USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 938 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 44 SER OG : rot -85:sc= 0.899 USER MOD Set 1.2: B 144 SER OG : rot 180:sc= 0.812 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0639 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.0217 X(o=-0.022,f=0) USER MOD Single : A 22 MET CE :methyl -176:sc= -0.0315 (180deg=-0.0632) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl -170:sc= -0.0725 (180deg=-0.304) USER MOD Single : A 35 GLN : amide:sc=-0.00699 K(o=-0.007,f=-1.2) USER MOD Single : A 38 GLN : amide:sc= 0.528 K(o=0.53,f=-1.1) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 70:sc= 0.599 USER MOD Single : A 49 LYS NZ :NH3+ -153:sc= 1.32 (180deg=1.09) USER MOD Single : A 52 LYS NZ :NH3+ -170:sc= 2.31 (180deg=1.93) USER MOD Single : A 55 ASN : amide:sc= -0.0951 K(o=-0.095,f=-1.9!) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 60 GLN : amide:sc= 0.453 K(o=0.45,f=-4.2!) USER MOD Single : B 104 SER OG : rot 180:sc= 0 USER MOD Single : B 105 TYR OH : rot 180:sc= 0 USER MOD Single : B 115 SER OG : rot 11:sc= 0.874 USER MOD Single : B 120 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : B 122 MET CE :methyl -160:sc= -0.0872 (180deg=-0.542) USER MOD Single : B 129 SER OG : rot 180:sc= 0 USER MOD Single : B 133 SER OG : rot -70:sc= 0.453 USER MOD Single : B 134 MET CE :methyl -178:sc= -0.0057 (180deg=-0.00949) USER MOD Single : B 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 139 GLN : amide:sc= 0.912 K(o=0.91,f=0) USER MOD Single : B 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 146 THR OG1 : rot 72:sc= 0.852 USER MOD Single : B 149 LYS NZ :NH3+ -142:sc= 1.21 (180deg=1.03) USER MOD Single : B 152 LYS NZ :NH3+ -148:sc= 1.53 (180deg=1.36) USER MOD Single : B 155 ASN : amide:sc=-0.00215 K(o=-0.0021,f=-1.1) USER MOD Single : B 156 GLN : amide:sc= 0.692 K(o=0.69,f=0) USER MOD Single : B 160 GLN : amide:sc= 1.1 K(o=1.1,f=-5.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.545 22.252 1.284 1.00 0.00 N ATOM 2 CA GLY A 1 10.676 21.835 2.406 1.00 0.00 C ATOM 3 C GLY A 1 9.824 20.611 2.062 1.00 0.00 C ATOM 4 O GLY A 1 9.781 20.192 0.899 1.00 0.00 O ATOM 0 H1 GLY A 1 12.542 22.143 1.558 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.348 21.659 0.453 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.357 23.248 1.051 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.293 21.611 3.276 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.023 22.663 2.683 1.00 0.00 H new ATOM 10 N PRO A 2 9.148 20.008 3.063 1.00 0.00 N ATOM 11 CA PRO A 2 8.288 18.829 2.882 1.00 0.00 C ATOM 12 C PRO A 2 7.017 19.130 2.067 1.00 0.00 C ATOM 13 O PRO A 2 6.544 20.273 2.006 1.00 0.00 O ATOM 14 CB PRO A 2 7.946 18.365 4.303 1.00 0.00 C ATOM 15 CG PRO A 2 7.998 19.657 5.119 1.00 0.00 C ATOM 16 CD PRO A 2 9.136 20.431 4.458 1.00 0.00 C ATOM 0 HA PRO A 2 8.802 18.060 2.306 1.00 0.00 H new ATOM 0 HB2 PRO A 2 6.961 17.901 4.348 1.00 0.00 H new ATOM 0 HB3 PRO A 2 8.662 17.629 4.669 1.00 0.00 H new ATOM 0 HG2 PRO A 2 7.056 20.204 5.071 1.00 0.00 H new ATOM 0 HG3 PRO A 2 8.200 19.462 6.172 1.00 0.00 H new ATOM 0 HD2 PRO A 2 8.976 21.506 4.539 1.00 0.00 H new ATOM 0 HD3 PRO A 2 10.089 20.213 4.941 1.00 0.00 H new ATOM 24 N GLY A 3 6.439 18.088 1.463 1.00 0.00 N ATOM 25 CA GLY A 3 5.146 18.148 0.761 1.00 0.00 C ATOM 26 C GLY A 3 3.930 18.238 1.698 1.00 0.00 C ATOM 27 O GLY A 3 4.056 18.178 2.927 1.00 0.00 O ATOM 0 H GLY A 3 6.862 17.160 1.446 1.00 0.00 H new ATOM 0 HA2 GLY A 3 5.145 19.012 0.096 1.00 0.00 H new ATOM 0 HA3 GLY A 3 5.043 17.263 0.133 1.00 0.00 H new ATOM 31 N SER A 4 2.734 18.368 1.115 1.00 0.00 N ATOM 32 CA SER A 4 1.461 18.473 1.848 1.00 0.00 C ATOM 33 C SER A 4 1.164 17.225 2.695 1.00 0.00 C ATOM 34 O SER A 4 1.392 16.088 2.265 1.00 0.00 O ATOM 35 CB SER A 4 0.298 18.702 0.875 1.00 0.00 C ATOM 36 OG SER A 4 0.524 19.872 0.091 1.00 0.00 O ATOM 0 H SER A 4 2.618 18.404 0.102 1.00 0.00 H new ATOM 0 HA SER A 4 1.562 19.324 2.522 1.00 0.00 H new ATOM 0 HB2 SER A 4 0.186 17.836 0.222 1.00 0.00 H new ATOM 0 HB3 SER A 4 -0.634 18.804 1.431 1.00 0.00 H new ATOM 0 HG SER A 4 -0.226 20.003 -0.526 1.00 0.00 H new ATOM 42 N TYR A 5 0.644 17.437 3.908 1.00 0.00 N ATOM 43 CA TYR A 5 0.333 16.379 4.885 1.00 0.00 C ATOM 44 C TYR A 5 -0.912 15.553 4.515 1.00 0.00 C ATOM 45 O TYR A 5 -1.791 16.011 3.784 1.00 0.00 O ATOM 46 CB TYR A 5 0.184 17.008 6.278 1.00 0.00 C ATOM 47 CG TYR A 5 1.388 17.821 6.719 1.00 0.00 C ATOM 48 CD1 TYR A 5 2.593 17.172 7.064 1.00 0.00 C ATOM 49 CD2 TYR A 5 1.323 19.231 6.745 1.00 0.00 C ATOM 50 CE1 TYR A 5 3.722 17.923 7.440 1.00 0.00 C ATOM 51 CE2 TYR A 5 2.453 19.986 7.120 1.00 0.00 C ATOM 52 CZ TYR A 5 3.657 19.335 7.467 1.00 0.00 C ATOM 53 OH TYR A 5 4.748 20.063 7.838 1.00 0.00 O ATOM 0 H TYR A 5 0.421 18.372 4.250 1.00 0.00 H new ATOM 0 HA TYR A 5 1.163 15.673 4.881 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -0.697 17.650 6.283 1.00 0.00 H new ATOM 0 HB3 TYR A 5 0.006 16.216 7.006 1.00 0.00 H new ATOM 0 HD1 TYR A 5 2.649 16.094 7.039 1.00 0.00 H new ATOM 0 HD2 TYR A 5 0.405 19.733 6.477 1.00 0.00 H new ATOM 0 HE1 TYR A 5 4.639 17.420 7.708 1.00 0.00 H new ATOM 0 HE2 TYR A 5 2.398 21.064 7.142 1.00 0.00 H new ATOM 0 HH TYR A 5 4.532 21.018 7.801 1.00 0.00 H new ATOM 63 N ASP A 6 -1.012 14.343 5.073 1.00 0.00 N ATOM 64 CA ASP A 6 -2.100 13.373 4.847 1.00 0.00 C ATOM 65 C ASP A 6 -3.384 13.702 5.652 1.00 0.00 C ATOM 66 O ASP A 6 -3.993 12.825 6.275 1.00 0.00 O ATOM 67 CB ASP A 6 -1.591 11.940 5.108 1.00 0.00 C ATOM 68 CG ASP A 6 -0.329 11.575 4.304 1.00 0.00 C ATOM 69 OD1 ASP A 6 0.527 10.839 4.851 1.00 0.00 O ATOM 70 OD2 ASP A 6 -0.201 11.981 3.122 1.00 0.00 O1- ATOM 0 H ASP A 6 -0.309 13.993 5.724 1.00 0.00 H new ATOM 0 HA ASP A 6 -2.398 13.446 3.801 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -1.379 11.827 6.171 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -2.384 11.232 4.864 1.00 0.00 H new ATOM 75 N ALA A 7 -3.775 14.977 5.688 1.00 0.00 N ATOM 76 CA ALA A 7 -4.822 15.537 6.551 1.00 0.00 C ATOM 77 C ALA A 7 -6.258 15.206 6.074 1.00 0.00 C ATOM 78 O ALA A 7 -6.959 16.059 5.513 1.00 0.00 O ATOM 79 CB ALA A 7 -4.557 17.044 6.695 1.00 0.00 C ATOM 0 H ALA A 7 -3.350 15.684 5.087 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.771 15.066 7.532 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -5.321 17.488 7.333 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -3.575 17.200 7.142 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -4.586 17.514 5.712 1.00 0.00 H new ATOM 85 N ALA A 8 -6.686 13.955 6.286 1.00 0.00 N ATOM 86 CA ALA A 8 -8.002 13.402 5.920 1.00 0.00 C ATOM 87 C ALA A 8 -8.390 13.611 4.435 1.00 0.00 C ATOM 88 O ALA A 8 -9.549 13.897 4.106 1.00 0.00 O ATOM 89 CB ALA A 8 -9.070 13.868 6.925 1.00 0.00 C ATOM 0 H ALA A 8 -6.093 13.261 6.742 1.00 0.00 H new ATOM 0 HA ALA A 8 -7.933 12.317 5.996 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -10.038 13.454 6.645 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -8.804 13.524 7.925 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -9.126 14.957 6.918 1.00 0.00 H new ATOM 95 N LEU A 9 -7.404 13.499 3.535 1.00 0.00 N ATOM 96 CA LEU A 9 -7.572 13.617 2.080 1.00 0.00 C ATOM 97 C LEU A 9 -8.542 12.550 1.510 1.00 0.00 C ATOM 98 O LEU A 9 -8.683 11.470 2.098 1.00 0.00 O ATOM 99 CB LEU A 9 -6.184 13.675 1.395 1.00 0.00 C ATOM 100 CG LEU A 9 -5.143 12.600 1.762 1.00 0.00 C ATOM 101 CD1 LEU A 9 -5.394 11.257 1.082 1.00 0.00 C ATOM 102 CD2 LEU A 9 -3.752 13.078 1.339 1.00 0.00 C ATOM 0 H LEU A 9 -6.438 13.318 3.808 1.00 0.00 H new ATOM 0 HA LEU A 9 -8.068 14.559 1.848 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -6.343 13.630 0.318 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -5.746 14.649 1.612 1.00 0.00 H new ATOM 0 HG LEU A 9 -5.220 12.454 2.839 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -4.625 10.547 1.384 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -6.373 10.878 1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -5.364 11.386 0.000 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -3.013 12.320 1.597 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -3.737 13.247 0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -3.514 14.008 1.856 1.00 0.00 H new ATOM 114 N PRO A 10 -9.267 12.848 0.410 1.00 0.00 N ATOM 115 CA PRO A 10 -10.326 11.980 -0.110 1.00 0.00 C ATOM 116 C PRO A 10 -9.800 10.679 -0.729 1.00 0.00 C ATOM 117 O PRO A 10 -8.620 10.549 -1.073 1.00 0.00 O ATOM 118 CB PRO A 10 -11.088 12.832 -1.133 1.00 0.00 C ATOM 119 CG PRO A 10 -10.021 13.797 -1.642 1.00 0.00 C ATOM 120 CD PRO A 10 -9.188 14.065 -0.392 1.00 0.00 C ATOM 0 HA PRO A 10 -10.971 11.640 0.701 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -11.499 12.223 -1.939 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -11.924 13.360 -0.675 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.424 13.356 -2.440 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -10.459 14.712 -2.040 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -8.155 14.294 -0.653 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -9.575 14.922 0.159 1.00 0.00 H new ATOM 128 N ILE A 11 -10.700 9.708 -0.913 1.00 0.00 N ATOM 129 CA ILE A 11 -10.382 8.388 -1.479 1.00 0.00 C ATOM 130 C ILE A 11 -9.829 8.453 -2.913 1.00 0.00 C ATOM 131 O ILE A 11 -8.961 7.666 -3.286 1.00 0.00 O ATOM 132 CB ILE A 11 -11.604 7.451 -1.378 1.00 0.00 C ATOM 133 CG1 ILE A 11 -11.172 6.000 -1.655 1.00 0.00 C ATOM 134 CG2 ILE A 11 -12.777 7.871 -2.284 1.00 0.00 C ATOM 135 CD1 ILE A 11 -12.218 4.985 -1.196 1.00 0.00 C ATOM 0 H ILE A 11 -11.685 9.816 -0.670 1.00 0.00 H new ATOM 0 HA ILE A 11 -9.573 7.973 -0.878 1.00 0.00 H new ATOM 0 HB ILE A 11 -11.984 7.528 -0.359 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -10.992 5.875 -2.723 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -10.229 5.801 -1.147 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -13.601 7.168 -2.162 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -13.110 8.872 -2.008 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.451 7.871 -3.324 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.866 3.976 -1.413 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -12.380 5.089 -0.123 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -13.155 5.164 -1.724 1.00 0.00 H new ATOM 147 N ASP A 12 -10.260 9.441 -3.704 1.00 0.00 N ATOM 148 CA ASP A 12 -9.744 9.690 -5.054 1.00 0.00 C ATOM 149 C ASP A 12 -8.256 10.097 -5.044 1.00 0.00 C ATOM 150 O ASP A 12 -7.503 9.729 -5.952 1.00 0.00 O ATOM 151 CB ASP A 12 -10.582 10.784 -5.745 1.00 0.00 C ATOM 152 CG ASP A 12 -12.064 10.424 -5.949 1.00 0.00 C ATOM 153 OD1 ASP A 12 -12.908 11.349 -5.980 1.00 0.00 O ATOM 154 OD2 ASP A 12 -12.399 9.225 -6.120 1.00 0.00 O1- ATOM 0 H ASP A 12 -10.986 10.099 -3.421 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.824 8.756 -5.610 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -10.522 11.697 -5.153 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -10.138 11.004 -6.716 1.00 0.00 H new ATOM 159 N GLU A 13 -7.811 10.820 -4.011 1.00 0.00 N ATOM 160 CA GLU A 13 -6.428 11.283 -3.874 1.00 0.00 C ATOM 161 C GLU A 13 -5.489 10.140 -3.464 1.00 0.00 C ATOM 162 O GLU A 13 -4.504 9.887 -4.153 1.00 0.00 O ATOM 163 CB GLU A 13 -6.396 12.464 -2.890 1.00 0.00 C ATOM 164 CG GLU A 13 -5.035 13.156 -2.750 1.00 0.00 C ATOM 165 CD GLU A 13 -4.579 13.953 -3.999 1.00 0.00 C ATOM 166 OE1 GLU A 13 -5.338 14.091 -4.990 1.00 0.00 O ATOM 167 OE2 GLU A 13 -3.440 14.479 -3.979 1.00 0.00 O1- ATOM 0 H GLU A 13 -8.411 11.103 -3.236 1.00 0.00 H new ATOM 0 HA GLU A 13 -6.058 11.630 -4.839 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -7.131 13.203 -3.209 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -6.708 12.108 -1.908 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -5.074 13.835 -1.898 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -4.282 12.402 -2.523 1.00 0.00 H new ATOM 174 N LEU A 14 -5.805 9.390 -2.400 1.00 0.00 N ATOM 175 CA LEU A 14 -4.976 8.250 -1.966 1.00 0.00 C ATOM 176 C LEU A 14 -4.945 7.106 -3.000 1.00 0.00 C ATOM 177 O LEU A 14 -3.919 6.443 -3.155 1.00 0.00 O ATOM 178 CB LEU A 14 -5.376 7.803 -0.550 1.00 0.00 C ATOM 179 CG LEU A 14 -6.789 7.211 -0.407 1.00 0.00 C ATOM 180 CD1 LEU A 14 -6.758 5.685 -0.407 1.00 0.00 C ATOM 181 CD2 LEU A 14 -7.441 7.663 0.894 1.00 0.00 C ATOM 0 H LEU A 14 -6.629 9.550 -1.821 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.940 8.585 -1.909 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.655 7.061 -0.207 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -5.293 8.660 0.118 1.00 0.00 H new ATOM 0 HG LEU A 14 -7.363 7.569 -1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.773 5.300 -0.304 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.328 5.330 -1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.151 5.333 0.427 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.439 7.231 0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -6.836 7.332 1.738 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.515 8.750 0.905 1.00 0.00 H new ATOM 193 N SER A 15 -6.027 6.915 -3.767 1.00 0.00 N ATOM 194 CA SER A 15 -6.072 5.983 -4.908 1.00 0.00 C ATOM 195 C SER A 15 -5.197 6.437 -6.089 1.00 0.00 C ATOM 196 O SER A 15 -4.569 5.610 -6.754 1.00 0.00 O ATOM 197 CB SER A 15 -7.527 5.783 -5.348 1.00 0.00 C ATOM 198 OG SER A 15 -7.641 4.813 -6.375 1.00 0.00 O ATOM 0 H SER A 15 -6.907 7.408 -3.613 1.00 0.00 H new ATOM 0 HA SER A 15 -5.655 5.033 -4.574 1.00 0.00 H new ATOM 0 HB2 SER A 15 -8.126 5.476 -4.491 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.934 6.732 -5.698 1.00 0.00 H new ATOM 0 HG SER A 15 -8.583 4.713 -6.627 1.00 0.00 H new ATOM 204 N ALA A 16 -5.074 7.747 -6.340 1.00 0.00 N ATOM 205 CA ALA A 16 -4.113 8.282 -7.313 1.00 0.00 C ATOM 206 C ALA A 16 -2.657 8.220 -6.817 1.00 0.00 C ATOM 207 O ALA A 16 -1.743 8.039 -7.627 1.00 0.00 O ATOM 208 CB ALA A 16 -4.497 9.725 -7.675 1.00 0.00 C ATOM 0 H ALA A 16 -5.635 8.462 -5.877 1.00 0.00 H new ATOM 0 HA ALA A 16 -4.162 7.650 -8.199 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -3.783 10.121 -8.397 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -5.497 9.738 -8.109 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.484 10.341 -6.776 1.00 0.00 H new ATOM 214 N LEU A 17 -2.402 8.365 -5.512 1.00 0.00 N ATOM 215 CA LEU A 17 -1.051 8.314 -4.928 1.00 0.00 C ATOM 216 C LEU A 17 -0.411 6.930 -5.091 1.00 0.00 C ATOM 217 O LEU A 17 0.736 6.859 -5.532 1.00 0.00 O ATOM 218 CB LEU A 17 -1.097 8.760 -3.454 1.00 0.00 C ATOM 219 CG LEU A 17 -0.635 10.212 -3.231 1.00 0.00 C ATOM 220 CD1 LEU A 17 -1.429 11.266 -3.999 1.00 0.00 C ATOM 221 CD2 LEU A 17 -0.732 10.565 -1.744 1.00 0.00 C ATOM 0 H LEU A 17 -3.135 8.523 -4.821 1.00 0.00 H new ATOM 0 HA LEU A 17 -0.414 9.010 -5.474 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.116 8.651 -3.083 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -0.469 8.094 -2.862 1.00 0.00 H new ATOM 0 HG LEU A 17 0.388 10.238 -3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.029 12.256 -3.777 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.349 11.074 -5.069 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.476 11.222 -3.700 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.404 11.593 -1.592 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.765 10.461 -1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -0.096 9.892 -1.168 1.00 0.00 H new ATOM 233 N LEU A 18 -1.122 5.826 -4.823 1.00 0.00 N ATOM 234 CA LEU A 18 -0.567 4.476 -5.022 1.00 0.00 C ATOM 235 C LEU A 18 -0.284 4.166 -6.501 1.00 0.00 C ATOM 236 O LEU A 18 0.739 3.548 -6.806 1.00 0.00 O ATOM 237 CB LEU A 18 -1.438 3.417 -4.313 1.00 0.00 C ATOM 238 CG LEU A 18 -2.788 3.083 -4.984 1.00 0.00 C ATOM 239 CD1 LEU A 18 -2.707 1.909 -5.966 1.00 0.00 C ATOM 240 CD2 LEU A 18 -3.807 2.680 -3.925 1.00 0.00 C ATOM 0 H LEU A 18 -2.079 5.839 -4.469 1.00 0.00 H new ATOM 0 HA LEU A 18 0.413 4.439 -4.546 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.859 2.497 -4.231 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.636 3.760 -3.298 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.074 3.985 -5.525 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.690 1.729 -6.400 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.998 2.146 -6.759 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.375 1.015 -5.438 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.757 2.446 -4.405 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.446 1.803 -3.388 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.948 3.503 -3.224 1.00 0.00 H new ATOM 252 N ARG A 19 -1.118 4.658 -7.429 1.00 0.00 N ATOM 253 CA ARG A 19 -0.886 4.549 -8.877 1.00 0.00 C ATOM 254 C ARG A 19 0.357 5.335 -9.303 1.00 0.00 C ATOM 255 O ARG A 19 1.209 4.800 -10.013 1.00 0.00 O ATOM 256 CB ARG A 19 -2.153 4.996 -9.632 1.00 0.00 C ATOM 257 CG ARG A 19 -3.206 3.873 -9.612 1.00 0.00 C ATOM 258 CD ARG A 19 -4.500 4.299 -10.313 1.00 0.00 C ATOM 259 NE ARG A 19 -5.413 3.160 -10.494 1.00 0.00 N ATOM 260 CZ ARG A 19 -5.485 2.358 -11.542 1.00 0.00 C ATOM 261 NH1 ARG A 19 -4.707 2.469 -12.582 1.00 0.00 N1+ ATOM 262 NH2 ARG A 19 -6.362 1.399 -11.562 1.00 0.00 N ATOM 0 H ARG A 19 -1.981 5.148 -7.193 1.00 0.00 H new ATOM 0 HA ARG A 19 -0.687 3.509 -9.134 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -2.561 5.896 -9.172 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -1.901 5.251 -10.662 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -2.802 2.986 -10.101 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.425 3.597 -8.580 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -4.995 5.074 -9.727 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -4.263 4.735 -11.283 1.00 0.00 H new ATOM 0 HE ARG A 19 -6.060 2.969 -9.729 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -3.999 3.203 -12.613 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -4.806 1.822 -13.364 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -6.992 1.267 -10.771 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -6.420 0.778 -12.369 1.00 0.00 H new ATOM 276 N GLN A 20 0.512 6.567 -8.815 1.00 0.00 N ATOM 277 CA GLN A 20 1.693 7.404 -9.076 1.00 0.00 C ATOM 278 C GLN A 20 2.985 6.832 -8.448 1.00 0.00 C ATOM 279 O GLN A 20 4.053 6.942 -9.048 1.00 0.00 O ATOM 280 CB GLN A 20 1.397 8.834 -8.606 1.00 0.00 C ATOM 281 CG GLN A 20 0.460 9.568 -9.589 1.00 0.00 C ATOM 282 CD GLN A 20 -0.043 10.887 -9.005 1.00 0.00 C ATOM 283 OE1 GLN A 20 0.337 11.976 -9.424 1.00 0.00 O ATOM 284 NE2 GLN A 20 -0.901 10.849 -8.011 1.00 0.00 N ATOM 0 H GLN A 20 -0.183 7.020 -8.221 1.00 0.00 H new ATOM 0 HA GLN A 20 1.886 7.412 -10.149 1.00 0.00 H new ATOM 0 HB2 GLN A 20 0.939 8.806 -7.617 1.00 0.00 H new ATOM 0 HB3 GLN A 20 2.331 9.387 -8.509 1.00 0.00 H new ATOM 0 HG2 GLN A 20 0.989 9.761 -10.522 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -0.389 8.928 -9.830 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -1.226 9.951 -7.652 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -1.242 11.717 -7.598 1.00 0.00 H new ATOM 293 N GLU A 21 2.913 6.149 -7.298 1.00 0.00 N ATOM 294 CA GLU A 21 4.045 5.402 -6.715 1.00 0.00 C ATOM 295 C GLU A 21 4.451 4.163 -7.542 1.00 0.00 C ATOM 296 O GLU A 21 5.632 3.816 -7.592 1.00 0.00 O ATOM 297 CB GLU A 21 3.727 4.974 -5.269 1.00 0.00 C ATOM 298 CG GLU A 21 3.813 6.107 -4.228 1.00 0.00 C ATOM 299 CD GLU A 21 5.198 6.774 -4.132 1.00 0.00 C ATOM 300 OE1 GLU A 21 6.218 6.156 -4.520 1.00 0.00 O ATOM 301 OE2 GLU A 21 5.263 7.932 -3.655 1.00 0.00 O1- ATOM 0 H GLU A 21 2.062 6.096 -6.738 1.00 0.00 H new ATOM 0 HA GLU A 21 4.893 6.087 -6.724 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.723 4.550 -5.243 1.00 0.00 H new ATOM 0 HB3 GLU A 21 4.416 4.180 -4.980 1.00 0.00 H new ATOM 0 HG2 GLU A 21 3.072 6.868 -4.474 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.546 5.707 -3.250 1.00 0.00 H new ATOM 308 N MET A 22 3.499 3.521 -8.230 1.00 0.00 N ATOM 309 CA MET A 22 3.741 2.433 -9.195 1.00 0.00 C ATOM 310 C MET A 22 4.189 2.929 -10.585 1.00 0.00 C ATOM 311 O MET A 22 4.580 2.120 -11.429 1.00 0.00 O ATOM 312 CB MET A 22 2.462 1.586 -9.327 1.00 0.00 C ATOM 313 CG MET A 22 2.113 0.865 -8.026 1.00 0.00 C ATOM 314 SD MET A 22 0.440 0.171 -8.011 1.00 0.00 S ATOM 315 CE MET A 22 0.257 -0.013 -6.223 1.00 0.00 C ATOM 0 H MET A 22 2.510 3.748 -8.130 1.00 0.00 H new ATOM 0 HA MET A 22 4.566 1.836 -8.806 1.00 0.00 H new ATOM 0 HB2 MET A 22 1.631 2.228 -9.619 1.00 0.00 H new ATOM 0 HB3 MET A 22 2.594 0.853 -10.123 1.00 0.00 H new ATOM 0 HG2 MET A 22 2.832 0.063 -7.860 1.00 0.00 H new ATOM 0 HG3 MET A 22 2.216 1.562 -7.195 1.00 0.00 H new ATOM 0 HE1 MET A 22 -0.694 -0.498 -6.003 1.00 0.00 H new ATOM 0 HE2 MET A 22 1.074 -0.622 -5.834 1.00 0.00 H new ATOM 0 HE3 MET A 22 0.281 0.970 -5.752 1.00 0.00 H new ATOM 325 N GLY A 23 4.132 4.242 -10.843 1.00 0.00 N ATOM 326 CA GLY A 23 4.485 4.867 -12.127 1.00 0.00 C ATOM 327 C GLY A 23 3.354 4.892 -13.170 1.00 0.00 C ATOM 328 O GLY A 23 3.608 5.205 -14.335 1.00 0.00 O ATOM 0 H GLY A 23 3.830 4.920 -10.144 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.808 5.891 -11.939 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.338 4.336 -12.550 1.00 0.00 H new ATOM 332 N ASP A 24 2.120 4.564 -12.783 1.00 0.00 N ATOM 333 CA ASP A 24 0.910 4.699 -13.611 1.00 0.00 C ATOM 334 C ASP A 24 0.481 6.171 -13.773 1.00 0.00 C ATOM 335 O ASP A 24 0.800 7.032 -12.949 1.00 0.00 O ATOM 336 CB ASP A 24 -0.215 3.843 -12.988 1.00 0.00 C ATOM 337 CG ASP A 24 -1.538 3.922 -13.760 1.00 0.00 C ATOM 338 OD1 ASP A 24 -2.587 4.201 -13.131 1.00 0.00 O ATOM 339 OD2 ASP A 24 -1.529 3.731 -14.998 1.00 0.00 O1- ATOM 0 H ASP A 24 1.924 4.185 -11.857 1.00 0.00 H new ATOM 0 HA ASP A 24 1.126 4.338 -14.617 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.111 2.804 -12.945 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.382 4.167 -11.961 1.00 0.00 H new ATOM 344 N ASP A 25 -0.289 6.463 -14.826 1.00 0.00 N ATOM 345 CA ASP A 25 -0.843 7.789 -15.135 1.00 0.00 C ATOM 346 C ASP A 25 -1.974 8.258 -14.179 1.00 0.00 C ATOM 347 O ASP A 25 -2.511 9.357 -14.353 1.00 0.00 O ATOM 348 CB ASP A 25 -1.333 7.809 -16.600 1.00 0.00 C ATOM 349 CG ASP A 25 -0.255 7.534 -17.667 1.00 0.00 C ATOM 350 OD1 ASP A 25 -0.636 7.193 -18.813 1.00 0.00 O ATOM 351 OD2 ASP A 25 0.963 7.689 -17.400 1.00 0.00 O1- ATOM 0 H ASP A 25 -0.555 5.758 -15.513 1.00 0.00 H new ATOM 0 HA ASP A 25 -0.032 8.502 -14.986 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.125 7.068 -16.710 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -1.778 8.783 -16.802 1.00 0.00 H new ATOM 356 N GLY A 26 -2.361 7.447 -13.182 1.00 0.00 N ATOM 357 CA GLY A 26 -3.518 7.700 -12.313 1.00 0.00 C ATOM 358 C GLY A 26 -4.842 7.253 -12.949 1.00 0.00 C ATOM 359 O GLY A 26 -5.833 7.984 -12.910 1.00 0.00 O ATOM 0 H GLY A 26 -1.869 6.583 -12.954 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.379 7.177 -11.367 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.570 8.764 -12.084 1.00 0.00 H new ATOM 363 N GLY A 27 -4.827 6.079 -13.588 1.00 0.00 N ATOM 364 CA GLY A 27 -5.954 5.495 -14.325 1.00 0.00 C ATOM 365 C GLY A 27 -7.085 4.918 -13.457 1.00 0.00 C ATOM 366 O GLY A 27 -7.184 5.172 -12.255 1.00 0.00 O ATOM 0 H GLY A 27 -3.998 5.486 -13.607 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -6.375 6.260 -14.977 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.573 4.702 -14.969 1.00 0.00 H new ATOM 370 N GLY A 28 -7.935 4.102 -14.086 1.00 0.00 N ATOM 371 CA GLY A 28 -9.083 3.429 -13.456 1.00 0.00 C ATOM 372 C GLY A 28 -10.376 4.267 -13.402 1.00 0.00 C ATOM 373 O GLY A 28 -10.361 5.480 -13.636 1.00 0.00 O ATOM 0 H GLY A 28 -7.844 3.882 -15.078 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.288 2.506 -13.999 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -8.807 3.147 -12.440 1.00 0.00 H new ATOM 377 N SER A 29 -11.498 3.609 -13.104 1.00 0.00 N ATOM 378 CA SER A 29 -12.849 4.203 -13.004 1.00 0.00 C ATOM 379 C SER A 29 -13.788 3.347 -12.139 1.00 0.00 C ATOM 380 O SER A 29 -13.463 2.206 -11.790 1.00 0.00 O ATOM 381 CB SER A 29 -13.444 4.406 -14.408 1.00 0.00 C ATOM 382 OG SER A 29 -13.632 3.168 -15.087 1.00 0.00 O ATOM 0 H SER A 29 -11.499 2.606 -12.917 1.00 0.00 H new ATOM 0 HA SER A 29 -12.750 5.172 -12.515 1.00 0.00 H new ATOM 0 HB2 SER A 29 -14.399 4.925 -14.326 1.00 0.00 H new ATOM 0 HB3 SER A 29 -12.783 5.045 -14.994 1.00 0.00 H new ATOM 0 HG SER A 29 -14.013 3.336 -15.974 1.00 0.00 H new ATOM 388 N GLY A 30 -14.965 3.882 -11.792 1.00 0.00 N ATOM 389 CA GLY A 30 -15.966 3.193 -10.971 1.00 0.00 C ATOM 390 C GLY A 30 -15.536 3.068 -9.504 1.00 0.00 C ATOM 391 O GLY A 30 -15.378 4.081 -8.814 1.00 0.00 O ATOM 0 H GLY A 30 -15.252 4.818 -12.078 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -16.911 3.734 -11.025 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -16.145 2.199 -11.380 1.00 0.00 H new ATOM 395 N GLY A 31 -15.341 1.833 -9.025 1.00 0.00 N ATOM 396 CA GLY A 31 -14.937 1.529 -7.649 1.00 0.00 C ATOM 397 C GLY A 31 -16.109 1.280 -6.680 1.00 0.00 C ATOM 398 O GLY A 31 -17.285 1.449 -7.017 1.00 0.00 O ATOM 0 H GLY A 31 -15.463 0.998 -9.598 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.296 0.647 -7.658 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -14.337 2.356 -7.269 1.00 0.00 H new ATOM 402 N GLY A 32 -15.762 0.886 -5.451 1.00 0.00 N ATOM 403 CA GLY A 32 -16.698 0.697 -4.330 1.00 0.00 C ATOM 404 C GLY A 32 -17.275 -0.719 -4.158 1.00 0.00 C ATOM 405 O GLY A 32 -17.853 -0.998 -3.104 1.00 0.00 O ATOM 0 H GLY A 32 -14.795 0.683 -5.198 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -16.188 0.973 -3.407 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -17.528 1.392 -4.456 1.00 0.00 H new ATOM 409 N SER A 33 -17.113 -1.626 -5.129 1.00 0.00 N ATOM 410 CA SER A 33 -17.439 -3.056 -4.970 1.00 0.00 C ATOM 411 C SER A 33 -16.310 -3.826 -4.273 1.00 0.00 C ATOM 412 O SER A 33 -15.151 -3.409 -4.295 1.00 0.00 O ATOM 413 CB SER A 33 -17.750 -3.704 -6.326 1.00 0.00 C ATOM 414 OG SER A 33 -18.258 -5.021 -6.161 1.00 0.00 O ATOM 0 H SER A 33 -16.751 -1.391 -6.053 1.00 0.00 H new ATOM 0 HA SER A 33 -18.326 -3.109 -4.339 1.00 0.00 H new ATOM 0 HB2 SER A 33 -18.477 -3.096 -6.865 1.00 0.00 H new ATOM 0 HB3 SER A 33 -16.846 -3.734 -6.934 1.00 0.00 H new ATOM 0 HG SER A 33 -18.449 -5.410 -7.040 1.00 0.00 H new ATOM 420 N MET A 34 -16.621 -4.995 -3.708 1.00 0.00 N ATOM 421 CA MET A 34 -15.645 -5.898 -3.084 1.00 0.00 C ATOM 422 C MET A 34 -14.539 -6.332 -4.062 1.00 0.00 C ATOM 423 O MET A 34 -13.366 -6.398 -3.691 1.00 0.00 O ATOM 424 CB MET A 34 -16.392 -7.120 -2.532 1.00 0.00 C ATOM 425 CG MET A 34 -15.556 -7.924 -1.519 1.00 0.00 C ATOM 426 SD MET A 34 -15.904 -7.625 0.240 1.00 0.00 S ATOM 427 CE MET A 34 -15.261 -5.941 0.449 1.00 0.00 C ATOM 0 H MET A 34 -17.577 -5.349 -3.670 1.00 0.00 H new ATOM 0 HA MET A 34 -15.146 -5.363 -2.276 1.00 0.00 H new ATOM 0 HB2 MET A 34 -17.315 -6.791 -2.054 1.00 0.00 H new ATOM 0 HB3 MET A 34 -16.676 -7.771 -3.359 1.00 0.00 H new ATOM 0 HG2 MET A 34 -15.704 -8.985 -1.720 1.00 0.00 H new ATOM 0 HG3 MET A 34 -14.503 -7.709 -1.700 1.00 0.00 H new ATOM 0 HE1 MET A 34 -15.241 -5.688 1.509 1.00 0.00 H new ATOM 0 HE2 MET A 34 -14.251 -5.884 0.044 1.00 0.00 H new ATOM 0 HE3 MET A 34 -15.904 -5.238 -0.080 1.00 0.00 H new ATOM 437 N GLN A 35 -14.895 -6.563 -5.332 1.00 0.00 N ATOM 438 CA GLN A 35 -13.937 -6.910 -6.385 1.00 0.00 C ATOM 439 C GLN A 35 -12.923 -5.784 -6.655 1.00 0.00 C ATOM 440 O GLN A 35 -11.759 -6.063 -6.958 1.00 0.00 O ATOM 441 CB GLN A 35 -14.743 -7.280 -7.647 1.00 0.00 C ATOM 442 CG GLN A 35 -13.904 -7.746 -8.854 1.00 0.00 C ATOM 443 CD GLN A 35 -13.214 -9.105 -8.686 1.00 0.00 C ATOM 444 OE1 GLN A 35 -13.237 -9.751 -7.649 1.00 0.00 O ATOM 445 NE2 GLN A 35 -12.571 -9.601 -9.722 1.00 0.00 N ATOM 0 H GLN A 35 -15.860 -6.514 -5.658 1.00 0.00 H new ATOM 0 HA GLN A 35 -13.334 -7.759 -6.064 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -15.448 -8.071 -7.389 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -15.332 -6.414 -7.948 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -14.551 -7.791 -9.730 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -13.143 -6.993 -9.059 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -12.538 -9.080 -10.599 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.106 -10.506 -9.648 1.00 0.00 H new ATOM 454 N ASP A 36 -13.325 -4.515 -6.516 1.00 0.00 N ATOM 455 CA ASP A 36 -12.461 -3.356 -6.747 1.00 0.00 C ATOM 456 C ASP A 36 -11.446 -3.171 -5.607 1.00 0.00 C ATOM 457 O ASP A 36 -10.244 -3.049 -5.857 1.00 0.00 O ATOM 458 CB ASP A 36 -13.305 -2.079 -6.935 1.00 0.00 C ATOM 459 CG ASP A 36 -14.426 -2.199 -7.979 1.00 0.00 C ATOM 460 OD1 ASP A 36 -14.220 -2.808 -9.057 1.00 0.00 O ATOM 461 OD2 ASP A 36 -15.525 -1.651 -7.719 1.00 0.00 O1- ATOM 0 H ASP A 36 -14.273 -4.263 -6.236 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.899 -3.540 -7.662 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.747 -1.808 -5.976 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.644 -1.262 -7.224 1.00 0.00 H new ATOM 466 N ILE A 37 -11.904 -3.208 -4.347 1.00 0.00 N ATOM 467 CA ILE A 37 -11.024 -3.109 -3.176 1.00 0.00 C ATOM 468 C ILE A 37 -10.049 -4.291 -3.087 1.00 0.00 C ATOM 469 O ILE A 37 -8.867 -4.081 -2.808 1.00 0.00 O ATOM 470 CB ILE A 37 -11.822 -2.878 -1.872 1.00 0.00 C ATOM 471 CG1 ILE A 37 -10.864 -2.665 -0.673 1.00 0.00 C ATOM 472 CG2 ILE A 37 -12.855 -3.976 -1.597 1.00 0.00 C ATOM 473 CD1 ILE A 37 -11.571 -2.517 0.678 1.00 0.00 C ATOM 0 H ILE A 37 -12.892 -3.307 -4.113 1.00 0.00 H new ATOM 0 HA ILE A 37 -10.405 -2.222 -3.310 1.00 0.00 H new ATOM 0 HB ILE A 37 -12.400 -1.964 -2.010 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -10.175 -3.508 -0.619 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.264 -1.774 -0.856 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -13.381 -3.756 -0.668 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -13.570 -4.017 -2.419 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.349 -4.937 -1.508 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.829 -2.372 1.463 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -12.239 -1.656 0.647 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -12.149 -3.417 0.887 1.00 0.00 H new ATOM 485 N GLN A 38 -10.483 -5.524 -3.395 1.00 0.00 N ATOM 486 CA GLN A 38 -9.590 -6.690 -3.421 1.00 0.00 C ATOM 487 C GLN A 38 -8.427 -6.509 -4.412 1.00 0.00 C ATOM 488 O GLN A 38 -7.317 -6.945 -4.118 1.00 0.00 O ATOM 489 CB GLN A 38 -10.355 -7.978 -3.770 1.00 0.00 C ATOM 490 CG GLN A 38 -11.167 -8.559 -2.596 1.00 0.00 C ATOM 491 CD GLN A 38 -11.912 -9.839 -2.973 1.00 0.00 C ATOM 492 OE1 GLN A 38 -13.110 -9.969 -2.760 1.00 0.00 O ATOM 493 NE2 GLN A 38 -11.263 -10.828 -3.564 1.00 0.00 N ATOM 0 H GLN A 38 -11.452 -5.738 -3.630 1.00 0.00 H new ATOM 0 HA GLN A 38 -9.178 -6.777 -2.416 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -11.031 -7.774 -4.601 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -9.644 -8.729 -4.114 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -10.496 -8.766 -1.762 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -11.884 -7.814 -2.251 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -10.264 -10.742 -3.752 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -11.761 -11.677 -3.832 1.00 0.00 H new ATOM 502 N GLN A 39 -8.651 -5.854 -5.556 1.00 0.00 N ATOM 503 CA GLN A 39 -7.601 -5.552 -6.537 1.00 0.00 C ATOM 504 C GLN A 39 -6.679 -4.408 -6.068 1.00 0.00 C ATOM 505 O GLN A 39 -5.463 -4.600 -5.988 1.00 0.00 O ATOM 506 CB GLN A 39 -8.223 -5.222 -7.902 1.00 0.00 C ATOM 507 CG GLN A 39 -8.811 -6.468 -8.583 1.00 0.00 C ATOM 508 CD GLN A 39 -9.564 -6.157 -9.882 1.00 0.00 C ATOM 509 OE1 GLN A 39 -9.610 -5.040 -10.385 1.00 0.00 O ATOM 510 NE2 GLN A 39 -10.176 -7.149 -10.502 1.00 0.00 N ATOM 0 H GLN A 39 -9.573 -5.515 -5.830 1.00 0.00 H new ATOM 0 HA GLN A 39 -6.981 -6.443 -6.636 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.007 -4.476 -7.772 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -7.465 -4.779 -8.548 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -8.005 -7.169 -8.799 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -9.489 -6.966 -7.890 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -10.154 -8.089 -10.106 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -10.671 -6.976 -11.377 1.00 0.00 H new ATOM 519 N LEU A 40 -7.235 -3.235 -5.730 1.00 0.00 N ATOM 520 CA LEU A 40 -6.449 -2.041 -5.377 1.00 0.00 C ATOM 521 C LEU A 40 -5.591 -2.255 -4.119 1.00 0.00 C ATOM 522 O LEU A 40 -4.405 -1.908 -4.109 1.00 0.00 O ATOM 523 CB LEU A 40 -7.391 -0.833 -5.174 1.00 0.00 C ATOM 524 CG LEU A 40 -7.628 0.023 -6.435 1.00 0.00 C ATOM 525 CD1 LEU A 40 -8.296 -0.734 -7.581 1.00 0.00 C ATOM 526 CD2 LEU A 40 -8.506 1.223 -6.073 1.00 0.00 C ATOM 0 H LEU A 40 -8.243 -3.086 -5.693 1.00 0.00 H new ATOM 0 HA LEU A 40 -5.767 -1.845 -6.204 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.353 -1.197 -4.813 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.978 -0.196 -4.392 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.642 0.329 -6.784 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.428 -0.065 -8.431 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -7.669 -1.575 -7.876 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.268 -1.103 -7.255 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.676 1.831 -6.962 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.462 0.871 -5.686 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.006 1.823 -5.313 1.00 0.00 H new ATOM 538 N LEU A 41 -6.167 -2.839 -3.067 1.00 0.00 N ATOM 539 CA LEU A 41 -5.486 -3.034 -1.784 1.00 0.00 C ATOM 540 C LEU A 41 -4.403 -4.129 -1.868 1.00 0.00 C ATOM 541 O LEU A 41 -3.330 -3.973 -1.278 1.00 0.00 O ATOM 542 CB LEU A 41 -6.566 -3.306 -0.716 1.00 0.00 C ATOM 543 CG LEU A 41 -6.081 -3.313 0.746 1.00 0.00 C ATOM 544 CD1 LEU A 41 -5.527 -1.948 1.145 1.00 0.00 C ATOM 545 CD2 LEU A 41 -7.246 -3.625 1.682 1.00 0.00 C ATOM 0 H LEU A 41 -7.124 -3.192 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.935 -2.137 -1.501 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.346 -2.551 -0.816 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.026 -4.271 -0.930 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.301 -4.070 0.827 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.192 -1.980 2.182 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.686 -1.694 0.499 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.307 -1.194 1.039 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.893 -3.628 2.713 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.020 -2.866 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.658 -4.604 1.437 1.00 0.00 H new ATOM 557 N ALA A 42 -4.625 -5.178 -2.667 1.00 0.00 N ATOM 558 CA ALA A 42 -3.604 -6.193 -2.952 1.00 0.00 C ATOM 559 C ALA A 42 -2.458 -5.654 -3.834 1.00 0.00 C ATOM 560 O ALA A 42 -1.300 -5.998 -3.603 1.00 0.00 O ATOM 561 CB ALA A 42 -4.258 -7.408 -3.613 1.00 0.00 C ATOM 0 H ALA A 42 -5.516 -5.348 -3.134 1.00 0.00 H new ATOM 0 HA ALA A 42 -3.157 -6.483 -2.001 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -3.498 -8.160 -3.824 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -5.008 -7.827 -2.942 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.735 -7.103 -4.545 1.00 0.00 H new ATOM 567 N LYS A 43 -2.743 -4.788 -4.819 1.00 0.00 N ATOM 568 CA LYS A 43 -1.723 -4.144 -5.661 1.00 0.00 C ATOM 569 C LYS A 43 -0.817 -3.209 -4.851 1.00 0.00 C ATOM 570 O LYS A 43 0.404 -3.268 -4.996 1.00 0.00 O ATOM 571 CB LYS A 43 -2.418 -3.423 -6.829 1.00 0.00 C ATOM 572 CG LYS A 43 -1.429 -3.167 -7.968 1.00 0.00 C ATOM 573 CD LYS A 43 -2.089 -2.421 -9.138 1.00 0.00 C ATOM 574 CE LYS A 43 -1.076 -2.235 -10.277 1.00 0.00 C ATOM 575 NZ LYS A 43 -1.680 -1.524 -11.434 1.00 0.00 N1+ ATOM 0 H LYS A 43 -3.696 -4.513 -5.055 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.062 -4.909 -6.069 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -3.251 -4.026 -7.192 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -2.836 -2.477 -6.483 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -0.587 -2.585 -7.594 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -1.028 -4.117 -8.322 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -2.953 -2.980 -9.496 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.454 -1.450 -8.802 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -0.216 -1.673 -9.912 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -0.707 -3.209 -10.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -0.968 -1.415 -12.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -2.485 -2.073 -11.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -2.010 -0.585 -11.131 1.00 0.00 H new ATOM 589 N SER A 44 -1.392 -2.413 -3.946 1.00 0.00 N ATOM 590 CA SER A 44 -0.633 -1.594 -2.988 1.00 0.00 C ATOM 591 C SER A 44 0.257 -2.451 -2.065 1.00 0.00 C ATOM 592 O SER A 44 1.451 -2.174 -1.924 1.00 0.00 O ATOM 593 CB SER A 44 -1.611 -0.724 -2.192 1.00 0.00 C ATOM 594 OG SER A 44 -0.908 0.169 -1.345 1.00 0.00 O ATOM 0 H SER A 44 -2.403 -2.316 -3.854 1.00 0.00 H new ATOM 0 HA SER A 44 0.050 -0.949 -3.541 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.246 -0.161 -2.876 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.268 -1.358 -1.596 1.00 0.00 H new ATOM 0 HG SER A 44 -0.693 -0.281 -0.502 1.00 0.00 H new ATOM 600 N LEU A 45 -0.276 -3.560 -1.533 1.00 0.00 N ATOM 601 CA LEU A 45 0.478 -4.538 -0.743 1.00 0.00 C ATOM 602 C LEU A 45 1.622 -5.201 -1.546 1.00 0.00 C ATOM 603 O LEU A 45 2.732 -5.369 -1.034 1.00 0.00 O ATOM 604 CB LEU A 45 -0.543 -5.537 -0.148 1.00 0.00 C ATOM 605 CG LEU A 45 -0.047 -6.712 0.713 1.00 0.00 C ATOM 606 CD1 LEU A 45 0.483 -7.892 -0.100 1.00 0.00 C ATOM 607 CD2 LEU A 45 0.994 -6.302 1.759 1.00 0.00 C ATOM 0 H LEU A 45 -1.260 -3.805 -1.643 1.00 0.00 H new ATOM 0 HA LEU A 45 1.005 -4.044 0.074 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -1.245 -4.963 0.457 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.109 -5.958 -0.979 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.945 -7.042 1.234 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.814 -8.680 0.576 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.309 -8.275 -0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.322 -7.564 -0.713 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.300 -7.178 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.863 -5.873 1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.561 -5.563 2.433 1.00 0.00 H new ATOM 619 N THR A 46 1.406 -5.518 -2.823 1.00 0.00 N ATOM 620 CA THR A 46 2.447 -6.068 -3.713 1.00 0.00 C ATOM 621 C THR A 46 3.621 -5.095 -3.893 1.00 0.00 C ATOM 622 O THR A 46 4.781 -5.506 -3.876 1.00 0.00 O ATOM 623 CB THR A 46 1.850 -6.468 -5.075 1.00 0.00 C ATOM 624 OG1 THR A 46 0.880 -7.480 -4.908 1.00 0.00 O ATOM 625 CG2 THR A 46 2.883 -7.025 -6.057 1.00 0.00 C ATOM 0 H THR A 46 0.501 -5.402 -3.278 1.00 0.00 H new ATOM 0 HA THR A 46 2.841 -6.964 -3.234 1.00 0.00 H new ATOM 0 HB THR A 46 1.429 -5.548 -5.480 1.00 0.00 H new ATOM 0 HG1 THR A 46 0.093 -7.108 -4.457 1.00 0.00 H new ATOM 0 HG21 THR A 46 2.391 -7.285 -6.994 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.648 -6.272 -6.246 1.00 0.00 H new ATOM 0 HG23 THR A 46 3.347 -7.915 -5.631 1.00 0.00 H new ATOM 633 N GLU A 47 3.344 -3.793 -4.006 1.00 0.00 N ATOM 634 CA GLU A 47 4.370 -2.746 -4.131 1.00 0.00 C ATOM 635 C GLU A 47 5.197 -2.554 -2.836 1.00 0.00 C ATOM 636 O GLU A 47 6.380 -2.225 -2.916 1.00 0.00 O ATOM 637 CB GLU A 47 3.683 -1.452 -4.602 1.00 0.00 C ATOM 638 CG GLU A 47 4.625 -0.298 -4.978 1.00 0.00 C ATOM 639 CD GLU A 47 5.474 -0.525 -6.244 1.00 0.00 C ATOM 640 OE1 GLU A 47 5.249 -1.497 -7.003 1.00 0.00 O ATOM 641 OE2 GLU A 47 6.370 0.307 -6.514 1.00 0.00 O1- ATOM 0 H GLU A 47 2.391 -3.429 -4.014 1.00 0.00 H new ATOM 0 HA GLU A 47 5.106 -3.052 -4.874 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.062 -1.686 -5.466 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.015 -1.109 -3.812 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.029 0.604 -5.117 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.296 -0.111 -4.140 1.00 0.00 H new ATOM 648 N ILE A 48 4.647 -2.840 -1.646 1.00 0.00 N ATOM 649 CA ILE A 48 5.429 -2.931 -0.388 1.00 0.00 C ATOM 650 C ILE A 48 6.480 -4.045 -0.504 1.00 0.00 C ATOM 651 O ILE A 48 7.677 -3.806 -0.324 1.00 0.00 O ATOM 652 CB ILE A 48 4.531 -3.182 0.855 1.00 0.00 C ATOM 653 CG1 ILE A 48 3.527 -2.036 1.097 1.00 0.00 C ATOM 654 CG2 ILE A 48 5.394 -3.420 2.112 1.00 0.00 C ATOM 655 CD1 ILE A 48 2.441 -2.400 2.123 1.00 0.00 C ATOM 0 H ILE A 48 3.650 -3.016 -1.521 1.00 0.00 H new ATOM 0 HA ILE A 48 5.919 -1.968 -0.244 1.00 0.00 H new ATOM 0 HB ILE A 48 3.949 -4.080 0.650 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.066 -1.154 1.443 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.053 -1.769 0.152 1.00 0.00 H new ATOM 0 HG21 ILE A 48 4.746 -3.594 2.971 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.031 -4.291 1.956 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.016 -2.544 2.298 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.764 -1.555 2.252 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.879 -3.264 1.767 1.00 0.00 H new ATOM 0 HD13 ILE A 48 2.908 -2.639 3.078 1.00 0.00 H new ATOM 667 N LYS A 49 6.028 -5.265 -0.831 1.00 0.00 N ATOM 668 CA LYS A 49 6.874 -6.466 -0.901 1.00 0.00 C ATOM 669 C LYS A 49 7.973 -6.347 -1.964 1.00 0.00 C ATOM 670 O LYS A 49 9.111 -6.749 -1.713 1.00 0.00 O ATOM 671 CB LYS A 49 5.988 -7.700 -1.150 1.00 0.00 C ATOM 672 CG LYS A 49 5.120 -8.030 0.068 1.00 0.00 C ATOM 673 CD LYS A 49 4.207 -9.235 -0.219 1.00 0.00 C ATOM 674 CE LYS A 49 3.343 -9.614 0.988 1.00 0.00 C ATOM 675 NZ LYS A 49 4.141 -10.226 2.081 1.00 0.00 N1+ ATOM 0 H LYS A 49 5.050 -5.448 -1.058 1.00 0.00 H new ATOM 0 HA LYS A 49 7.388 -6.576 0.054 1.00 0.00 H new ATOM 0 HB2 LYS A 49 5.349 -7.520 -2.014 1.00 0.00 H new ATOM 0 HB3 LYS A 49 6.617 -8.557 -1.391 1.00 0.00 H new ATOM 0 HG2 LYS A 49 5.757 -8.247 0.925 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.513 -7.164 0.333 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.561 -9.004 -1.066 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.818 -10.090 -0.507 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.838 -8.725 1.364 1.00 0.00 H new ATOM 0 HE3 LYS A 49 2.567 -10.312 0.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 3.535 -10.858 2.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.927 -10.771 1.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.521 -9.477 2.695 1.00 0.00 H new ATOM 689 N ARG A 50 7.668 -5.710 -3.102 1.00 0.00 N ATOM 690 CA ARG A 50 8.620 -5.365 -4.175 1.00 0.00 C ATOM 691 C ARG A 50 9.794 -4.526 -3.660 1.00 0.00 C ATOM 692 O ARG A 50 10.955 -4.891 -3.870 1.00 0.00 O ATOM 693 CB ARG A 50 7.838 -4.614 -5.268 1.00 0.00 C ATOM 694 CG ARG A 50 8.646 -4.263 -6.526 1.00 0.00 C ATOM 695 CD ARG A 50 7.788 -3.322 -7.376 1.00 0.00 C ATOM 696 NE ARG A 50 8.401 -3.016 -8.677 1.00 0.00 N ATOM 697 CZ ARG A 50 7.915 -2.166 -9.570 1.00 0.00 C ATOM 698 NH1 ARG A 50 6.827 -1.482 -9.351 1.00 0.00 N1+ ATOM 699 NH2 ARG A 50 8.523 -1.992 -10.709 1.00 0.00 N ATOM 0 H ARG A 50 6.717 -5.408 -3.312 1.00 0.00 H new ATOM 0 HA ARG A 50 9.060 -6.277 -4.577 1.00 0.00 H new ATOM 0 HB2 ARG A 50 6.983 -5.222 -5.563 1.00 0.00 H new ATOM 0 HB3 ARG A 50 7.442 -3.693 -4.841 1.00 0.00 H new ATOM 0 HG2 ARG A 50 9.587 -3.785 -6.256 1.00 0.00 H new ATOM 0 HG3 ARG A 50 8.896 -5.165 -7.085 1.00 0.00 H new ATOM 0 HD2 ARG A 50 6.810 -3.775 -7.537 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.623 -2.394 -6.829 1.00 0.00 H new ATOM 0 HE ARG A 50 9.270 -3.496 -8.911 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.323 -1.593 -8.471 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.480 -0.836 -10.060 1.00 0.00 H new ATOM 0 HH21 ARG A 50 9.376 -2.511 -10.916 1.00 0.00 H new ATOM 0 HH22 ARG A 50 8.146 -1.337 -11.394 1.00 0.00 H new ATOM 713 N LEU A 51 9.516 -3.433 -2.950 1.00 0.00 N ATOM 714 CA LEU A 51 10.547 -2.522 -2.423 1.00 0.00 C ATOM 715 C LEU A 51 11.348 -3.146 -1.269 1.00 0.00 C ATOM 716 O LEU A 51 12.564 -2.950 -1.199 1.00 0.00 O ATOM 717 CB LEU A 51 9.895 -1.179 -2.020 1.00 0.00 C ATOM 718 CG LEU A 51 9.806 -0.128 -3.147 1.00 0.00 C ATOM 719 CD1 LEU A 51 11.186 0.398 -3.545 1.00 0.00 C ATOM 720 CD2 LEU A 51 9.111 -0.618 -4.416 1.00 0.00 C ATOM 0 H LEU A 51 8.564 -3.148 -2.720 1.00 0.00 H new ATOM 0 HA LEU A 51 11.273 -2.334 -3.214 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.889 -1.378 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 51 10.461 -0.753 -1.191 1.00 0.00 H new ATOM 0 HG LEU A 51 9.197 0.665 -2.712 1.00 0.00 H new ATOM 0 HD11 LEU A 51 11.079 1.135 -4.341 1.00 0.00 H new ATOM 0 HD12 LEU A 51 11.661 0.863 -2.681 1.00 0.00 H new ATOM 0 HD13 LEU A 51 11.803 -0.429 -3.897 1.00 0.00 H new ATOM 0 HD21 LEU A 51 9.093 0.184 -5.154 1.00 0.00 H new ATOM 0 HD22 LEU A 51 9.654 -1.472 -4.821 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.090 -0.916 -4.179 1.00 0.00 H new ATOM 732 N LYS A 52 10.708 -3.941 -0.398 1.00 0.00 N ATOM 733 CA LYS A 52 11.402 -4.694 0.662 1.00 0.00 C ATOM 734 C LYS A 52 12.363 -5.742 0.106 1.00 0.00 C ATOM 735 O LYS A 52 13.498 -5.820 0.563 1.00 0.00 O ATOM 736 CB LYS A 52 10.392 -5.334 1.626 1.00 0.00 C ATOM 737 CG LYS A 52 9.754 -4.259 2.508 1.00 0.00 C ATOM 738 CD LYS A 52 8.837 -4.856 3.576 1.00 0.00 C ATOM 739 CE LYS A 52 8.240 -3.722 4.416 1.00 0.00 C ATOM 740 NZ LYS A 52 7.437 -4.237 5.546 1.00 0.00 N1+ ATOM 0 H LYS A 52 9.698 -4.081 -0.407 1.00 0.00 H new ATOM 0 HA LYS A 52 12.007 -3.976 1.215 1.00 0.00 H new ATOM 0 HB2 LYS A 52 9.620 -5.858 1.062 1.00 0.00 H new ATOM 0 HB3 LYS A 52 10.891 -6.077 2.248 1.00 0.00 H new ATOM 0 HG2 LYS A 52 10.538 -3.675 2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 52 9.183 -3.572 1.884 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.042 -5.435 3.107 1.00 0.00 H new ATOM 0 HD3 LYS A 52 9.397 -5.541 4.213 1.00 0.00 H new ATOM 0 HE2 LYS A 52 9.043 -3.092 4.799 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.615 -3.092 3.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 6.915 -3.453 5.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.764 -4.949 5.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 8.067 -4.672 6.250 1.00 0.00 H new ATOM 754 N ALA A 53 11.959 -6.498 -0.918 1.00 0.00 N ATOM 755 CA ALA A 53 12.826 -7.471 -1.582 1.00 0.00 C ATOM 756 C ALA A 53 14.043 -6.792 -2.248 1.00 0.00 C ATOM 757 O ALA A 53 15.164 -7.281 -2.107 1.00 0.00 O ATOM 758 CB ALA A 53 11.992 -8.266 -2.596 1.00 0.00 C ATOM 0 H ALA A 53 11.018 -6.451 -1.310 1.00 0.00 H new ATOM 0 HA ALA A 53 13.232 -8.156 -0.838 1.00 0.00 H new ATOM 0 HB1 ALA A 53 12.628 -8.995 -3.098 1.00 0.00 H new ATOM 0 HB2 ALA A 53 11.185 -8.784 -2.077 1.00 0.00 H new ATOM 0 HB3 ALA A 53 11.570 -7.584 -3.334 1.00 0.00 H new ATOM 764 N ALA A 54 13.850 -5.640 -2.903 1.00 0.00 N ATOM 765 CA ALA A 54 14.941 -4.862 -3.497 1.00 0.00 C ATOM 766 C ALA A 54 15.929 -4.326 -2.443 1.00 0.00 C ATOM 767 O ALA A 54 17.141 -4.492 -2.597 1.00 0.00 O ATOM 768 CB ALA A 54 14.327 -3.728 -4.328 1.00 0.00 C ATOM 0 H ALA A 54 12.929 -5.221 -3.035 1.00 0.00 H new ATOM 0 HA ALA A 54 15.532 -5.515 -4.140 1.00 0.00 H new ATOM 0 HB1 ALA A 54 15.123 -3.136 -4.780 1.00 0.00 H new ATOM 0 HB2 ALA A 54 13.699 -4.151 -5.113 1.00 0.00 H new ATOM 0 HB3 ALA A 54 13.722 -3.091 -3.683 1.00 0.00 H new ATOM 774 N ASN A 55 15.422 -3.749 -1.347 1.00 0.00 N ATOM 775 CA ASN A 55 16.219 -3.237 -0.227 1.00 0.00 C ATOM 776 C ASN A 55 17.045 -4.363 0.442 1.00 0.00 C ATOM 777 O ASN A 55 18.252 -4.224 0.646 1.00 0.00 O ATOM 778 CB ASN A 55 15.249 -2.539 0.750 1.00 0.00 C ATOM 779 CG ASN A 55 15.932 -1.760 1.868 1.00 0.00 C ATOM 780 OD1 ASN A 55 16.858 -2.217 2.518 1.00 0.00 O ATOM 781 ND2 ASN A 55 15.495 -0.553 2.147 1.00 0.00 N ATOM 0 H ASN A 55 14.419 -3.622 -1.212 1.00 0.00 H new ATOM 0 HA ASN A 55 16.957 -2.515 -0.576 1.00 0.00 H new ATOM 0 HB2 ASN A 55 14.612 -1.858 0.186 1.00 0.00 H new ATOM 0 HB3 ASN A 55 14.597 -3.291 1.194 1.00 0.00 H new ATOM 0 HD21 ASN A 55 15.929 -0.014 2.896 1.00 0.00 H new ATOM 0 HD22 ASN A 55 14.722 -0.155 1.614 1.00 0.00 H new ATOM 788 N GLN A 56 16.414 -5.513 0.707 1.00 0.00 N ATOM 789 CA GLN A 56 17.075 -6.693 1.277 1.00 0.00 C ATOM 790 C GLN A 56 18.173 -7.250 0.360 1.00 0.00 C ATOM 791 O GLN A 56 19.283 -7.537 0.819 1.00 0.00 O ATOM 792 CB GLN A 56 16.020 -7.772 1.567 1.00 0.00 C ATOM 793 CG GLN A 56 15.156 -7.429 2.796 1.00 0.00 C ATOM 794 CD GLN A 56 13.885 -8.282 2.927 1.00 0.00 C ATOM 795 OE1 GLN A 56 13.616 -9.218 2.179 1.00 0.00 O ATOM 796 NE2 GLN A 56 13.053 -8.001 3.910 1.00 0.00 N ATOM 0 H GLN A 56 15.419 -5.652 0.530 1.00 0.00 H new ATOM 0 HA GLN A 56 17.565 -6.390 2.202 1.00 0.00 H new ATOM 0 HB2 GLN A 56 15.377 -7.892 0.695 1.00 0.00 H new ATOM 0 HB3 GLN A 56 16.517 -8.728 1.730 1.00 0.00 H new ATOM 0 HG2 GLN A 56 15.758 -7.553 3.696 1.00 0.00 H new ATOM 0 HG3 GLN A 56 14.872 -6.378 2.745 1.00 0.00 H new ATOM 0 HE21 GLN A 56 13.255 -7.228 4.544 1.00 0.00 H new ATOM 0 HE22 GLN A 56 12.207 -8.556 4.037 1.00 0.00 H new ATOM 805 N ALA A 57 17.895 -7.375 -0.943 1.00 0.00 N ATOM 806 CA ALA A 57 18.826 -7.938 -1.916 1.00 0.00 C ATOM 807 C ALA A 57 20.071 -7.063 -2.125 1.00 0.00 C ATOM 808 O ALA A 57 21.191 -7.585 -2.092 1.00 0.00 O ATOM 809 CB ALA A 57 18.076 -8.179 -3.233 1.00 0.00 C ATOM 0 H ALA A 57 17.007 -7.084 -1.351 1.00 0.00 H new ATOM 0 HA ALA A 57 19.201 -8.885 -1.527 1.00 0.00 H new ATOM 0 HB1 ALA A 57 18.760 -8.600 -3.970 1.00 0.00 H new ATOM 0 HB2 ALA A 57 17.254 -8.875 -3.062 1.00 0.00 H new ATOM 0 HB3 ALA A 57 17.680 -7.234 -3.604 1.00 0.00 H new ATOM 815 N LEU A 58 19.917 -5.740 -2.293 1.00 0.00 N ATOM 816 CA LEU A 58 21.072 -4.837 -2.446 1.00 0.00 C ATOM 817 C LEU A 58 21.913 -4.755 -1.158 1.00 0.00 C ATOM 818 O LEU A 58 23.136 -4.653 -1.247 1.00 0.00 O ATOM 819 CB LEU A 58 20.636 -3.463 -3.009 1.00 0.00 C ATOM 820 CG LEU A 58 19.852 -2.553 -2.048 1.00 0.00 C ATOM 821 CD1 LEU A 58 20.758 -1.730 -1.131 1.00 0.00 C ATOM 822 CD2 LEU A 58 18.978 -1.557 -2.820 1.00 0.00 C ATOM 0 H LEU A 58 19.011 -5.273 -2.326 1.00 0.00 H new ATOM 0 HA LEU A 58 21.744 -5.262 -3.192 1.00 0.00 H new ATOM 0 HB2 LEU A 58 21.528 -2.928 -3.336 1.00 0.00 H new ATOM 0 HB3 LEU A 58 20.024 -3.634 -3.895 1.00 0.00 H new ATOM 0 HG LEU A 58 19.247 -3.231 -1.447 1.00 0.00 H new ATOM 0 HD11 LEU A 58 20.146 -1.109 -0.477 1.00 0.00 H new ATOM 0 HD12 LEU A 58 21.369 -2.400 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 58 21.405 -1.094 -1.735 1.00 0.00 H new ATOM 0 HD21 LEU A 58 18.435 -0.927 -2.115 1.00 0.00 H new ATOM 0 HD22 LEU A 58 19.609 -0.933 -3.453 1.00 0.00 H new ATOM 0 HD23 LEU A 58 18.267 -2.102 -3.441 1.00 0.00 H new ATOM 834 N GLU A 59 21.309 -4.840 0.032 1.00 0.00 N ATOM 835 CA GLU A 59 22.053 -4.860 1.302 1.00 0.00 C ATOM 836 C GLU A 59 22.854 -6.161 1.474 1.00 0.00 C ATOM 837 O GLU A 59 24.011 -6.112 1.892 1.00 0.00 O ATOM 838 CB GLU A 59 21.109 -4.647 2.498 1.00 0.00 C ATOM 839 CG GLU A 59 20.821 -3.161 2.777 1.00 0.00 C ATOM 840 CD GLU A 59 22.084 -2.378 3.186 1.00 0.00 C ATOM 841 OE1 GLU A 59 22.911 -2.893 3.977 1.00 0.00 O ATOM 842 OE2 GLU A 59 22.287 -1.236 2.717 1.00 0.00 O1- ATOM 0 H GLU A 59 20.297 -4.897 0.145 1.00 0.00 H new ATOM 0 HA GLU A 59 22.764 -4.035 1.270 1.00 0.00 H new ATOM 0 HB2 GLU A 59 20.169 -5.165 2.309 1.00 0.00 H new ATOM 0 HB3 GLU A 59 21.549 -5.100 3.387 1.00 0.00 H new ATOM 0 HG2 GLU A 59 20.388 -2.705 1.886 1.00 0.00 H new ATOM 0 HG3 GLU A 59 20.077 -3.082 3.569 1.00 0.00 H new ATOM 849 N GLN A 60 22.295 -7.317 1.107 1.00 0.00 N ATOM 850 CA GLN A 60 23.003 -8.598 1.131 1.00 0.00 C ATOM 851 C GLN A 60 24.119 -8.672 0.069 1.00 0.00 C ATOM 852 O GLN A 60 25.166 -9.273 0.313 1.00 0.00 O ATOM 853 CB GLN A 60 21.933 -9.693 0.973 1.00 0.00 C ATOM 854 CG GLN A 60 22.467 -11.105 0.741 1.00 0.00 C ATOM 855 CD GLN A 60 23.380 -11.665 1.834 1.00 0.00 C ATOM 856 OE1 GLN A 60 23.540 -11.135 2.928 1.00 0.00 O ATOM 857 NE2 GLN A 60 24.024 -12.785 1.581 1.00 0.00 N ATOM 0 H GLN A 60 21.331 -7.390 0.782 1.00 0.00 H new ATOM 0 HA GLN A 60 23.534 -8.733 2.073 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.311 -9.701 1.868 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.286 -9.426 0.138 1.00 0.00 H new ATOM 0 HG2 GLN A 60 21.618 -11.778 0.624 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.014 -11.115 -0.202 1.00 0.00 H new ATOM 0 HE21 GLN A 60 23.909 -13.247 0.679 1.00 0.00 H new ATOM 0 HE22 GLN A 60 24.638 -13.191 2.287 1.00 0.00 H new ATOM 866 N ALA A 61 23.949 -8.009 -1.082 1.00 0.00 N ATOM 867 CA ALA A 61 24.990 -7.853 -2.099 1.00 0.00 C ATOM 868 C ALA A 61 26.128 -6.880 -1.700 1.00 0.00 C ATOM 869 O ALA A 61 27.172 -6.841 -2.360 1.00 0.00 O ATOM 870 CB ALA A 61 24.319 -7.402 -3.405 1.00 0.00 C ATOM 0 H ALA A 61 23.069 -7.560 -1.334 1.00 0.00 H new ATOM 0 HA ALA A 61 25.480 -8.819 -2.220 1.00 0.00 H new ATOM 0 HB1 ALA A 61 25.076 -7.279 -4.179 1.00 0.00 H new ATOM 0 HB2 ALA A 61 23.596 -8.154 -3.721 1.00 0.00 H new ATOM 0 HB3 ALA A 61 23.808 -6.453 -3.243 1.00 0.00 H new ATOM 876 N ARG A 62 25.936 -6.099 -0.628 1.00 0.00 N ATOM 877 CA ARG A 62 26.828 -5.030 -0.126 1.00 0.00 C ATOM 878 C ARG A 62 26.993 -5.126 1.405 1.00 0.00 C ATOM 879 O ARG A 62 26.909 -4.127 2.119 1.00 0.00 O ATOM 880 CB ARG A 62 26.283 -3.650 -0.546 1.00 0.00 C ATOM 881 CG ARG A 62 26.061 -3.448 -2.056 1.00 0.00 C ATOM 882 CD ARG A 62 25.360 -2.100 -2.264 1.00 0.00 C ATOM 883 NE ARG A 62 24.955 -1.856 -3.664 1.00 0.00 N ATOM 884 CZ ARG A 62 24.040 -0.990 -4.069 1.00 0.00 C ATOM 885 NH1 ARG A 62 23.795 -0.799 -5.334 1.00 0.00 N1+ ATOM 886 NH2 ARG A 62 23.338 -0.282 -3.230 1.00 0.00 N ATOM 0 H ARG A 62 25.103 -6.198 -0.048 1.00 0.00 H new ATOM 0 HA ARG A 62 27.816 -5.158 -0.569 1.00 0.00 H new ATOM 0 HB2 ARG A 62 25.336 -3.483 -0.033 1.00 0.00 H new ATOM 0 HB3 ARG A 62 26.975 -2.885 -0.194 1.00 0.00 H new ATOM 0 HG2 ARG A 62 27.014 -3.466 -2.586 1.00 0.00 H new ATOM 0 HG3 ARG A 62 25.455 -4.258 -2.462 1.00 0.00 H new ATOM 0 HD2 ARG A 62 24.477 -2.056 -1.626 1.00 0.00 H new ATOM 0 HD3 ARG A 62 26.026 -1.300 -1.942 1.00 0.00 H new ATOM 0 HE ARG A 62 25.424 -2.405 -4.384 1.00 0.00 H new ATOM 0 HH11 ARG A 62 24.314 -1.323 -6.039 1.00 0.00 H new ATOM 0 HH12 ARG A 62 23.084 -0.125 -5.620 1.00 0.00 H new ATOM 0 HH21 ARG A 62 23.486 -0.386 -2.226 1.00 0.00 H new ATOM 0 HH22 ARG A 62 22.641 0.377 -3.577 1.00 0.00 H new ATOM 900 N ARG A 63 27.129 -6.355 1.930 1.00 0.00 N ATOM 901 CA ARG A 63 26.984 -6.719 3.361 1.00 0.00 C ATOM 902 C ARG A 63 28.163 -6.324 4.284 1.00 0.00 C ATOM 903 O ARG A 63 28.561 -7.074 5.177 1.00 0.00 O ATOM 904 CB ARG A 63 26.548 -8.194 3.476 1.00 0.00 C ATOM 905 CG ARG A 63 27.604 -9.228 3.037 1.00 0.00 C ATOM 906 CD ARG A 63 27.028 -10.649 2.918 1.00 0.00 C ATOM 907 NE ARG A 63 26.254 -11.074 4.102 1.00 0.00 N ATOM 908 CZ ARG A 63 26.725 -11.456 5.275 1.00 0.00 C ATOM 909 NH1 ARG A 63 28.005 -11.524 5.534 1.00 0.00 N1+ ATOM 910 NH2 ARG A 63 25.899 -11.783 6.227 1.00 0.00 N ATOM 0 H ARG A 63 27.353 -7.162 1.348 1.00 0.00 H new ATOM 0 HA ARG A 63 26.190 -6.091 3.766 1.00 0.00 H new ATOM 0 HB2 ARG A 63 26.275 -8.395 4.512 1.00 0.00 H new ATOM 0 HB3 ARG A 63 25.650 -8.338 2.875 1.00 0.00 H new ATOM 0 HG2 ARG A 63 28.023 -8.928 2.076 1.00 0.00 H new ATOM 0 HG3 ARG A 63 28.424 -9.231 3.755 1.00 0.00 H new ATOM 0 HD2 ARG A 63 26.387 -10.700 2.038 1.00 0.00 H new ATOM 0 HD3 ARG A 63 27.846 -11.351 2.758 1.00 0.00 H new ATOM 0 HE ARG A 63 25.239 -11.072 4.002 1.00 0.00 H new ATOM 0 HH11 ARG A 63 28.685 -11.276 4.815 1.00 0.00 H new ATOM 0 HH12 ARG A 63 28.324 -11.825 6.455 1.00 0.00 H new ATOM 0 HH21 ARG A 63 24.893 -11.743 6.065 1.00 0.00 H new ATOM 0 HH22 ARG A 63 26.258 -12.079 7.135 1.00 0.00 H new ATOM 924 N GLU A 64 28.710 -5.121 4.085 1.00 0.00 N ATOM 925 CA GLU A 64 29.825 -4.515 4.838 1.00 0.00 C ATOM 926 C GLU A 64 29.721 -2.980 4.960 1.00 0.00 C ATOM 927 O GLU A 64 30.449 -2.397 5.797 1.00 0.00 O ATOM 928 CB GLU A 64 31.179 -4.961 4.233 1.00 0.00 C ATOM 929 CG GLU A 64 31.472 -4.480 2.800 1.00 0.00 C ATOM 930 CD GLU A 64 30.717 -5.264 1.703 1.00 0.00 C ATOM 931 OE1 GLU A 64 30.720 -6.526 1.711 1.00 0.00 O ATOM 932 OE2 GLU A 64 30.142 -4.627 0.785 1.00 0.00 O1- ATOM 933 OXT GLU A 64 28.895 -2.370 4.243 1.00 0.00 O1- ATOM 0 H GLU A 64 28.369 -4.502 3.350 1.00 0.00 H new ATOM 0 HA GLU A 64 29.761 -4.884 5.862 1.00 0.00 H new ATOM 0 HB2 GLU A 64 31.979 -4.607 4.884 1.00 0.00 H new ATOM 0 HB3 GLU A 64 31.217 -6.050 4.244 1.00 0.00 H new ATOM 0 HG2 GLU A 64 31.210 -3.425 2.722 1.00 0.00 H new ATOM 0 HG3 GLU A 64 32.543 -4.557 2.614 1.00 0.00 H new TER 940 GLU A 64 ATOM 941 N GLY B 101 -8.394 -23.624 -7.175 1.00 0.00 N ATOM 942 CA GLY B 101 -7.812 -23.273 -5.861 1.00 0.00 C ATOM 943 C GLY B 101 -7.809 -21.762 -5.642 1.00 0.00 C ATOM 944 O GLY B 101 -7.410 -21.033 -6.554 1.00 0.00 O ATOM 0 HA2 GLY B 101 -8.382 -23.757 -5.068 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -6.793 -23.654 -5.799 1.00 0.00 H new ATOM 950 N PRO B 102 -8.232 -21.264 -4.459 1.00 0.00 N ATOM 951 CA PRO B 102 -8.200 -19.837 -4.110 1.00 0.00 C ATOM 952 C PRO B 102 -6.790 -19.222 -4.080 1.00 0.00 C ATOM 953 O PRO B 102 -5.776 -19.930 -4.100 1.00 0.00 O ATOM 954 CB PRO B 102 -8.863 -19.735 -2.728 1.00 0.00 C ATOM 955 CG PRO B 102 -9.732 -20.985 -2.637 1.00 0.00 C ATOM 956 CD PRO B 102 -8.892 -22.011 -3.394 1.00 0.00 C ATOM 0 HA PRO B 102 -8.722 -19.267 -4.879 1.00 0.00 H new ATOM 0 HB2 PRO B 102 -8.120 -19.708 -1.931 1.00 0.00 H new ATOM 0 HB3 PRO B 102 -9.460 -18.827 -2.639 1.00 0.00 H new ATOM 0 HG2 PRO B 102 -9.909 -21.285 -1.604 1.00 0.00 H new ATOM 0 HG3 PRO B 102 -10.709 -20.837 -3.098 1.00 0.00 H new ATOM 0 HD2 PRO B 102 -8.163 -22.484 -2.736 1.00 0.00 H new ATOM 0 HD3 PRO B 102 -9.517 -22.806 -3.801 1.00 0.00 H new ATOM 964 N GLY B 103 -6.730 -17.890 -3.985 1.00 0.00 N ATOM 965 CA GLY B 103 -5.488 -17.132 -3.782 1.00 0.00 C ATOM 966 C GLY B 103 -4.751 -16.679 -5.049 1.00 0.00 C ATOM 967 O GLY B 103 -3.651 -16.134 -4.944 1.00 0.00 O ATOM 0 H GLY B 103 -7.557 -17.296 -4.048 1.00 0.00 H new ATOM 0 HA2 GLY B 103 -5.720 -16.248 -3.187 1.00 0.00 H new ATOM 0 HA3 GLY B 103 -4.807 -17.744 -3.191 1.00 0.00 H new ATOM 971 N SER B 104 -5.344 -16.865 -6.236 1.00 0.00 N ATOM 972 CA SER B 104 -4.797 -16.389 -7.521 1.00 0.00 C ATOM 973 C SER B 104 -4.492 -14.887 -7.503 1.00 0.00 C ATOM 974 O SER B 104 -5.223 -14.095 -6.893 1.00 0.00 O ATOM 975 CB SER B 104 -5.758 -16.706 -8.674 1.00 0.00 C ATOM 976 OG SER B 104 -6.065 -18.098 -8.702 1.00 0.00 O ATOM 0 H SER B 104 -6.231 -17.358 -6.336 1.00 0.00 H new ATOM 0 HA SER B 104 -3.857 -16.920 -7.675 1.00 0.00 H new ATOM 0 HB2 SER B 104 -6.675 -16.128 -8.560 1.00 0.00 H new ATOM 0 HB3 SER B 104 -5.309 -16.408 -9.621 1.00 0.00 H new ATOM 0 HG SER B 104 -6.680 -18.282 -9.442 1.00 0.00 H new ATOM 982 N TYR B 105 -3.402 -14.488 -8.167 1.00 0.00 N ATOM 983 CA TYR B 105 -2.892 -13.104 -8.256 1.00 0.00 C ATOM 984 C TYR B 105 -2.589 -12.429 -6.896 1.00 0.00 C ATOM 985 O TYR B 105 -2.413 -11.211 -6.829 1.00 0.00 O ATOM 986 CB TYR B 105 -3.823 -12.245 -9.136 1.00 0.00 C ATOM 987 CG TYR B 105 -4.341 -12.950 -10.374 1.00 0.00 C ATOM 988 CD1 TYR B 105 -5.624 -13.527 -10.362 1.00 0.00 C ATOM 989 CD2 TYR B 105 -3.530 -13.065 -11.520 1.00 0.00 C ATOM 990 CE1 TYR B 105 -6.114 -14.206 -11.496 1.00 0.00 C ATOM 991 CE2 TYR B 105 -4.014 -13.736 -12.662 1.00 0.00 C ATOM 992 CZ TYR B 105 -5.306 -14.309 -12.650 1.00 0.00 C ATOM 993 OH TYR B 105 -5.782 -14.974 -13.740 1.00 0.00 O ATOM 0 H TYR B 105 -2.820 -15.148 -8.683 1.00 0.00 H new ATOM 0 HA TYR B 105 -1.915 -13.177 -8.734 1.00 0.00 H new ATOM 0 HB2 TYR B 105 -4.673 -11.920 -8.535 1.00 0.00 H new ATOM 0 HB3 TYR B 105 -3.287 -11.347 -9.442 1.00 0.00 H new ATOM 0 HD1 TYR B 105 -6.238 -13.449 -9.477 1.00 0.00 H new ATOM 0 HD2 TYR B 105 -2.537 -12.639 -11.524 1.00 0.00 H new ATOM 0 HE1 TYR B 105 -7.101 -14.645 -11.483 1.00 0.00 H new ATOM 0 HE2 TYR B 105 -3.398 -13.812 -13.546 1.00 0.00 H new ATOM 0 HH TYR B 105 -5.110 -14.957 -14.453 1.00 0.00 H new ATOM 1003 N ASP B 106 -2.572 -13.208 -5.809 1.00 0.00 N ATOM 1004 CA ASP B 106 -2.577 -12.749 -4.408 1.00 0.00 C ATOM 1005 C ASP B 106 -3.755 -11.806 -4.061 1.00 0.00 C ATOM 1006 O ASP B 106 -3.658 -10.968 -3.161 1.00 0.00 O ATOM 1007 CB ASP B 106 -1.198 -12.209 -3.981 1.00 0.00 C ATOM 1008 CG ASP B 106 -0.016 -13.154 -4.271 1.00 0.00 C ATOM 1009 OD1 ASP B 106 -0.180 -14.399 -4.233 1.00 0.00 O ATOM 1010 OD2 ASP B 106 1.111 -12.648 -4.499 1.00 0.00 O1- ATOM 0 H ASP B 106 -2.553 -14.225 -5.881 1.00 0.00 H new ATOM 0 HA ASP B 106 -2.764 -13.632 -3.796 1.00 0.00 H new ATOM 0 HB2 ASP B 106 -1.021 -11.262 -4.490 1.00 0.00 H new ATOM 0 HB3 ASP B 106 -1.222 -11.997 -2.912 1.00 0.00 H new ATOM 1015 N ALA B 107 -4.879 -11.930 -4.784 1.00 0.00 N ATOM 1016 CA ALA B 107 -6.043 -11.033 -4.710 1.00 0.00 C ATOM 1017 C ALA B 107 -7.413 -11.732 -4.831 1.00 0.00 C ATOM 1018 O ALA B 107 -8.428 -11.157 -4.427 1.00 0.00 O ATOM 1019 CB ALA B 107 -5.868 -9.963 -5.796 1.00 0.00 C ATOM 0 H ALA B 107 -5.007 -12.684 -5.459 1.00 0.00 H new ATOM 0 HA ALA B 107 -6.063 -10.597 -3.711 1.00 0.00 H new ATOM 0 HB1 ALA B 107 -6.715 -9.278 -5.771 1.00 0.00 H new ATOM 0 HB2 ALA B 107 -4.947 -9.408 -5.615 1.00 0.00 H new ATOM 0 HB3 ALA B 107 -5.817 -10.442 -6.774 1.00 0.00 H new ATOM 1025 N ALA B 108 -7.466 -12.962 -5.353 1.00 0.00 N ATOM 1026 CA ALA B 108 -8.684 -13.775 -5.440 1.00 0.00 C ATOM 1027 C ALA B 108 -9.051 -14.492 -4.123 1.00 0.00 C ATOM 1028 O ALA B 108 -10.183 -14.953 -3.948 1.00 0.00 O ATOM 1029 CB ALA B 108 -8.538 -14.765 -6.604 1.00 0.00 C ATOM 0 H ALA B 108 -6.645 -13.431 -5.735 1.00 0.00 H new ATOM 0 HA ALA B 108 -9.519 -13.100 -5.627 1.00 0.00 H new ATOM 0 HB1 ALA B 108 -9.438 -15.375 -6.678 1.00 0.00 H new ATOM 0 HB2 ALA B 108 -8.395 -14.215 -7.534 1.00 0.00 H new ATOM 0 HB3 ALA B 108 -7.677 -15.409 -6.428 1.00 0.00 H new ATOM 1035 N LEU B 109 -8.100 -14.546 -3.185 1.00 0.00 N ATOM 1036 CA LEU B 109 -8.335 -14.763 -1.751 1.00 0.00 C ATOM 1037 C LEU B 109 -9.264 -13.676 -1.159 1.00 0.00 C ATOM 1038 O LEU B 109 -9.319 -12.567 -1.706 1.00 0.00 O ATOM 1039 CB LEU B 109 -6.968 -14.866 -1.024 1.00 0.00 C ATOM 1040 CG LEU B 109 -5.840 -13.891 -1.437 1.00 0.00 C ATOM 1041 CD1 LEU B 109 -5.967 -12.528 -0.780 1.00 0.00 C ATOM 1042 CD2 LEU B 109 -4.474 -14.441 -1.045 1.00 0.00 C ATOM 0 H LEU B 109 -7.111 -14.436 -3.409 1.00 0.00 H new ATOM 0 HA LEU B 109 -8.864 -15.704 -1.601 1.00 0.00 H new ATOM 0 HB2 LEU B 109 -7.148 -14.732 0.043 1.00 0.00 H new ATOM 0 HB3 LEU B 109 -6.595 -15.881 -1.160 1.00 0.00 H new ATOM 0 HG LEU B 109 -5.935 -13.785 -2.518 1.00 0.00 H new ATOM 0 HD11 LEU B 109 -5.148 -11.888 -1.108 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -6.917 -12.075 -1.063 1.00 0.00 H new ATOM 0 HD13 LEU B 109 -5.927 -12.641 0.303 1.00 0.00 H new ATOM 0 HD21 LEU B 109 -3.698 -13.737 -1.346 1.00 0.00 H new ATOM 0 HD22 LEU B 109 -4.435 -14.583 0.035 1.00 0.00 H new ATOM 0 HD23 LEU B 109 -4.310 -15.397 -1.543 1.00 0.00 H new ATOM 1054 N PRO B 110 -10.020 -13.965 -0.080 1.00 0.00 N ATOM 1055 CA PRO B 110 -10.977 -13.018 0.492 1.00 0.00 C ATOM 1056 C PRO B 110 -10.296 -11.769 1.059 1.00 0.00 C ATOM 1057 O PRO B 110 -9.115 -11.779 1.422 1.00 0.00 O ATOM 1058 CB PRO B 110 -11.750 -13.798 1.562 1.00 0.00 C ATOM 1059 CG PRO B 110 -10.776 -14.897 1.970 1.00 0.00 C ATOM 1060 CD PRO B 110 -10.043 -15.218 0.669 1.00 0.00 C ATOM 0 HA PRO B 110 -11.650 -12.633 -0.274 1.00 0.00 H new ATOM 0 HB2 PRO B 110 -12.017 -13.164 2.407 1.00 0.00 H new ATOM 0 HB3 PRO B 110 -12.678 -14.210 1.167 1.00 0.00 H new ATOM 0 HG2 PRO B 110 -10.089 -14.558 2.746 1.00 0.00 H new ATOM 0 HG3 PRO B 110 -11.297 -15.770 2.364 1.00 0.00 H new ATOM 0 HD2 PRO B 110 -9.033 -15.577 0.865 1.00 0.00 H new ATOM 0 HD3 PRO B 110 -10.557 -16.000 0.111 1.00 0.00 H new ATOM 1068 N ILE B 111 -11.072 -10.688 1.183 1.00 0.00 N ATOM 1069 CA ILE B 111 -10.591 -9.370 1.633 1.00 0.00 C ATOM 1070 C ILE B 111 -9.930 -9.404 3.026 1.00 0.00 C ATOM 1071 O ILE B 111 -8.984 -8.659 3.280 1.00 0.00 O ATOM 1072 CB ILE B 111 -11.756 -8.352 1.546 1.00 0.00 C ATOM 1073 CG1 ILE B 111 -11.309 -6.886 1.679 1.00 0.00 C ATOM 1074 CG2 ILE B 111 -12.848 -8.608 2.602 1.00 0.00 C ATOM 1075 CD1 ILE B 111 -10.518 -6.404 0.466 1.00 0.00 C ATOM 0 H ILE B 111 -12.070 -10.700 0.971 1.00 0.00 H new ATOM 0 HA ILE B 111 -9.791 -9.050 0.966 1.00 0.00 H new ATOM 0 HB ILE B 111 -12.159 -8.509 0.545 1.00 0.00 H new ATOM 0 HG12 ILE B 111 -12.186 -6.253 1.812 1.00 0.00 H new ATOM 0 HG13 ILE B 111 -10.698 -6.776 2.575 1.00 0.00 H new ATOM 0 HG21 ILE B 111 -13.639 -7.866 2.495 1.00 0.00 H new ATOM 0 HG22 ILE B 111 -13.265 -9.605 2.460 1.00 0.00 H new ATOM 0 HG23 ILE B 111 -12.414 -8.535 3.599 1.00 0.00 H new ATOM 0 HD11 ILE B 111 -10.227 -5.364 0.611 1.00 0.00 H new ATOM 0 HD12 ILE B 111 -9.625 -7.017 0.347 1.00 0.00 H new ATOM 0 HD13 ILE B 111 -11.136 -6.486 -0.428 1.00 0.00 H new ATOM 1087 N ASP B 112 -10.374 -10.307 3.903 1.00 0.00 N ATOM 1088 CA ASP B 112 -9.815 -10.516 5.245 1.00 0.00 C ATOM 1089 C ASP B 112 -8.336 -10.946 5.225 1.00 0.00 C ATOM 1090 O ASP B 112 -7.582 -10.583 6.129 1.00 0.00 O ATOM 1091 CB ASP B 112 -10.638 -11.587 5.988 1.00 0.00 C ATOM 1092 CG ASP B 112 -12.125 -11.263 6.205 1.00 0.00 C ATOM 1093 OD1 ASP B 112 -12.522 -10.081 6.120 1.00 0.00 O ATOM 1094 OD2 ASP B 112 -12.893 -12.203 6.519 1.00 0.00 O1- ATOM 0 H ASP B 112 -11.154 -10.931 3.696 1.00 0.00 H new ATOM 0 HA ASP B 112 -9.868 -9.556 5.758 1.00 0.00 H new ATOM 0 HB2 ASP B 112 -10.568 -12.522 5.432 1.00 0.00 H new ATOM 0 HB3 ASP B 112 -10.178 -11.760 6.961 1.00 0.00 H new ATOM 1099 N GLU B 113 -7.892 -11.690 4.203 1.00 0.00 N ATOM 1100 CA GLU B 113 -6.508 -12.167 4.067 1.00 0.00 C ATOM 1101 C GLU B 113 -5.574 -11.072 3.550 1.00 0.00 C ATOM 1102 O GLU B 113 -4.597 -10.742 4.222 1.00 0.00 O ATOM 1103 CB GLU B 113 -6.462 -13.411 3.157 1.00 0.00 C ATOM 1104 CG GLU B 113 -7.139 -14.651 3.761 1.00 0.00 C ATOM 1105 CD GLU B 113 -6.498 -15.154 5.071 1.00 0.00 C ATOM 1106 OE1 GLU B 113 -5.251 -15.111 5.205 1.00 0.00 O ATOM 1107 OE2 GLU B 113 -7.235 -15.620 5.972 1.00 0.00 O1- ATOM 0 H GLU B 113 -8.495 -11.983 3.434 1.00 0.00 H new ATOM 0 HA GLU B 113 -6.151 -12.444 5.059 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -6.943 -13.173 2.208 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -5.421 -13.649 2.936 1.00 0.00 H new ATOM 0 HG2 GLU B 113 -8.188 -14.422 3.949 1.00 0.00 H new ATOM 0 HG3 GLU B 113 -7.115 -15.456 3.027 1.00 0.00 H new ATOM 1114 N LEU B 114 -5.870 -10.445 2.408 1.00 0.00 N ATOM 1115 CA LEU B 114 -5.015 -9.371 1.880 1.00 0.00 C ATOM 1116 C LEU B 114 -4.973 -8.139 2.807 1.00 0.00 C ATOM 1117 O LEU B 114 -3.947 -7.459 2.882 1.00 0.00 O ATOM 1118 CB LEU B 114 -5.407 -9.015 0.435 1.00 0.00 C ATOM 1119 CG LEU B 114 -6.781 -8.348 0.251 1.00 0.00 C ATOM 1120 CD1 LEU B 114 -6.604 -6.850 0.049 1.00 0.00 C ATOM 1121 CD2 LEU B 114 -7.493 -8.911 -0.975 1.00 0.00 C ATOM 0 H LEU B 114 -6.686 -10.657 1.834 1.00 0.00 H new ATOM 0 HA LEU B 114 -3.993 -9.750 1.853 1.00 0.00 H new ATOM 0 HB2 LEU B 114 -4.646 -8.350 0.027 1.00 0.00 H new ATOM 0 HB3 LEU B 114 -5.386 -9.927 -0.161 1.00 0.00 H new ATOM 0 HG LEU B 114 -7.374 -8.547 1.144 1.00 0.00 H new ATOM 0 HD11 LEU B 114 -7.580 -6.383 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU B 114 -6.109 -6.421 0.921 1.00 0.00 H new ATOM 0 HD13 LEU B 114 -5.996 -6.672 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU B 114 -8.463 -8.426 -1.087 1.00 0.00 H new ATOM 0 HD22 LEU B 114 -6.889 -8.725 -1.863 1.00 0.00 H new ATOM 0 HD23 LEU B 114 -7.636 -9.984 -0.852 1.00 0.00 H new ATOM 1133 N SER B 115 -6.055 -7.881 3.550 1.00 0.00 N ATOM 1134 CA SER B 115 -6.087 -6.850 4.596 1.00 0.00 C ATOM 1135 C SER B 115 -5.255 -7.228 5.834 1.00 0.00 C ATOM 1136 O SER B 115 -4.642 -6.347 6.434 1.00 0.00 O ATOM 1137 CB SER B 115 -7.535 -6.554 4.990 1.00 0.00 C ATOM 1138 OG SER B 115 -7.580 -5.447 5.871 1.00 0.00 O ATOM 0 H SER B 115 -6.937 -8.383 3.443 1.00 0.00 H new ATOM 0 HA SER B 115 -5.630 -5.953 4.179 1.00 0.00 H new ATOM 0 HB2 SER B 115 -8.127 -6.345 4.099 1.00 0.00 H new ATOM 0 HB3 SER B 115 -7.976 -7.428 5.468 1.00 0.00 H new ATOM 0 HG SER B 115 -6.702 -5.012 5.895 1.00 0.00 H new ATOM 1144 N ALA B 116 -5.150 -8.512 6.201 1.00 0.00 N ATOM 1145 CA ALA B 116 -4.221 -8.975 7.241 1.00 0.00 C ATOM 1146 C ALA B 116 -2.743 -8.891 6.802 1.00 0.00 C ATOM 1147 O ALA B 116 -1.879 -8.551 7.609 1.00 0.00 O ATOM 1148 CB ALA B 116 -4.581 -10.411 7.642 1.00 0.00 C ATOM 0 H ALA B 116 -5.706 -9.259 5.786 1.00 0.00 H new ATOM 0 HA ALA B 116 -4.327 -8.310 8.098 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -3.893 -10.757 8.414 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -5.600 -10.437 8.027 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -4.506 -11.062 6.771 1.00 0.00 H new ATOM 1154 N LEU B 117 -2.451 -9.165 5.520 1.00 0.00 N ATOM 1155 CA LEU B 117 -1.087 -9.140 4.966 1.00 0.00 C ATOM 1156 C LEU B 117 -0.432 -7.759 5.111 1.00 0.00 C ATOM 1157 O LEU B 117 0.709 -7.686 5.566 1.00 0.00 O ATOM 1158 CB LEU B 117 -1.116 -9.631 3.498 1.00 0.00 C ATOM 1159 CG LEU B 117 -0.720 -11.109 3.309 1.00 0.00 C ATOM 1160 CD1 LEU B 117 -1.574 -12.107 4.087 1.00 0.00 C ATOM 1161 CD2 LEU B 117 -0.814 -11.489 1.829 1.00 0.00 C ATOM 0 H LEU B 117 -3.162 -9.413 4.832 1.00 0.00 H new ATOM 0 HA LEU B 117 -0.462 -9.822 5.542 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -2.119 -9.483 3.099 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -0.443 -9.010 2.907 1.00 0.00 H new ATOM 0 HG LEU B 117 0.297 -11.175 3.697 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -1.220 -13.119 3.891 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -1.498 -11.897 5.154 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -2.614 -12.019 3.773 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -0.533 -12.535 1.703 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -1.836 -11.344 1.480 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -0.140 -10.860 1.248 1.00 0.00 H new ATOM 1173 N LEU B 118 -1.135 -6.658 4.814 1.00 0.00 N ATOM 1174 CA LEU B 118 -0.569 -5.306 4.974 1.00 0.00 C ATOM 1175 C LEU B 118 -0.358 -4.901 6.449 1.00 0.00 C ATOM 1176 O LEU B 118 0.569 -4.147 6.747 1.00 0.00 O ATOM 1177 CB LEU B 118 -1.390 -4.280 4.167 1.00 0.00 C ATOM 1178 CG LEU B 118 -2.736 -3.876 4.801 1.00 0.00 C ATOM 1179 CD1 LEU B 118 -2.635 -2.561 5.585 1.00 0.00 C ATOM 1180 CD2 LEU B 118 -3.801 -3.699 3.724 1.00 0.00 C ATOM 0 H LEU B 118 -2.093 -6.673 4.463 1.00 0.00 H new ATOM 0 HA LEU B 118 0.438 -5.320 4.556 1.00 0.00 H new ATOM 0 HB2 LEU B 118 -0.787 -3.383 4.030 1.00 0.00 H new ATOM 0 HB3 LEU B 118 -1.582 -4.690 3.175 1.00 0.00 H new ATOM 0 HG LEU B 118 -3.008 -4.679 5.486 1.00 0.00 H new ATOM 0 HD11 LEU B 118 -3.607 -2.317 6.013 1.00 0.00 H new ATOM 0 HD12 LEU B 118 -1.903 -2.670 6.385 1.00 0.00 H new ATOM 0 HD13 LEU B 118 -2.323 -1.761 4.914 1.00 0.00 H new ATOM 0 HD21 LEU B 118 -4.745 -3.414 4.189 1.00 0.00 H new ATOM 0 HD22 LEU B 118 -3.489 -2.920 3.028 1.00 0.00 H new ATOM 0 HD23 LEU B 118 -3.931 -4.637 3.184 1.00 0.00 H new ATOM 1192 N ARG B 119 -1.169 -5.426 7.380 1.00 0.00 N ATOM 1193 CA ARG B 119 -1.010 -5.201 8.830 1.00 0.00 C ATOM 1194 C ARG B 119 0.262 -5.870 9.348 1.00 0.00 C ATOM 1195 O ARG B 119 1.096 -5.205 9.963 1.00 0.00 O ATOM 1196 CB ARG B 119 -2.238 -5.721 9.599 1.00 0.00 C ATOM 1197 CG ARG B 119 -3.540 -4.974 9.260 1.00 0.00 C ATOM 1198 CD ARG B 119 -4.735 -5.672 9.921 1.00 0.00 C ATOM 1199 NE ARG B 119 -5.961 -5.558 9.103 1.00 0.00 N ATOM 1200 CZ ARG B 119 -7.166 -5.978 9.445 1.00 0.00 C ATOM 1201 NH1 ARG B 119 -7.430 -6.505 10.603 1.00 0.00 N1+ ATOM 1202 NH2 ARG B 119 -8.141 -5.911 8.599 1.00 0.00 N ATOM 0 H ARG B 119 -1.962 -6.025 7.148 1.00 0.00 H new ATOM 0 HA ARG B 119 -0.926 -4.127 8.996 1.00 0.00 H new ATOM 0 HB2 ARG B 119 -2.370 -6.781 9.382 1.00 0.00 H new ATOM 0 HB3 ARG B 119 -2.049 -5.636 10.669 1.00 0.00 H new ATOM 0 HG2 ARG B 119 -3.476 -3.942 9.604 1.00 0.00 H new ATOM 0 HG3 ARG B 119 -3.679 -4.942 8.179 1.00 0.00 H new ATOM 0 HD2 ARG B 119 -4.500 -6.725 10.078 1.00 0.00 H new ATOM 0 HD3 ARG B 119 -4.912 -5.235 10.904 1.00 0.00 H new ATOM 0 HE ARG B 119 -5.868 -5.114 8.190 1.00 0.00 H new ATOM 0 HH11 ARG B 119 -6.689 -6.610 11.296 1.00 0.00 H new ATOM 0 HH12 ARG B 119 -8.378 -6.814 10.819 1.00 0.00 H new ATOM 0 HH21 ARG B 119 -7.981 -5.533 7.665 1.00 0.00 H new ATOM 0 HH22 ARG B 119 -9.070 -6.236 8.865 1.00 0.00 H new ATOM 1216 N GLN B 120 0.457 -7.155 9.042 1.00 0.00 N ATOM 1217 CA GLN B 120 1.631 -7.913 9.498 1.00 0.00 C ATOM 1218 C GLN B 120 2.932 -7.528 8.771 1.00 0.00 C ATOM 1219 O GLN B 120 4.013 -7.683 9.341 1.00 0.00 O ATOM 1220 CB GLN B 120 1.335 -9.420 9.489 1.00 0.00 C ATOM 1221 CG GLN B 120 1.262 -10.065 8.099 1.00 0.00 C ATOM 1222 CD GLN B 120 0.806 -11.525 8.127 1.00 0.00 C ATOM 1223 OE1 GLN B 120 0.542 -12.128 9.161 1.00 0.00 O ATOM 1224 NE2 GLN B 120 0.712 -12.167 6.981 1.00 0.00 N ATOM 0 H GLN B 120 -0.191 -7.700 8.473 1.00 0.00 H new ATOM 0 HA GLN B 120 1.823 -7.630 10.533 1.00 0.00 H new ATOM 0 HB2 GLN B 120 2.106 -9.929 10.067 1.00 0.00 H new ATOM 0 HB3 GLN B 120 0.388 -9.591 10.001 1.00 0.00 H new ATOM 0 HG2 GLN B 120 0.576 -9.490 7.476 1.00 0.00 H new ATOM 0 HG3 GLN B 120 2.244 -10.008 7.629 1.00 0.00 H new ATOM 0 HE21 GLN B 120 0.927 -11.686 6.108 1.00 0.00 H new ATOM 0 HE22 GLN B 120 0.424 -13.146 6.967 1.00 0.00 H new ATOM 1233 N GLU B 121 2.866 -6.939 7.572 1.00 0.00 N ATOM 1234 CA GLU B 121 4.008 -6.251 6.944 1.00 0.00 C ATOM 1235 C GLU B 121 4.516 -5.069 7.796 1.00 0.00 C ATOM 1236 O GLU B 121 5.725 -4.862 7.899 1.00 0.00 O ATOM 1237 CB GLU B 121 3.625 -5.753 5.536 1.00 0.00 C ATOM 1238 CG GLU B 121 3.781 -6.823 4.444 1.00 0.00 C ATOM 1239 CD GLU B 121 5.235 -7.280 4.233 1.00 0.00 C ATOM 1240 OE1 GLU B 121 6.169 -6.543 4.634 1.00 0.00 O ATOM 1241 OE2 GLU B 121 5.443 -8.384 3.675 1.00 0.00 O1- ATOM 0 H GLU B 121 2.018 -6.924 7.005 1.00 0.00 H new ATOM 0 HA GLU B 121 4.818 -6.977 6.868 1.00 0.00 H new ATOM 0 HB2 GLU B 121 2.591 -5.408 5.550 1.00 0.00 H new ATOM 0 HB3 GLU B 121 4.245 -4.893 5.282 1.00 0.00 H new ATOM 0 HG2 GLU B 121 3.171 -7.688 4.705 1.00 0.00 H new ATOM 0 HG3 GLU B 121 3.392 -6.431 3.504 1.00 0.00 H new ATOM 1248 N MET B 122 3.608 -4.347 8.468 1.00 0.00 N ATOM 1249 CA MET B 122 3.911 -3.309 9.470 1.00 0.00 C ATOM 1250 C MET B 122 4.014 -3.857 10.912 1.00 0.00 C ATOM 1251 O MET B 122 4.038 -3.082 11.875 1.00 0.00 O ATOM 1252 CB MET B 122 2.887 -2.167 9.342 1.00 0.00 C ATOM 1253 CG MET B 122 3.143 -1.344 8.073 1.00 0.00 C ATOM 1254 SD MET B 122 1.958 0.000 7.793 1.00 0.00 S ATOM 1255 CE MET B 122 0.605 -0.940 7.043 1.00 0.00 C ATOM 0 H MET B 122 2.606 -4.472 8.325 1.00 0.00 H new ATOM 0 HA MET B 122 4.906 -2.917 9.260 1.00 0.00 H new ATOM 0 HB2 MET B 122 1.878 -2.579 9.316 1.00 0.00 H new ATOM 0 HB3 MET B 122 2.945 -1.521 10.218 1.00 0.00 H new ATOM 0 HG2 MET B 122 4.146 -0.921 8.126 1.00 0.00 H new ATOM 0 HG3 MET B 122 3.124 -2.012 7.212 1.00 0.00 H new ATOM 0 HE1 MET B 122 -0.046 -0.263 6.491 1.00 0.00 H new ATOM 0 HE2 MET B 122 1.014 -1.686 6.362 1.00 0.00 H new ATOM 0 HE3 MET B 122 0.031 -1.438 7.824 1.00 0.00 H new ATOM 1265 N GLY B 123 4.087 -5.180 11.085 1.00 0.00 N ATOM 1266 CA GLY B 123 4.273 -5.861 12.372 1.00 0.00 C ATOM 1267 C GLY B 123 3.024 -5.995 13.256 1.00 0.00 C ATOM 1268 O GLY B 123 3.132 -6.513 14.368 1.00 0.00 O ATOM 0 H GLY B 123 4.016 -5.832 10.304 1.00 0.00 H new ATOM 0 HA2 GLY B 123 4.664 -6.860 12.178 1.00 0.00 H new ATOM 0 HA3 GLY B 123 5.036 -5.325 12.936 1.00 0.00 H new ATOM 1272 N ASP B 124 1.849 -5.554 12.794 1.00 0.00 N ATOM 1273 CA ASP B 124 0.575 -5.716 13.507 1.00 0.00 C ATOM 1274 C ASP B 124 -0.034 -7.114 13.259 1.00 0.00 C ATOM 1275 O ASP B 124 -0.467 -7.427 12.152 1.00 0.00 O ATOM 1276 CB ASP B 124 -0.378 -4.574 13.109 1.00 0.00 C ATOM 1277 CG ASP B 124 -1.762 -4.635 13.789 1.00 0.00 C ATOM 1278 OD1 ASP B 124 -2.643 -3.836 13.400 1.00 0.00 O ATOM 1279 OD2 ASP B 124 -1.973 -5.452 14.718 1.00 0.00 O1- ATOM 0 H ASP B 124 1.754 -5.068 11.902 1.00 0.00 H new ATOM 0 HA ASP B 124 0.748 -5.653 14.581 1.00 0.00 H new ATOM 0 HB2 ASP B 124 0.093 -3.622 13.354 1.00 0.00 H new ATOM 0 HB3 ASP B 124 -0.516 -4.592 12.028 1.00 0.00 H new ATOM 1284 N ASP B 125 -0.064 -7.955 14.295 1.00 0.00 N ATOM 1285 CA ASP B 125 -0.594 -9.324 14.256 1.00 0.00 C ATOM 1286 C ASP B 125 -2.137 -9.402 14.250 1.00 0.00 C ATOM 1287 O ASP B 125 -2.698 -10.485 14.096 1.00 0.00 O ATOM 1288 CB ASP B 125 -0.015 -10.139 15.426 1.00 0.00 C ATOM 1289 CG ASP B 125 -0.427 -9.615 16.813 1.00 0.00 C ATOM 1290 OD1 ASP B 125 -0.036 -8.485 17.190 1.00 0.00 O ATOM 1291 OD2 ASP B 125 -1.119 -10.355 17.554 1.00 0.00 O1- ATOM 0 H ASP B 125 0.291 -7.695 15.215 1.00 0.00 H new ATOM 0 HA ASP B 125 -0.276 -9.752 13.305 1.00 0.00 H new ATOM 0 HB2 ASP B 125 -0.338 -11.176 15.329 1.00 0.00 H new ATOM 0 HB3 ASP B 125 1.073 -10.136 15.355 1.00 0.00 H new ATOM 1296 N GLY B 126 -2.839 -8.272 14.403 1.00 0.00 N ATOM 1297 CA GLY B 126 -4.305 -8.172 14.422 1.00 0.00 C ATOM 1298 C GLY B 126 -4.971 -8.304 13.041 1.00 0.00 C ATOM 1299 O GLY B 126 -5.604 -7.361 12.561 1.00 0.00 O ATOM 0 H GLY B 126 -2.384 -7.367 14.522 1.00 0.00 H new ATOM 0 HA2 GLY B 126 -4.701 -8.947 15.078 1.00 0.00 H new ATOM 0 HA3 GLY B 126 -4.586 -7.213 14.857 1.00 0.00 H new ATOM 1303 N GLY B 127 -4.819 -9.463 12.396 1.00 0.00 N ATOM 1304 CA GLY B 127 -5.457 -9.822 11.126 1.00 0.00 C ATOM 1305 C GLY B 127 -6.955 -10.153 11.241 1.00 0.00 C ATOM 1306 O GLY B 127 -7.543 -10.130 12.328 1.00 0.00 O ATOM 0 H GLY B 127 -4.224 -10.208 12.759 1.00 0.00 H new ATOM 0 HA2 GLY B 127 -5.332 -8.997 10.424 1.00 0.00 H new ATOM 0 HA3 GLY B 127 -4.938 -10.682 10.703 1.00 0.00 H new ATOM 1310 N GLY B 128 -7.580 -10.470 10.100 1.00 0.00 N ATOM 1311 CA GLY B 128 -9.020 -10.746 9.977 1.00 0.00 C ATOM 1312 C GLY B 128 -9.892 -9.483 9.915 1.00 0.00 C ATOM 1313 O GLY B 128 -9.461 -8.396 10.304 1.00 0.00 O ATOM 0 H GLY B 128 -7.085 -10.544 9.211 1.00 0.00 H new ATOM 0 HA2 GLY B 128 -9.191 -11.338 9.078 1.00 0.00 H new ATOM 0 HA3 GLY B 128 -9.337 -11.354 10.824 1.00 0.00 H new ATOM 1317 N SER B 129 -11.117 -9.629 9.396 1.00 0.00 N ATOM 1318 CA SER B 129 -12.075 -8.531 9.139 1.00 0.00 C ATOM 1319 C SER B 129 -11.480 -7.400 8.279 1.00 0.00 C ATOM 1320 O SER B 129 -10.962 -6.404 8.793 1.00 0.00 O ATOM 1321 CB SER B 129 -12.669 -7.991 10.448 1.00 0.00 C ATOM 1322 OG SER B 129 -13.308 -9.022 11.187 1.00 0.00 O ATOM 0 H SER B 129 -11.487 -10.542 9.132 1.00 0.00 H new ATOM 0 HA SER B 129 -12.886 -8.962 8.552 1.00 0.00 H new ATOM 0 HB2 SER B 129 -11.879 -7.544 11.051 1.00 0.00 H new ATOM 0 HB3 SER B 129 -13.387 -7.201 10.226 1.00 0.00 H new ATOM 0 HG SER B 129 -13.676 -8.651 12.016 1.00 0.00 H new ATOM 1328 N GLY B 130 -11.514 -7.566 6.953 1.00 0.00 N ATOM 1329 CA GLY B 130 -11.033 -6.585 5.973 1.00 0.00 C ATOM 1330 C GLY B 130 -11.955 -5.367 5.782 1.00 0.00 C ATOM 1331 O GLY B 130 -12.822 -5.075 6.613 1.00 0.00 O ATOM 0 H GLY B 130 -11.887 -8.410 6.519 1.00 0.00 H new ATOM 0 HA2 GLY B 130 -10.048 -6.234 6.282 1.00 0.00 H new ATOM 0 HA3 GLY B 130 -10.906 -7.083 5.012 1.00 0.00 H new ATOM 1335 N GLY B 131 -11.770 -4.643 4.670 1.00 0.00 N ATOM 1336 CA GLY B 131 -12.573 -3.463 4.314 1.00 0.00 C ATOM 1337 C GLY B 131 -14.052 -3.774 4.031 1.00 0.00 C ATOM 1338 O GLY B 131 -14.429 -4.927 3.811 1.00 0.00 O ATOM 0 H GLY B 131 -11.049 -4.862 3.983 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -12.514 -2.738 5.126 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -12.137 -2.992 3.433 1.00 0.00 H new ATOM 1342 N GLY B 132 -14.893 -2.734 4.024 1.00 0.00 N ATOM 1343 CA GLY B 132 -16.344 -2.847 3.854 1.00 0.00 C ATOM 1344 C GLY B 132 -16.992 -1.543 3.379 1.00 0.00 C ATOM 1345 O GLY B 132 -17.301 -1.396 2.191 1.00 0.00 O ATOM 0 H GLY B 132 -14.577 -1.771 4.139 1.00 0.00 H new ATOM 0 HA2 GLY B 132 -16.560 -3.637 3.135 1.00 0.00 H new ATOM 0 HA3 GLY B 132 -16.793 -3.146 4.801 1.00 0.00 H new ATOM 1349 N SER B 133 -17.187 -0.590 4.292 1.00 0.00 N ATOM 1350 CA SER B 133 -17.709 0.751 3.962 1.00 0.00 C ATOM 1351 C SER B 133 -16.636 1.642 3.322 1.00 0.00 C ATOM 1352 O SER B 133 -15.436 1.351 3.380 1.00 0.00 O ATOM 1353 CB SER B 133 -18.282 1.435 5.218 1.00 0.00 C ATOM 1354 OG SER B 133 -17.257 1.871 6.097 1.00 0.00 O ATOM 0 H SER B 133 -16.989 -0.720 5.284 1.00 0.00 H new ATOM 0 HA SER B 133 -18.508 0.615 3.233 1.00 0.00 H new ATOM 0 HB2 SER B 133 -18.892 2.288 4.921 1.00 0.00 H new ATOM 0 HB3 SER B 133 -18.939 0.740 5.742 1.00 0.00 H new ATOM 0 HG SER B 133 -16.828 1.093 6.510 1.00 0.00 H new ATOM 1360 N MET B 134 -17.055 2.781 2.755 1.00 0.00 N ATOM 1361 CA MET B 134 -16.147 3.789 2.184 1.00 0.00 C ATOM 1362 C MET B 134 -15.152 4.357 3.217 1.00 0.00 C ATOM 1363 O MET B 134 -14.031 4.721 2.866 1.00 0.00 O ATOM 1364 CB MET B 134 -16.990 4.907 1.542 1.00 0.00 C ATOM 1365 CG MET B 134 -16.177 5.795 0.577 1.00 0.00 C ATOM 1366 SD MET B 134 -16.457 5.491 -1.198 1.00 0.00 S ATOM 1367 CE MET B 134 -15.888 3.776 -1.359 1.00 0.00 C ATOM 0 H MET B 134 -18.041 3.032 2.678 1.00 0.00 H new ATOM 0 HA MET B 134 -15.532 3.305 1.425 1.00 0.00 H new ATOM 0 HB2 MET B 134 -17.824 4.461 1.001 1.00 0.00 H new ATOM 0 HB3 MET B 134 -17.417 5.530 2.328 1.00 0.00 H new ATOM 0 HG2 MET B 134 -16.409 6.839 0.790 1.00 0.00 H new ATOM 0 HG3 MET B 134 -15.117 5.655 0.789 1.00 0.00 H new ATOM 0 HE1 MET B 134 -15.966 3.463 -2.400 1.00 0.00 H new ATOM 0 HE2 MET B 134 -14.849 3.705 -1.036 1.00 0.00 H new ATOM 0 HE3 MET B 134 -16.506 3.128 -0.738 1.00 0.00 H new ATOM 1377 N GLN B 135 -15.522 4.387 4.500 1.00 0.00 N ATOM 1378 CA GLN B 135 -14.662 4.828 5.608 1.00 0.00 C ATOM 1379 C GLN B 135 -13.578 3.794 5.970 1.00 0.00 C ATOM 1380 O GLN B 135 -12.495 4.168 6.431 1.00 0.00 O ATOM 1381 CB GLN B 135 -15.535 5.135 6.843 1.00 0.00 C ATOM 1382 CG GLN B 135 -16.576 6.238 6.579 1.00 0.00 C ATOM 1383 CD GLN B 135 -17.321 6.675 7.841 1.00 0.00 C ATOM 1384 OE1 GLN B 135 -17.307 7.835 8.242 1.00 0.00 O ATOM 1385 NE2 GLN B 135 -17.977 5.769 8.538 1.00 0.00 N ATOM 0 H GLN B 135 -16.451 4.099 4.808 1.00 0.00 H new ATOM 0 HA GLN B 135 -14.141 5.727 5.280 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -16.048 4.225 7.155 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -14.893 5.438 7.670 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -16.077 7.103 6.141 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -17.297 5.880 5.844 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -18.000 4.800 8.221 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -18.462 6.037 9.395 1.00 0.00 H new ATOM 1394 N ASP B 136 -13.828 2.498 5.759 1.00 0.00 N ATOM 1395 CA ASP B 136 -12.876 1.418 6.054 1.00 0.00 C ATOM 1396 C ASP B 136 -11.750 1.329 5.007 1.00 0.00 C ATOM 1397 O ASP B 136 -10.573 1.218 5.364 1.00 0.00 O ATOM 1398 CB ASP B 136 -13.609 0.072 6.141 1.00 0.00 C ATOM 1399 CG ASP B 136 -14.724 0.032 7.201 1.00 0.00 C ATOM 1400 OD1 ASP B 136 -15.812 -0.510 6.891 1.00 0.00 O ATOM 1401 OD2 ASP B 136 -14.524 0.532 8.332 1.00 0.00 O1- ATOM 0 H ASP B 136 -14.710 2.163 5.373 1.00 0.00 H new ATOM 0 HA ASP B 136 -12.416 1.651 7.015 1.00 0.00 H new ATOM 0 HB2 ASP B 136 -14.040 -0.159 5.167 1.00 0.00 H new ATOM 0 HB3 ASP B 136 -12.884 -0.711 6.362 1.00 0.00 H new ATOM 1406 N ILE B 137 -12.098 1.427 3.720 1.00 0.00 N ATOM 1407 CA ILE B 137 -11.140 1.365 2.605 1.00 0.00 C ATOM 1408 C ILE B 137 -10.144 2.533 2.630 1.00 0.00 C ATOM 1409 O ILE B 137 -8.959 2.309 2.391 1.00 0.00 O ATOM 1410 CB ILE B 137 -11.869 1.234 1.246 1.00 0.00 C ATOM 1411 CG1 ILE B 137 -10.860 1.163 0.074 1.00 0.00 C ATOM 1412 CG2 ILE B 137 -12.906 2.341 1.027 1.00 0.00 C ATOM 1413 CD1 ILE B 137 -11.514 0.881 -1.291 1.00 0.00 C ATOM 0 H ILE B 137 -13.064 1.553 3.417 1.00 0.00 H new ATOM 0 HA ILE B 137 -10.545 0.461 2.736 1.00 0.00 H new ATOM 0 HB ILE B 137 -12.420 0.294 1.273 1.00 0.00 H new ATOM 0 HG12 ILE B 137 -10.315 2.105 0.018 1.00 0.00 H new ATOM 0 HG13 ILE B 137 -10.128 0.383 0.284 1.00 0.00 H new ATOM 0 HG21 ILE B 137 -13.388 2.202 0.059 1.00 0.00 H new ATOM 0 HG22 ILE B 137 -13.657 2.297 1.816 1.00 0.00 H new ATOM 0 HG23 ILE B 137 -12.412 3.312 1.050 1.00 0.00 H new ATOM 0 HD11 ILE B 137 -10.745 0.846 -2.063 1.00 0.00 H new ATOM 0 HD12 ILE B 137 -12.035 -0.076 -1.254 1.00 0.00 H new ATOM 0 HD13 ILE B 137 -12.226 1.673 -1.524 1.00 0.00 H new ATOM 1425 N GLN B 138 -10.583 3.754 2.978 1.00 0.00 N ATOM 1426 CA GLN B 138 -9.691 4.923 3.084 1.00 0.00 C ATOM 1427 C GLN B 138 -8.530 4.660 4.058 1.00 0.00 C ATOM 1428 O GLN B 138 -7.378 4.967 3.751 1.00 0.00 O ATOM 1429 CB GLN B 138 -10.465 6.173 3.540 1.00 0.00 C ATOM 1430 CG GLN B 138 -11.278 6.835 2.420 1.00 0.00 C ATOM 1431 CD GLN B 138 -11.887 8.164 2.872 1.00 0.00 C ATOM 1432 OE1 GLN B 138 -13.073 8.276 3.159 1.00 0.00 O ATOM 1433 NE2 GLN B 138 -11.111 9.228 2.970 1.00 0.00 N ATOM 0 H GLN B 138 -11.559 3.959 3.193 1.00 0.00 H new ATOM 0 HA GLN B 138 -9.282 5.099 2.089 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -11.138 5.897 4.352 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -9.760 6.900 3.944 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -10.636 7.004 1.556 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -12.072 6.161 2.100 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -10.120 9.160 2.737 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -11.502 10.118 3.279 1.00 0.00 H new ATOM 1442 N GLN B 139 -8.823 4.073 5.223 1.00 0.00 N ATOM 1443 CA GLN B 139 -7.827 3.774 6.259 1.00 0.00 C ATOM 1444 C GLN B 139 -6.831 2.703 5.793 1.00 0.00 C ATOM 1445 O GLN B 139 -5.619 2.924 5.844 1.00 0.00 O ATOM 1446 CB GLN B 139 -8.529 3.346 7.562 1.00 0.00 C ATOM 1447 CG GLN B 139 -9.383 4.460 8.185 1.00 0.00 C ATOM 1448 CD GLN B 139 -10.250 3.930 9.327 1.00 0.00 C ATOM 1449 OE1 GLN B 139 -9.783 3.662 10.431 1.00 0.00 O ATOM 1450 NE2 GLN B 139 -11.539 3.762 9.119 1.00 0.00 N ATOM 0 H GLN B 139 -9.769 3.789 5.477 1.00 0.00 H new ATOM 0 HA GLN B 139 -7.256 4.682 6.452 1.00 0.00 H new ATOM 0 HB2 GLN B 139 -9.162 2.483 7.359 1.00 0.00 H new ATOM 0 HB3 GLN B 139 -7.777 3.027 8.284 1.00 0.00 H new ATOM 0 HG2 GLN B 139 -8.734 5.252 8.557 1.00 0.00 H new ATOM 0 HG3 GLN B 139 -10.020 4.903 7.419 1.00 0.00 H new ATOM 0 HE21 GLN B 139 -11.941 3.980 8.207 1.00 0.00 H new ATOM 0 HE22 GLN B 139 -12.136 3.414 9.869 1.00 0.00 H new ATOM 1459 N LEU B 140 -7.323 1.561 5.303 1.00 0.00 N ATOM 1460 CA LEU B 140 -6.490 0.430 4.869 1.00 0.00 C ATOM 1461 C LEU B 140 -5.587 0.791 3.679 1.00 0.00 C ATOM 1462 O LEU B 140 -4.391 0.486 3.690 1.00 0.00 O ATOM 1463 CB LEU B 140 -7.398 -0.758 4.498 1.00 0.00 C ATOM 1464 CG LEU B 140 -8.177 -1.368 5.679 1.00 0.00 C ATOM 1465 CD1 LEU B 140 -9.198 -2.373 5.145 1.00 0.00 C ATOM 1466 CD2 LEU B 140 -7.248 -2.069 6.673 1.00 0.00 C ATOM 0 H LEU B 140 -8.323 1.392 5.194 1.00 0.00 H new ATOM 0 HA LEU B 140 -5.835 0.162 5.698 1.00 0.00 H new ATOM 0 HB2 LEU B 140 -8.111 -0.430 3.741 1.00 0.00 H new ATOM 0 HB3 LEU B 140 -6.786 -1.537 4.043 1.00 0.00 H new ATOM 0 HG LEU B 140 -8.679 -0.556 6.205 1.00 0.00 H new ATOM 0 HD11 LEU B 140 -9.751 -2.807 5.978 1.00 0.00 H new ATOM 0 HD12 LEU B 140 -9.891 -1.866 4.474 1.00 0.00 H new ATOM 0 HD13 LEU B 140 -8.680 -3.164 4.602 1.00 0.00 H new ATOM 0 HD21 LEU B 140 -7.837 -2.485 7.490 1.00 0.00 H new ATOM 0 HD22 LEU B 140 -6.712 -2.872 6.166 1.00 0.00 H new ATOM 0 HD23 LEU B 140 -6.532 -1.350 7.071 1.00 0.00 H new ATOM 1478 N LEU B 141 -6.149 1.457 2.671 1.00 0.00 N ATOM 1479 CA LEU B 141 -5.447 1.769 1.424 1.00 0.00 C ATOM 1480 C LEU B 141 -4.401 2.882 1.622 1.00 0.00 C ATOM 1481 O LEU B 141 -3.309 2.800 1.054 1.00 0.00 O ATOM 1482 CB LEU B 141 -6.519 2.074 0.360 1.00 0.00 C ATOM 1483 CG LEU B 141 -6.032 2.077 -1.100 1.00 0.00 C ATOM 1484 CD1 LEU B 141 -5.448 0.721 -1.511 1.00 0.00 C ATOM 1485 CD2 LEU B 141 -7.219 2.360 -2.020 1.00 0.00 C ATOM 0 H LEU B 141 -7.110 1.798 2.696 1.00 0.00 H new ATOM 0 HA LEU B 141 -4.854 0.923 1.078 1.00 0.00 H new ATOM 0 HB2 LEU B 141 -7.318 1.339 0.455 1.00 0.00 H new ATOM 0 HB3 LEU B 141 -6.955 3.049 0.580 1.00 0.00 H new ATOM 0 HG LEU B 141 -5.258 2.840 -1.185 1.00 0.00 H new ATOM 0 HD11 LEU B 141 -5.116 0.767 -2.548 1.00 0.00 H new ATOM 0 HD12 LEU B 141 -4.600 0.480 -0.869 1.00 0.00 H new ATOM 0 HD13 LEU B 141 -6.211 -0.050 -1.408 1.00 0.00 H new ATOM 0 HD21 LEU B 141 -6.883 2.364 -3.057 1.00 0.00 H new ATOM 0 HD22 LEU B 141 -7.975 1.586 -1.887 1.00 0.00 H new ATOM 0 HD23 LEU B 141 -7.647 3.332 -1.774 1.00 0.00 H new ATOM 1497 N ALA B 142 -4.664 3.862 2.501 1.00 0.00 N ATOM 1498 CA ALA B 142 -3.679 4.864 2.919 1.00 0.00 C ATOM 1499 C ALA B 142 -2.556 4.269 3.788 1.00 0.00 C ATOM 1500 O ALA B 142 -1.386 4.617 3.601 1.00 0.00 O ATOM 1501 CB ALA B 142 -4.388 6.002 3.658 1.00 0.00 C ATOM 0 H ALA B 142 -5.575 3.979 2.944 1.00 0.00 H new ATOM 0 HA ALA B 142 -3.200 5.250 2.019 1.00 0.00 H new ATOM 0 HB1 ALA B 142 -3.655 6.747 3.968 1.00 0.00 H new ATOM 0 HB2 ALA B 142 -5.119 6.466 2.996 1.00 0.00 H new ATOM 0 HB3 ALA B 142 -4.896 5.604 4.537 1.00 0.00 H new ATOM 1507 N LYS B 143 -2.869 3.345 4.711 1.00 0.00 N ATOM 1508 CA LYS B 143 -1.866 2.633 5.523 1.00 0.00 C ATOM 1509 C LYS B 143 -0.922 1.794 4.656 1.00 0.00 C ATOM 1510 O LYS B 143 0.293 1.843 4.849 1.00 0.00 O ATOM 1511 CB LYS B 143 -2.576 1.759 6.576 1.00 0.00 C ATOM 1512 CG LYS B 143 -2.979 2.538 7.836 1.00 0.00 C ATOM 1513 CD LYS B 143 -1.813 2.894 8.773 1.00 0.00 C ATOM 1514 CE LYS B 143 -1.176 1.657 9.413 1.00 0.00 C ATOM 1515 NZ LYS B 143 -0.075 2.033 10.340 1.00 0.00 N1+ ATOM 0 H LYS B 143 -3.829 3.069 4.917 1.00 0.00 H new ATOM 0 HA LYS B 143 -1.250 3.374 6.032 1.00 0.00 H new ATOM 0 HB2 LYS B 143 -3.467 1.316 6.130 1.00 0.00 H new ATOM 0 HB3 LYS B 143 -1.919 0.937 6.860 1.00 0.00 H new ATOM 0 HG2 LYS B 143 -3.478 3.459 7.533 1.00 0.00 H new ATOM 0 HG3 LYS B 143 -3.708 1.949 8.393 1.00 0.00 H new ATOM 0 HD2 LYS B 143 -1.054 3.440 8.212 1.00 0.00 H new ATOM 0 HD3 LYS B 143 -2.172 3.561 9.557 1.00 0.00 H new ATOM 0 HE2 LYS B 143 -1.935 1.095 9.956 1.00 0.00 H new ATOM 0 HE3 LYS B 143 -0.789 1.000 8.634 1.00 0.00 H new ATOM 0 HZ1 LYS B 143 0.336 1.174 10.757 1.00 0.00 H new ATOM 0 HZ2 LYS B 143 0.660 2.549 9.815 1.00 0.00 H new ATOM 0 HZ3 LYS B 143 -0.450 2.640 11.097 1.00 0.00 H new ATOM 1529 N SER B 144 -1.462 1.088 3.667 1.00 0.00 N ATOM 1530 CA SER B 144 -0.676 0.320 2.693 1.00 0.00 C ATOM 1531 C SER B 144 0.232 1.226 1.838 1.00 0.00 C ATOM 1532 O SER B 144 1.433 0.982 1.722 1.00 0.00 O ATOM 1533 CB SER B 144 -1.635 -0.527 1.852 1.00 0.00 C ATOM 1534 OG SER B 144 -0.922 -1.384 0.982 1.00 0.00 O ATOM 0 H SER B 144 -2.469 1.029 3.513 1.00 0.00 H new ATOM 0 HA SER B 144 0.008 -0.346 3.219 1.00 0.00 H new ATOM 0 HB2 SER B 144 -2.274 -1.118 2.508 1.00 0.00 H new ATOM 0 HB3 SER B 144 -2.289 0.125 1.272 1.00 0.00 H new ATOM 0 HG SER B 144 -1.555 -1.916 0.456 1.00 0.00 H new ATOM 1540 N LEU B 145 -0.300 2.346 1.330 1.00 0.00 N ATOM 1541 CA LEU B 145 0.450 3.365 0.583 1.00 0.00 C ATOM 1542 C LEU B 145 1.586 4.004 1.414 1.00 0.00 C ATOM 1543 O LEU B 145 2.697 4.184 0.910 1.00 0.00 O ATOM 1544 CB LEU B 145 -0.580 4.379 0.035 1.00 0.00 C ATOM 1545 CG LEU B 145 -0.096 5.599 -0.770 1.00 0.00 C ATOM 1546 CD1 LEU B 145 0.399 6.749 0.108 1.00 0.00 C ATOM 1547 CD2 LEU B 145 0.969 5.252 -1.811 1.00 0.00 C ATOM 0 H LEU B 145 -1.289 2.574 1.430 1.00 0.00 H new ATOM 0 HA LEU B 145 0.984 2.911 -0.252 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -1.276 3.827 -0.597 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -1.150 4.755 0.884 1.00 0.00 H new ATOM 0 HG LEU B 145 -0.989 5.937 -1.296 1.00 0.00 H new ATOM 0 HD11 LEU B 145 0.725 7.575 -0.524 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -0.410 7.085 0.757 1.00 0.00 H new ATOM 0 HD13 LEU B 145 1.235 6.407 0.718 1.00 0.00 H new ATOM 0 HD21 LEU B 145 1.266 6.156 -2.343 1.00 0.00 H new ATOM 0 HD22 LEU B 145 1.838 4.822 -1.313 1.00 0.00 H new ATOM 0 HD23 LEU B 145 0.563 4.531 -2.520 1.00 0.00 H new ATOM 1559 N THR B 146 1.346 4.290 2.697 1.00 0.00 N ATOM 1560 CA THR B 146 2.349 4.885 3.602 1.00 0.00 C ATOM 1561 C THR B 146 3.590 3.999 3.759 1.00 0.00 C ATOM 1562 O THR B 146 4.714 4.508 3.757 1.00 0.00 O ATOM 1563 CB THR B 146 1.724 5.180 4.980 1.00 0.00 C ATOM 1564 OG1 THR B 146 0.688 6.133 4.853 1.00 0.00 O ATOM 1565 CG2 THR B 146 2.722 5.772 5.979 1.00 0.00 C ATOM 0 H THR B 146 0.446 4.116 3.145 1.00 0.00 H new ATOM 0 HA THR B 146 2.675 5.821 3.148 1.00 0.00 H new ATOM 0 HB THR B 146 1.365 4.218 5.346 1.00 0.00 H new ATOM 0 HG1 THR B 146 -0.084 5.721 4.412 1.00 0.00 H new ATOM 0 HG21 THR B 146 2.220 5.957 6.929 1.00 0.00 H new ATOM 0 HG22 THR B 146 3.542 5.071 6.133 1.00 0.00 H new ATOM 0 HG23 THR B 146 3.115 6.710 5.588 1.00 0.00 H new ATOM 1573 N GLU B 147 3.425 2.677 3.837 1.00 0.00 N ATOM 1574 CA GLU B 147 4.543 1.731 3.944 1.00 0.00 C ATOM 1575 C GLU B 147 5.415 1.690 2.673 1.00 0.00 C ATOM 1576 O GLU B 147 6.634 1.531 2.775 1.00 0.00 O ATOM 1577 CB GLU B 147 3.976 0.349 4.324 1.00 0.00 C ATOM 1578 CG GLU B 147 5.010 -0.775 4.523 1.00 0.00 C ATOM 1579 CD GLU B 147 5.850 -0.683 5.808 1.00 0.00 C ATOM 1580 OE1 GLU B 147 6.340 -1.748 6.256 1.00 0.00 O ATOM 1581 OE2 GLU B 147 6.052 0.418 6.372 1.00 0.00 O1- ATOM 0 H GLU B 147 2.509 2.228 3.828 1.00 0.00 H new ATOM 0 HA GLU B 147 5.222 2.067 4.728 1.00 0.00 H new ATOM 0 HB2 GLU B 147 3.402 0.455 5.245 1.00 0.00 H new ATOM 0 HB3 GLU B 147 3.277 0.039 3.547 1.00 0.00 H new ATOM 0 HG2 GLU B 147 4.486 -1.731 4.520 1.00 0.00 H new ATOM 0 HG3 GLU B 147 5.686 -0.779 3.668 1.00 0.00 H new ATOM 1588 N ILE B 148 4.845 1.915 1.478 1.00 0.00 N ATOM 1589 CA ILE B 148 5.625 2.044 0.225 1.00 0.00 C ATOM 1590 C ILE B 148 6.581 3.240 0.322 1.00 0.00 C ATOM 1591 O ILE B 148 7.788 3.100 0.116 1.00 0.00 O ATOM 1592 CB ILE B 148 4.712 2.186 -1.022 1.00 0.00 C ATOM 1593 CG1 ILE B 148 3.725 1.010 -1.177 1.00 0.00 C ATOM 1594 CG2 ILE B 148 5.561 2.339 -2.298 1.00 0.00 C ATOM 1595 CD1 ILE B 148 2.604 1.284 -2.187 1.00 0.00 C ATOM 0 H ILE B 148 3.838 2.013 1.348 1.00 0.00 H new ATOM 0 HA ILE B 148 6.200 1.126 0.102 1.00 0.00 H new ATOM 0 HB ILE B 148 4.116 3.086 -0.872 1.00 0.00 H new ATOM 0 HG12 ILE B 148 4.275 0.122 -1.488 1.00 0.00 H new ATOM 0 HG13 ILE B 148 3.283 0.786 -0.206 1.00 0.00 H new ATOM 0 HG21 ILE B 148 4.904 2.437 -3.162 1.00 0.00 H new ATOM 0 HG22 ILE B 148 6.186 3.228 -2.214 1.00 0.00 H new ATOM 0 HG23 ILE B 148 6.194 1.460 -2.421 1.00 0.00 H new ATOM 0 HD11 ILE B 148 1.947 0.416 -2.246 1.00 0.00 H new ATOM 0 HD12 ILE B 148 2.029 2.153 -1.866 1.00 0.00 H new ATOM 0 HD13 ILE B 148 3.038 1.478 -3.168 1.00 0.00 H new ATOM 1607 N LYS B 149 6.054 4.416 0.685 1.00 0.00 N ATOM 1608 CA LYS B 149 6.824 5.671 0.826 1.00 0.00 C ATOM 1609 C LYS B 149 7.917 5.560 1.898 1.00 0.00 C ATOM 1610 O LYS B 149 9.048 5.998 1.664 1.00 0.00 O ATOM 1611 CB LYS B 149 5.861 6.830 1.145 1.00 0.00 C ATOM 1612 CG LYS B 149 4.948 7.191 -0.042 1.00 0.00 C ATOM 1613 CD LYS B 149 4.007 8.351 0.324 1.00 0.00 C ATOM 1614 CE LYS B 149 3.118 8.778 -0.851 1.00 0.00 C ATOM 1615 NZ LYS B 149 3.868 9.536 -1.885 1.00 0.00 N1+ ATOM 0 H LYS B 149 5.062 4.530 0.894 1.00 0.00 H new ATOM 0 HA LYS B 149 7.330 5.867 -0.119 1.00 0.00 H new ATOM 0 HB2 LYS B 149 5.245 6.559 2.002 1.00 0.00 H new ATOM 0 HB3 LYS B 149 6.439 7.708 1.433 1.00 0.00 H new ATOM 0 HG2 LYS B 149 5.556 7.468 -0.903 1.00 0.00 H new ATOM 0 HG3 LYS B 149 4.362 6.320 -0.333 1.00 0.00 H new ATOM 0 HD2 LYS B 149 3.377 8.053 1.163 1.00 0.00 H new ATOM 0 HD3 LYS B 149 4.599 9.204 0.657 1.00 0.00 H new ATOM 0 HE2 LYS B 149 2.672 7.893 -1.306 1.00 0.00 H new ATOM 0 HE3 LYS B 149 2.298 9.392 -0.478 1.00 0.00 H new ATOM 0 HZ1 LYS B 149 3.268 10.299 -2.259 1.00 0.00 H new ATOM 0 HZ2 LYS B 149 4.725 9.945 -1.462 1.00 0.00 H new ATOM 0 HZ3 LYS B 149 4.136 8.895 -2.659 1.00 0.00 H new ATOM 1629 N ARG B 150 7.610 4.925 3.032 1.00 0.00 N ATOM 1630 CA ARG B 150 8.549 4.653 4.138 1.00 0.00 C ATOM 1631 C ARG B 150 9.754 3.812 3.687 1.00 0.00 C ATOM 1632 O ARG B 150 10.898 4.190 3.957 1.00 0.00 O ATOM 1633 CB ARG B 150 7.755 4.002 5.284 1.00 0.00 C ATOM 1634 CG ARG B 150 8.625 3.627 6.495 1.00 0.00 C ATOM 1635 CD ARG B 150 7.730 3.178 7.662 1.00 0.00 C ATOM 1636 NE ARG B 150 8.514 2.562 8.746 1.00 0.00 N ATOM 1637 CZ ARG B 150 8.643 1.271 9.010 1.00 0.00 C ATOM 1638 NH1 ARG B 150 8.028 0.342 8.336 1.00 0.00 N1+ ATOM 1639 NH2 ARG B 150 9.423 0.876 9.979 1.00 0.00 N ATOM 0 H ARG B 150 6.671 4.572 3.218 1.00 0.00 H new ATOM 0 HA ARG B 150 8.986 5.587 4.492 1.00 0.00 H new ATOM 0 HB2 ARG B 150 6.971 4.687 5.608 1.00 0.00 H new ATOM 0 HB3 ARG B 150 7.261 3.105 4.910 1.00 0.00 H new ATOM 0 HG2 ARG B 150 9.314 2.827 6.225 1.00 0.00 H new ATOM 0 HG3 ARG B 150 9.231 4.481 6.797 1.00 0.00 H new ATOM 0 HD2 ARG B 150 7.183 4.036 8.052 1.00 0.00 H new ATOM 0 HD3 ARG B 150 6.989 2.466 7.299 1.00 0.00 H new ATOM 0 HE ARG B 150 9.014 3.202 9.363 1.00 0.00 H new ATOM 0 HH11 ARG B 150 7.412 0.595 7.563 1.00 0.00 H new ATOM 0 HH12 ARG B 150 8.162 -0.639 8.581 1.00 0.00 H new ATOM 0 HH21 ARG B 150 9.934 1.562 10.534 1.00 0.00 H new ATOM 0 HH22 ARG B 150 9.521 -0.119 10.181 1.00 0.00 H new ATOM 1653 N LEU B 151 9.519 2.711 2.975 1.00 0.00 N ATOM 1654 CA LEU B 151 10.582 1.834 2.477 1.00 0.00 C ATOM 1655 C LEU B 151 11.388 2.462 1.324 1.00 0.00 C ATOM 1656 O LEU B 151 12.608 2.278 1.280 1.00 0.00 O ATOM 1657 CB LEU B 151 9.982 0.466 2.097 1.00 0.00 C ATOM 1658 CG LEU B 151 9.930 -0.561 3.247 1.00 0.00 C ATOM 1659 CD1 LEU B 151 11.334 -1.051 3.616 1.00 0.00 C ATOM 1660 CD2 LEU B 151 9.260 -0.053 4.529 1.00 0.00 C ATOM 0 H LEU B 151 8.581 2.399 2.725 1.00 0.00 H new ATOM 0 HA LEU B 151 11.306 1.689 3.279 1.00 0.00 H new ATOM 0 HB2 LEU B 151 8.971 0.621 1.721 1.00 0.00 H new ATOM 0 HB3 LEU B 151 10.565 0.044 1.278 1.00 0.00 H new ATOM 0 HG LEU B 151 9.317 -1.370 2.851 1.00 0.00 H new ATOM 0 HD11 LEU B 151 11.265 -1.774 4.429 1.00 0.00 H new ATOM 0 HD12 LEU B 151 11.794 -1.524 2.748 1.00 0.00 H new ATOM 0 HD13 LEU B 151 11.943 -0.205 3.933 1.00 0.00 H new ATOM 0 HD21 LEU B 151 9.269 -0.842 5.281 1.00 0.00 H new ATOM 0 HD22 LEU B 151 9.804 0.814 4.905 1.00 0.00 H new ATOM 0 HD23 LEU B 151 8.230 0.231 4.313 1.00 0.00 H new ATOM 1672 N LYS B 152 10.760 3.262 0.452 1.00 0.00 N ATOM 1673 CA LYS B 152 11.481 4.053 -0.566 1.00 0.00 C ATOM 1674 C LYS B 152 12.413 5.098 0.056 1.00 0.00 C ATOM 1675 O LYS B 152 13.552 5.232 -0.391 1.00 0.00 O ATOM 1676 CB LYS B 152 10.487 4.718 -1.530 1.00 0.00 C ATOM 1677 CG LYS B 152 9.901 3.712 -2.529 1.00 0.00 C ATOM 1678 CD LYS B 152 9.034 4.421 -3.572 1.00 0.00 C ATOM 1679 CE LYS B 152 8.449 3.415 -4.569 1.00 0.00 C ATOM 1680 NZ LYS B 152 7.740 4.133 -5.653 1.00 0.00 N1+ ATOM 0 H LYS B 152 9.747 3.382 0.428 1.00 0.00 H new ATOM 0 HA LYS B 152 12.111 3.361 -1.125 1.00 0.00 H new ATOM 0 HB2 LYS B 152 9.679 5.176 -0.960 1.00 0.00 H new ATOM 0 HB3 LYS B 152 10.988 5.519 -2.073 1.00 0.00 H new ATOM 0 HG2 LYS B 152 10.708 3.174 -3.026 1.00 0.00 H new ATOM 0 HG3 LYS B 152 9.304 2.971 -1.997 1.00 0.00 H new ATOM 0 HD2 LYS B 152 8.226 4.959 -3.075 1.00 0.00 H new ATOM 0 HD3 LYS B 152 9.630 5.162 -4.104 1.00 0.00 H new ATOM 0 HE2 LYS B 152 9.246 2.801 -4.988 1.00 0.00 H new ATOM 0 HE3 LYS B 152 7.762 2.741 -4.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 152 6.941 3.557 -5.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 152 7.386 5.042 -5.293 1.00 0.00 H new ATOM 0 HZ3 LYS B 152 8.395 4.305 -6.442 1.00 0.00 H new ATOM 1694 N ALA B 153 11.977 5.790 1.110 1.00 0.00 N ATOM 1695 CA ALA B 153 12.809 6.742 1.849 1.00 0.00 C ATOM 1696 C ALA B 153 14.019 6.057 2.521 1.00 0.00 C ATOM 1697 O ALA B 153 15.140 6.563 2.438 1.00 0.00 O ATOM 1698 CB ALA B 153 11.931 7.473 2.866 1.00 0.00 C ATOM 0 H ALA B 153 11.029 5.705 1.478 1.00 0.00 H new ATOM 0 HA ALA B 153 13.230 7.465 1.150 1.00 0.00 H new ATOM 0 HB1 ALA B 153 12.538 8.186 3.424 1.00 0.00 H new ATOM 0 HB2 ALA B 153 11.135 8.004 2.344 1.00 0.00 H new ATOM 0 HB3 ALA B 153 11.494 6.750 3.555 1.00 0.00 H new ATOM 1704 N ALA B 154 13.823 4.869 3.111 1.00 0.00 N ATOM 1705 CA ALA B 154 14.902 4.060 3.678 1.00 0.00 C ATOM 1706 C ALA B 154 15.911 3.593 2.604 1.00 0.00 C ATOM 1707 O ALA B 154 17.124 3.703 2.802 1.00 0.00 O ATOM 1708 CB ALA B 154 14.281 2.885 4.432 1.00 0.00 C ATOM 0 H ALA B 154 12.901 4.442 3.207 1.00 0.00 H new ATOM 0 HA ALA B 154 15.481 4.670 4.372 1.00 0.00 H new ATOM 0 HB1 ALA B 154 15.072 2.270 4.862 1.00 0.00 H new ATOM 0 HB2 ALA B 154 13.640 3.262 5.229 1.00 0.00 H new ATOM 0 HB3 ALA B 154 13.688 2.284 3.743 1.00 0.00 H new ATOM 1714 N ASN B 155 15.425 3.129 1.446 1.00 0.00 N ATOM 1715 CA ASN B 155 16.250 2.700 0.310 1.00 0.00 C ATOM 1716 C ASN B 155 17.085 3.874 -0.260 1.00 0.00 C ATOM 1717 O ASN B 155 18.285 3.742 -0.497 1.00 0.00 O ATOM 1718 CB ASN B 155 15.315 2.074 -0.742 1.00 0.00 C ATOM 1719 CG ASN B 155 16.043 1.258 -1.800 1.00 0.00 C ATOM 1720 OD1 ASN B 155 16.999 1.691 -2.425 1.00 0.00 O ATOM 1721 ND2 ASN B 155 15.608 0.041 -2.050 1.00 0.00 N ATOM 0 H ASN B 155 14.424 3.039 1.269 1.00 0.00 H new ATOM 0 HA ASN B 155 16.979 1.956 0.630 1.00 0.00 H new ATOM 0 HB2 ASN B 155 14.591 1.434 -0.237 1.00 0.00 H new ATOM 0 HB3 ASN B 155 14.751 2.868 -1.232 1.00 0.00 H new ATOM 0 HD21 ASN B 155 16.068 -0.530 -2.759 1.00 0.00 H new ATOM 0 HD22 ASN B 155 14.811 -0.331 -1.535 1.00 0.00 H new ATOM 1728 N GLN B 156 16.480 5.057 -0.395 1.00 0.00 N ATOM 1729 CA GLN B 156 17.167 6.276 -0.831 1.00 0.00 C ATOM 1730 C GLN B 156 18.263 6.724 0.159 1.00 0.00 C ATOM 1731 O GLN B 156 19.339 7.143 -0.277 1.00 0.00 O ATOM 1732 CB GLN B 156 16.130 7.391 -1.081 1.00 0.00 C ATOM 1733 CG GLN B 156 16.720 8.755 -1.493 1.00 0.00 C ATOM 1734 CD GLN B 156 17.469 8.725 -2.827 1.00 0.00 C ATOM 1735 OE1 GLN B 156 16.934 9.041 -3.881 1.00 0.00 O ATOM 1736 NE2 GLN B 156 18.734 8.352 -2.839 1.00 0.00 N ATOM 0 H GLN B 156 15.488 5.197 -0.203 1.00 0.00 H new ATOM 0 HA GLN B 156 17.685 6.058 -1.765 1.00 0.00 H new ATOM 0 HB2 GLN B 156 15.444 7.059 -1.861 1.00 0.00 H new ATOM 0 HB3 GLN B 156 15.540 7.527 -0.174 1.00 0.00 H new ATOM 0 HG2 GLN B 156 15.913 9.485 -1.556 1.00 0.00 H new ATOM 0 HG3 GLN B 156 17.400 9.097 -0.713 1.00 0.00 H new ATOM 0 HE21 GLN B 156 19.195 8.085 -1.969 1.00 0.00 H new ATOM 0 HE22 GLN B 156 19.251 8.330 -3.718 1.00 0.00 H new ATOM 1745 N ALA B 157 18.022 6.621 1.472 1.00 0.00 N ATOM 1746 CA ALA B 157 18.996 7.017 2.491 1.00 0.00 C ATOM 1747 C ALA B 157 20.279 6.155 2.466 1.00 0.00 C ATOM 1748 O ALA B 157 21.388 6.689 2.508 1.00 0.00 O ATOM 1749 CB ALA B 157 18.313 6.977 3.865 1.00 0.00 C ATOM 0 H ALA B 157 17.148 6.261 1.855 1.00 0.00 H new ATOM 0 HA ALA B 157 19.329 8.032 2.274 1.00 0.00 H new ATOM 0 HB1 ALA B 157 19.027 7.270 4.635 1.00 0.00 H new ATOM 0 HB2 ALA B 157 17.469 7.666 3.872 1.00 0.00 H new ATOM 0 HB3 ALA B 157 17.958 5.966 4.065 1.00 0.00 H new ATOM 1755 N LEU B 158 20.140 4.826 2.353 1.00 0.00 N ATOM 1756 CA LEU B 158 21.279 3.903 2.245 1.00 0.00 C ATOM 1757 C LEU B 158 21.964 3.941 0.868 1.00 0.00 C ATOM 1758 O LEU B 158 23.170 3.722 0.800 1.00 0.00 O ATOM 1759 CB LEU B 158 20.857 2.485 2.684 1.00 0.00 C ATOM 1760 CG LEU B 158 19.761 1.793 1.844 1.00 0.00 C ATOM 1761 CD1 LEU B 158 20.307 1.097 0.598 1.00 0.00 C ATOM 1762 CD2 LEU B 158 19.025 0.736 2.661 1.00 0.00 C ATOM 0 H LEU B 158 19.233 4.360 2.334 1.00 0.00 H new ATOM 0 HA LEU B 158 22.052 4.244 2.934 1.00 0.00 H new ATOM 0 HB2 LEU B 158 21.743 1.850 2.677 1.00 0.00 H new ATOM 0 HB3 LEU B 158 20.511 2.538 3.716 1.00 0.00 H new ATOM 0 HG LEU B 158 19.090 2.597 1.541 1.00 0.00 H new ATOM 0 HD11 LEU B 158 19.486 0.631 0.052 1.00 0.00 H new ATOM 0 HD12 LEU B 158 20.798 1.830 -0.042 1.00 0.00 H new ATOM 0 HD13 LEU B 158 21.026 0.333 0.894 1.00 0.00 H new ATOM 0 HD21 LEU B 158 18.260 0.266 2.043 1.00 0.00 H new ATOM 0 HD22 LEU B 158 19.733 -0.021 2.999 1.00 0.00 H new ATOM 0 HD23 LEU B 158 18.556 1.206 3.525 1.00 0.00 H new ATOM 1774 N GLU B 159 21.264 4.283 -0.224 1.00 0.00 N ATOM 1775 CA GLU B 159 21.873 4.432 -1.560 1.00 0.00 C ATOM 1776 C GLU B 159 22.948 5.539 -1.574 1.00 0.00 C ATOM 1777 O GLU B 159 23.975 5.391 -2.241 1.00 0.00 O ATOM 1778 CB GLU B 159 20.788 4.717 -2.616 1.00 0.00 C ATOM 1779 CG GLU B 159 20.168 3.427 -3.177 1.00 0.00 C ATOM 1780 CD GLU B 159 21.041 2.792 -4.276 1.00 0.00 C ATOM 1781 OE1 GLU B 159 21.599 1.693 -4.044 1.00 0.00 O ATOM 1782 OE2 GLU B 159 21.180 3.380 -5.378 1.00 0.00 O1- ATOM 0 H GLU B 159 20.260 4.465 -0.209 1.00 0.00 H new ATOM 0 HA GLU B 159 22.366 3.492 -1.807 1.00 0.00 H new ATOM 0 HB2 GLU B 159 20.004 5.331 -2.172 1.00 0.00 H new ATOM 0 HB3 GLU B 159 21.221 5.294 -3.433 1.00 0.00 H new ATOM 0 HG2 GLU B 159 20.028 2.711 -2.367 1.00 0.00 H new ATOM 0 HG3 GLU B 159 19.180 3.647 -3.582 1.00 0.00 H new ATOM 1789 N GLN B 160 22.763 6.607 -0.795 1.00 0.00 N ATOM 1790 CA GLN B 160 23.743 7.692 -0.621 1.00 0.00 C ATOM 1791 C GLN B 160 24.989 7.264 0.181 1.00 0.00 C ATOM 1792 O GLN B 160 26.067 7.833 0.003 1.00 0.00 O ATOM 1793 CB GLN B 160 23.075 8.894 0.069 1.00 0.00 C ATOM 1794 CG GLN B 160 21.950 9.537 -0.771 1.00 0.00 C ATOM 1795 CD GLN B 160 22.448 10.321 -1.983 1.00 0.00 C ATOM 1796 OE1 GLN B 160 23.639 10.551 -2.189 1.00 0.00 O ATOM 1797 NE2 GLN B 160 21.559 10.767 -2.841 1.00 0.00 N ATOM 0 H GLN B 160 21.910 6.749 -0.254 1.00 0.00 H new ATOM 0 HA GLN B 160 24.086 7.966 -1.619 1.00 0.00 H new ATOM 0 HB2 GLN B 160 22.665 8.572 1.026 1.00 0.00 H new ATOM 0 HB3 GLN B 160 23.833 9.647 0.284 1.00 0.00 H new ATOM 0 HG2 GLN B 160 21.273 8.754 -1.112 1.00 0.00 H new ATOM 0 HG3 GLN B 160 21.371 10.204 -0.133 1.00 0.00 H new ATOM 0 HE21 GLN B 160 20.567 10.587 -2.688 1.00 0.00 H new ATOM 0 HE22 GLN B 160 21.861 11.294 -3.661 1.00 0.00 H new ATOM 1806 N ALA B 161 24.861 6.253 1.047 1.00 0.00 N ATOM 1807 CA ALA B 161 25.977 5.635 1.772 1.00 0.00 C ATOM 1808 C ALA B 161 26.719 4.575 0.930 1.00 0.00 C ATOM 1809 O ALA B 161 27.949 4.503 0.961 1.00 0.00 O ATOM 1810 CB ALA B 161 25.419 5.043 3.078 1.00 0.00 C ATOM 0 H ALA B 161 23.959 5.832 1.268 1.00 0.00 H new ATOM 0 HA ALA B 161 26.727 6.394 1.995 1.00 0.00 H new ATOM 0 HB1 ALA B 161 26.227 4.575 3.640 1.00 0.00 H new ATOM 0 HB2 ALA B 161 24.973 5.838 3.676 1.00 0.00 H new ATOM 0 HB3 ALA B 161 24.660 4.296 2.844 1.00 0.00 H new ATOM 1816 N ARG B 162 25.983 3.760 0.160 1.00 0.00 N ATOM 1817 CA ARG B 162 26.511 2.600 -0.594 1.00 0.00 C ATOM 1818 C ARG B 162 27.262 2.940 -1.884 1.00 0.00 C ATOM 1819 O ARG B 162 27.999 2.094 -2.392 1.00 0.00 O ATOM 1820 CB ARG B 162 25.369 1.594 -0.865 1.00 0.00 C ATOM 1821 CG ARG B 162 25.261 0.481 0.195 1.00 0.00 C ATOM 1822 CD ARG B 162 25.032 0.961 1.635 1.00 0.00 C ATOM 1823 NE ARG B 162 24.881 -0.190 2.543 1.00 0.00 N ATOM 1824 CZ ARG B 162 25.837 -0.911 3.101 1.00 0.00 C ATOM 1825 NH1 ARG B 162 27.104 -0.641 2.966 1.00 0.00 N1+ ATOM 1826 NH2 ARG B 162 25.540 -1.943 3.824 1.00 0.00 N ATOM 0 H ARG B 162 24.978 3.888 0.038 1.00 0.00 H new ATOM 0 HA ARG B 162 27.272 2.154 0.046 1.00 0.00 H new ATOM 0 HB2 ARG B 162 24.423 2.134 -0.910 1.00 0.00 H new ATOM 0 HB3 ARG B 162 25.522 1.138 -1.843 1.00 0.00 H new ATOM 0 HG2 ARG B 162 24.443 -0.183 -0.083 1.00 0.00 H new ATOM 0 HG3 ARG B 162 26.175 -0.112 0.169 1.00 0.00 H new ATOM 0 HD2 ARG B 162 25.871 1.578 1.957 1.00 0.00 H new ATOM 0 HD3 ARG B 162 24.140 1.586 1.679 1.00 0.00 H new ATOM 0 HE ARG B 162 23.924 -0.462 2.767 1.00 0.00 H new ATOM 0 HH11 ARG B 162 27.398 0.160 2.408 1.00 0.00 H new ATOM 0 HH12 ARG B 162 27.802 -1.231 3.419 1.00 0.00 H new ATOM 0 HH21 ARG B 162 24.564 -2.203 3.965 1.00 0.00 H new ATOM 0 HH22 ARG B 162 26.282 -2.496 4.252 1.00 0.00 H new ATOM 1840 N ARG B 163 27.104 4.160 -2.396 1.00 0.00 N ATOM 1841 CA ARG B 163 27.781 4.664 -3.616 1.00 0.00 C ATOM 1842 C ARG B 163 29.278 4.987 -3.459 1.00 0.00 C ATOM 1843 O ARG B 163 29.971 5.173 -4.462 1.00 0.00 O ATOM 1844 CB ARG B 163 27.022 5.871 -4.204 1.00 0.00 C ATOM 1845 CG ARG B 163 26.959 7.074 -3.248 1.00 0.00 C ATOM 1846 CD ARG B 163 26.500 8.330 -3.996 1.00 0.00 C ATOM 1847 NE ARG B 163 26.153 9.431 -3.079 1.00 0.00 N ATOM 1848 CZ ARG B 163 26.950 10.179 -2.339 1.00 0.00 C ATOM 1849 NH1 ARG B 163 28.245 10.035 -2.314 1.00 0.00 N1+ ATOM 1850 NH2 ARG B 163 26.426 11.112 -1.601 1.00 0.00 N ATOM 0 H ARG B 163 26.488 4.853 -1.971 1.00 0.00 H new ATOM 0 HA ARG B 163 27.750 3.826 -4.313 1.00 0.00 H new ATOM 0 HB2 ARG B 163 27.505 6.178 -5.132 1.00 0.00 H new ATOM 0 HB3 ARG B 163 26.007 5.564 -4.459 1.00 0.00 H new ATOM 0 HG2 ARG B 163 26.272 6.860 -2.429 1.00 0.00 H new ATOM 0 HG3 ARG B 163 27.940 7.246 -2.805 1.00 0.00 H new ATOM 0 HD2 ARG B 163 27.291 8.658 -4.671 1.00 0.00 H new ATOM 0 HD3 ARG B 163 25.635 8.087 -4.613 1.00 0.00 H new ATOM 0 HE ARG B 163 25.158 9.645 -3.006 1.00 0.00 H new ATOM 0 HH11 ARG B 163 28.689 9.316 -2.885 1.00 0.00 H new ATOM 0 HH12 ARG B 163 28.814 10.641 -1.723 1.00 0.00 H new ATOM 0 HH21 ARG B 163 25.416 11.255 -1.601 1.00 0.00 H new ATOM 0 HH22 ARG B 163 27.025 11.701 -1.022 1.00 0.00 H new ATOM 1864 N GLU B 164 29.746 5.068 -2.211 1.00 0.00 N ATOM 1865 CA GLU B 164 31.102 5.484 -1.779 1.00 0.00 C ATOM 1866 C GLU B 164 31.538 6.839 -2.390 1.00 0.00 C ATOM 1867 O GLU B 164 30.957 7.866 -1.973 1.00 0.00 O ATOM 1868 CB GLU B 164 32.095 4.315 -1.961 1.00 0.00 C ATOM 1869 CG GLU B 164 33.498 4.513 -1.349 1.00 0.00 C ATOM 1870 CD GLU B 164 33.489 4.858 0.161 1.00 0.00 C ATOM 1871 OE1 GLU B 164 32.808 4.160 0.956 1.00 0.00 O ATOM 1872 OE2 GLU B 164 34.198 5.812 0.573 1.00 0.00 O1- ATOM 1873 OXT GLU B 164 32.425 6.886 -3.275 1.00 0.00 O1- ATOM 0 H GLU B 164 29.155 4.831 -1.414 1.00 0.00 H new ATOM 0 HA GLU B 164 31.089 5.700 -0.711 1.00 0.00 H new ATOM 0 HB2 GLU B 164 31.654 3.419 -1.524 1.00 0.00 H new ATOM 0 HB3 GLU B 164 32.210 4.126 -3.028 1.00 0.00 H new ATOM 0 HG2 GLU B 164 34.079 3.603 -1.499 1.00 0.00 H new ATOM 0 HG3 GLU B 164 34.009 5.310 -1.889 1.00 0.00 H new TER 1880 GLU B 164