 GLU A 63 85.796 30.243 -10.301 1.00 0.00 O ATOM 0 H GLU A 63 84.858 30.930 -6.031 1.00 0.00 H new ATOM 0 HA GLU A 63 84.621 28.125 -5.299 1.00 0.00 H new ATOM 0 HB2 GLU A 63 85.693 27.793 -7.521 1.00 0.00 H new ATOM 0 HB3 GLU A 63 84.228 28.751 -7.605 1.00 0.00 H new ATOM 0 HG2 GLU A 63 85.447 30.785 -7.914 1.00 0.00 H new ATOM 0 HG3 GLU A 63 86.963 30.041 -7.444 1.00 0.00 H new ATOM 1017 N ASN A 64 87.134 29.656 -4.385 1.00 0.00 N ATOM 1018 CA ASN A 64 88.471 29.592 -3.806 1.00 0.00 C ATOM 1019 C ASN A 64 88.401 29.492 -2.285 1.00 0.00 C ATOM 1020 O ASN A 64 89.269 28.891 -1.651 1.00 0.00 O ATOM 1021 CB ASN A 64 89.284 30.823 -4.210 1.00 0.00 C ATOM 1022 CG ASN A 64 90.767 30.650 -3.944 1.00 0.00 C ATOM 1023 OD1 ASN A 64 91.229 30.814 -2.815 1.00 0.00 O ATOM 1024 ND2 ASN A 64 91.520 30.318 -4.986 1.00 0.00 N ATOM 0 H ASN A 64 86.598 30.482 -4.119 1.00 0.00 H new ATOM 0 HA ASN A 64 88.963 28.698 -4.189 1.00 0.00 H new ATOM 0 HB2 ASN A 64 89.129 31.025 -5.270 1.00 0.00 H new ATOM 0 HB3 ASN A 64 88.919 31.692 -3.663 1.00 0.00 H new ATOM 0 HD21 ASN A 64 92.525 30.189 -4.868 1.00 0.00 H new ATOM 0 HD22 ASN A 64 91.094 30.192 -5.904 1.00 0.00 H new ATOM 1031 N VAL A 65 87.361 30.084 -1.706 1.00 0.00 N ATOM 1032 CA VAL A 65 87.176 30.061 -0.260 1.00 0.00 C ATOM 1033 C VAL A 65 87.274 28.640 0.284 1.00 0.00 C ATOM 1034 O VAL A 65 86.974 27.673 -0.418 1.00 0.00 O ATOM 1035 CB VAL A 65 85.815 30.660 0.141 1.00 0.00 C ATOM 1036 CG1 VAL A 65 84.678 29.770 -0.336 1.00 0.00 C ATOM 1037 CG2 VAL A 65 85.747 30.864 1.647 1.00 0.00 C ATOM 0 H VAL A 65 86.634 30.585 -2.216 1.00 0.00 H new ATOM 0 HA VAL A 65 87.973 30.667 0.171 1.00 0.00 H new ATOM 0 HB VAL A 65 85.709 31.632 -0.340 1.00 0.00 H new ATOM 0 HG11 VAL A 65 83.724 30.210 -0.043 1.00 0.00 H new ATOM 0 HG12 VAL A 65 84.718 29.679 -1.421 1.00 0.00 H new ATOM 0 HG13 VAL A 65 84.776 28.782 0.114 1.00 0.00 H new ATOM 0 HG21 VAL A 65 84.779 31.288 1.913 1.00 0.00 H new ATOM 0 HG22 VAL A 65 85.874 29.905 2.150 1.00 0.00 H new ATOM 0 HG23 VAL A 65 86.539 31.545 1.958 1.00 0.00 H new ATOM 1047 N HIS A 66 87.695 28.520 1.539 1.00 0.00 N ATOM 1048 CA HIS A 66 87.831 27.216 2.178 1.00 0.00 C ATOM 1049 C HIS A 66 86.548 26.403 2.032 1.00 0.00 C ATOM 1050 O HIS A 66 85.458 26.961 1.910 1.00 0.00 O ATOM 1051 CB HIS A 66 88.177 27.383 3.658 1.00 0.00 C ATOM 1052 CG HIS A 66 87.030 27.868 4.490 1.00 0.00 C ATOM 1053 ND1 HIS A 66 86.054 27.031 4.987 1.00 0.00 N ATOM 1054 CD2 HIS A 66 86.708 29.113 4.914 1.00 0.00 C ATOM 1055 CE1 HIS A 66 85.180 27.739 5.679 1.00 0.00 C ATOM 1056 NE2 HIS A 66 85.554 29.006 5.650 1.00 0.00 N ATOM 0 H HIS A 66 87.948 29.309 2.133 1.00 0.00 H new ATOM 0 HA HIS A 66 88.639 26.679 1.682 1.00 0.00 H new ATOM 0 HB2 HIS A 66 88.522 26.427 4.052 1.00 0.00 H new ATOM 0 HB3 HIS A 66 89.006 28.085 3.752 1.00 0.00 H new ATOM 0 HD1 HIS A 66 86.013 26.022 4.843 1.00 0.00 H new ATOM 0 HD2 HIS A 66 87.257 30.021 4.711 1.00 0.00 H new ATOM 0 HE1 HIS A 66 84.308 27.349 6.183 1.00 0.00 H new ATOM 1064 N HIS A 67 86.686 25.081 2.046 1.00 0.00 N ATOM 1065 CA HIS A 67 85.538 24.191 1.916 1.00 0.00 C ATOM 1066 C HIS A 67 84.696 24.565 0.700 1.00 0.00 C ATOM 1067 O HIS A 67 83.484 24.752 0.807 1.00 0.00 O ATOM 1068 CB HIS A 67 84.680 24.241 3.181 1.00 0.00 C ATOM 1069 CG HIS A 67 85.249 23.455 4.322 1.00 0.00 C ATOM 1070 ND1 HIS A 67 84.504 23.073 5.417 1.00 0.00 N ATOM 1071 CD2 HIS A 67 86.497 22.977 4.532 1.00 0.00 C ATOM 1072 CE1 HIS A 67 85.270 22.396 6.254 1.00 0.00 C ATOM 1073 NE2 HIS A 67 86.485 22.323 5.740 1.00 0.00 N ATOM 0 H HIS A 67 87.581 24.603 2.146 1.00 0.00 H new ATOM 0 HA HIS A 67 85.910 23.176 1.780 1.00 0.00 H new ATOM 0 HB2 HIS A 67 84.562 25.280 3.489 1.00 0.00 H new ATOM 0 HB3 HIS A 67 83.684 23.862 2.950 1.00 0.00 H new ATOM 0 HD2 HIS A 67 87.345 23.089 3.873 1.00 0.00 H new ATOM 0 HE1 HIS A 67 84.956 21.974 7.197 1.00 0.00 H new ATOM 0 HE2 HIS A 67 87.284 21.857 6.170 1.00 0.00 H new ATOM 1081 N ARG A 68 85.346 24.674 -0.454 1.00 0.00 N ATOM 1082 CA ARG A 68 84.657 25.028 -1.689 1.00 0.00 C ATOM 1083 C ARG A 68 83.942 23.817 -2.279 1.00 0.00 C ATOM 1084 O ARG A 68 84.205 23.418 -3.414 1.00 0.00 O ATOM 1085 CB ARG A 68 85.649 25.594 -2.707 1.00 0.00 C ATOM 1086 CG ARG A 68 86.837 24.684 -2.971 1.00 0.00 C ATOM 1087 CD ARG A 68 87.147 24.590 -4.457 1.00 0.00 C ATOM 1088 NE ARG A 68 88.556 24.299 -4.705 1.00 0.00 N ATOM 1089 CZ ARG A 68 89.080 23.081 -4.631 1.00 0.00 C ATOM 1090 NH1 ARG A 68 88.314 22.044 -4.318 1.00 0.00 N ATOM 1091 NH2 ARG A 68 90.372 22.896 -4.870 1.00 0.00 N ATOM 0 H ARG A 68 86.349 24.522 -0.559 1.00 0.00 H new ATOM 0 HA ARG A 68 83.913 25.789 -1.455 1.00 0.00 H new ATOM 0 HB2 ARG A 68 85.127 25.778 -3.646 1.00 0.00 H new ATOM 0 HB3 ARG A 68 86.013 26.558 -2.350 1.00 0.00 H new ATOM 0 HG2 ARG A 68 87.711 25.061 -2.439 1.00 0.00 H new ATOM 0 HG3 ARG A 68 86.629 23.689 -2.578 1.00 0.00 H new ATOM 0 HD2 ARG A 68 86.531 23.811 -4.907 1.00 0.00 H new ATOM 0 HD3 ARG A 68 86.880 25.528 -4.943 1.00 0.00 H new ATOM 0 HE ARG A 68 89.172 25.074 -4.949 1.00 0.00 H new ATOM 0 HH11 ARG A 68 87.320 22.181 -4.134 1.00 0.00 H new ATOM 0 HH12 ARG A 68 88.719 21.109 -4.262 1.00 0.00 H new ATOM 0 HH21 ARG A 68 90.965 23.690 -5.111 1.00 0.00 H new ATOM 0 HH22 ARG A 68 90.772 21.960 -4.813 1.00 0.00 H new ATOM 1105 N THR A 69 83.036 23.233 -1.500 1.00 0.00 N ATOM 1106 CA THR A 69 82.284 22.066 -1.944 1.00 0.00 C ATOM 1107 C THR A 69 80.812 22.405 -2.146 1.00 0.00 C ATOM 1108 O THR A 69 80.144 22.885 -1.230 1.00 0.00 O ATOM 1109 CB THR A 69 82.399 20.907 -0.937 1.00 0.00 C ATOM 1110 OG1 THR A 69 83.464 21.163 -0.014 1.00 0.00 O ATOM 1111 CG2 THR A 69 82.649 19.589 -1.654 1.00 0.00 C ATOM 0 H THR A 69 82.806 23.550 -0.558 1.00 0.00 H new ATOM 0 HA THR A 69 82.716 21.755 -2.895 1.00 0.00 H new ATOM 0 HB THR A 69 81.457 20.834 -0.393 1.00 0.00 H new ATOM 0 HG1 THR A 69 83.529 20.422 0.624 1.00 0.00 H new ATOM 0 HG21 THR A 69 82.727 18.785 -0.922 1.00 0.00 H new ATOM 0 HG22 THR A 69 81.822 19.382 -2.334 1.00 0.00 H new ATOM 0 HG23 THR A 69 83.578 19.654 -2.221 1.00 0.00 H new ATOM 1119 N TYR A 70 80.311 22.152 -3.350 1.00 0.00 N ATOM 1120 CA TYR A 70 78.917 22.432 -3.672 1.00 0.00 C ATOM 1121 C TYR A 70 77.987 21.883 -2.594 1.00 0.00 C ATOM 1122 O TYR A 70 77.066 22.565 -2.145 1.00 0.00 O ATOM 1123 CB TYR A 70 78.554 21.829 -5.030 1.00 0.00 C ATOM 1124 CG TYR A 70 78.779 20.336 -5.109 1.00 0.00 C ATOM 1125 CD1 TYR A 70 80.039 19.816 -5.378 1.00 0.00 C ATOM 1126 CD2 TYR A 70 77.731 19.444 -4.912 1.00 0.00 C ATOM 1127 CE1 TYR A 70 80.248 18.452 -5.452 1.00 0.00 C ATOM 1128 CE2 TYR A 70 77.931 18.079 -4.982 1.00 0.00 C ATOM 1129 CZ TYR A 70 79.192 17.588 -5.252 1.00 0.00 C ATOM 1130 OH TYR A 70 79.397 16.229 -5.323 1.00 0.00 O ATOM 0 H TYR A 70 80.850 21.753 -4.119 1.00 0.00 H new ATOM 0 HA TYR A 70 78.792 23.514 -3.717 1.00 0.00 H new ATOM 0 HB2 TYR A 70 77.507 22.042 -5.244 1.00 0.00 H new ATOM 0 HB3 TYR A 70 79.144 22.318 -5.805 1.00 0.00 H new ATOM 0 HD1 TYR A 70 80.869 20.489 -5.532 1.00 0.00 H new ATOM 0 HD2 TYR A 70 76.743 19.825 -4.700 1.00 0.00 H new ATOM 0 HE1 TYR A 70 81.233 18.065 -5.665 1.00 0.00 H new ATOM 0 HE2 TYR A 70 77.105 17.400 -4.826 1.00 0.00 H new ATOM 0 HH TYR A 70 78.552 15.762 -5.157 1.00 0.00 H new ATOM 1140 N VAL A 71 78.236 20.644 -2.183 1.00 0.00 N ATOM 1141 CA VAL A 71 77.424 20.001 -1.156 1.00 0.00 C ATOM 1142 C VAL A 71 77.628 20.665 0.201 1.00 0.00 C ATOM 1143 O VAL A 71 76.709 20.725 1.018 1.00 0.00 O ATOM 1144 CB VAL A 71 77.755 18.502 -1.037 1.00 0.00 C ATOM 1145 CG1 VAL A 71 79.218 18.305 -0.670 1.00 0.00 C ATOM 1146 CG2 VAL A 71 76.846 17.837 -0.013 1.00 0.00 C ATOM 0 H VAL A 71 78.994 20.065 -2.545 1.00 0.00 H new ATOM 0 HA VAL A 71 76.383 20.113 -1.459 1.00 0.00 H new ATOM 0 HB VAL A 71 77.582 18.031 -2.005 1.00 0.00 H new ATOM 0 HG11 VAL A 71 79.433 17.239 -0.590 1.00 0.00 H new ATOM 0 HG12 VAL A 71 79.849 18.746 -1.442 1.00 0.00 H new ATOM 0 HG13 VAL A 71 79.422 18.788 0.285 1.00 0.00 H new ATOM 0 HG21 VAL A 71 77.093 16.778 0.059 1.00 0.00 H new ATOM 0 HG22 VAL A 71 76.986 18.309 0.959 1.00 0.00 H new ATOM 0 HG23 VAL A 71 75.807 17.947 -0.323 1.00 0.00 H new ATOM 1156 N ASP A 72 78.837 21.164 0.434 1.00 0.00 N ATOM 1157 CA ASP A 72 79.161 21.826 1.692 1.00 0.00 C ATOM 1158 C ASP A 72 78.360 23.114 1.850 1.00 0.00 C ATOM 1159 O ASP A 72 77.873 23.425 2.938 1.00 0.00 O ATOM 1160 CB ASP A 72 80.659 22.131 1.761 1.00 0.00 C ATOM 1161 CG ASP A 72 81.072 22.697 3.105 1.00 0.00 C ATOM 1162 OD1 ASP A 72 81.402 21.901 4.009 1.00 0.00 O ATOM 1163 OD2 ASP A 72 81.068 23.937 3.252 1.00 0.00 O ATOM 0 H ASP A 72 79.609 21.123 -0.232 1.00 0.00 H new ATOM 0 HA ASP A 72 78.897 21.153 2.507 1.00 0.00 H new ATOM 0 HB2 ASP A 72 81.222 21.218 1.566 1.00 0.00 H new ATOM 0 HB3 ASP A 72 80.919 22.841 0.976 1.00 0.00 H new ATOM 1168 N LEU A 73 78.227 23.861 0.760 1.00 0.00 N ATOM 1169 CA LEU A 73 77.486 25.117 0.777 1.00 0.00 C ATOM 1170 C LEU A 73 75.997 24.867 0.998 1.00 0.00 C ATOM 1171 O LEU A 73 75.379 25.469 1.876 1.00 0.00 O ATOM 1172 CB LEU A 73 77.698 25.876 -0.534 1.00 0.00 C ATOM 1173 CG LEU A 73 79.058 26.553 -0.704 1.00 0.00 C ATOM 1174 CD1 LEU A 73 79.944 25.744 -1.639 1.00 0.00 C ATOM 1175 CD2 LEU A 73 78.885 27.973 -1.226 1.00 0.00 C ATOM 0 H LEU A 73 78.623 23.618 -0.148 1.00 0.00 H new ATOM 0 HA LEU A 73 77.862 25.721 1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 73 77.555 25.180 -1.361 1.00 0.00 H new ATOM 0 HB3 LEU A 73 76.922 26.637 -0.620 1.00 0.00 H new ATOM 0 HG LEU A 73 79.543 26.602 0.271 1.00 0.00 H new ATOM 0 HD11 LEU A 73 80.908 26.241 -1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 73 80.095 24.747 -1.225 1.00 0.00 H new ATOM 0 HD13 LEU A 73 79.465 25.663 -2.615 1.00 0.00 H new ATOM 0 HD21 LEU A 73 79.863 28.440 -1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 73 78.380 27.947 -2.191 1.00 0.00 H new ATOM 0 HD23 LEU A 73 78.288 28.550 -0.520 1.00 0.00 H new ATOM 1187 N LYS A 74 75.427 23.973 0.197 1.00 0.00 N ATOM 1188 CA LYS A 74 74.012 23.640 0.306 1.00 0.00 C ATOM 1189 C LYS A 74 73.687 23.094 1.692 1.00 0.00 C ATOM 1190 O LYS A 74 72.713 23.509 2.321 1.00 0.00 O ATOM 1191 CB LYS A 74 73.625 22.614 -0.762 1.00 0.00 C ATOM 1192 CG LYS A 74 72.196 22.113 -0.635 1.00 0.00 C ATOM 1193 CD LYS A 74 71.192 23.196 -0.991 1.00 0.00 C ATOM 1194 CE LYS A 74 69.762 22.693 -0.867 1.00 0.00 C ATOM 1195 NZ LYS A 74 68.869 23.302 -1.891 1.00 0.00 N ATOM 0 H LYS A 74 75.924 23.466 -0.535 1.00 0.00 H new ATOM 0 HA LYS A 74 73.436 24.552 0.150 1.00 0.00 H new ATOM 0 HB2 LYS A 74 73.759 23.060 -1.748 1.00 0.00 H new ATOM 0 HB3 LYS A 74 74.306 21.765 -0.702 1.00 0.00 H new ATOM 0 HG2 LYS A 74 72.052 21.253 -1.289 1.00 0.00 H new ATOM 0 HG3 LYS A 74 72.018 21.772 0.385 1.00 0.00 H new ATOM 0 HD2 LYS A 74 71.335 24.055 -0.336 1.00 0.00 H new ATOM 0 HD3 LYS A 74 71.371 23.539 -2.010 1.00 0.00 H new ATOM 0 HE2 LYS A 74 69.748 21.608 -0.972 1.00 0.00 H new ATOM 0 HE3 LYS A 74 69.382 22.922 0.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 67.904 22.934 -1.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 68.862 24.335 -1.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 69.217 23.063 -2.841 1.00 0.00 H new ATOM 1209 N ASP A 75 74.509 22.162 2.164 1.00 0.00 N ATOM 1210 CA ASP A 75 74.310 21.561 3.477 1.00 0.00 C ATOM 1211 C ASP A 75 74.465 22.603 4.581 1.00 0.00 C ATOM 1212 O ASP A 75 73.727 22.595 5.566 1.00 0.00 O ATOM 1213 CB ASP A 75 75.302 20.418 3.694 1.00 0.00 C ATOM 1214 CG ASP A 75 74.853 19.459 4.779 1.00 0.00 C ATOM 1215 OD1 ASP A 75 73.969 18.621 4.501 1.00 0.00 O ATOM 1216 OD2 ASP A 75 75.385 19.545 5.905 1.00 0.00 O ATOM 0 H ASP A 75 75.319 21.807 1.656 1.00 0.00 H new ATOM 0 HA ASP A 75 73.296 21.164 3.517 1.00 0.00 H new ATOM 0 HB2 ASP A 75 75.431 19.871 2.760 1.00 0.00 H new ATOM 0 HB3 ASP A 75 76.275 20.831 3.958 1.00 0.00 H new ATOM 1221 N LYS A 76 75.432 23.499 4.410 1.00 0.00 N ATOM 1222 CA LYS A 76 75.686 24.548 5.390 1.00 0.00 C ATOM 1223 C LYS A 76 74.509 25.515 5.469 1.00 0.00 C ATOM 1224 O LYS A 76 74.206 26.053 6.534 1.00 0.00 O ATOM 1225 CB LYS A 76 76.963 25.310 5.033 1.00 0.00 C ATOM 1226 CG LYS A 76 77.419 26.274 6.114 1.00 0.00 C ATOM 1227 CD LYS A 76 78.895 26.610 5.976 1.00 0.00 C ATOM 1228 CE LYS A 76 79.471 27.137 7.281 1.00 0.00 C ATOM 1229 NZ LYS A 76 79.360 26.139 8.380 1.00 0.00 N ATOM 0 H LYS A 76 76.053 23.519 3.601 1.00 0.00 H new ATOM 0 HA LYS A 76 75.813 24.077 6.365 1.00 0.00 H new ATOM 0 HB2 LYS A 76 77.761 24.593 4.837 1.00 0.00 H new ATOM 0 HB3 LYS A 76 76.799 25.865 4.109 1.00 0.00 H new ATOM 0 HG2 LYS A 76 76.830 27.189 6.058 1.00 0.00 H new ATOM 0 HG3 LYS A 76 77.235 25.836 7.095 1.00 0.00 H new ATOM 0 HD2 LYS A 76 79.444 25.721 5.668 1.00 0.00 H new ATOM 0 HD3 LYS A 76 79.028 27.355 5.191 1.00 0.00 H new ATOM 0 HE2 LYS A 76 80.518 27.401 7.135 1.00 0.00 H new ATOM 0 HE3 LYS A 76 78.949 28.050 7.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 80.061 26.355 9.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 78.405 26.178 8.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 79.536 25.186 8.003 1.00 0.00 H new ATOM 1243 N TRP A 77 73.849 25.730 4.337 1.00 0.00 N ATOM 1244 CA TRP A 77 72.704 26.632 4.278 1.00 0.00 C ATOM 1245 C TRP A 77 71.516 26.052 5.038 1.00 0.00 C ATOM 1246 O TRP A 77 70.924 26.719 5.887 1.00 0.00 O ATOM 1247 CB TRP A 77 72.314 26.900 2.824 1.00 0.00 C ATOM 1248 CG TRP A 77 70.956 27.518 2.678 1.00 0.00 C ATOM 1249 CD1 TRP A 77 70.540 28.712 3.193 1.00 0.00 C ATOM 1250 CD2 TRP A 77 69.837 26.971 1.972 1.00 0.00 C ATOM 1251 NE1 TRP A 77 69.229 28.941 2.849 1.00 0.00 N ATOM 1252 CE2 TRP A 77 68.775 27.888 2.100 1.00 0.00 C ATOM 1253 CE3 TRP A 77 69.629 25.797 1.243 1.00 0.00 C ATOM 1254 CZ2 TRP A 77 67.527 27.665 1.526 1.00 0.00 C ATOM 1255 CZ3 TRP A 77 68.389 25.577 0.674 1.00 0.00 C ATOM 1256 CH2 TRP A 77 67.351 26.508 0.818 1.00 0.00 C ATOM 0 H TRP A 77 74.087 25.292 3.447 1.00 0.00 H new ATOM 0 HA TRP A 77 72.989 27.573 4.749 1.00 0.00 H new ATOM 0 HB2 TRP A 77 73.056 27.558 2.372 1.00 0.00 H new ATOM 0 HB3 TRP A 77 72.340 25.962 2.269 1.00 0.00 H new ATOM 0 HD1 TRP A 77 71.151 29.378 3.784 1.00 0.00 H new ATOM 0 HE1 TRP A 77 68.683 29.762 3.109 1.00 0.00 H new ATOM 0 HE3 TRP A 77 70.423 25.074 1.126 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 66.725 28.380 1.636 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 68.217 24.673 0.109 1.00 0.00 H new ATOM 0 HH2 TRP A 77 66.393 26.308 0.361 1.00 0.00 H new ATOM 1267 N LYS A 78 71.171 24.807 4.729 1.00 0.00 N ATOM 1268 CA LYS A 78 70.054 24.137 5.383 1.00 0.00 C ATOM 1269 C LYS A 78 70.243 24.116 6.897 1.00 0.00 C ATOM 1270 O LYS A 78 69.321 24.421 7.653 1.00 0.00 O ATOM 1271 CB LYS A 78 69.911 22.707 4.857 1.00 0.00 C ATOM 1272 CG LYS A 78 69.180 21.778 5.810 1.00 0.00 C ATOM 1273 CD LYS A 78 70.148 21.026 6.708 1.00 0.00 C ATOM 1274 CE LYS A 78 69.607 19.656 7.087 1.00 0.00 C ATOM 1275 NZ LYS A 78 68.315 19.753 7.820 1.00 0.00 N ATOM 0 H LYS A 78 71.650 24.241 4.029 1.00 0.00 H new ATOM 0 HA LYS A 78 69.145 24.694 5.155 1.00 0.00 H new ATOM 0 HB2 LYS A 78 69.379 22.730 3.906 1.00 0.00 H new ATOM 0 HB3 LYS A 78 70.903 22.302 4.657 1.00 0.00 H new ATOM 0 HG2 LYS A 78 68.488 22.355 6.423 1.00 0.00 H new ATOM 0 HG3 LYS A 78 68.584 21.066 5.240 1.00 0.00 H new ATOM 0 HD2 LYS A 78 71.105 20.912 6.199 1.00 0.00 H new ATOM 0 HD3 LYS A 78 70.335 21.607 7.611 1.00 0.00 H new ATOM 0 HE2 LYS A 78 69.469 19.058 6.186 1.00 0.00 H new ATOM 0 HE3 LYS A 78 70.338 19.136 7.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 68.048 18.814 8.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 68.417 20.412 8.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 67.576 20.101 7.176 1.00 0.00 H new ATOM 1289 N THR A 79 71.446 23.754 7.333 1.00 0.00 N ATOM 1290 CA THR A 79 71.756 23.694 8.756 1.00 0.00 C ATOM 1291 C THR A 79 71.576 25.056 9.416 1.00 0.00 C ATOM 1292 O THR A 79 70.887 25.180 10.429 1.00 0.00 O ATOM 1293 CB THR A 79 73.197 23.206 8.996 1.00 0.00 C ATOM 1294 OG1 THR A 79 73.365 21.890 8.457 1.00 0.00 O ATOM 1295 CG2 THR A 79 73.524 23.196 10.482 1.00 0.00 C ATOM 0 H THR A 79 72.221 23.498 6.721 1.00 0.00 H new ATOM 0 HA THR A 79 71.060 22.983 9.202 1.00 0.00 H new ATOM 0 HB THR A 79 73.878 23.893 8.494 1.00 0.00 H new ATOM 0 HG1 THR A 79 73.497 21.948 7.488 1.00 0.00 H new ATOM 0 HG21 THR A 79 74.547 22.848 10.627 1.00 0.00 H new ATOM 0 HG22 THR A 79 73.423 24.204 10.883 1.00 0.00 H new ATOM 0 HG23 THR A 79 72.836 22.529 11.001 1.00 0.00 H new ATOM 1303 N LEU A 80 72.199 26.076 8.836 1.00 0.00 N ATOM 1304 CA LEU A 80 72.107 27.431 9.368 1.00 0.00 C ATOM 1305 C LEU A 80 70.652 27.876 9.477 1.00 0.00 C ATOM 1306 O LEU A 80 70.293 28.650 10.364 1.00 0.00 O ATOM 1307 CB LEU A 80 72.885 28.403 8.479 1.00 0.00 C ATOM 1308 CG LEU A 80 72.053 29.217 7.487 1.00 0.00 C ATOM 1309 CD1 LEU A 80 71.471 30.449 8.162 1.00 0.00 C ATOM 1310 CD2 LEU A 80 72.896 29.614 6.284 1.00 0.00 C ATOM 0 H LEU A 80 72.773 25.990 7.997 1.00 0.00 H new ATOM 0 HA LEU A 80 72.544 27.433 10.367 1.00 0.00 H new ATOM 0 HB2 LEU A 80 73.429 29.096 9.121 1.00 0.00 H new ATOM 0 HB3 LEU A 80 73.629 27.836 7.919 1.00 0.00 H new ATOM 0 HG LEU A 80 71.228 28.596 7.139 1.00 0.00 H new ATOM 0 HD11 LEU A 80 70.882 31.015 7.440 1.00 0.00 H new ATOM 0 HD12 LEU A 80 70.832 30.142 8.990 1.00 0.00 H new ATOM 0 HD13 LEU A 80 72.281 31.074 8.540 1.00 0.00 H new ATOM 0 HD21 LEU A 80 72.288 30.193 5.589 1.00 0.00 H new ATOM 0 HD22 LEU A 80 73.741 30.217 6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 80 73.263 28.717 5.785 1.00 0.00 H new ATOM 1322 N VAL A 81 69.818 27.380 8.569 1.00 0.00 N ATOM 1323 CA VAL A 81 68.401 27.723 8.565 1.00 0.00 C ATOM 1324 C VAL A 81 67.692 27.149 9.786 1.00 0.00 C ATOM 1325 O VAL A 81 66.904 27.834 10.439 1.00 0.00 O ATOM 1326 CB VAL A 81 67.703 27.209 7.291 1.00 0.00 C ATOM 1327 CG1 VAL A 81 66.201 27.434 7.378 1.00 0.00 C ATOM 1328 CG2 VAL A 81 68.281 27.885 6.057 1.00 0.00 C ATOM 0 H VAL A 81 70.099 26.739 7.827 1.00 0.00 H new ATOM 0 HA VAL A 81 68.339 28.811 8.591 1.00 0.00 H new ATOM 0 HB VAL A 81 67.882 26.137 7.207 1.00 0.00 H new ATOM 0 HG11 VAL A 81 65.725 27.065 6.470 1.00 0.00 H new ATOM 0 HG12 VAL A 81 65.802 26.899 8.240 1.00 0.00 H new ATOM 0 HG13 VAL A 81 65.998 28.499 7.487 1.00 0.00 H new ATOM 0 HG21 VAL A 81 67.776 27.510 5.167 1.00 0.00 H new ATOM 0 HG22 VAL A 81 68.135 28.963 6.130 1.00 0.00 H new ATOM 0 HG23 VAL A 81 69.347 27.667 5.989 1.00 0.00 H new ATOM 1338 N HIS A 82 67.978 25.887 10.091 1.00 0.00 N ATOM 1339 CA HIS A 82 67.369 25.220 11.236 1.00 0.00 C ATOM 1340 C HIS A 82 67.758 25.913 12.539 1.00 0.00 C ATOM 1341 O HIS A 82 66.936 26.067 13.442 1.00 0.00 O ATOM 1342 CB HIS A 82 67.790 23.751 11.281 1.00 0.00 C ATOM 1343 CG HIS A 82 67.196 22.992 12.427 1.00 0.00 C ATOM 1344 ND1 HIS A 82 65.950 22.402 12.374 1.00 0.00 N ATOM 1345 CD2 HIS A 82 67.683 22.727 13.662 1.00 0.00 C ATOM 1346 CE1 HIS A 82 65.697 21.808 13.526 1.00 0.00 C ATOM 1347 NE2 HIS A 82 66.733 21.990 14.325 1.00 0.00 N ATOM 0 H HIS A 82 68.628 25.306 9.561 1.00 0.00 H new ATOM 0 HA HIS A 82 66.286 25.276 11.124 1.00 0.00 H new ATOM 0 HB2 HIS A 82 67.499 23.270 10.347 1.00 0.00 H new ATOM 0 HB3 HIS A 82 68.877 23.695 11.343 1.00 0.00 H new ATOM 0 HD2 HIS A 82 68.641 23.038 14.053 1.00 0.00 H new ATOM 0 HE1 HIS A 82 64.796 21.266 13.773 1.00 0.00 H new ATOM 0 HE2 HIS A 82 66.814 21.640 15.280 1.00 0.00 H new ATOM 1355 N THR A 83 69.017 26.330 12.629 1.00 0.00 N ATOM 1356 CA THR A 83 69.516 27.005 13.821 1.00 0.00 C ATOM 1357 C THR A 83 68.951 28.416 13.930 1.00 0.00 C ATOM 1358 O THR A 83 68.772 28.940 15.029 1.00 0.00 O ATOM 1359 CB THR A 83 71.054 27.078 13.823 1.00 0.00 C ATOM 1360 OG1 THR A 83 71.607 25.777 13.595 1.00 0.00 O ATOM 1361 CG2 THR A 83 71.568 27.628 15.144 1.00 0.00 C ATOM 0 H THR A 83 69.710 26.212 11.890 1.00 0.00 H new ATOM 0 HA THR A 83 69.187 26.418 14.678 1.00 0.00 H new ATOM 0 HB THR A 83 71.364 27.750 13.023 1.00 0.00 H new ATOM 0 HG1 THR A 83 71.453 25.515 12.663 1.00 0.00 H new ATOM 0 HG21 THR A 83 72.657 27.670 15.122 1.00 0.00 H new ATOM 0 HG22 THR A 83 71.169 28.630 15.301 1.00 0.00 H new ATOM 0 HG23 THR A 83 71.247 26.978 15.958 1.00 0.00 H new ATOM 1369 N ALA A 84 68.671 29.027 12.783 1.00 0.00 N ATOM 1370 CA ALA A 84 68.124 30.378 12.751 1.00 0.00 C ATOM 1371 C ALA A 84 66.608 30.360 12.915 1.00 0.00 C ATOM 1372 O ALA A 84 65.979 31.405 13.077 1.00 0.00 O ATOM 1373 CB ALA A 84 68.508 31.072 11.453 1.00 0.00 C ATOM 0 H ALA A 84 68.814 28.608 11.864 1.00 0.00 H new ATOM 0 HA ALA A 84 68.547 30.935 13.587 1.00 0.00 H new ATOM 0 HB1 ALA A 84 68.093 32.080 11.443 1.00 0.00 H new ATOM 0 HB2 ALA A 84 69.594 31.126 11.377 1.00 0.00 H new ATOM 0 HB3 ALA A 84 68.113 30.508 10.608 1.00 0.00 H new ATOM 1379 N SER A 85 66.027 29.165 12.870 1.00 0.00 N ATOM 1380 CA SER A 85 64.583 29.012 13.009 1.00 0.00 C ATOM 1381 C SER A 85 64.222 28.515 14.406 1.00 0.00 C ATOM 1382 O SER A 85 63.195 28.899 14.967 1.00 0.00 O ATOM 1383 CB SER A 85 64.048 28.040 11.956 1.00 0.00 C ATOM 1384 OG SER A 85 62.692 28.315 11.650 1.00 0.00 O ATOM 0 H SER A 85 66.533 28.289 12.739 1.00 0.00 H new ATOM 0 HA SER A 85 64.123 29.989 12.859 1.00 0.00 H new ATOM 0 HB2 SER A 85 64.650 28.112 11.050 1.00 0.00 H new ATOM 0 HB3 SER A 85 64.142 27.017 12.320 1.00 0.00 H new ATOM 0 HG SER A 85 62.374 27.681 10.973 1.00 0.00 H new ATOM 1390 N ILE A 86 65.073 27.659 14.961 1.00 0.00 N ATOM 1391 CA ILE A 86 64.845 27.110 16.292 1.00 0.00 C ATOM 1392 C ILE A 86 64.663 28.221 17.321 1.00 0.00 C ATOM 1393 O ILE A 86 64.746 29.404 16.993 1.00 0.00 O ATOM 1394 CB ILE A 86 66.009 26.202 16.733 1.00 0.00 C ATOM 1395 CG1 ILE A 86 67.343 26.935 16.579 1.00 0.00 C ATOM 1396 CG2 ILE A 86 66.010 24.913 15.927 1.00 0.00 C ATOM 1397 CD1 ILE A 86 68.516 26.186 17.172 1.00 0.00 C ATOM 0 H ILE A 86 65.927 27.331 14.510 1.00 0.00 H new ATOM 0 HA ILE A 86 63.933 26.516 16.237 1.00 0.00 H new ATOM 0 HB ILE A 86 65.875 25.949 17.785 1.00 0.00 H new ATOM 0 HG12 ILE A 86 67.532 27.110 15.520 1.00 0.00 H new ATOM 0 HG13 ILE A 86 67.268 27.913 17.055 1.00 0.00 H new ATOM 0 HG21 ILE A 86 66.838 24.282 16.250 1.00 0.00 H new ATOM 0 HG22 ILE A 86 65.069 24.385 16.084 1.00 0.00 H new ATOM 0 HG23 ILE A 86 66.123 25.146 14.868 1.00 0.00 H new ATOM 0 HD11 ILE A 86 69.428 26.764 17.026 1.00 0.00 H new ATOM 0 HD12 ILE A 86 68.349 26.034 18.238 1.00 0.00 H new ATOM 0 HD13 ILE A 86 68.617 25.219 16.679 1.00 0.00 H new ATOM 1409 N ALA A 87 64.416 27.830 18.567 1.00 0.00 N ATOM 1410 CA ALA A 87 64.226 28.793 19.645 1.00 0.00 C ATOM 1411 C ALA A 87 65.368 29.802 19.688 1.00 0.00 C ATOM 1412 O ALA A 87 66.453 29.571 19.153 1.00 0.00 O ATOM 1413 CB ALA A 87 64.105 28.072 20.980 1.00 0.00 C ATOM 0 H ALA A 87 64.343 26.854 18.855 1.00 0.00 H new ATOM 0 HA ALA A 87 63.302 29.339 19.453 1.00 0.00 H new ATOM 0 HB1 ALA A 87 63.964 28.802 21.777 1.00 0.00 H new ATOM 0 HB2 ALA A 87 63.251 27.396 20.952 1.00 0.00 H new ATOM 0 HB3 ALA A 87 65.014 27.501 21.169 1.00 0.00 H new ATOM 1419 N PRO A 88 65.120 30.950 20.337 1.00 0.00 N ATOM 1420 CA PRO A 88 66.116 32.018 20.464 1.00 0.00 C ATOM 1421 C PRO A 88 67.268 31.630 21.386 1.00 0.00 C ATOM 1422 O PRO A 88 68.393 32.098 21.217 1.00 0.00 O ATOM 1423 CB PRO A 88 65.318 33.177 21.065 1.00 0.00 C ATOM 1424 CG PRO A 88 64.189 32.526 21.787 1.00 0.00 C ATOM 1425 CD PRO A 88 63.850 31.292 20.998 1.00 0.00 C ATOM 0 HA PRO A 88 66.584 32.255 19.508 1.00 0.00 H new ATOM 0 HB2 PRO A 88 65.932 33.770 21.743 1.00 0.00 H new ATOM 0 HB3 PRO A 88 64.955 33.852 20.290 1.00 0.00 H new ATOM 0 HG2 PRO A 88 64.474 32.271 22.808 1.00 0.00 H new ATOM 0 HG3 PRO A 88 63.331 33.195 21.853 1.00 0.00 H new ATOM 0 HD2 PRO A 88 63.503 30.485 21.643 1.00 0.00 H new ATOM 0 HD3 PRO A 88 63.059 31.483 20.273 1.00 0.00 H new ATOM 1433 N GLN A 89 66.977 30.773 22.359 1.00 0.00 N ATOM 1434 CA GLN A 89 67.990 30.323 23.308 1.00 0.00 C ATOM 1435 C GLN A 89 68.866 29.236 22.694 1.00 0.00 C ATOM 1436 O GLN A 89 69.812 28.762 23.321 1.00 0.00 O ATOM 1437 CB GLN A 89 67.327 29.801 24.584 1.00 0.00 C ATOM 1438 CG GLN A 89 66.384 28.632 24.345 1.00 0.00 C ATOM 1439 CD GLN A 89 65.790 28.090 25.630 1.00 0.00 C ATOM 1440 OE1 GLN A 89 64.673 28.444 26.009 1.00 0.00 O ATOM 1441 NE2 GLN A 89 66.535 27.225 26.308 1.00 0.00 N ATOM 0 H GLN A 89 66.050 30.376 22.511 1.00 0.00 H new ATOM 0 HA GLN A 89 68.622 31.175 23.558 1.00 0.00 H new ATOM 0 HB2 GLN A 89 68.102 29.494 25.287 1.00 0.00 H new ATOM 0 HB3 GLN A 89 66.773 30.614 25.054 1.00 0.00 H new ATOM 0 HG2 GLN A 89 65.579 28.949 23.682 1.00 0.00 H new ATOM 0 HG3 GLN A 89 66.922 27.834 23.833 1.00 0.00 H new ATOM 0 HE21 GLN A 89 67.455 26.960 25.957 1.00 0.00 H new ATOM 0 HE22 GLN A 89 66.187 26.826 27.180 1.00 0.00 H new ATOM 1450 N GLN A 90 68.544 28.847 21.464 1.00 0.00 N ATOM 1451 CA GLN A 90 69.302 27.816 20.767 1.00 0.00 C ATOM 1452 C GLN A 90 69.946 28.374 19.502 1.00 0.00 C ATOM 1453 O GLN A 90 71.004 27.912 19.076 1.00 0.00 O ATOM 1454 CB GLN A 90 68.393 26.637 20.412 1.00 0.00 C ATOM 1455 CG GLN A 90 67.541 26.154 21.575 1.00 0.00 C ATOM 1456 CD GLN A 90 66.570 25.062 21.174 1.00 0.00 C ATOM 1457 OE1 GLN A 90 66.210 24.935 20.003 1.00 0.00 O ATOM 1458 NE2 GLN A 90 66.141 24.265 22.145 1.00 0.00 N ATOM 0 H GLN A 90 67.764 29.230 20.931 1.00 0.00 H new ATOM 0 HA GLN A 90 70.092 27.470 21.433 1.00 0.00 H new ATOM 0 HB2 GLN A 90 67.739 26.928 19.590 1.00 0.00 H new ATOM 0 HB3 GLN A 90 69.007 25.810 20.054 1.00 0.00 H new ATOM 0 HG2 GLN A 90 68.191 25.783 22.367 1.00 0.00 H new ATOM 0 HG3 GLN A 90 66.985 26.996 21.987 1.00 0.00 H new ATOM 0 HE21 GLN A 90 66.465 24.406 23.102 1.00 0.00 H new ATOM 0 HE22 GLN A 90 65.487 23.511 21.934 1.00 0.00 H new ATOM 1467 N ARG A 91 69.300 29.372 18.906 1.00 0.00 N ATOM 1468 CA ARG A 91 69.809 29.992 17.689 1.00 0.00 C ATOM 1469 C ARG A 91 71.117 30.730 17.961 1.00 0.00 C ATOM 1470 O ARG A 91 71.932 30.922 17.059 1.00 0.00 O ATOM 1471 CB ARG A 91 68.774 30.961 17.114 1.00 0.00 C ATOM 1472 CG ARG A 91 68.660 32.262 17.892 1.00 0.00 C ATOM 1473 CD ARG A 91 67.593 33.171 17.303 1.00 0.00 C ATOM 1474 NE ARG A 91 67.668 34.526 17.844 1.00 0.00 N ATOM 1475 CZ ARG A 91 66.759 35.464 17.605 1.00 0.00 C ATOM 1476 NH1 ARG A 91 65.711 35.197 16.838 1.00 0.00 N ATOM 1477 NH2 ARG A 91 66.897 36.674 18.133 1.00 0.00 N ATOM 0 H ARG A 91 68.424 29.768 19.246 1.00 0.00 H new ATOM 0 HA ARG A 91 70.001 29.203 16.962 1.00 0.00 H new ATOM 0 HB2 ARG A 91 69.035 31.187 16.080 1.00 0.00 H new ATOM 0 HB3 ARG A 91 67.800 30.471 17.097 1.00 0.00 H new ATOM 0 HG2 ARG A 91 68.421 32.045 18.933 1.00 0.00 H new ATOM 0 HG3 ARG A 91 69.621 32.776 17.886 1.00 0.00 H new ATOM 0 HD2 ARG A 91 67.705 33.207 16.219 1.00 0.00 H new ATOM 0 HD3 ARG A 91 66.607 32.753 17.508 1.00 0.00 H new ATOM 0 HE ARG A 91 68.462 34.765 18.438 1.00 0.00 H new ATOM 0 HH11 ARG A 91 65.601 34.269 16.430 1.00 0.00 H new ATOM 0 HH12 ARG A 91 65.015 35.920 16.656 1.00 0.00 H new ATOM 0 HH21 ARG A 91 67.702 36.884 18.723 1.00 0.00 H new ATOM 0 HH22 ARG A 91 66.198 37.394 17.949 1.00 0.00 H new ATOM 1491 N ARG A 92 71.309 31.142 19.210 1.00 0.00 N ATOM 1492 CA ARG A 92 72.516 31.860 19.600 1.00 0.00 C ATOM 1493 C ARG A 92 73.766 31.101 19.164 1.00 0.00 C ATOM 1494 O ARG A 92 73.945 29.932 19.504 1.00 0.00 O ATOM 1495 CB ARG A 92 72.540 32.075 21.115 1.00 0.00 C ATOM 1496 CG ARG A 92 73.858 32.630 21.630 1.00 0.00 C ATOM 1497 CD ARG A 92 73.849 32.769 23.145 1.00 0.00 C ATOM 1498 NE ARG A 92 75.134 33.236 23.658 1.00 0.00 N ATOM 1499 CZ ARG A 92 75.309 33.697 24.892 1.00 0.00 C ATOM 1500 NH1 ARG A 92 74.286 33.753 25.733 1.00 0.00 N ATOM 1501 NH2 ARG A 92 76.509 34.104 25.286 1.00 0.00 N ATOM 0 H ARG A 92 70.644 30.991 19.969 1.00 0.00 H new ATOM 0 HA ARG A 92 72.508 32.829 19.102 1.00 0.00 H new ATOM 0 HB2 ARG A 92 71.736 32.758 21.389 1.00 0.00 H new ATOM 0 HB3 ARG A 92 72.336 31.126 21.611 1.00 0.00 H new ATOM 0 HG2 ARG A 92 74.674 31.973 21.328 1.00 0.00 H new ATOM 0 HG3 ARG A 92 74.047 33.602 21.175 1.00 0.00 H new ATOM 0 HD2 ARG A 92 73.065 33.466 23.441 1.00 0.00 H new ATOM 0 HD3 ARG A 92 73.606 31.807 23.596 1.00 0.00 H new ATOM 0 HE ARG A 92 75.941 33.207 23.035 1.00 0.00 H new ATOM 0 HH11 ARG A 92 73.362 33.442 25.433 1.00 0.00 H new ATOM 0 HH12 ARG A 92 74.423 34.107 26.680 1.00 0.00 H new ATOM 0 HH21 ARG A 92 77.298 34.063 24.641 1.00 0.00 H new ATOM 0 HH22 ARG A 92 76.642 34.458 26.233 1.00 0.00 H new ATOM 1515 N GLY A 93 74.627 31.774 18.407 1.00 0.00 N ATOM 1516 CA GLY A 93 75.848 31.147 17.935 1.00 0.00 C ATOM 1517 C GLY A 93 76.960 32.149 17.697 1.00 0.00 C ATOM 1518 O GLY A 93 77.676 32.524 18.625 1.00 0.00 O ATOM 0 H GLY A 93 74.501 32.742 18.112 1.00 0.00 H new ATOM 0 HA2 GLY A 93 76.179 30.408 18.665 1.00 0.00 H new ATOM 0 HA3 GLY A 93 75.643 30.610 17.009 1.00 0.00 H new ATOM 1522 N ALA A 94 77.106 32.583 16.449 1.00 0.00 N ATOM 1523 CA ALA A 94 78.138 33.548 16.092 1.00 0.00 C ATOM 1524 C ALA A 94 77.538 34.928 15.844 1.00 0.00 C ATOM 1525 O ALA A 94 76.340 35.075 15.598 1.00 0.00 O ATOM 1526 CB ALA A 94 78.902 33.074 14.865 1.00 0.00 C ATOM 0 H ALA A 94 76.522 32.281 15.669 1.00 0.00 H new ATOM 0 HA ALA A 94 78.831 33.628 16.930 1.00 0.00 H new ATOM 0 HB1 ALA A 94 79.670 33.805 14.610 1.00 0.00 H new ATOM 0 HB2 ALA A 94 79.371 32.113 15.077 1.00 0.00 H new ATOM 0 HB3 ALA A 94 78.213 32.964 14.028 1.00 0.00 H new ATOM 1532 N PRO A 95 78.387 35.964 15.909 1.00 0.00 N ATOM 1533 CA PRO A 95 77.962 37.351 15.695 1.00 0.00 C ATOM 1534 C PRO A 95 77.587 37.624 14.242 1.00 0.00 C ATOM 1535 O PRO A 95 78.397 38.131 13.466 1.00 0.00 O ATOM 1536 CB PRO A 95 79.196 38.165 16.090 1.00 0.00 C ATOM 1537 CG PRO A 95 80.344 37.239 15.883 1.00 0.00 C ATOM 1538 CD PRO A 95 79.827 35.862 16.198 1.00 0.00 C ATOM 0 HA PRO A 95 77.070 37.597 16.271 1.00 0.00 H new ATOM 0 HB2 PRO A 95 79.293 39.060 15.475 1.00 0.00 H new ATOM 0 HB3 PRO A 95 79.137 38.496 17.127 1.00 0.00 H new ATOM 0 HG2 PRO A 95 80.709 37.294 14.858 1.00 0.00 H new ATOM 0 HG3 PRO A 95 81.179 37.501 16.533 1.00 0.00 H new ATOM 0 HD2 PRO A 95 80.308 35.102 15.582 1.00 0.00 H new ATOM 0 HD3 PRO A 95 80.010 35.592 17.238 1.00 0.00 H new ATOM 1546 N VAL A 96 76.354 37.284 13.880 1.00 0.00 N ATOM 1547 CA VAL A 96 75.871 37.494 12.521 1.00 0.00 C ATOM 1548 C VAL A 96 74.637 38.390 12.508 1.00 0.00 C ATOM 1549 O VAL A 96 73.908 38.499 13.494 1.00 0.00 O ATOM 1550 CB VAL A 96 75.529 36.159 11.833 1.00 0.00 C ATOM 1551 CG1 VAL A 96 76.797 35.461 11.364 1.00 0.00 C ATOM 1552 CG2 VAL A 96 74.735 35.264 12.773 1.00 0.00 C ATOM 0 H VAL A 96 75.671 36.862 14.509 1.00 0.00 H new ATOM 0 HA VAL A 96 76.677 37.981 11.972 1.00 0.00 H new ATOM 0 HB VAL A 96 74.912 36.367 10.959 1.00 0.00 H new ATOM 0 HG11 VAL A 96 76.536 34.520 10.880 1.00 0.00 H new ATOM 0 HG12 VAL A 96 77.323 36.100 10.655 1.00 0.00 H new ATOM 0 HG13 VAL A 96 77.441 35.263 12.221 1.00 0.00 H new ATOM 0 HG21 VAL A 96 74.502 34.325 12.271 1.00 0.00 H new ATOM 0 HG22 VAL A 96 75.325 35.061 13.667 1.00 0.00 H new ATOM 0 HG23 VAL A 96 73.809 35.764 13.056 1.00 0.00 H new ATOM 1562 N PRO A 97 74.394 39.047 11.364 1.00 0.00 N ATOM 1563 CA PRO A 97 73.248 39.944 11.194 1.00 0.00 C ATOM 1564 C PRO A 97 71.922 39.190 11.157 1.00 0.00 C ATOM 1565 O PRO A 97 71.840 38.091 10.610 1.00 0.00 O ATOM 1566 CB PRO A 97 73.519 40.616 9.846 1.00 0.00 C ATOM 1567 CG PRO A 97 74.379 39.649 9.107 1.00 0.00 C ATOM 1568 CD PRO A 97 75.221 38.964 10.148 1.00 0.00 C ATOM 0 HA PRO A 97 73.153 40.645 12.023 1.00 0.00 H new ATOM 0 HB2 PRO A 97 72.592 40.813 9.308 1.00 0.00 H new ATOM 0 HB3 PRO A 97 74.022 41.574 9.975 1.00 0.00 H new ATOM 0 HG2 PRO A 97 73.773 38.928 8.559 1.00 0.00 H new ATOM 0 HG3 PRO A 97 75.004 40.162 8.376 1.00 0.00 H new ATOM 0 HD2 PRO A 97 75.434 37.930 9.876 1.00 0.00 H new ATOM 0 HD3 PRO A 97 76.181 39.463 10.280 1.00 0.00 H new ATOM 1576 N GLN A 98 70.890 39.789 11.740 1.00 0.00 N ATOM 1577 CA GLN A 98 69.568 39.173 11.773 1.00 0.00 C ATOM 1578 C GLN A 98 68.998 39.033 10.365 1.00 0.00 C ATOM 1579 O GLN A 98 68.254 38.096 10.078 1.00 0.00 O ATOM 1580 CB GLN A 98 68.618 39.999 12.641 1.00 0.00 C ATOM 1581 CG GLN A 98 68.487 41.446 12.192 1.00 0.00 C ATOM 1582 CD GLN A 98 67.524 42.239 13.053 1.00 0.00 C ATOM 1583 OE1 GLN A 98 67.249 41.874 14.196 1.00 0.00 O ATOM 1584 NE2 GLN A 98 67.004 43.332 12.507 1.00 0.00 N ATOM 0 H GLN A 98 70.943 40.700 12.196 1.00 0.00 H new ATOM 0 HA GLN A 98 69.669 38.177 12.205 1.00 0.00 H new ATOM 0 HB2 GLN A 98 67.632 39.533 12.631 1.00 0.00 H new ATOM 0 HB3 GLN A 98 68.970 39.978 13.672 1.00 0.00 H new ATOM 0 HG2 GLN A 98 69.468 41.921 12.219 1.00 0.00 H new ATOM 0 HG3 GLN A 98 68.148 41.472 11.156 1.00 0.00 H new ATOM 0 HE21 GLN A 98 67.259 43.598 11.556 1.00 0.00 H new ATOM 0 HE22 GLN A 98 66.349 43.906 13.039 1.00 0.00 H new ATOM 1593 N GLU A 99 69.353 39.971 9.492 1.00 0.00 N ATOM 1594 CA GLU A 99 68.875 39.951 8.115 1.00 0.00 C ATOM 1595 C GLU A 99 69.217 38.626 7.439 1.00 0.00 C ATOM 1596 O GLU A 99 68.518 38.183 6.527 1.00 0.00 O ATOM 1597 CB GLU A 99 69.482 41.112 7.324 1.00 0.00 C ATOM 1598 CG GLU A 99 71.002 41.117 7.321 1.00 0.00 C ATOM 1599 CD GLU A 99 71.580 41.622 6.014 1.00 0.00 C ATOM 1600 OE1 GLU A 99 70.844 42.287 5.256 1.00 0.00 O ATOM 1601 OE2 GLU A 99 72.771 41.352 5.749 1.00 0.00 O ATOM 0 H GLU A 99 69.969 40.753 9.714 1.00 0.00 H new ATOM 0 HA GLU A 99 67.791 40.060 8.132 1.00 0.00 H new ATOM 0 HB2 GLU A 99 69.125 41.066 6.295 1.00 0.00 H new ATOM 0 HB3 GLU A 99 69.125 42.053 7.743 1.00 0.00 H new ATOM 0 HG2 GLU A 99 71.361 41.742 8.139 1.00 0.00 H new ATOM 0 HG3 GLU A 99 71.365 40.107 7.509 1.00 0.00 H new ATOM 1608 N LEU A 100 70.297 38.000 7.892 1.00 0.00 N ATOM 1609 CA LEU A 100 70.734 36.726 7.332 1.00 0.00 C ATOM 1610 C LEU A 100 69.771 35.605 7.710 1.00 0.00 C ATOM 1611 O LEU A 100 69.473 34.728 6.899 1.00 0.00 O ATOM 1612 CB LEU A 100 72.144 36.388 7.820 1.00 0.00 C ATOM 1613 CG LEU A 100 73.274 36.608 6.813 1.00 0.00 C ATOM 1614 CD1 LEU A 100 73.205 38.012 6.232 1.00 0.00 C ATOM 1615 CD2 LEU A 100 74.626 36.365 7.468 1.00 0.00 C ATOM 0 H LEU A 100 70.886 38.354 8.646 1.00 0.00 H new ATOM 0 HA LEU A 100 70.745 36.820 6.246 1.00 0.00 H new ATOM 0 HB2 LEU A 100 72.353 36.986 8.707 1.00 0.00 H new ATOM 0 HB3 LEU A 100 72.159 35.343 8.130 1.00 0.00 H new ATOM 0 HG LEU A 100 73.154 35.894 5.998 1.00 0.00 H new ATOM 0 HD11 LEU A 100 74.017 38.150 5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 100 72.249 38.150 5.727 1.00 0.00 H new ATOM 0 HD13 LEU A 100 73.300 38.743 7.035 1.00 0.00 H new ATOM 0 HD21 LEU A 100 75.419 36.526 6.737 1.00 0.00 H new ATOM 0 HD22 LEU A 100 74.756 37.055 8.302 1.00 0.00 H new ATOM 0 HD23 LEU A 100 74.674 35.340 7.835 1.00 0.00 H new ATOM 1627 N LEU A 101 69.285 35.643 8.946 1.00 0.00 N ATOM 1628 CA LEU A 101 68.352 34.631 9.432 1.00 0.00 C ATOM 1629 C LEU A 101 66.961 34.845 8.842 1.00 0.00 C ATOM 1630 O LEU A 101 66.189 33.898 8.688 1.00 0.00 O ATOM 1631 CB LEU A 101 68.282 34.666 10.959 1.00 0.00 C ATOM 1632 CG LEU A 101 69.587 34.369 11.698 1.00 0.00 C ATOM 1633 CD1 LEU A 101 70.548 33.608 10.798 1.00 0.00 C ATOM 1634 CD2 LEU A 101 70.225 35.658 12.194 1.00 0.00 C ATOM 0 H LEU A 101 69.521 36.362 9.629 1.00 0.00 H new ATOM 0 HA LEU A 101 68.715 33.654 9.114 1.00 0.00 H new ATOM 0 HB2 LEU A 101 67.931 35.652 11.264 1.00 0.00 H new ATOM 0 HB3 LEU A 101 67.531 33.946 11.285 1.00 0.00 H new ATOM 0 HG LEU A 101 69.359 33.745 12.562 1.00 0.00 H new ATOM 0 HD11 LEU A 101 71.471 33.405 11.341 1.00 0.00 H new ATOM 0 HD12 LEU A 101 70.092 32.666 10.493 1.00 0.00 H new ATOM 0 HD13 LEU A 101 70.770 34.206 9.915 1.00 0.00 H new ATOM 0 HD21 LEU A 101 71.153 35.427 12.717 1.00 0.00 H new ATOM 0 HD22 LEU A 101 70.439 36.308 11.346 1.00 0.00 H new ATOM 0 HD23 LEU A 101 69.541 36.164 12.875 1.00 0.00 H new ATOM 1646 N ASP A 102 66.650 36.094 8.512 1.00 0.00 N ATOM 1647 CA ASP A 102 65.353 36.431 7.936 1.00 0.00 C ATOM 1648 C ASP A 102 65.279 36.000 6.475 1.00 0.00 C ATOM 1649 O ASP A 102 64.245 35.518 6.012 1.00 0.00 O ATOM 1650 CB ASP A 102 65.097 37.935 8.050 1.00 0.00 C ATOM 1651 CG ASP A 102 63.786 38.349 7.412 1.00 0.00 C ATOM 1652 OD1 ASP A 102 62.810 37.573 7.503 1.00 0.00 O ATOM 1653 OD2 ASP A 102 63.734 39.448 6.822 1.00 0.00 O ATOM 0 H ASP A 102 67.277 36.889 8.633 1.00 0.00 H new ATOM 0 HA ASP A 102 64.585 35.895 8.494 1.00 0.00 H new ATOM 0 HB2 ASP A 102 65.092 38.221 9.102 1.00 0.00 H new ATOM 0 HB3 ASP A 102 65.915 38.477 7.576 1.00 0.00 H new ATOM 1658 N ARG A 103 66.381 36.176 5.754 1.00 0.00 N ATOM 1659 CA ARG A 103 66.440 35.808 4.345 1.00 0.00 C ATOM 1660 C ARG A 103 66.446 34.291 4.180 1.00 0.00 C ATOM 1661 O ARG A 103 65.765 33.748 3.310 1.00 0.00 O ATOM 1662 CB ARG A 103 67.686 36.407 3.690 1.00 0.00 C ATOM 1663 CG ARG A 103 68.985 35.997 4.364 1.00 0.00 C ATOM 1664 CD ARG A 103 70.185 36.672 3.717 1.00 0.00 C ATOM 1665 NE ARG A 103 70.052 38.127 3.702 1.00 0.00 N ATOM 1666 CZ ARG A 103 70.752 38.920 2.899 1.00 0.00 C ATOM 1667 NH1 ARG A 103 71.629 38.402 2.050 1.00 0.00 N ATOM 1668 NH2 ARG A 103 70.575 40.234 2.943 1.00 0.00 N ATOM 0 H ARG A 103 67.246 36.572 6.123 1.00 0.00 H new ATOM 0 HA ARG A 103 65.553 36.207 3.854 1.00 0.00 H new ATOM 0 HB2 ARG A 103 67.718 36.103 2.644 1.00 0.00 H new ATOM 0 HB3 ARG A 103 67.607 37.494 3.704 1.00 0.00 H new ATOM 0 HG2 ARG A 103 68.946 36.258 5.422 1.00 0.00 H new ATOM 0 HG3 ARG A 103 69.100 34.915 4.307 1.00 0.00 H new ATOM 0 HD2 ARG A 103 71.091 36.396 4.257 1.00 0.00 H new ATOM 0 HD3 ARG A 103 70.299 36.308 2.696 1.00 0.00 H new ATOM 0 HE ARG A 103 69.385 38.557 4.343 1.00 0.00 H new ATOM 0 HH11 ARG A 103 71.767 37.392 2.013 1.00 0.00 H new ATOM 0 HH12 ARG A 103 72.165 39.013 1.434 1.00 0.00 H new ATOM 0 HH21 ARG A 103 69.901 40.636 3.594 1.00 0.00 H new ATOM 0 HH22 ARG A 103 71.113 40.842 2.326 1.00 0.00 H new ATOM 1682 N VAL A 104 67.220 33.612 5.021 1.00 0.00 N ATOM 1683 CA VAL A 104 67.315 32.158 4.969 1.00 0.00 C ATOM 1684 C VAL A 104 65.990 31.507 5.351 1.00 0.00 C ATOM 1685 O VAL A 104 65.580 30.510 4.755 1.00 0.00 O ATOM 1686 CB VAL A 104 68.421 31.634 5.903 1.00 0.00 C ATOM 1687 CG1 VAL A 104 69.773 32.205 5.504 1.00 0.00 C ATOM 1688 CG2 VAL A 104 68.098 31.969 7.351 1.00 0.00 C ATOM 0 H VAL A 104 67.790 34.046 5.747 1.00 0.00 H new ATOM 0 HA VAL A 104 67.563 31.893 3.941 1.00 0.00 H new ATOM 0 HB VAL A 104 68.469 30.549 5.807 1.00 0.00 H new ATOM 0 HG11 VAL A 104 70.542 31.823 6.176 1.00 0.00 H new ATOM 0 HG12 VAL A 104 70.005 31.909 4.481 1.00 0.00 H new ATOM 0 HG13 VAL A 104 69.742 33.293 5.569 1.00 0.00 H new ATOM 0 HG21 VAL A 104 68.890 31.591 7.997 1.00 0.00 H new ATOM 0 HG22 VAL A 104 68.021 33.050 7.466 1.00 0.00 H new ATOM 0 HG23 VAL A 104 67.151 31.506 7.629 1.00 0.00 H new ATOM 1698 N LEU A 105 65.324 32.077 6.350 1.00 0.00 N ATOM 1699 CA LEU A 105 64.044 31.552 6.813 1.00 0.00 C ATOM 1700 C LEU A 105 62.950 31.793 5.777 1.00 0.00 C ATOM 1701 O LEU A 105 62.247 30.867 5.376 1.00 0.00 O ATOM 1702 CB LEU A 105 63.656 32.202 8.142 1.00 0.00 C ATOM 1703 CG LEU A 105 64.401 31.698 9.379 1.00 0.00 C ATOM 1704 CD1 LEU A 105 64.051 32.542 10.594 1.00 0.00 C ATOM 1705 CD2 LEU A 105 64.078 30.233 9.635 1.00 0.00 C ATOM 0 H LEU A 105 65.649 32.902 6.854 1.00 0.00 H new ATOM 0 HA LEU A 105 64.150 30.477 6.958 1.00 0.00 H new ATOM 0 HB2 LEU A 105 63.817 33.277 8.058 1.00 0.00 H new ATOM 0 HB3 LEU A 105 62.588 32.051 8.299 1.00 0.00 H new ATOM 0 HG LEU A 105 65.472 31.788 9.196 1.00 0.00 H new ATOM 0 HD11 LEU A 105 64.591 32.168 11.464 1.00 0.00 H new ATOM 0 HD12 LEU A 105 64.333 33.579 10.410 1.00 0.00 H new ATOM 0 HD13 LEU A 105 62.979 32.485 10.780 1.00 0.00 H new ATOM 0 HD21 LEU A 105 64.617 29.891 10.519 1.00 0.00 H new ATOM 0 HD22 LEU A 105 63.006 30.120 9.797 1.00 0.00 H new ATOM 0 HD23 LEU A 105 64.380 29.638 8.773 1.00 0.00 H new ATOM 1717 N ALA A 106 62.815 33.043 5.347 1.00 0.00 N ATOM 1718 CA ALA A 106 61.810 33.405 4.355 1.00 0.00 C ATOM 1719 C ALA A 106 62.025 32.642 3.053 1.00 0.00 C ATOM 1720 O ALA A 106 61.074 32.146 2.449 1.00 0.00 O ATOM 1721 CB ALA A 106 61.836 34.905 4.101 1.00 0.00 C ATOM 0 H ALA A 106 63.389 33.822 5.670 1.00 0.00 H new ATOM 0 HA ALA A 106 60.831 33.131 4.748 1.00 0.00 H new ATOM 0 HB1 ALA A 106 61.081 35.161 3.358 1.00 0.00 H new ATOM 0 HB2 ALA A 106 61.626 35.435 5.030 1.00 0.00 H new ATOM 0 HB3 ALA A 106 62.820 35.195 3.733 1.00 0.00 H new ATOM 1727 N ALA A 107 63.280 32.552 2.625 1.00 0.00 N ATOM 1728 CA ALA A 107 63.619 31.848 1.394 1.00 0.00 C ATOM 1729 C ALA A 107 63.377 30.349 1.535 1.00 0.00 C ATOM 1730 O ALA A 107 62.978 29.684 0.579 1.00 0.00 O ATOM 1731 CB ALA A 107 65.067 32.118 1.014 1.00 0.00 C ATOM 0 H ALA A 107 64.079 32.958 3.112 1.00 0.00 H new ATOM 0 HA ALA A 107 62.971 32.221 0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 107 65.307 31.586 0.093 1.00 0.00 H new ATOM 0 HB2 ALA A 107 65.210 33.188 0.863 1.00 0.00 H new ATOM 0 HB3 ALA A 107 65.723 31.773 1.813 1.00 0.00 H new ATOM 1737 N GLN A 108 63.621 29.825 2.731 1.00 0.00 N ATOM 1738 CA GLN A 108 63.430 28.404 2.995 1.00 0.00 C ATOM 1739 C GLN A 108 61.973 28.002 2.790 1.00 0.00 C ATOM 1740 O GLN A 108 61.678 27.048 2.071 1.00 0.00 O ATOM 1741 CB GLN A 108 63.869 28.065 4.421 1.00 0.00 C ATOM 1742 CG GLN A 108 63.742 26.589 4.762 1.00 0.00 C ATOM 1743 CD GLN A 108 62.330 26.199 5.153 1.00 0.00 C ATOM 1744 OE1 GLN A 108 61.618 25.549 4.387 1.00 0.00 O ATOM 1745 NE2 GLN A 108 61.916 26.597 6.350 1.00 0.00 N ATOM 0 H GLN A 108 63.951 30.363 3.532 1.00 0.00 H new ATOM 0 HA GLN A 108 64.044 27.844 2.290 1.00 0.00 H new ATOM 0 HB2 GLN A 108 64.906 28.373 4.556 1.00 0.00 H new ATOM 0 HB3 GLN A 108 63.271 28.645 5.124 1.00 0.00 H new ATOM 0 HG2 GLN A 108 64.055 25.994 3.904 1.00 0.00 H new ATOM 0 HG3 GLN A 108 64.421 26.350 5.581 1.00 0.00 H new ATOM 0 HE21 GLN A 108 62.539 27.134 6.953 1.00 0.00 H new ATOM 0 HE22 GLN A 108 60.974 26.366 6.667 1.00 0.00 H new ATOM 1754 N ALA A 109 61.067 28.737 3.426 1.00 0.00 N ATOM 1755 CA ALA A 109 59.641 28.459 3.312 1.00 0.00 C ATOM 1756 C ALA A 109 59.115 28.844 1.933 1.00 0.00 C ATOM 1757 O ALA A 109 58.158 28.251 1.436 1.00 0.00 O ATOM 1758 CB ALA A 109 58.871 29.196 4.397 1.00 0.00 C ATOM 0 H ALA A 109 61.295 29.530 4.026 1.00 0.00 H new ATOM 0 HA ALA A 109 59.494 27.387 3.442 1.00 0.00 H new ATOM 0 HB1 ALA A 109 57.807 28.979 4.300 1.00 0.00 H new ATOM 0 HB2 ALA A 109 59.220 28.869 5.377 1.00 0.00 H new ATOM 0 HB3 ALA A 109 59.033 30.269 4.294 1.00 0.00 H new ATOM 1764 N TYR A 110 59.746 29.839 1.321 1.00 0.00 N ATOM 1765 CA TYR A 110 59.340 30.305 0.001 1.00 0.00 C ATOM 1766 C TYR A 110 59.716 29.291 -1.074 1.00 0.00 C ATOM 1767 O TYR A 110 58.925 28.998 -1.971 1.00 0.00 O ATOM 1768 CB TYR A 110 59.988 31.656 -0.308 1.00 0.00 C ATOM 1769 CG TYR A 110 59.153 32.841 0.122 1.00 0.00 C ATOM 1770 CD1 TYR A 110 58.486 32.839 1.341 1.00 0.00 C ATOM 1771 CD2 TYR A 110 59.030 33.961 -0.690 1.00 0.00 C ATOM 1772 CE1 TYR A 110 57.721 33.919 1.738 1.00 0.00 C ATOM 1773 CE2 TYR A 110 58.269 35.046 -0.300 1.00 0.00 C ATOM 1774 CZ TYR A 110 57.616 35.020 0.914 1.00 0.00 C ATOM 1775 OH TYR A 110 56.855 36.098 1.306 1.00 0.00 O ATOM 0 H TYR A 110 60.541 30.339 1.718 1.00 0.00 H new ATOM 0 HA TYR A 110 58.256 30.421 0.003 1.00 0.00 H new ATOM 0 HB2 TYR A 110 60.957 31.706 0.188 1.00 0.00 H new ATOM 0 HB3 TYR A 110 60.174 31.723 -1.380 1.00 0.00 H new ATOM 0 HD1 TYR A 110 58.567 31.979 1.989 1.00 0.00 H new ATOM 0 HD2 TYR A 110 59.538 33.984 -1.643 1.00 0.00 H new ATOM 0 HE1 TYR A 110 57.208 33.901 2.688 1.00 0.00 H new ATOM 0 HE2 TYR A 110 58.186 35.910 -0.943 1.00 0.00 H new ATOM 0 HH TYR A 110 56.887 36.790 0.613 1.00 0.00 H new ATOM 1785 N TRP A 111 60.928 28.757 -0.976 1.00 0.00 N ATOM 1786 CA TRP A 111 61.410 27.773 -1.940 1.00 0.00 C ATOM 1787 C TRP A 111 60.689 26.441 -1.764 1.00 0.00 C ATOM 1788 O TRP A 111 60.687 25.603 -2.666 1.00 0.00 O ATOM 1789 CB TRP A 111 62.919 27.575 -1.786 1.00 0.00 C ATOM 1790 CG TRP A 111 63.726 28.703 -2.353 1.00 0.00 C ATOM 1791 CD1 TRP A 111 64.712 29.405 -1.719 1.00 0.00 C ATOM 1792 CD2 TRP A 111 63.616 29.261 -3.667 1.00 0.00 C ATOM 1793 NE1 TRP A 111 65.221 30.365 -2.560 1.00 0.00 N ATOM 1794 CE2 TRP A 111 64.566 30.297 -3.761 1.00 0.00 C ATOM 1795 CE3 TRP A 111 62.808 28.986 -4.773 1.00 0.00 C ATOM 1796 CZ2 TRP A 111 64.727 31.056 -4.917 1.00 0.00 C ATOM 1797 CZ3 TRP A 111 62.969 29.740 -5.920 1.00 0.00 C ATOM 1798 CH2 TRP A 111 63.923 30.764 -5.985 1.00 0.00 C ATOM 0 H TRP A 111 61.595 28.988 -0.240 1.00 0.00 H new ATOM 0 HA TRP A 111 61.201 28.149 -2.942 1.00 0.00 H new ATOM 0 HB2 TRP A 111 63.158 27.463 -0.728 1.00 0.00 H new ATOM 0 HB3 TRP A 111 63.209 26.647 -2.279 1.00 0.00 H new ATOM 0 HD1 TRP A 111 65.043 29.231 -0.706 1.00 0.00 H new ATOM 0 HE1 TRP A 111 65.966 31.022 -2.328 1.00 0.00 H new ATOM 0 HE3 TRP A 111 62.071 28.198 -4.732 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 65.460 31.847 -4.969 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 62.349 29.536 -6.781 1.00 0.00 H new ATOM 0 HH2 TRP A 111 64.026 31.334 -6.896 1.00 0.00 H new ATOM 1809 N SER A 112 60.078 26.252 -0.599 1.00 0.00 N ATOM 1810 CA SER A 112 59.357 25.019 -0.305 1.00 0.00 C ATOM 1811 C SER A 112 58.216 24.808 -1.295 1.00 0.00 C ATOM 1812 O SER A 112 57.194 25.492 -1.236 1.00 0.00 O ATOM 1813 CB SER A 112 58.810 25.052 1.123 1.00 0.00 C ATOM 1814 OG SER A 112 58.740 23.748 1.673 1.00 0.00 O ATOM 0 H SER A 112 60.068 26.937 0.157 1.00 0.00 H new ATOM 0 HA SER A 112 60.055 24.187 -0.400 1.00 0.00 H new ATOM 0 HB2 SER A 112 59.448 25.679 1.746 1.00 0.00 H new ATOM 0 HB3 SER A 112 57.818 25.505 1.126 1.00 0.00 H new ATOM 0 HG SER A 112 58.389 23.797 2.587 1.00 0.00 H new ATOM 1820 N VAL A 113 58.398 23.856 -2.204 1.00 0.00 N ATOM 1821 CA VAL A 113 57.384 23.553 -3.207 1.00 0.00 C ATOM 1822 C VAL A 113 56.793 22.165 -2.989 1.00 0.00 C ATOM 1823 O VAL A 113 55.595 21.953 -3.173 1.00 0.00 O ATOM 1824 CB VAL A 113 57.962 23.634 -4.633 1.00 0.00 C ATOM 1825 CG1 VAL A 113 59.171 22.721 -4.772 1.00 0.00 C ATOM 1826 CG2 VAL A 113 56.897 23.283 -5.660 1.00 0.00 C ATOM 0 H VAL A 113 59.238 23.281 -2.267 1.00 0.00 H new ATOM 0 HA VAL A 113 56.599 24.301 -3.098 1.00 0.00 H new ATOM 0 HB VAL A 113 58.287 24.658 -4.817 1.00 0.00 H new ATOM 0 HG11 VAL A 113 59.566 22.792 -5.786 1.00 0.00 H new ATOM 0 HG12 VAL A 113 59.940 23.025 -4.061 1.00 0.00 H new ATOM 0 HG13 VAL A 113 58.875 21.692 -4.569 1.00 0.00 H new ATOM 0 HG21 VAL A 113 57.323 23.345 -6.661 1.00 0.00 H new ATOM 0 HG22 VAL A 113 56.539 22.269 -5.481 1.00 0.00 H new ATOM 0 HG23 VAL A 113 56.065 23.982 -5.575 1.00 0.00 H new ATOM 1836 N ASP A 114 57.642 21.222 -2.594 1.00 0.00 N ATOM 1837 CA ASP A 114 57.204 19.853 -2.349 1.00 0.00 C ATOM 1838 C ASP A 114 58.233 19.094 -1.516 1.00 0.00 C ATOM 1839 O ASP A 114 59.413 19.445 -1.498 1.00 0.00 O ATOM 1840 CB ASP A 114 56.965 19.126 -3.673 1.00 0.00 C ATOM 1841 CG ASP A 114 58.240 18.542 -4.251 1.00 0.00 C ATOM 1842 OD1 ASP A 114 59.169 19.322 -4.546 1.00 0.00 O ATOM 1843 OD2 ASP A 114 58.308 17.305 -4.406 1.00 0.00 O ATOM 0 H ASP A 114 58.637 21.381 -2.437 1.00 0.00 H new ATOM 0 HA ASP A 114 56.268 19.892 -1.791 1.00 0.00 H new ATOM 0 HB2 ASP A 114 56.240 18.327 -3.520 1.00 0.00 H new ATOM 0 HB3 ASP A 114 56.528 19.820 -4.391 1.00 0.00 H new ATOM 1848 N SER A 115 57.777 18.054 -0.826 1.00 0.00 N ATOM 1849 CA SER A 115 58.656 17.249 0.014 1.00 0.00 C ATOM 1850 C SER A 115 59.383 16.194 -0.816 1.00 0.00 C ATOM 1851 O SER A 115 58.916 15.063 -0.949 1.00 0.00 O ATOM 1852 CB SER A 115 57.855 16.574 1.128 1.00 0.00 C ATOM 1853 OG SER A 115 56.905 15.667 0.596 1.00 0.00 O ATOM 0 H SER A 115 56.804 17.749 -0.832 1.00 0.00 H new ATOM 0 HA SER A 115 59.398 17.911 0.460 1.00 0.00 H new ATOM 0 HB2 SER A 115 58.533 16.044 1.798 1.00 0.00 H new ATOM 0 HB3 SER A 115 57.345 17.331 1.724 1.00 0.00 H new ATOM 0 HG SER A 115 57.339 15.090 -0.066 1.00 0.00 H new ATOM 1859 N SER A 116 60.530 16.574 -1.371 1.00 0.00 N ATOM 1860 CA SER A 116 61.321 15.664 -2.191 1.00 0.00 C ATOM 1861 C SER A 116 62.812 15.861 -1.937 1.00 0.00 C ATOM 1862 O SER A 116 63.291 16.989 -1.826 1.00 0.00 O ATOM 1863 CB SER A 116 61.011 15.880 -3.673 1.00 0.00 C ATOM 1864 OG SER A 116 59.823 15.207 -4.050 1.00 0.00 O ATOM 0 H SER A 116 60.932 17.506 -1.268 1.00 0.00 H new ATOM 0 HA SER A 116 61.056 14.643 -1.917 1.00 0.00 H new ATOM 0 HB2 SER A 116 60.908 16.946 -3.874 1.00 0.00 H new ATOM 0 HB3 SER A 116 61.844 15.521 -4.278 1.00 0.00 H new ATOM 0 HG SER A 116 59.053 15.796 -3.904 1.00 0.00 H new ATOM 1870 N GLY A 117 63.542 14.753 -1.846 1.00 0.00 N ATOM 1871 CA GLY A 117 64.971 14.824 -1.605 1.00 0.00 C ATOM 1872 C GLY A 117 65.411 13.938 -0.456 1.00 0.00 C ATOM 1873 O GLY A 117 64.609 13.593 0.412 1.00 0.00 O ATOM 0 H GLY A 117 63.169 13.808 -1.935 1.00 0.00 H new ATOM 0 HA2 GLY A 117 65.504 14.531 -2.510 1.00 0.00 H new ATOM 0 HA3 GLY A 117 65.249 15.856 -1.391 1.00 0.00 H new ATOM 1877 N ARG A 118 66.687 13.568 -0.451 1.00 0.00 N ATOM 1878 CA ARG A 118 67.231 12.715 0.598 1.00 0.00 C ATOM 1879 C ARG A 118 68.743 12.570 0.453 1.00 0.00 C ATOM 1880 O ARG A 118 69.316 12.943 -0.571 1.00 0.00 O ATOM 1881 CB ARG A 118 66.570 11.336 0.557 1.00 0.00 C ATOM 1882 CG ARG A 118 66.498 10.655 1.914 1.00 0.00 C ATOM 1883 CD ARG A 118 65.310 9.709 2.000 1.00 0.00 C ATOM 1884 NE ARG A 118 65.401 8.818 3.154 1.00 0.00 N ATOM 1885 CZ ARG A 118 64.686 7.706 3.283 1.00 0.00 C ATOM 1886 NH1 ARG A 118 63.831 7.350 2.334 1.00 0.00 N ATOM 1887 NH2 ARG A 118 64.826 6.948 4.363 1.00 0.00 N ATOM 0 H ARG A 118 67.364 13.846 -1.162 1.00 0.00 H new ATOM 0 HA ARG A 118 67.019 13.184 1.559 1.00 0.00 H new ATOM 0 HB2 ARG A 118 65.561 11.438 0.157 1.00 0.00 H new ATOM 0 HB3 ARG A 118 67.123 10.697 -0.132 1.00 0.00 H new ATOM 0 HG2 ARG A 118 67.419 10.101 2.094 1.00 0.00 H new ATOM 0 HG3 ARG A 118 66.422 11.409 2.697 1.00 0.00 H new ATOM 0 HD2 ARG A 118 64.389 10.289 2.062 1.00 0.00 H new ATOM 0 HD3 ARG A 118 65.253 9.115 1.088 1.00 0.00 H new ATOM 0 HE ARG A 118 66.049 9.063 3.902 1.00 0.00 H new ATOM 0 HH11 ARG A 118 63.721 7.931 1.503 1.00 0.00 H new ATOM 0 HH12 ARG A 118 63.283 6.496 2.435 1.00 0.00 H new ATOM 0 HH21 ARG A 118 65.483 7.219 5.095 1.00 0.00 H new ATOM 0 HH22 ARG A 118 64.277 6.094 4.462 1.00 0.00 H new ATOM 1901 N ILE A 119 69.382 12.027 1.483 1.00 0.00 N ATOM 1902 CA ILE A 119 70.827 11.834 1.469 1.00 0.00 C ATOM 1903 C ILE A 119 71.250 10.932 0.314 1.00 0.00 C ATOM 1904 O ILE A 119 71.191 9.707 0.415 1.00 0.00 O ATOM 1905 CB ILE A 119 71.326 11.222 2.792 1.00 0.00 C ATOM 1906 CG1 ILE A 119 70.885 12.085 3.976 1.00 0.00 C ATOM 1907 CG2 ILE A 119 72.840 11.076 2.770 1.00 0.00 C ATOM 1908 CD1 ILE A 119 71.457 13.485 3.949 1.00 0.00 C ATOM 0 H ILE A 119 68.922 11.713 2.338 1.00 0.00 H new ATOM 0 HA ILE A 119 71.276 12.819 1.341 1.00 0.00 H new ATOM 0 HB ILE A 119 70.887 10.231 2.906 1.00 0.00 H new ATOM 0 HG12 ILE A 119 69.797 12.146 3.985 1.00 0.00 H new ATOM 0 HG13 ILE A 119 71.185 11.596 4.903 1.00 0.00 H new ATOM 0 HG21 ILE A 119 73.177 10.642 3.711 1.00 0.00 H new ATOM 0 HG22 ILE A 119 73.131 10.425 1.946 1.00 0.00 H new ATOM 0 HG23 ILE A 119 73.298 12.056 2.637 1.00 0.00 H new ATOM 0 HD11 ILE A 119 71.102 14.040 4.818 1.00 0.00 H new ATOM 0 HD12 ILE A 119 72.546 13.434 3.971 1.00 0.00 H new ATOM 0 HD13 ILE A 119 71.136 13.992 3.039 1.00 0.00 H new ATOM 1920 N VAL A 120 71.677 11.548 -0.784 1.00 0.00 N ATOM 1921 CA VAL A 120 72.113 10.802 -1.958 1.00 0.00 C ATOM 1922 C VAL A 120 73.118 11.604 -2.777 1.00 0.00 C ATOM 1923 O VAL A 120 72.916 12.790 -3.042 1.00 0.00 O ATOM 1924 CB VAL A 120 70.921 10.423 -2.857 1.00 0.00 C ATOM 1925 CG1 VAL A 120 70.268 11.671 -3.431 1.00 0.00 C ATOM 1926 CG2 VAL A 120 71.369 9.486 -3.968 1.00 0.00 C ATOM 0 H VAL A 120 71.730 12.562 -0.885 1.00 0.00 H new ATOM 0 HA VAL A 120 72.589 9.891 -1.595 1.00 0.00 H new ATOM 0 HB VAL A 120 70.181 9.901 -2.250 1.00 0.00 H new ATOM 0 HG11 VAL A 120 69.428 11.384 -4.063 1.00 0.00 H new ATOM 0 HG12 VAL A 120 69.911 12.302 -2.617 1.00 0.00 H new ATOM 0 HG13 VAL A 120 70.997 12.223 -4.024 1.00 0.00 H new ATOM 0 HG21 VAL A 120 70.514 9.228 -4.594 1.00 0.00 H new ATOM 0 HG22 VAL A 120 72.128 9.979 -4.576 1.00 0.00 H new ATOM 0 HG23 VAL A 120 71.786 8.578 -3.532 1.00 0.00 H new ATOM 1936 N THR A 121 74.204 10.950 -3.177 1.00 0.00 N ATOM 1937 CA THR A 121 75.242 11.602 -3.966 1.00 0.00 C ATOM 1938 C THR A 121 75.263 11.070 -5.394 1.00 0.00 C ATOM 1939 O THR A 121 75.315 11.841 -6.354 1.00 0.00 O ATOM 1940 CB THR A 121 76.634 11.403 -3.336 1.00 0.00 C ATOM 1941 OG1 THR A 121 76.529 11.392 -1.908 1.00 0.00 O ATOM 1942 CG2 THR A 121 77.587 12.507 -3.771 1.00 0.00 C ATOM 0 H THR A 121 74.388 9.969 -2.967 1.00 0.00 H new ATOM 0 HA THR A 121 75.006 12.666 -3.981 1.00 0.00 H new ATOM 0 HB THR A 121 77.030 10.447 -3.678 1.00 0.00 H new ATOM 0 HG1 THR A 121 77.418 11.263 -1.516 1.00 0.00 H new ATOM 0 HG21 THR A 121 78.563 12.346 -3.314 1.00 0.00 H new ATOM 0 HG22 THR A 121 77.688 12.494 -4.856 1.00 0.00 H new ATOM 0 HG23 THR A 121 77.193 13.473 -3.455 1.00 0.00 H new ATOM 1950 N LEU A 122 75.221 9.749 -5.529 1.00 0.00 N ATOM 1951 CA LEU A 122 75.234 9.114 -6.842 1.00 0.00 C ATOM 1952 C LEU A 122 73.958 8.310 -7.071 1.00 0.00 C ATOM 1953 O LEU A 122 73.512 7.571 -6.193 1.00 0.00 O ATOM 1954 CB LEU A 122 76.455 8.203 -6.978 1.00 0.00 C ATOM 1955 CG LEU A 122 76.984 7.995 -8.398 1.00 0.00 C ATOM 1956 CD1 LEU A 122 75.930 7.327 -9.267 1.00 0.00 C ATOM 1957 CD2 LEU A 122 77.416 9.322 -9.005 1.00 0.00 C ATOM 0 H LEU A 122 75.178 9.097 -4.746 1.00 0.00 H new ATOM 0 HA LEU A 122 75.288 9.899 -7.597 1.00 0.00 H new ATOM 0 HB2 LEU A 122 77.260 8.615 -6.369 1.00 0.00 H new ATOM 0 HB3 LEU A 122 76.204 7.228 -6.559 1.00 0.00 H new ATOM 0 HG LEU A 122 77.854 7.340 -8.350 1.00 0.00 H new ATOM 0 HD11 LEU A 122 76.324 7.187 -10.274 1.00 0.00 H new ATOM 0 HD12 LEU A 122 75.668 6.358 -8.842 1.00 0.00 H new ATOM 0 HD13 LEU A 122 75.041 7.956 -9.309 1.00 0.00 H new ATOM 0 HD21 LEU A 122 77.790 9.155 -10.015 1.00 0.00 H new ATOM 0 HD22 LEU A 122 76.564 10.000 -9.041 1.00 0.00 H new ATOM 0 HD23 LEU A 122 78.205 9.762 -8.394 1.00 0.00 H new TER 1969 LEU A 122