USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 744 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 87 ASN : amide:sc= 0.579 K(o=1.5,f=-6!) USER MOD Set 1.2: A 109 THR OG1 : rot -153:sc= 0.905 USER MOD Set 2.1: A 14 LYS NZ :NH3+ 168:sc= 1.29 (180deg=0) USER MOD Set 2.2: A 18 GLN : amide:sc= 0.989 K(o=2.3,f=-8.5!) USER MOD Single : A 11 THR OG1 : rot -41:sc= 1.22 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.143 USER MOD Single : A 73 LYS NZ :NH3+ 164:sc= 1.24 (180deg=0.741) USER MOD Single : A 79 SER OG : rot 146:sc= -0.305! USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 149:sc= 1.3 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl -169:sc= -1.93! (180deg=-2.99!) USER MOD Single : A 141 LYS NZ :NH3+ 162:sc= 1.26 (180deg=0.968) USER MOD Single : A 144 GLN : amide:sc= -0.98 K(o=-0.98,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 1.530 8.217 2.413 1.00 13.13 N ATOM 57 CA VAL A 5 1.530 6.982 3.164 1.00 74.35 C ATOM 58 C VAL A 5 0.238 6.855 3.960 1.00 11.25 C ATOM 59 O VAL A 5 0.003 7.604 4.903 1.00 73.14 O ATOM 60 CB VAL A 5 2.749 6.889 4.107 1.00 24.14 C ATOM 61 CG1 VAL A 5 2.630 5.681 5.002 1.00 54.24 C ATOM 62 CG2 VAL A 5 4.044 6.828 3.316 1.00 50.23 C ATOM 0 HA VAL A 5 1.598 6.159 2.453 1.00 74.35 H new ATOM 0 HB VAL A 5 2.767 7.786 4.725 1.00 24.14 H new ATOM 0 HG11 VAL A 5 3.497 5.629 5.661 1.00 54.24 H new ATOM 0 HG12 VAL A 5 1.723 5.760 5.601 1.00 54.24 H new ATOM 0 HG13 VAL A 5 2.584 4.779 4.392 1.00 54.24 H new ATOM 0 HG21 VAL A 5 4.887 6.763 4.003 1.00 50.23 H new ATOM 0 HG22 VAL A 5 4.034 5.951 2.669 1.00 50.23 H new ATOM 0 HG23 VAL A 5 4.141 7.727 2.707 1.00 50.23 H new ATOM 72 N VAL A 6 -0.605 5.917 3.551 1.00 11.32 N ATOM 73 CA VAL A 6 -1.894 5.695 4.189 1.00 2.44 C ATOM 74 C VAL A 6 -2.253 4.222 4.143 1.00 73.41 C ATOM 75 O VAL A 6 -1.823 3.501 3.245 1.00 43.11 O ATOM 76 CB VAL A 6 -3.036 6.494 3.514 1.00 23.34 C ATOM 77 CG1 VAL A 6 -2.912 7.983 3.798 1.00 31.52 C ATOM 78 CG2 VAL A 6 -3.070 6.235 2.011 1.00 53.11 C ATOM 0 H VAL A 6 -0.415 5.290 2.769 1.00 11.32 H new ATOM 0 HA VAL A 6 -1.793 6.039 5.218 1.00 2.44 H new ATOM 0 HB VAL A 6 -3.977 6.148 3.942 1.00 23.34 H new ATOM 0 HG11 VAL A 6 -3.728 8.516 3.310 1.00 31.52 H new ATOM 0 HG12 VAL A 6 -2.959 8.153 4.874 1.00 31.52 H new ATOM 0 HG13 VAL A 6 -1.960 8.349 3.414 1.00 31.52 H new ATOM 0 HG21 VAL A 6 -3.881 6.808 1.561 1.00 53.11 H new ATOM 0 HG22 VAL A 6 -2.122 6.539 1.568 1.00 53.11 H new ATOM 0 HG23 VAL A 6 -3.232 5.173 1.828 1.00 53.11 H new ATOM 88 N ARG A 7 -3.020 3.771 5.118 1.00 53.00 N ATOM 89 CA ARG A 7 -3.533 2.415 5.093 1.00 11.42 C ATOM 90 C ARG A 7 -4.950 2.424 4.520 1.00 14.34 C ATOM 91 O ARG A 7 -5.882 2.945 5.136 1.00 34.14 O ATOM 92 CB ARG A 7 -3.499 1.793 6.502 1.00 61.55 C ATOM 93 CG ARG A 7 -4.373 2.502 7.527 1.00 10.31 C ATOM 94 CD ARG A 7 -5.507 1.606 7.995 1.00 31.15 C ATOM 95 NE ARG A 7 -6.550 2.351 8.700 1.00 50.22 N ATOM 96 CZ ARG A 7 -6.883 2.151 9.974 1.00 64.14 C ATOM 97 NH1 ARG A 7 -6.206 1.282 10.713 1.00 64.25 N ATOM 98 NH2 ARG A 7 -7.894 2.831 10.499 1.00 4.05 N ATOM 0 H ARG A 7 -3.300 4.319 5.931 1.00 53.00 H new ATOM 0 HA ARG A 7 -2.901 1.799 4.454 1.00 11.42 H new ATOM 0 HB2 ARG A 7 -3.814 0.752 6.433 1.00 61.55 H new ATOM 0 HB3 ARG A 7 -2.469 1.792 6.860 1.00 61.55 H new ATOM 0 HG2 ARG A 7 -3.766 2.801 8.381 1.00 10.31 H new ATOM 0 HG3 ARG A 7 -4.782 3.414 7.092 1.00 10.31 H new ATOM 0 HD2 ARG A 7 -5.944 1.099 7.135 1.00 31.15 H new ATOM 0 HD3 ARG A 7 -5.109 0.833 8.652 1.00 31.15 H new ATOM 0 HE ARG A 7 -7.055 3.070 8.182 1.00 50.22 H new ATOM 0 HH11 ARG A 7 -5.427 0.764 10.306 1.00 64.25 H new ATOM 0 HH12 ARG A 7 -6.464 1.132 11.688 1.00 64.25 H new ATOM 0 HH21 ARG A 7 -8.409 3.501 9.928 1.00 4.05 H new ATOM 0 HH22 ARG A 7 -8.156 2.684 11.474 1.00 4.05 H new ATOM 112 N ASP A 8 -5.105 1.892 3.318 1.00 22.03 N ATOM 113 CA ASP A 8 -6.409 1.854 2.680 1.00 40.10 C ATOM 114 C ASP A 8 -6.446 0.753 1.631 1.00 42.01 C ATOM 115 O ASP A 8 -5.428 0.109 1.366 1.00 20.51 O ATOM 116 CB ASP A 8 -6.752 3.206 2.057 1.00 74.33 C ATOM 117 CG ASP A 8 -8.247 3.446 2.012 1.00 45.12 C ATOM 118 OD1 ASP A 8 -8.905 2.982 1.064 1.00 32.41 O ATOM 119 OD2 ASP A 8 -8.770 4.094 2.943 1.00 21.00 O ATOM 0 H ASP A 8 -4.349 1.483 2.768 1.00 22.03 H new ATOM 0 HA ASP A 8 -7.159 1.637 3.441 1.00 40.10 H new ATOM 0 HB2 ASP A 8 -6.274 4.001 2.630 1.00 74.33 H new ATOM 0 HB3 ASP A 8 -6.346 3.253 1.046 1.00 74.33 H new ATOM 124 N ALA A 9 -7.615 0.533 1.056 1.00 52.10 N ATOM 125 CA ALA A 9 -7.817 -0.564 0.130 1.00 2.20 C ATOM 126 C ALA A 9 -8.510 -0.084 -1.134 1.00 3.44 C ATOM 127 O ALA A 9 -9.518 0.621 -1.070 1.00 42.53 O ATOM 128 CB ALA A 9 -8.641 -1.654 0.791 1.00 73.54 C ATOM 0 H ALA A 9 -8.444 1.105 1.217 1.00 52.10 H new ATOM 0 HA ALA A 9 -6.842 -0.966 -0.145 1.00 2.20 H new ATOM 0 HB1 ALA A 9 -8.789 -2.475 0.089 1.00 73.54 H new ATOM 0 HB2 ALA A 9 -8.117 -2.021 1.674 1.00 73.54 H new ATOM 0 HB3 ALA A 9 -9.610 -1.250 1.086 1.00 73.54 H new ATOM 134 N VAL A 10 -7.972 -0.460 -2.282 1.00 53.14 N ATOM 135 CA VAL A 10 -8.583 -0.103 -3.554 1.00 31.21 C ATOM 136 C VAL A 10 -9.030 -1.354 -4.307 1.00 10.32 C ATOM 137 O VAL A 10 -8.317 -2.361 -4.348 1.00 14.52 O ATOM 138 CB VAL A 10 -7.642 0.746 -4.444 1.00 53.53 C ATOM 139 CG1 VAL A 10 -7.447 2.135 -3.851 1.00 32.50 C ATOM 140 CG2 VAL A 10 -6.299 0.058 -4.639 1.00 62.40 C ATOM 0 H VAL A 10 -7.117 -1.010 -2.361 1.00 53.14 H new ATOM 0 HA VAL A 10 -9.455 0.510 -3.324 1.00 31.21 H new ATOM 0 HB VAL A 10 -8.113 0.849 -5.421 1.00 53.53 H new ATOM 0 HG11 VAL A 10 -6.783 2.714 -4.492 1.00 32.50 H new ATOM 0 HG12 VAL A 10 -8.411 2.638 -3.778 1.00 32.50 H new ATOM 0 HG13 VAL A 10 -7.007 2.048 -2.857 1.00 32.50 H new ATOM 0 HG21 VAL A 10 -5.660 0.678 -5.268 1.00 62.40 H new ATOM 0 HG22 VAL A 10 -5.821 -0.089 -3.670 1.00 62.40 H new ATOM 0 HG23 VAL A 10 -6.452 -0.909 -5.119 1.00 62.40 H new ATOM 150 N THR A 11 -10.218 -1.286 -4.890 1.00 54.24 N ATOM 151 CA THR A 11 -10.790 -2.408 -5.612 1.00 34.21 C ATOM 152 C THR A 11 -10.256 -2.444 -7.037 1.00 14.15 C ATOM 153 O THR A 11 -10.644 -1.629 -7.875 1.00 42.41 O ATOM 154 CB THR A 11 -12.326 -2.301 -5.662 1.00 12.22 C ATOM 155 OG1 THR A 11 -12.844 -1.906 -4.384 1.00 14.30 O ATOM 156 CG2 THR A 11 -12.945 -3.625 -6.070 1.00 30.04 C ATOM 0 H THR A 11 -10.809 -0.455 -4.875 1.00 54.24 H new ATOM 0 HA THR A 11 -10.509 -3.321 -5.087 1.00 34.21 H new ATOM 0 HB THR A 11 -12.584 -1.545 -6.404 1.00 12.22 H new ATOM 0 HG1 THR A 11 -12.366 -2.384 -3.675 1.00 14.30 H new ATOM 0 HG21 THR A 11 -14.030 -3.526 -6.099 1.00 30.04 H new ATOM 0 HG22 THR A 11 -12.580 -3.908 -7.057 1.00 30.04 H new ATOM 0 HG23 THR A 11 -12.670 -4.393 -5.347 1.00 30.04 H new ATOM 164 N ILE A 12 -9.352 -3.370 -7.309 1.00 0.25 N ATOM 165 CA ILE A 12 -8.732 -3.448 -8.623 1.00 2.11 C ATOM 166 C ILE A 12 -9.122 -4.741 -9.339 1.00 23.11 C ATOM 167 O ILE A 12 -9.370 -5.762 -8.701 1.00 4.42 O ATOM 168 CB ILE A 12 -7.191 -3.376 -8.544 1.00 44.34 C ATOM 169 CG1 ILE A 12 -6.721 -2.238 -7.638 1.00 4.13 C ATOM 170 CG2 ILE A 12 -6.625 -3.177 -9.931 1.00 54.45 C ATOM 171 CD1 ILE A 12 -7.205 -0.876 -8.070 1.00 31.51 C ATOM 0 H ILE A 12 -9.032 -4.074 -6.644 1.00 0.25 H new ATOM 0 HA ILE A 12 -9.097 -2.587 -9.184 1.00 2.11 H new ATOM 0 HB ILE A 12 -6.834 -4.314 -8.119 1.00 44.34 H new ATOM 0 HG12 ILE A 12 -7.065 -2.430 -6.622 1.00 4.13 H new ATOM 0 HG13 ILE A 12 -5.631 -2.234 -7.611 1.00 4.13 H new ATOM 0 HG21 ILE A 12 -5.538 -3.126 -9.876 1.00 54.45 H new ATOM 0 HG22 ILE A 12 -6.918 -4.013 -10.567 1.00 54.45 H new ATOM 0 HG23 ILE A 12 -7.011 -2.249 -10.352 1.00 54.45 H new ATOM 0 HD11 ILE A 12 -6.831 -0.121 -7.379 1.00 31.51 H new ATOM 0 HD12 ILE A 12 -6.839 -0.662 -9.074 1.00 31.51 H new ATOM 0 HD13 ILE A 12 -8.295 -0.860 -8.070 1.00 31.51 H new ATOM 183 N GLY A 13 -9.173 -4.688 -10.667 1.00 75.34 N ATOM 184 CA GLY A 13 -9.476 -5.871 -11.456 1.00 5.13 C ATOM 185 C GLY A 13 -8.235 -6.685 -11.793 1.00 62.41 C ATOM 186 O GLY A 13 -8.207 -7.402 -12.794 1.00 41.55 O ATOM 0 H GLY A 13 -9.009 -3.843 -11.214 1.00 75.34 H new ATOM 0 HA2 GLY A 13 -10.179 -6.498 -10.908 1.00 5.13 H new ATOM 0 HA3 GLY A 13 -9.970 -5.570 -12.380 1.00 5.13 H new ATOM 190 N LYS A 14 -7.209 -6.570 -10.963 1.00 32.54 N ATOM 191 CA LYS A 14 -5.986 -7.349 -11.127 1.00 41.54 C ATOM 192 C LYS A 14 -6.041 -8.551 -10.191 1.00 23.44 C ATOM 193 O LYS A 14 -6.592 -8.449 -9.095 1.00 22.42 O ATOM 194 CB LYS A 14 -4.748 -6.502 -10.801 1.00 21.15 C ATOM 195 CG LYS A 14 -4.623 -5.197 -11.588 1.00 70.23 C ATOM 196 CD LYS A 14 -3.813 -5.351 -12.867 1.00 13.13 C ATOM 197 CE LYS A 14 -4.610 -5.998 -13.985 1.00 45.02 C ATOM 198 NZ LYS A 14 -3.818 -6.068 -15.242 1.00 12.32 N ATOM 0 H LYS A 14 -7.198 -5.939 -10.161 1.00 32.54 H new ATOM 0 HA LYS A 14 -5.911 -7.677 -12.164 1.00 41.54 H new ATOM 0 HB2 LYS A 14 -4.760 -6.266 -9.737 1.00 21.15 H new ATOM 0 HB3 LYS A 14 -3.858 -7.104 -10.984 1.00 21.15 H new ATOM 0 HG2 LYS A 14 -5.619 -4.832 -11.837 1.00 70.23 H new ATOM 0 HG3 LYS A 14 -4.155 -4.441 -10.957 1.00 70.23 H new ATOM 0 HD2 LYS A 14 -3.465 -4.371 -13.193 1.00 13.13 H new ATOM 0 HD3 LYS A 14 -2.927 -5.952 -12.662 1.00 13.13 H new ATOM 0 HE2 LYS A 14 -4.911 -7.002 -13.686 1.00 45.02 H new ATOM 0 HE3 LYS A 14 -5.524 -5.430 -14.159 1.00 45.02 H new ATOM 0 HZ1 LYS A 14 -4.301 -6.688 -15.923 1.00 12.32 H new ATOM 0 HZ2 LYS A 14 -3.725 -5.115 -15.647 1.00 12.32 H new ATOM 0 HZ3 LYS A 14 -2.873 -6.450 -15.036 1.00 12.32 H new ATOM 212 N PRO A 15 -5.481 -9.702 -10.599 1.00 31.02 N ATOM 213 CA PRO A 15 -5.550 -10.926 -9.795 1.00 4.32 C ATOM 214 C PRO A 15 -4.925 -10.763 -8.405 1.00 21.30 C ATOM 215 O PRO A 15 -5.607 -10.938 -7.397 1.00 43.34 O ATOM 216 CB PRO A 15 -4.757 -11.951 -10.618 1.00 43.45 C ATOM 217 CG PRO A 15 -3.974 -11.155 -11.607 1.00 14.32 C ATOM 218 CD PRO A 15 -4.776 -9.914 -11.870 1.00 53.11 C ATOM 0 HA PRO A 15 -6.583 -11.217 -9.606 1.00 4.32 H new ATOM 0 HB2 PRO A 15 -4.098 -12.540 -9.980 1.00 43.45 H new ATOM 0 HB3 PRO A 15 -5.425 -12.651 -11.120 1.00 43.45 H new ATOM 0 HG2 PRO A 15 -2.988 -10.906 -11.214 1.00 14.32 H new ATOM 0 HG3 PRO A 15 -3.818 -11.720 -12.526 1.00 14.32 H new ATOM 0 HD2 PRO A 15 -4.138 -9.067 -12.124 1.00 53.11 H new ATOM 0 HD3 PRO A 15 -5.470 -10.050 -12.699 1.00 53.11 H new ATOM 226 N ALA A 16 -3.641 -10.402 -8.371 1.00 53.00 N ATOM 227 CA ALA A 16 -2.909 -10.159 -7.121 1.00 12.11 C ATOM 228 C ALA A 16 -1.435 -9.924 -7.423 1.00 14.44 C ATOM 229 O ALA A 16 -0.811 -9.015 -6.876 1.00 72.40 O ATOM 230 CB ALA A 16 -3.051 -11.323 -6.144 1.00 44.31 C ATOM 0 H ALA A 16 -3.076 -10.269 -9.210 1.00 53.00 H new ATOM 0 HA ALA A 16 -3.340 -9.274 -6.653 1.00 12.11 H new ATOM 0 HB1 ALA A 16 -2.495 -11.103 -5.233 1.00 44.31 H new ATOM 0 HB2 ALA A 16 -4.104 -11.467 -5.901 1.00 44.31 H new ATOM 0 HB3 ALA A 16 -2.656 -12.231 -6.600 1.00 44.31 H new ATOM 236 N GLU A 17 -0.906 -10.759 -8.315 1.00 43.02 N ATOM 237 CA GLU A 17 0.498 -10.715 -8.727 1.00 31.13 C ATOM 238 C GLU A 17 0.940 -9.295 -9.083 1.00 62.20 C ATOM 239 O GLU A 17 1.937 -8.788 -8.570 1.00 24.41 O ATOM 240 CB GLU A 17 0.686 -11.624 -9.944 1.00 52.42 C ATOM 241 CG GLU A 17 2.107 -11.665 -10.481 1.00 53.11 C ATOM 242 CD GLU A 17 2.178 -12.279 -11.863 1.00 52.13 C ATOM 243 OE1 GLU A 17 2.074 -13.518 -11.979 1.00 44.21 O ATOM 244 OE2 GLU A 17 2.325 -11.525 -12.844 1.00 75.52 O ATOM 0 H GLU A 17 -1.444 -11.492 -8.777 1.00 43.02 H new ATOM 0 HA GLU A 17 1.110 -11.056 -7.892 1.00 31.13 H new ATOM 0 HB2 GLU A 17 0.382 -12.636 -9.677 1.00 52.42 H new ATOM 0 HB3 GLU A 17 0.019 -11.290 -10.739 1.00 52.42 H new ATOM 0 HG2 GLU A 17 2.511 -10.653 -10.514 1.00 53.11 H new ATOM 0 HG3 GLU A 17 2.735 -12.237 -9.798 1.00 53.11 H new ATOM 251 N GLN A 18 0.166 -8.654 -9.942 1.00 52.55 N ATOM 252 CA GLN A 18 0.521 -7.343 -10.466 1.00 24.22 C ATOM 253 C GLN A 18 0.221 -6.236 -9.456 1.00 12.14 C ATOM 254 O GLN A 18 0.644 -5.096 -9.629 1.00 13.10 O ATOM 255 CB GLN A 18 -0.229 -7.091 -11.775 1.00 32.05 C ATOM 256 CG GLN A 18 0.281 -7.932 -12.937 1.00 63.21 C ATOM 257 CD GLN A 18 -0.639 -7.889 -14.143 1.00 3.44 C ATOM 258 OE1 GLN A 18 -1.366 -6.921 -14.354 1.00 55.32 O ATOM 259 NE2 GLN A 18 -0.604 -8.933 -14.955 1.00 50.30 N ATOM 0 H GLN A 18 -0.718 -9.022 -10.294 1.00 52.55 H new ATOM 0 HA GLN A 18 1.594 -7.330 -10.656 1.00 24.22 H new ATOM 0 HB2 GLN A 18 -1.288 -7.299 -11.624 1.00 32.05 H new ATOM 0 HB3 GLN A 18 -0.145 -6.036 -12.036 1.00 32.05 H new ATOM 0 HG2 GLN A 18 1.270 -7.579 -13.228 1.00 63.21 H new ATOM 0 HG3 GLN A 18 0.395 -8.965 -12.609 1.00 63.21 H new ATOM 0 HE21 GLN A 18 0.012 -9.719 -14.748 1.00 50.30 H new ATOM 0 HE22 GLN A 18 -1.193 -8.951 -15.788 1.00 50.30 H new ATOM 268 N LEU A 19 -0.499 -6.577 -8.399 1.00 1.40 N ATOM 269 CA LEU A 19 -0.861 -5.599 -7.391 1.00 42.45 C ATOM 270 C LEU A 19 0.256 -5.405 -6.373 1.00 75.25 C ATOM 271 O LEU A 19 0.627 -4.275 -6.073 1.00 34.32 O ATOM 272 CB LEU A 19 -2.149 -6.012 -6.692 1.00 62.31 C ATOM 273 CG LEU A 19 -3.399 -5.951 -7.566 1.00 42.32 C ATOM 274 CD1 LEU A 19 -4.597 -6.511 -6.825 1.00 63.33 C ATOM 275 CD2 LEU A 19 -3.669 -4.521 -8.008 1.00 62.50 C ATOM 0 H LEU A 19 -0.842 -7.521 -8.219 1.00 1.40 H new ATOM 0 HA LEU A 19 -1.020 -4.646 -7.895 1.00 42.45 H new ATOM 0 HB2 LEU A 19 -2.033 -7.029 -6.319 1.00 62.31 H new ATOM 0 HB3 LEU A 19 -2.297 -5.369 -5.824 1.00 62.31 H new ATOM 0 HG LEU A 19 -3.228 -6.562 -8.453 1.00 42.32 H new ATOM 0 HD11 LEU A 19 -5.478 -6.459 -7.465 1.00 63.33 H new ATOM 0 HD12 LEU A 19 -4.405 -7.550 -6.556 1.00 63.33 H new ATOM 0 HD13 LEU A 19 -4.770 -5.928 -5.921 1.00 63.33 H new ATOM 0 HD21 LEU A 19 -4.564 -4.495 -8.630 1.00 62.50 H new ATOM 0 HD22 LEU A 19 -3.819 -3.891 -7.131 1.00 62.50 H new ATOM 0 HD23 LEU A 19 -2.818 -4.150 -8.580 1.00 62.50 H new ATOM 287 N TYR A 20 0.806 -6.500 -5.851 1.00 45.44 N ATOM 288 CA TYR A 20 1.842 -6.390 -4.823 1.00 62.24 C ATOM 289 C TYR A 20 3.149 -5.882 -5.423 1.00 74.01 C ATOM 290 O TYR A 20 3.977 -5.290 -4.732 1.00 72.42 O ATOM 291 CB TYR A 20 2.064 -7.722 -4.077 1.00 3.04 C ATOM 292 CG TYR A 20 2.708 -8.833 -4.887 1.00 54.51 C ATOM 293 CD1 TYR A 20 4.079 -8.846 -5.129 1.00 54.21 C ATOM 294 CD2 TYR A 20 1.948 -9.879 -5.390 1.00 60.24 C ATOM 295 CE1 TYR A 20 4.668 -9.864 -5.851 1.00 51.21 C ATOM 296 CE2 TYR A 20 2.532 -10.902 -6.115 1.00 34.32 C ATOM 297 CZ TYR A 20 3.891 -10.888 -6.344 1.00 61.42 C ATOM 298 OH TYR A 20 4.476 -11.905 -7.063 1.00 60.51 O ATOM 0 H TYR A 20 0.560 -7.454 -6.115 1.00 45.44 H new ATOM 0 HA TYR A 20 1.491 -5.664 -4.089 1.00 62.24 H new ATOM 0 HB2 TYR A 20 2.686 -7.528 -3.203 1.00 3.04 H new ATOM 0 HB3 TYR A 20 1.101 -8.077 -3.711 1.00 3.04 H new ATOM 0 HD1 TYR A 20 4.693 -8.045 -4.745 1.00 54.21 H new ATOM 0 HD2 TYR A 20 0.883 -9.895 -5.213 1.00 60.24 H new ATOM 0 HE1 TYR A 20 5.733 -9.857 -6.028 1.00 51.21 H new ATOM 0 HE2 TYR A 20 1.926 -11.708 -6.500 1.00 34.32 H new ATOM 0 HH TYR A 20 3.790 -12.548 -7.338 1.00 60.51 H new ATOM 308 N ALA A 21 3.317 -6.102 -6.722 1.00 14.35 N ATOM 309 CA ALA A 21 4.537 -5.713 -7.417 1.00 51.45 C ATOM 310 C ALA A 21 4.635 -4.198 -7.569 1.00 50.42 C ATOM 311 O ALA A 21 5.702 -3.671 -7.867 1.00 31.30 O ATOM 312 CB ALA A 21 4.604 -6.389 -8.779 1.00 0.23 C ATOM 0 H ALA A 21 2.620 -6.550 -7.317 1.00 14.35 H new ATOM 0 HA ALA A 21 5.385 -6.041 -6.815 1.00 51.45 H new ATOM 0 HB1 ALA A 21 5.520 -6.090 -9.289 1.00 0.23 H new ATOM 0 HB2 ALA A 21 4.597 -7.471 -8.649 1.00 0.23 H new ATOM 0 HB3 ALA A 21 3.743 -6.090 -9.376 1.00 0.23 H new ATOM 318 N VAL A 22 3.525 -3.501 -7.320 1.00 3.55 N ATOM 319 CA VAL A 22 3.449 -2.056 -7.531 1.00 12.31 C ATOM 320 C VAL A 22 4.524 -1.303 -6.732 1.00 13.55 C ATOM 321 O VAL A 22 4.892 -0.176 -7.077 1.00 51.41 O ATOM 322 CB VAL A 22 2.047 -1.506 -7.178 1.00 14.33 C ATOM 323 CG1 VAL A 22 1.836 -1.439 -5.672 1.00 72.52 C ATOM 324 CG2 VAL A 22 1.833 -0.149 -7.828 1.00 33.10 C ATOM 0 H VAL A 22 2.662 -3.918 -6.970 1.00 3.55 H new ATOM 0 HA VAL A 22 3.633 -1.887 -8.592 1.00 12.31 H new ATOM 0 HB VAL A 22 1.302 -2.196 -7.574 1.00 14.33 H new ATOM 0 HG11 VAL A 22 0.841 -1.048 -5.461 1.00 72.52 H new ATOM 0 HG12 VAL A 22 1.931 -2.438 -5.246 1.00 72.52 H new ATOM 0 HG13 VAL A 22 2.585 -0.783 -5.229 1.00 72.52 H new ATOM 0 HG21 VAL A 22 0.842 0.225 -7.571 1.00 33.10 H new ATOM 0 HG22 VAL A 22 2.589 0.549 -7.470 1.00 33.10 H new ATOM 0 HG23 VAL A 22 1.914 -0.247 -8.911 1.00 33.10 H new ATOM 334 N TRP A 23 5.030 -1.945 -5.677 1.00 51.21 N ATOM 335 CA TRP A 23 6.090 -1.379 -4.847 1.00 3.31 C ATOM 336 C TRP A 23 7.294 -0.979 -5.705 1.00 20.55 C ATOM 337 O TRP A 23 7.992 -0.011 -5.404 1.00 33.50 O ATOM 338 CB TRP A 23 6.506 -2.397 -3.777 1.00 32.10 C ATOM 339 CG TRP A 23 7.549 -1.894 -2.823 1.00 62.23 C ATOM 340 CD1 TRP A 23 8.868 -2.243 -2.797 1.00 42.52 C ATOM 341 CD2 TRP A 23 7.361 -0.957 -1.755 1.00 62.14 C ATOM 342 NE1 TRP A 23 9.512 -1.581 -1.782 1.00 52.02 N ATOM 343 CE2 TRP A 23 8.609 -0.786 -1.126 1.00 71.22 C ATOM 344 CE3 TRP A 23 6.261 -0.247 -1.269 1.00 24.13 C ATOM 345 CZ2 TRP A 23 8.785 0.066 -0.039 1.00 12.41 C ATOM 346 CZ3 TRP A 23 6.437 0.598 -0.190 1.00 62.33 C ATOM 347 CH2 TRP A 23 7.690 0.747 0.416 1.00 64.33 C ATOM 0 H TRP A 23 4.717 -2.868 -5.377 1.00 51.21 H new ATOM 0 HA TRP A 23 5.713 -0.481 -4.357 1.00 3.31 H new ATOM 0 HB2 TRP A 23 5.623 -2.693 -3.210 1.00 32.10 H new ATOM 0 HB3 TRP A 23 6.883 -3.293 -4.271 1.00 32.10 H new ATOM 0 HD1 TRP A 23 9.337 -2.939 -3.477 1.00 42.52 H new ATOM 0 HE1 TRP A 23 10.502 -1.667 -1.553 1.00 52.02 H new ATOM 0 HE3 TRP A 23 5.290 -0.356 -1.728 1.00 24.13 H new ATOM 0 HZ2 TRP A 23 9.752 0.185 0.428 1.00 12.41 H new ATOM 0 HZ3 TRP A 23 5.593 1.153 0.192 1.00 62.33 H new ATOM 0 HH2 TRP A 23 7.794 1.413 1.260 1.00 64.33 H new ATOM 358 N ARG A 24 7.518 -1.717 -6.787 1.00 14.33 N ATOM 359 CA ARG A 24 8.587 -1.401 -7.719 1.00 0.22 C ATOM 360 C ARG A 24 8.063 -1.515 -9.152 1.00 64.21 C ATOM 361 O ARG A 24 8.807 -1.837 -10.078 1.00 11.10 O ATOM 362 CB ARG A 24 9.789 -2.332 -7.491 1.00 62.24 C ATOM 363 CG ARG A 24 11.082 -1.881 -8.178 1.00 10.54 C ATOM 364 CD ARG A 24 11.582 -0.536 -7.653 1.00 50.20 C ATOM 365 NE ARG A 24 10.708 0.574 -8.036 1.00 41.14 N ATOM 366 CZ ARG A 24 10.664 1.742 -7.395 1.00 23.54 C ATOM 367 NH1 ARG A 24 11.487 1.992 -6.385 1.00 4.40 N ATOM 368 NH2 ARG A 24 9.806 2.678 -7.776 1.00 43.30 N ATOM 0 H ARG A 24 6.970 -2.540 -7.038 1.00 14.33 H new ATOM 0 HA ARG A 24 8.925 -0.378 -7.552 1.00 0.22 H new ATOM 0 HB2 ARG A 24 9.971 -2.413 -6.419 1.00 62.24 H new ATOM 0 HB3 ARG A 24 9.532 -3.330 -7.847 1.00 62.24 H new ATOM 0 HG2 ARG A 24 11.853 -2.636 -8.027 1.00 10.54 H new ATOM 0 HG3 ARG A 24 10.913 -1.809 -9.252 1.00 10.54 H new ATOM 0 HD2 ARG A 24 11.656 -0.578 -6.566 1.00 50.20 H new ATOM 0 HD3 ARG A 24 12.587 -0.352 -8.034 1.00 50.20 H new ATOM 0 HE ARG A 24 10.096 0.446 -8.842 1.00 41.14 H new ATOM 0 HH11 ARG A 24 12.163 1.287 -6.091 1.00 4.40 H new ATOM 0 HH12 ARG A 24 11.444 2.889 -5.902 1.00 4.40 H new ATOM 0 HH21 ARG A 24 9.178 2.505 -8.561 1.00 43.30 H new ATOM 0 HH22 ARG A 24 9.774 3.571 -7.284 1.00 43.30 H new ATOM 382 N ASP A 25 6.775 -1.196 -9.310 1.00 35.22 N ATOM 383 CA ASP A 25 6.068 -1.290 -10.587 1.00 23.34 C ATOM 384 C ASP A 25 5.960 -2.746 -11.063 1.00 12.45 C ATOM 385 O ASP A 25 6.579 -3.642 -10.492 1.00 13.14 O ATOM 386 CB ASP A 25 6.763 -0.402 -11.617 1.00 3.24 C ATOM 387 CG ASP A 25 6.071 -0.372 -12.967 1.00 50.20 C ATOM 388 OD1 ASP A 25 5.059 0.347 -13.103 1.00 13.35 O ATOM 389 OD2 ASP A 25 6.534 -1.059 -13.901 1.00 3.41 O ATOM 0 H ASP A 25 6.189 -0.862 -8.545 1.00 35.22 H new ATOM 0 HA ASP A 25 5.046 -0.934 -10.456 1.00 23.34 H new ATOM 0 HB2 ASP A 25 6.821 0.614 -11.227 1.00 3.24 H new ATOM 0 HB3 ASP A 25 7.787 -0.751 -11.752 1.00 3.24 H new ATOM 394 N LEU A 26 5.154 -2.980 -12.089 1.00 33.14 N ATOM 395 CA LEU A 26 4.907 -4.329 -12.583 1.00 52.43 C ATOM 396 C LEU A 26 5.616 -4.592 -13.918 1.00 2.32 C ATOM 397 O LEU A 26 5.046 -4.386 -14.992 1.00 51.03 O ATOM 398 CB LEU A 26 3.394 -4.593 -12.695 1.00 51.45 C ATOM 399 CG LEU A 26 2.501 -3.355 -12.878 1.00 70.23 C ATOM 400 CD1 LEU A 26 2.644 -2.757 -14.270 1.00 63.14 C ATOM 401 CD2 LEU A 26 1.047 -3.707 -12.601 1.00 74.25 C ATOM 0 H LEU A 26 4.657 -2.249 -12.598 1.00 33.14 H new ATOM 0 HA LEU A 26 5.328 -5.027 -11.859 1.00 52.43 H new ATOM 0 HB2 LEU A 26 3.225 -5.265 -13.536 1.00 51.45 H new ATOM 0 HB3 LEU A 26 3.071 -5.119 -11.797 1.00 51.45 H new ATOM 0 HG LEU A 26 2.829 -2.603 -12.161 1.00 70.23 H new ATOM 0 HD11 LEU A 26 1.997 -1.884 -14.359 1.00 63.14 H new ATOM 0 HD12 LEU A 26 3.680 -2.459 -14.433 1.00 63.14 H new ATOM 0 HD13 LEU A 26 2.358 -3.499 -15.016 1.00 63.14 H new ATOM 0 HD21 LEU A 26 0.426 -2.821 -12.734 1.00 74.25 H new ATOM 0 HD22 LEU A 26 0.723 -4.485 -13.293 1.00 74.25 H new ATOM 0 HD23 LEU A 26 0.949 -4.068 -11.577 1.00 74.25 H new ATOM 413 N PRO A 27 6.887 -5.028 -13.872 1.00 21.34 N ATOM 414 CA PRO A 27 7.682 -5.305 -15.061 1.00 54.44 C ATOM 415 C PRO A 27 7.469 -6.727 -15.581 1.00 44.03 C ATOM 416 O PRO A 27 6.578 -7.445 -15.120 1.00 21.13 O ATOM 417 CB PRO A 27 9.131 -5.114 -14.571 1.00 74.11 C ATOM 418 CG PRO A 27 9.052 -4.897 -13.089 1.00 12.43 C ATOM 419 CD PRO A 27 7.665 -5.293 -12.666 1.00 43.42 C ATOM 0 HA PRO A 27 7.414 -4.657 -15.896 1.00 54.44 H new ATOM 0 HB2 PRO A 27 9.738 -5.989 -14.804 1.00 74.11 H new ATOM 0 HB3 PRO A 27 9.598 -4.262 -15.064 1.00 74.11 H new ATOM 0 HG2 PRO A 27 9.800 -5.496 -12.570 1.00 12.43 H new ATOM 0 HG3 PRO A 27 9.249 -3.854 -12.840 1.00 12.43 H new ATOM 0 HD2 PRO A 27 7.613 -6.341 -12.370 1.00 43.42 H new ATOM 0 HD3 PRO A 27 7.314 -4.705 -11.818 1.00 43.42 H new ATOM 998 N ALA A 64 17.101 -9.387 5.727 1.00 11.01 N ATOM 999 CA ALA A 64 15.744 -8.934 5.998 1.00 3.12 C ATOM 1000 C ALA A 64 14.978 -10.058 6.673 1.00 64.11 C ATOM 1001 O ALA A 64 15.331 -11.230 6.520 1.00 15.43 O ATOM 1002 CB ALA A 64 15.037 -8.513 4.718 1.00 41.30 C ATOM 0 HA ALA A 64 15.786 -8.064 6.653 1.00 3.12 H new ATOM 0 HB1 ALA A 64 14.026 -8.180 4.953 1.00 41.30 H new ATOM 0 HB2 ALA A 64 15.588 -7.698 4.249 1.00 41.30 H new ATOM 0 HB3 ALA A 64 14.990 -9.360 4.033 1.00 41.30 H new ATOM 1008 N GLU A 65 13.953 -9.714 7.426 1.00 73.15 N ATOM 1009 CA GLU A 65 13.150 -10.715 8.094 1.00 14.23 C ATOM 1010 C GLU A 65 11.710 -10.563 7.621 1.00 0.41 C ATOM 1011 O GLU A 65 11.184 -9.453 7.556 1.00 73.41 O ATOM 1012 CB GLU A 65 13.271 -10.552 9.615 1.00 61.03 C ATOM 1013 CG GLU A 65 13.229 -11.861 10.401 1.00 74.21 C ATOM 1014 CD GLU A 65 11.944 -12.649 10.228 1.00 51.54 C ATOM 1015 OE1 GLU A 65 10.994 -12.430 11.011 1.00 11.41 O ATOM 1016 OE2 GLU A 65 11.888 -13.513 9.323 1.00 71.22 O ATOM 0 H GLU A 65 13.658 -8.751 7.590 1.00 73.15 H new ATOM 0 HA GLU A 65 13.498 -11.719 7.849 1.00 14.23 H new ATOM 0 HB2 GLU A 65 14.206 -10.039 9.839 1.00 61.03 H new ATOM 0 HB3 GLU A 65 12.463 -9.908 9.963 1.00 61.03 H new ATOM 0 HG2 GLU A 65 14.068 -12.484 10.093 1.00 74.21 H new ATOM 0 HG3 GLU A 65 13.367 -11.641 11.460 1.00 74.21 H new ATOM 1023 N LEU A 66 11.069 -11.669 7.301 1.00 13.00 N ATOM 1024 CA LEU A 66 9.772 -11.618 6.650 1.00 40.31 C ATOM 1025 C LEU A 66 8.695 -12.168 7.573 1.00 11.44 C ATOM 1026 O LEU A 66 8.816 -13.281 8.087 1.00 52.55 O ATOM 1027 CB LEU A 66 9.807 -12.422 5.351 1.00 15.24 C ATOM 1028 CG LEU A 66 8.578 -12.280 4.452 1.00 5.41 C ATOM 1029 CD1 LEU A 66 8.459 -10.857 3.933 1.00 22.44 C ATOM 1030 CD2 LEU A 66 8.649 -13.265 3.294 1.00 4.35 C ATOM 0 H LEU A 66 11.421 -12.610 7.479 1.00 13.00 H new ATOM 0 HA LEU A 66 9.538 -10.579 6.419 1.00 40.31 H new ATOM 0 HB2 LEU A 66 10.687 -12.122 4.783 1.00 15.24 H new ATOM 0 HB3 LEU A 66 9.933 -13.476 5.600 1.00 15.24 H new ATOM 0 HG LEU A 66 7.691 -12.506 5.043 1.00 5.41 H new ATOM 0 HD11 LEU A 66 7.579 -10.775 3.295 1.00 22.44 H new ATOM 0 HD12 LEU A 66 8.363 -10.170 4.774 1.00 22.44 H new ATOM 0 HD13 LEU A 66 9.349 -10.604 3.357 1.00 22.44 H new ATOM 0 HD21 LEU A 66 7.767 -13.150 2.664 1.00 4.35 H new ATOM 0 HD22 LEU A 66 9.544 -13.069 2.704 1.00 4.35 H new ATOM 0 HD23 LEU A 66 8.687 -14.282 3.683 1.00 4.35 H new ATOM 1042 N THR A 67 7.639 -11.398 7.773 1.00 14.11 N ATOM 1043 CA THR A 67 6.585 -11.789 8.694 1.00 2.03 C ATOM 1044 C THR A 67 5.478 -12.544 7.972 1.00 42.11 C ATOM 1045 O THR A 67 4.760 -13.351 8.569 1.00 0.30 O ATOM 1046 CB THR A 67 5.992 -10.560 9.403 1.00 23.23 C ATOM 1047 OG1 THR A 67 5.249 -9.754 8.481 1.00 54.04 O ATOM 1048 CG2 THR A 67 7.099 -9.722 10.005 1.00 61.45 C ATOM 0 H THR A 67 7.489 -10.501 7.312 1.00 14.11 H new ATOM 0 HA THR A 67 7.031 -12.448 9.439 1.00 2.03 H new ATOM 0 HB THR A 67 5.326 -10.913 10.190 1.00 23.23 H new ATOM 0 HG1 THR A 67 4.878 -8.978 8.950 1.00 54.04 H new ATOM 0 HG21 THR A 67 6.668 -8.854 10.505 1.00 61.45 H new ATOM 0 HG22 THR A 67 7.654 -10.319 10.729 1.00 61.45 H new ATOM 0 HG23 THR A 67 7.773 -9.389 9.216 1.00 61.45 H new ATOM 1056 N ALA A 68 5.354 -12.293 6.680 1.00 4.24 N ATOM 1057 CA ALA A 68 4.299 -12.913 5.894 1.00 72.12 C ATOM 1058 C ALA A 68 4.793 -13.323 4.519 1.00 13.02 C ATOM 1059 O ALA A 68 5.382 -12.524 3.794 1.00 30.54 O ATOM 1060 CB ALA A 68 3.111 -11.980 5.769 1.00 63.31 C ATOM 0 H ALA A 68 5.966 -11.668 6.155 1.00 4.24 H new ATOM 0 HA ALA A 68 3.986 -13.816 6.418 1.00 72.12 H new ATOM 0 HB1 ALA A 68 2.332 -12.461 5.178 1.00 63.31 H new ATOM 0 HB2 ALA A 68 2.724 -11.749 6.761 1.00 63.31 H new ATOM 0 HB3 ALA A 68 3.422 -11.058 5.278 1.00 63.31 H new ATOM 1066 N ASP A 69 4.539 -14.575 4.176 1.00 72.13 N ATOM 1067 CA ASP A 69 4.955 -15.134 2.896 1.00 44.43 C ATOM 1068 C ASP A 69 3.782 -15.831 2.221 1.00 74.00 C ATOM 1069 O ASP A 69 3.965 -16.734 1.404 1.00 11.45 O ATOM 1070 CB ASP A 69 6.116 -16.121 3.097 1.00 64.41 C ATOM 1071 CG ASP A 69 5.774 -17.265 4.039 1.00 53.24 C ATOM 1072 OD1 ASP A 69 5.727 -17.035 5.269 1.00 25.04 O ATOM 1073 OD2 ASP A 69 5.573 -18.405 3.559 1.00 71.33 O ATOM 0 H ASP A 69 4.040 -15.233 4.774 1.00 72.13 H new ATOM 0 HA ASP A 69 5.296 -14.321 2.254 1.00 44.43 H new ATOM 0 HB2 ASP A 69 6.408 -16.530 2.130 1.00 64.41 H new ATOM 0 HB3 ASP A 69 6.979 -15.582 3.489 1.00 64.41 H new ATOM 1078 N GLU A 70 2.575 -15.382 2.550 1.00 44.11 N ATOM 1079 CA GLU A 70 1.359 -15.989 2.027 1.00 62.14 C ATOM 1080 C GLU A 70 1.297 -15.849 0.505 1.00 63.23 C ATOM 1081 O GLU A 70 1.661 -14.807 -0.045 1.00 10.43 O ATOM 1082 CB GLU A 70 0.141 -15.305 2.656 1.00 11.35 C ATOM 1083 CG GLU A 70 0.117 -15.345 4.176 1.00 13.42 C ATOM 1084 CD GLU A 70 -0.331 -16.682 4.723 1.00 64.44 C ATOM 1085 OE1 GLU A 70 0.459 -17.643 4.688 1.00 63.44 O ATOM 1086 OE2 GLU A 70 -1.488 -16.778 5.190 1.00 3.04 O ATOM 0 H GLU A 70 2.414 -14.596 3.180 1.00 44.11 H new ATOM 0 HA GLU A 70 1.360 -17.050 2.277 1.00 62.14 H new ATOM 0 HB2 GLU A 70 0.115 -14.265 2.331 1.00 11.35 H new ATOM 0 HB3 GLU A 70 -0.764 -15.780 2.277 1.00 11.35 H new ATOM 0 HG2 GLU A 70 1.113 -15.118 4.556 1.00 13.42 H new ATOM 0 HG3 GLU A 70 -0.550 -14.566 4.544 1.00 13.42 H new ATOM 1093 N PRO A 71 0.804 -16.883 -0.192 1.00 4.34 N ATOM 1094 CA PRO A 71 0.688 -16.879 -1.649 1.00 44.24 C ATOM 1095 C PRO A 71 -0.493 -16.038 -2.127 1.00 44.14 C ATOM 1096 O PRO A 71 -1.639 -16.504 -2.132 1.00 2.01 O ATOM 1097 CB PRO A 71 0.475 -18.360 -2.010 1.00 33.25 C ATOM 1098 CG PRO A 71 0.645 -19.122 -0.734 1.00 55.35 C ATOM 1099 CD PRO A 71 0.348 -18.155 0.374 1.00 31.43 C ATOM 0 HA PRO A 71 1.567 -16.442 -2.123 1.00 44.24 H new ATOM 0 HB2 PRO A 71 -0.517 -18.520 -2.431 1.00 33.25 H new ATOM 0 HB3 PRO A 71 1.196 -18.687 -2.759 1.00 33.25 H new ATOM 0 HG2 PRO A 71 -0.032 -19.976 -0.697 1.00 55.35 H new ATOM 0 HG3 PRO A 71 1.658 -19.514 -0.647 1.00 55.35 H new ATOM 0 HD2 PRO A 71 -0.713 -18.133 0.621 1.00 31.43 H new ATOM 0 HD3 PRO A 71 0.883 -18.408 1.289 1.00 31.43 H new ATOM 1107 N GLY A 72 -0.214 -14.785 -2.480 1.00 24.32 N ATOM 1108 CA GLY A 72 -1.251 -13.892 -2.976 1.00 20.24 C ATOM 1109 C GLY A 72 -2.335 -13.620 -1.945 1.00 22.45 C ATOM 1110 O GLY A 72 -3.446 -13.223 -2.291 1.00 41.40 O ATOM 0 H GLY A 72 0.716 -14.370 -2.431 1.00 24.32 H new ATOM 0 HA2 GLY A 72 -0.798 -12.948 -3.278 1.00 20.24 H new ATOM 0 HA3 GLY A 72 -1.704 -14.327 -3.867 1.00 20.24 H new ATOM 1114 N LYS A 73 -2.007 -13.834 -0.679 1.00 60.23 N ATOM 1115 CA LYS A 73 -2.970 -13.678 0.402 1.00 64.12 C ATOM 1116 C LYS A 73 -2.621 -12.451 1.238 1.00 64.45 C ATOM 1117 O LYS A 73 -3.424 -11.530 1.373 1.00 34.20 O ATOM 1118 CB LYS A 73 -2.982 -14.963 1.252 1.00 2.13 C ATOM 1119 CG LYS A 73 -3.998 -14.996 2.389 1.00 4.45 C ATOM 1120 CD LYS A 73 -3.481 -14.297 3.637 1.00 75.12 C ATOM 1121 CE LYS A 73 -4.303 -14.647 4.865 1.00 65.41 C ATOM 1122 NZ LYS A 73 -4.174 -16.084 5.228 1.00 53.41 N ATOM 0 H LYS A 73 -1.076 -14.118 -0.374 1.00 60.23 H new ATOM 0 HA LYS A 73 -3.970 -13.523 -0.003 1.00 64.12 H new ATOM 0 HB2 LYS A 73 -3.174 -15.810 0.593 1.00 2.13 H new ATOM 0 HB3 LYS A 73 -1.987 -15.106 1.674 1.00 2.13 H new ATOM 0 HG2 LYS A 73 -4.922 -14.519 2.063 1.00 4.45 H new ATOM 0 HG3 LYS A 73 -4.241 -16.031 2.628 1.00 4.45 H new ATOM 0 HD2 LYS A 73 -2.441 -14.577 3.805 1.00 75.12 H new ATOM 0 HD3 LYS A 73 -3.500 -13.218 3.483 1.00 75.12 H new ATOM 0 HE2 LYS A 73 -3.982 -14.030 5.705 1.00 65.41 H new ATOM 0 HE3 LYS A 73 -5.351 -14.412 4.679 1.00 65.41 H new ATOM 0 HZ1 LYS A 73 -4.515 -16.229 6.200 1.00 53.41 H new ATOM 0 HZ2 LYS A 73 -4.740 -16.660 4.573 1.00 53.41 H new ATOM 0 HZ3 LYS A 73 -3.176 -16.370 5.166 1.00 53.41 H new ATOM 1136 N ARG A 74 -1.412 -12.440 1.782 1.00 45.11 N ATOM 1137 CA ARG A 74 -0.948 -11.339 2.612 1.00 11.11 C ATOM 1138 C ARG A 74 0.572 -11.288 2.599 1.00 73.40 C ATOM 1139 O ARG A 74 1.236 -12.185 3.119 1.00 61.21 O ATOM 1140 CB ARG A 74 -1.460 -11.496 4.048 1.00 13.32 C ATOM 1141 CG ARG A 74 -0.798 -10.565 5.048 1.00 52.33 C ATOM 1142 CD ARG A 74 -1.056 -11.016 6.475 1.00 43.23 C ATOM 1143 NE ARG A 74 -0.334 -12.250 6.801 1.00 64.13 N ATOM 1144 CZ ARG A 74 -0.763 -13.160 7.677 1.00 5.14 C ATOM 1145 NH1 ARG A 74 -1.955 -13.029 8.248 1.00 44.23 N ATOM 1146 NH2 ARG A 74 -0.010 -14.214 7.967 1.00 25.32 N ATOM 0 H ARG A 74 -0.730 -13.189 1.661 1.00 45.11 H new ATOM 0 HA ARG A 74 -1.340 -10.406 2.207 1.00 11.11 H new ATOM 0 HB2 ARG A 74 -2.535 -11.319 4.060 1.00 13.32 H new ATOM 0 HB3 ARG A 74 -1.303 -12.526 4.368 1.00 13.32 H new ATOM 0 HG2 ARG A 74 0.276 -10.533 4.863 1.00 52.33 H new ATOM 0 HG3 ARG A 74 -1.176 -9.552 4.910 1.00 52.33 H new ATOM 0 HD2 ARG A 74 -0.755 -10.227 7.164 1.00 43.23 H new ATOM 0 HD3 ARG A 74 -2.125 -11.173 6.618 1.00 43.23 H new ATOM 0 HE ARG A 74 0.553 -12.424 6.328 1.00 64.13 H new ATOM 0 HH11 ARG A 74 -2.546 -12.230 8.017 1.00 44.23 H new ATOM 0 HH12 ARG A 74 -2.279 -13.727 8.917 1.00 44.23 H new ATOM 0 HH21 ARG A 74 0.899 -14.330 7.520 1.00 25.32 H new ATOM 0 HH22 ARG A 74 -0.341 -14.908 8.637 1.00 25.32 H new ATOM 1160 N ILE A 75 1.113 -10.253 1.988 1.00 71.44 N ATOM 1161 CA ILE A 75 2.549 -10.079 1.921 1.00 33.22 C ATOM 1162 C ILE A 75 2.962 -8.917 2.812 1.00 12.41 C ATOM 1163 O ILE A 75 2.644 -7.761 2.533 1.00 73.51 O ATOM 1164 CB ILE A 75 3.050 -9.830 0.473 1.00 61.20 C ATOM 1165 CG1 ILE A 75 2.761 -11.033 -0.441 1.00 14.31 C ATOM 1166 CG2 ILE A 75 4.542 -9.527 0.471 1.00 44.13 C ATOM 1167 CD1 ILE A 75 1.320 -11.139 -0.896 1.00 51.23 C ATOM 0 H ILE A 75 0.576 -9.517 1.529 1.00 71.44 H new ATOM 0 HA ILE A 75 3.007 -11.005 2.268 1.00 33.22 H new ATOM 0 HB ILE A 75 2.507 -8.969 0.083 1.00 61.20 H new ATOM 0 HG12 ILE A 75 3.403 -10.969 -1.319 1.00 14.31 H new ATOM 0 HG13 ILE A 75 3.031 -11.948 0.086 1.00 14.31 H new ATOM 0 HG21 ILE A 75 4.877 -9.355 -0.552 1.00 44.13 H new ATOM 0 HG22 ILE A 75 4.733 -8.637 1.070 1.00 44.13 H new ATOM 0 HG23 ILE A 75 5.085 -10.372 0.893 1.00 44.13 H new ATOM 0 HD11 ILE A 75 1.204 -12.014 -1.536 1.00 51.23 H new ATOM 0 HD12 ILE A 75 0.670 -11.237 -0.026 1.00 51.23 H new ATOM 0 HD13 ILE A 75 1.048 -10.243 -1.454 1.00 51.23 H new ATOM 1179 N ALA A 76 3.640 -9.231 3.897 1.00 1.20 N ATOM 1180 CA ALA A 76 4.131 -8.210 4.804 1.00 4.22 C ATOM 1181 C ALA A 76 5.637 -8.278 4.886 1.00 5.33 C ATOM 1182 O ALA A 76 6.200 -9.265 5.359 1.00 25.51 O ATOM 1183 CB ALA A 76 3.509 -8.363 6.181 1.00 34.24 C ATOM 0 H ALA A 76 3.865 -10.187 4.174 1.00 1.20 H new ATOM 0 HA ALA A 76 3.844 -7.232 4.417 1.00 4.22 H new ATOM 0 HB1 ALA A 76 3.893 -7.586 6.842 1.00 34.24 H new ATOM 0 HB2 ALA A 76 2.426 -8.270 6.103 1.00 34.24 H new ATOM 0 HB3 ALA A 76 3.761 -9.343 6.587 1.00 34.24 H new ATOM 1189 N TRP A 77 6.282 -7.225 4.428 1.00 45.43 N ATOM 1190 CA TRP A 77 7.728 -7.184 4.398 1.00 42.13 C ATOM 1191 C TRP A 77 8.241 -6.283 5.500 1.00 21.43 C ATOM 1192 O TRP A 77 7.697 -5.202 5.744 1.00 53.41 O ATOM 1193 CB TRP A 77 8.244 -6.726 3.029 1.00 62.00 C ATOM 1194 CG TRP A 77 7.763 -5.366 2.605 1.00 14.04 C ATOM 1195 CD1 TRP A 77 8.440 -4.187 2.727 1.00 51.14 C ATOM 1196 CD2 TRP A 77 6.508 -5.045 1.989 1.00 64.35 C ATOM 1197 NE1 TRP A 77 7.685 -3.154 2.229 1.00 35.55 N ATOM 1198 CE2 TRP A 77 6.495 -3.653 1.768 1.00 2.53 C ATOM 1199 CE3 TRP A 77 5.395 -5.800 1.602 1.00 24.30 C ATOM 1200 CZ2 TRP A 77 5.411 -3.005 1.178 1.00 2.43 C ATOM 1201 CZ3 TRP A 77 4.323 -5.154 1.018 1.00 4.33 C ATOM 1202 CH2 TRP A 77 4.336 -3.769 0.810 1.00 63.42 C ATOM 0 H TRP A 77 5.826 -6.385 4.071 1.00 45.43 H new ATOM 0 HA TRP A 77 8.105 -8.193 4.566 1.00 42.13 H new ATOM 0 HB2 TRP A 77 9.334 -6.722 3.048 1.00 62.00 H new ATOM 0 HB3 TRP A 77 7.941 -7.455 2.278 1.00 62.00 H new ATOM 0 HD1 TRP A 77 9.427 -4.082 3.153 1.00 51.14 H new ATOM 0 HE1 TRP A 77 7.965 -2.173 2.206 1.00 35.55 H new ATOM 0 HE3 TRP A 77 5.375 -6.869 1.757 1.00 24.30 H new ATOM 0 HZ2 TRP A 77 5.419 -1.937 1.017 1.00 2.43 H new ATOM 0 HZ3 TRP A 77 3.459 -5.727 0.716 1.00 4.33 H new ATOM 0 HH2 TRP A 77 3.482 -3.294 0.350 1.00 63.42 H new ATOM 1213 N ARG A 78 9.265 -6.753 6.180 1.00 10.41 N ATOM 1214 CA ARG A 78 9.839 -6.050 7.310 1.00 13.14 C ATOM 1215 C ARG A 78 11.341 -6.228 7.285 1.00 70.40 C ATOM 1216 O ARG A 78 11.870 -6.961 6.448 1.00 11.41 O ATOM 1217 CB ARG A 78 9.279 -6.602 8.630 1.00 2.32 C ATOM 1218 CG ARG A 78 7.765 -6.548 8.733 1.00 55.43 C ATOM 1219 CD ARG A 78 7.259 -5.122 8.855 1.00 62.34 C ATOM 1220 NE ARG A 78 5.994 -4.934 8.146 1.00 24.13 N ATOM 1221 CZ ARG A 78 4.813 -4.780 8.742 1.00 31.14 C ATOM 1222 NH1 ARG A 78 4.707 -4.878 10.060 1.00 63.01 N ATOM 1223 NH2 ARG A 78 3.733 -4.553 8.009 1.00 31.41 N ATOM 0 H ARG A 78 9.726 -7.637 5.964 1.00 10.41 H new ATOM 0 HA ARG A 78 9.584 -4.993 7.241 1.00 13.14 H new ATOM 0 HB2 ARG A 78 9.603 -7.636 8.745 1.00 2.32 H new ATOM 0 HB3 ARG A 78 9.709 -6.039 9.458 1.00 2.32 H new ATOM 0 HG2 ARG A 78 7.324 -7.016 7.853 1.00 55.43 H new ATOM 0 HG3 ARG A 78 7.439 -7.125 9.598 1.00 55.43 H new ATOM 0 HD2 ARG A 78 7.127 -4.872 9.908 1.00 62.34 H new ATOM 0 HD3 ARG A 78 8.006 -4.436 8.455 1.00 62.34 H new ATOM 0 HE ARG A 78 6.018 -4.920 7.126 1.00 24.13 H new ATOM 0 HH11 ARG A 78 5.534 -5.073 10.625 1.00 63.01 H new ATOM 0 HH12 ARG A 78 3.799 -4.759 10.509 1.00 63.01 H new ATOM 0 HH21 ARG A 78 3.808 -4.497 6.993 1.00 31.41 H new ATOM 0 HH22 ARG A 78 2.826 -4.434 8.460 1.00 31.41 H new ATOM 1237 N SER A 79 12.026 -5.552 8.174 1.00 53.24 N ATOM 1238 CA SER A 79 13.435 -5.786 8.355 1.00 0.24 C ATOM 1239 C SER A 79 13.630 -6.703 9.551 1.00 12.03 C ATOM 1240 O SER A 79 12.681 -7.360 9.992 1.00 2.55 O ATOM 1241 CB SER A 79 14.153 -4.456 8.553 1.00 74.43 C ATOM 1242 OG SER A 79 13.533 -3.705 9.580 1.00 41.22 O ATOM 0 H SER A 79 11.630 -4.836 8.783 1.00 53.24 H new ATOM 0 HA SER A 79 13.858 -6.267 7.473 1.00 0.24 H new ATOM 0 HB2 SER A 79 15.198 -4.635 8.806 1.00 74.43 H new ATOM 0 HB3 SER A 79 14.142 -3.888 7.623 1.00 74.43 H new ATOM 0 HG SER A 79 14.212 -3.193 10.067 1.00 41.22 H new ATOM 1248 N LEU A 80 14.839 -6.766 10.079 1.00 21.51 N ATOM 1249 CA LEU A 80 15.093 -7.618 11.225 1.00 70.43 C ATOM 1250 C LEU A 80 14.448 -7.018 12.466 1.00 52.30 C ATOM 1251 O LEU A 80 14.439 -5.799 12.638 1.00 72.14 O ATOM 1252 CB LEU A 80 16.596 -7.824 11.433 1.00 44.11 C ATOM 1253 CG LEU A 80 17.343 -8.362 10.214 1.00 5.11 C ATOM 1254 CD1 LEU A 80 18.700 -8.891 10.610 1.00 74.31 C ATOM 1255 CD2 LEU A 80 16.545 -9.442 9.513 1.00 71.15 C ATOM 0 H LEU A 80 15.648 -6.246 9.739 1.00 21.51 H new ATOM 0 HA LEU A 80 14.651 -8.597 11.039 1.00 70.43 H new ATOM 0 HB2 LEU A 80 17.042 -6.873 11.724 1.00 44.11 H new ATOM 0 HB3 LEU A 80 16.742 -8.513 12.265 1.00 44.11 H new ATOM 0 HG LEU A 80 17.479 -7.534 9.518 1.00 5.11 H new ATOM 0 HD11 LEU A 80 19.215 -9.269 9.727 1.00 74.31 H new ATOM 0 HD12 LEU A 80 19.287 -8.089 11.057 1.00 74.31 H new ATOM 0 HD13 LEU A 80 18.579 -9.698 11.333 1.00 74.31 H new ATOM 0 HD21 LEU A 80 17.103 -9.805 8.650 1.00 71.15 H new ATOM 0 HD22 LEU A 80 16.366 -10.267 10.202 1.00 71.15 H new ATOM 0 HD23 LEU A 80 15.591 -9.032 9.182 1.00 71.15 H new ATOM 1267 N PRO A 81 13.906 -7.870 13.349 1.00 1.03 N ATOM 1268 CA PRO A 81 13.146 -7.431 14.526 1.00 20.45 C ATOM 1269 C PRO A 81 13.984 -6.622 15.510 1.00 2.55 C ATOM 1270 O PRO A 81 13.445 -5.891 16.342 1.00 54.14 O ATOM 1271 CB PRO A 81 12.685 -8.743 15.173 1.00 32.23 C ATOM 1272 CG PRO A 81 12.808 -9.770 14.103 1.00 1.02 C ATOM 1273 CD PRO A 81 13.971 -9.338 13.262 1.00 50.34 C ATOM 0 HA PRO A 81 12.329 -6.767 14.243 1.00 20.45 H new ATOM 0 HB2 PRO A 81 13.303 -8.996 16.034 1.00 32.23 H new ATOM 0 HB3 PRO A 81 11.658 -8.667 15.529 1.00 32.23 H new ATOM 0 HG2 PRO A 81 12.977 -10.760 14.527 1.00 1.02 H new ATOM 0 HG3 PRO A 81 11.896 -9.829 13.510 1.00 1.02 H new ATOM 0 HD2 PRO A 81 14.915 -9.725 13.647 1.00 50.34 H new ATOM 0 HD3 PRO A 81 13.879 -9.687 12.234 1.00 50.34 H new ATOM 1281 N GLY A 82 15.297 -6.767 15.422 1.00 74.13 N ATOM 1282 CA GLY A 82 16.186 -6.018 16.282 1.00 42.02 C ATOM 1283 C GLY A 82 16.941 -4.938 15.537 1.00 30.45 C ATOM 1284 O GLY A 82 17.935 -4.414 16.036 1.00 13.52 O ATOM 0 H GLY A 82 15.764 -7.394 14.767 1.00 74.13 H new ATOM 0 HA2 GLY A 82 15.609 -5.564 17.088 1.00 42.02 H new ATOM 0 HA3 GLY A 82 16.898 -6.701 16.746 1.00 42.02 H new ATOM 1288 N ALA A 83 16.474 -4.597 14.347 1.00 43.42 N ATOM 1289 CA ALA A 83 17.155 -3.615 13.517 1.00 30.12 C ATOM 1290 C ALA A 83 16.226 -2.464 13.154 1.00 15.32 C ATOM 1291 O ALA A 83 15.050 -2.461 13.519 1.00 43.15 O ATOM 1292 CB ALA A 83 17.689 -4.279 12.257 1.00 73.44 C ATOM 0 H ALA A 83 15.626 -4.985 13.934 1.00 43.42 H new ATOM 0 HA ALA A 83 17.990 -3.207 14.087 1.00 30.12 H new ATOM 0 HB1 ALA A 83 18.197 -3.536 11.642 1.00 73.44 H new ATOM 0 HB2 ALA A 83 18.392 -5.066 12.530 1.00 73.44 H new ATOM 0 HB3 ALA A 83 16.861 -4.711 11.695 1.00 73.44 H new ATOM 1298 N ARG A 84 16.775 -1.480 12.451 1.00 63.45 N ATOM 1299 CA ARG A 84 15.999 -0.356 11.945 1.00 23.40 C ATOM 1300 C ARG A 84 14.956 -0.852 10.945 1.00 51.31 C ATOM 1301 O ARG A 84 15.249 -1.714 10.113 1.00 22.33 O ATOM 1302 CB ARG A 84 16.941 0.659 11.290 1.00 0.42 C ATOM 1303 CG ARG A 84 17.619 0.138 10.030 1.00 41.24 C ATOM 1304 CD ARG A 84 18.933 0.851 9.746 1.00 64.45 C ATOM 1305 NE ARG A 84 18.816 2.306 9.793 1.00 44.21 N ATOM 1306 CZ ARG A 84 18.479 3.069 8.754 1.00 44.22 C ATOM 1307 NH1 ARG A 84 18.091 2.514 7.611 1.00 33.11 N ATOM 1308 NH2 ARG A 84 18.504 4.389 8.871 1.00 34.33 N ATOM 0 H ARG A 84 17.767 -1.439 12.217 1.00 63.45 H new ATOM 0 HA ARG A 84 15.477 0.131 12.769 1.00 23.40 H new ATOM 0 HB2 ARG A 84 16.377 1.559 11.043 1.00 0.42 H new ATOM 0 HB3 ARG A 84 17.706 0.950 12.010 1.00 0.42 H new ATOM 0 HG2 ARG A 84 17.803 -0.931 10.135 1.00 41.24 H new ATOM 0 HG3 ARG A 84 16.948 0.264 9.180 1.00 41.24 H new ATOM 0 HD2 ARG A 84 19.679 0.529 10.472 1.00 64.45 H new ATOM 0 HD3 ARG A 84 19.296 0.553 8.762 1.00 64.45 H new ATOM 0 HE ARG A 84 19.005 2.770 10.682 1.00 44.21 H new ATOM 0 HH11 ARG A 84 18.050 1.498 7.525 1.00 33.11 H new ATOM 0 HH12 ARG A 84 17.834 3.103 6.819 1.00 33.11 H new ATOM 0 HH21 ARG A 84 18.781 4.818 9.754 1.00 34.33 H new ATOM 0 HH22 ARG A 84 18.247 4.976 8.078 1.00 34.33 H new ATOM 1322 N ILE A 85 13.742 -0.327 11.033 1.00 2.34 N ATOM 1323 CA ILE A 85 12.660 -0.791 10.173 1.00 2.15 C ATOM 1324 C ILE A 85 12.176 0.315 9.236 1.00 41.13 C ATOM 1325 O ILE A 85 11.687 0.035 8.142 1.00 23.53 O ATOM 1326 CB ILE A 85 11.479 -1.354 11.006 1.00 2.22 C ATOM 1327 CG1 ILE A 85 10.451 -2.033 10.096 1.00 11.51 C ATOM 1328 CG2 ILE A 85 10.820 -0.254 11.832 1.00 11.21 C ATOM 1329 CD1 ILE A 85 9.362 -2.766 10.851 1.00 52.00 C ATOM 0 H ILE A 85 13.482 0.414 11.684 1.00 2.34 H new ATOM 0 HA ILE A 85 13.060 -1.600 9.561 1.00 2.15 H new ATOM 0 HB ILE A 85 11.877 -2.101 11.693 1.00 2.22 H new ATOM 0 HG12 ILE A 85 9.993 -1.280 9.455 1.00 11.51 H new ATOM 0 HG13 ILE A 85 10.966 -2.738 9.443 1.00 11.51 H new ATOM 0 HG21 ILE A 85 9.995 -0.675 12.407 1.00 11.21 H new ATOM 0 HG22 ILE A 85 11.553 0.178 12.513 1.00 11.21 H new ATOM 0 HG23 ILE A 85 10.440 0.522 11.167 1.00 11.21 H new ATOM 0 HD11 ILE A 85 8.671 -3.222 10.142 1.00 52.00 H new ATOM 0 HD12 ILE A 85 9.809 -3.542 11.472 1.00 52.00 H new ATOM 0 HD13 ILE A 85 8.821 -2.062 11.484 1.00 52.00 H new ATOM 1341 N GLU A 86 12.340 1.568 9.667 1.00 4.10 N ATOM 1342 CA GLU A 86 11.967 2.740 8.871 1.00 33.14 C ATOM 1343 C GLU A 86 10.451 2.830 8.666 1.00 21.30 C ATOM 1344 O GLU A 86 9.760 3.548 9.391 1.00 51.02 O ATOM 1345 CB GLU A 86 12.682 2.732 7.514 1.00 14.00 C ATOM 1346 CG GLU A 86 14.199 2.724 7.618 1.00 62.12 C ATOM 1347 CD GLU A 86 14.747 3.966 8.290 1.00 74.33 C ATOM 1348 OE1 GLU A 86 14.860 5.010 7.614 1.00 53.33 O ATOM 1349 OE2 GLU A 86 15.080 3.903 9.487 1.00 3.44 O ATOM 0 H GLU A 86 12.735 1.799 10.578 1.00 4.10 H new ATOM 0 HA GLU A 86 12.284 3.620 9.431 1.00 33.14 H new ATOM 0 HB2 GLU A 86 12.361 1.856 6.950 1.00 14.00 H new ATOM 0 HB3 GLU A 86 12.371 3.608 6.945 1.00 14.00 H new ATOM 0 HG2 GLU A 86 14.516 1.844 8.177 1.00 62.12 H new ATOM 0 HG3 GLU A 86 14.627 2.638 6.619 1.00 62.12 H new ATOM 1356 N ASN A 87 9.942 2.084 7.695 1.00 3.31 N ATOM 1357 CA ASN A 87 8.525 2.110 7.358 1.00 55.32 C ATOM 1358 C ASN A 87 8.004 0.687 7.216 1.00 62.45 C ATOM 1359 O ASN A 87 8.622 -0.141 6.548 1.00 2.53 O ATOM 1360 CB ASN A 87 8.300 2.891 6.052 1.00 14.24 C ATOM 1361 CG ASN A 87 6.856 2.860 5.570 1.00 64.32 C ATOM 1362 OD1 ASN A 87 5.919 2.750 6.359 1.00 72.14 O ATOM 1363 ND2 ASN A 87 6.665 2.978 4.266 1.00 42.44 N ATOM 0 H ASN A 87 10.496 1.447 7.122 1.00 3.31 H new ATOM 0 HA ASN A 87 7.980 2.611 8.158 1.00 55.32 H new ATOM 0 HB2 ASN A 87 8.604 3.927 6.200 1.00 14.24 H new ATOM 0 HB3 ASN A 87 8.944 2.478 5.275 1.00 14.24 H new ATOM 0 HD21 ASN A 87 5.718 2.980 3.887 1.00 42.44 H new ATOM 0 HD22 ASN A 87 7.465 3.067 3.639 1.00 42.44 H new ATOM 1370 N SER A 88 6.874 0.406 7.840 1.00 35.32 N ATOM 1371 CA SER A 88 6.296 -0.924 7.794 1.00 32.04 C ATOM 1372 C SER A 88 5.224 -1.002 6.712 1.00 34.24 C ATOM 1373 O SER A 88 4.313 -0.174 6.668 1.00 12.12 O ATOM 1374 CB SER A 88 5.692 -1.273 9.153 1.00 73.12 C ATOM 1375 OG SER A 88 6.649 -1.110 10.181 1.00 34.12 O ATOM 0 H SER A 88 6.339 1.082 8.385 1.00 35.32 H new ATOM 0 HA SER A 88 7.083 -1.640 7.556 1.00 32.04 H new ATOM 0 HB2 SER A 88 4.829 -0.636 9.348 1.00 73.12 H new ATOM 0 HB3 SER A 88 5.333 -2.302 9.144 1.00 73.12 H new ATOM 0 HG SER A 88 6.244 -1.336 11.044 1.00 34.12 H new ATOM 1381 N GLY A 89 5.346 -1.998 5.843 1.00 40.00 N ATOM 1382 CA GLY A 89 4.366 -2.198 4.795 1.00 40.52 C ATOM 1383 C GLY A 89 3.805 -3.603 4.814 1.00 71.12 C ATOM 1384 O GLY A 89 4.514 -4.556 5.153 1.00 51.24 O ATOM 0 H GLY A 89 6.110 -2.673 5.847 1.00 40.00 H new ATOM 0 HA2 GLY A 89 3.554 -1.480 4.914 1.00 40.52 H new ATOM 0 HA3 GLY A 89 4.825 -2.002 3.826 1.00 40.52 H new ATOM 1388 N GLU A 90 2.528 -3.729 4.493 1.00 74.53 N ATOM 1389 CA GLU A 90 1.876 -5.028 4.423 1.00 52.12 C ATOM 1390 C GLU A 90 0.657 -4.954 3.515 1.00 61.32 C ATOM 1391 O GLU A 90 -0.139 -4.021 3.611 1.00 32.41 O ATOM 1392 CB GLU A 90 1.480 -5.504 5.824 1.00 2.31 C ATOM 1393 CG GLU A 90 0.566 -4.546 6.575 1.00 62.21 C ATOM 1394 CD GLU A 90 0.520 -4.834 8.061 1.00 64.41 C ATOM 1395 OE1 GLU A 90 -0.146 -5.809 8.463 1.00 74.12 O ATOM 1396 OE2 GLU A 90 1.172 -4.092 8.833 1.00 74.01 O ATOM 0 H GLU A 90 1.918 -2.941 4.275 1.00 74.53 H new ATOM 0 HA GLU A 90 2.576 -5.750 4.004 1.00 52.12 H new ATOM 0 HB2 GLU A 90 0.984 -6.471 5.740 1.00 2.31 H new ATOM 0 HB3 GLU A 90 2.385 -5.660 6.411 1.00 2.31 H new ATOM 0 HG2 GLU A 90 0.908 -3.523 6.417 1.00 62.21 H new ATOM 0 HG3 GLU A 90 -0.441 -4.612 6.164 1.00 62.21 H new ATOM 1403 N VAL A 91 0.527 -5.921 2.620 1.00 55.32 N ATOM 1404 CA VAL A 91 -0.599 -5.955 1.699 1.00 73.41 C ATOM 1405 C VAL A 91 -1.358 -7.276 1.792 1.00 53.43 C ATOM 1406 O VAL A 91 -0.806 -8.351 1.548 1.00 74.31 O ATOM 1407 CB VAL A 91 -0.158 -5.705 0.235 1.00 3.21 C ATOM 1408 CG1 VAL A 91 1.041 -6.561 -0.138 1.00 42.31 C ATOM 1409 CG2 VAL A 91 -1.307 -5.961 -0.725 1.00 75.42 C ATOM 0 H VAL A 91 1.186 -6.692 2.512 1.00 55.32 H new ATOM 0 HA VAL A 91 -1.266 -5.146 1.997 1.00 73.41 H new ATOM 0 HB VAL A 91 0.137 -4.659 0.156 1.00 3.21 H new ATOM 0 HG11 VAL A 91 1.324 -6.360 -1.171 1.00 42.31 H new ATOM 0 HG12 VAL A 91 1.877 -6.323 0.520 1.00 42.31 H new ATOM 0 HG13 VAL A 91 0.783 -7.615 -0.030 1.00 42.31 H new ATOM 0 HG21 VAL A 91 -0.975 -5.779 -1.747 1.00 75.42 H new ATOM 0 HG22 VAL A 91 -1.637 -6.995 -0.629 1.00 75.42 H new ATOM 0 HG23 VAL A 91 -2.135 -5.292 -0.488 1.00 75.42 H new ATOM 1419 N LEU A 92 -2.623 -7.184 2.168 1.00 72.13 N ATOM 1420 CA LEU A 92 -3.506 -8.331 2.193 1.00 40.43 C ATOM 1421 C LEU A 92 -4.508 -8.209 1.054 1.00 22.15 C ATOM 1422 O LEU A 92 -5.176 -7.183 0.914 1.00 3.24 O ATOM 1423 CB LEU A 92 -4.258 -8.427 3.528 1.00 14.22 C ATOM 1424 CG LEU A 92 -3.403 -8.459 4.803 1.00 4.43 C ATOM 1425 CD1 LEU A 92 -2.803 -7.092 5.115 1.00 44.12 C ATOM 1426 CD2 LEU A 92 -4.240 -8.933 5.972 1.00 10.24 C ATOM 0 H LEU A 92 -3.063 -6.312 2.463 1.00 72.13 H new ATOM 0 HA LEU A 92 -2.906 -9.234 2.077 1.00 40.43 H new ATOM 0 HB2 LEU A 92 -4.939 -7.578 3.596 1.00 14.22 H new ATOM 0 HB3 LEU A 92 -4.872 -9.327 3.508 1.00 14.22 H new ATOM 0 HG LEU A 92 -2.580 -9.153 4.635 1.00 4.43 H new ATOM 0 HD11 LEU A 92 -2.205 -7.156 6.024 1.00 44.12 H new ATOM 0 HD12 LEU A 92 -2.170 -6.775 4.286 1.00 44.12 H new ATOM 0 HD13 LEU A 92 -3.604 -6.367 5.258 1.00 44.12 H new ATOM 0 HD21 LEU A 92 -3.628 -8.953 6.873 1.00 10.24 H new ATOM 0 HD22 LEU A 92 -5.079 -8.252 6.119 1.00 10.24 H new ATOM 0 HD23 LEU A 92 -4.617 -9.935 5.767 1.00 10.24 H new ATOM 1438 N PHE A 93 -4.604 -9.239 0.239 1.00 14.03 N ATOM 1439 CA PHE A 93 -5.513 -9.218 -0.893 1.00 31.34 C ATOM 1440 C PHE A 93 -6.862 -9.793 -0.500 1.00 64.25 C ATOM 1441 O PHE A 93 -6.958 -10.934 -0.042 1.00 14.11 O ATOM 1442 CB PHE A 93 -4.922 -9.982 -2.072 1.00 10.34 C ATOM 1443 CG PHE A 93 -3.680 -9.345 -2.619 1.00 61.12 C ATOM 1444 CD1 PHE A 93 -3.755 -8.190 -3.384 1.00 1.15 C ATOM 1445 CD2 PHE A 93 -2.435 -9.898 -2.371 1.00 2.32 C ATOM 1446 CE1 PHE A 93 -2.611 -7.601 -3.880 1.00 51.42 C ATOM 1447 CE2 PHE A 93 -1.288 -9.312 -2.866 1.00 61.21 C ATOM 1448 CZ PHE A 93 -1.377 -8.164 -3.625 1.00 24.20 C ATOM 0 H PHE A 93 -4.066 -10.100 0.337 1.00 14.03 H new ATOM 0 HA PHE A 93 -5.658 -8.182 -1.200 1.00 31.34 H new ATOM 0 HB2 PHE A 93 -4.694 -11.001 -1.760 1.00 10.34 H new ATOM 0 HB3 PHE A 93 -5.668 -10.051 -2.864 1.00 10.34 H new ATOM 0 HD1 PHE A 93 -4.718 -7.748 -3.593 1.00 1.15 H new ATOM 0 HD2 PHE A 93 -2.361 -10.800 -1.782 1.00 2.32 H new ATOM 0 HE1 PHE A 93 -2.681 -6.698 -4.469 1.00 51.42 H new ATOM 0 HE2 PHE A 93 -0.323 -9.751 -2.660 1.00 61.21 H new ATOM 0 HZ PHE A 93 -0.482 -7.706 -4.019 1.00 24.20 H new ATOM 1458 N ARG A 94 -7.898 -8.984 -0.647 1.00 72.21 N ATOM 1459 CA ARG A 94 -9.245 -9.396 -0.291 1.00 70.25 C ATOM 1460 C ARG A 94 -10.088 -9.560 -1.551 1.00 12.11 C ATOM 1461 O ARG A 94 -9.917 -8.813 -2.513 1.00 64.11 O ATOM 1462 CB ARG A 94 -9.887 -8.358 0.640 1.00 43.33 C ATOM 1463 CG ARG A 94 -9.038 -7.991 1.855 1.00 70.40 C ATOM 1464 CD ARG A 94 -8.970 -9.110 2.888 1.00 32.22 C ATOM 1465 NE ARG A 94 -8.315 -10.315 2.376 1.00 60.24 N ATOM 1466 CZ ARG A 94 -8.229 -11.463 3.046 1.00 61.14 C ATOM 1467 NH1 ARG A 94 -8.727 -11.567 4.271 1.00 32.44 N ATOM 1468 NH2 ARG A 94 -7.628 -12.505 2.487 1.00 65.31 N ATOM 0 H ARG A 94 -7.831 -8.034 -1.012 1.00 72.21 H new ATOM 0 HA ARG A 94 -9.196 -10.352 0.230 1.00 70.25 H new ATOM 0 HB2 ARG A 94 -10.092 -7.453 0.069 1.00 43.33 H new ATOM 0 HB3 ARG A 94 -10.847 -8.742 0.985 1.00 43.33 H new ATOM 0 HG2 ARG A 94 -8.028 -7.745 1.526 1.00 70.40 H new ATOM 0 HG3 ARG A 94 -9.448 -7.096 2.322 1.00 70.40 H new ATOM 0 HD2 ARG A 94 -8.432 -8.755 3.767 1.00 32.22 H new ATOM 0 HD3 ARG A 94 -9.980 -9.361 3.212 1.00 32.22 H new ATOM 0 HE ARG A 94 -7.898 -10.273 1.446 1.00 60.24 H new ATOM 0 HH11 ARG A 94 -9.180 -10.764 4.707 1.00 32.44 H new ATOM 0 HH12 ARG A 94 -8.657 -12.450 4.777 1.00 32.44 H new ATOM 0 HH21 ARG A 94 -7.235 -12.424 1.549 1.00 65.31 H new ATOM 0 HH22 ARG A 94 -7.559 -13.387 2.995 1.00 65.31 H new ATOM 1482 N PRO A 95 -10.992 -10.547 -1.573 1.00 21.35 N ATOM 1483 CA PRO A 95 -11.895 -10.756 -2.707 1.00 74.53 C ATOM 1484 C PRO A 95 -12.767 -9.529 -2.953 1.00 12.41 C ATOM 1485 O PRO A 95 -13.567 -9.145 -2.095 1.00 5.10 O ATOM 1486 CB PRO A 95 -12.750 -11.954 -2.279 1.00 10.20 C ATOM 1487 CG PRO A 95 -11.963 -12.630 -1.210 1.00 45.14 C ATOM 1488 CD PRO A 95 -11.207 -11.541 -0.506 1.00 24.20 C ATOM 0 HA PRO A 95 -11.359 -10.929 -3.640 1.00 74.53 H new ATOM 0 HB2 PRO A 95 -13.723 -11.632 -1.908 1.00 10.20 H new ATOM 0 HB3 PRO A 95 -12.935 -12.626 -3.117 1.00 10.20 H new ATOM 0 HG2 PRO A 95 -12.618 -13.161 -0.519 1.00 45.14 H new ATOM 0 HG3 PRO A 95 -11.282 -13.368 -1.634 1.00 45.14 H new ATOM 0 HD2 PRO A 95 -11.777 -11.125 0.325 1.00 24.20 H new ATOM 0 HD3 PRO A 95 -10.265 -11.904 -0.096 1.00 24.20 H new ATOM 1496 N ALA A 96 -12.601 -8.913 -4.118 1.00 64.44 N ATOM 1497 CA ALA A 96 -13.288 -7.663 -4.426 1.00 31.34 C ATOM 1498 C ALA A 96 -14.798 -7.844 -4.459 1.00 13.20 C ATOM 1499 O ALA A 96 -15.298 -8.890 -4.883 1.00 65.24 O ATOM 1500 CB ALA A 96 -12.804 -7.102 -5.753 1.00 2.43 C ATOM 0 H ALA A 96 -11.997 -9.258 -4.864 1.00 64.44 H new ATOM 0 HA ALA A 96 -13.051 -6.957 -3.630 1.00 31.34 H new ATOM 0 HB1 ALA A 96 -13.327 -6.170 -5.966 1.00 2.43 H new ATOM 0 HB2 ALA A 96 -11.732 -6.912 -5.699 1.00 2.43 H new ATOM 0 HB3 ALA A 96 -13.005 -7.821 -6.547 1.00 2.43 H new ATOM 1506 N PRO A 97 -15.539 -6.821 -4.000 1.00 51.43 N ATOM 1507 CA PRO A 97 -17.004 -6.819 -4.034 1.00 1.34 C ATOM 1508 C PRO A 97 -17.536 -7.073 -5.439 1.00 74.44 C ATOM 1509 O PRO A 97 -17.082 -6.452 -6.406 1.00 31.33 O ATOM 1510 CB PRO A 97 -17.372 -5.405 -3.575 1.00 70.02 C ATOM 1511 CG PRO A 97 -16.210 -4.952 -2.767 1.00 65.21 C ATOM 1512 CD PRO A 97 -15.004 -5.586 -3.397 1.00 34.15 C ATOM 0 HA PRO A 97 -17.431 -7.605 -3.411 1.00 1.34 H new ATOM 0 HB2 PRO A 97 -17.543 -4.745 -4.426 1.00 70.02 H new ATOM 0 HB3 PRO A 97 -18.288 -5.407 -2.984 1.00 70.02 H new ATOM 0 HG2 PRO A 97 -16.129 -3.865 -2.773 1.00 65.21 H new ATOM 0 HG3 PRO A 97 -16.314 -5.258 -1.726 1.00 65.21 H new ATOM 0 HD2 PRO A 97 -14.554 -4.935 -4.147 1.00 34.15 H new ATOM 0 HD3 PRO A 97 -14.232 -5.802 -2.658 1.00 34.15 H new ATOM 1520 N GLY A 98 -18.470 -8.003 -5.552 1.00 51.22 N ATOM 1521 CA GLY A 98 -19.059 -8.310 -6.839 1.00 32.10 C ATOM 1522 C GLY A 98 -18.183 -9.224 -7.664 1.00 32.33 C ATOM 1523 O GLY A 98 -18.463 -9.460 -8.838 1.00 20.02 O ATOM 0 H GLY A 98 -18.832 -8.553 -4.773 1.00 51.22 H new ATOM 0 HA2 GLY A 98 -20.031 -8.779 -6.689 1.00 32.10 H new ATOM 0 HA3 GLY A 98 -19.233 -7.384 -7.387 1.00 32.10 H new ATOM 1527 N ALA A 99 -17.108 -9.715 -7.047 1.00 53.43 N ATOM 1528 CA ALA A 99 -16.181 -10.641 -7.694 1.00 62.13 C ATOM 1529 C ALA A 99 -15.536 -10.018 -8.932 1.00 2.35 C ATOM 1530 O ALA A 99 -15.126 -10.723 -9.850 1.00 64.44 O ATOM 1531 CB ALA A 99 -16.898 -11.938 -8.052 1.00 72.15 C ATOM 0 H ALA A 99 -16.856 -9.482 -6.086 1.00 53.43 H new ATOM 0 HA ALA A 99 -15.381 -10.864 -6.988 1.00 62.13 H new ATOM 0 HB1 ALA A 99 -16.197 -12.620 -8.533 1.00 72.15 H new ATOM 0 HB2 ALA A 99 -17.289 -12.400 -7.145 1.00 72.15 H new ATOM 0 HB3 ALA A 99 -17.721 -11.723 -8.733 1.00 72.15 H new ATOM 1537 N ARG A 100 -15.409 -8.696 -8.929 1.00 25.13 N ATOM 1538 CA ARG A 100 -14.877 -7.972 -10.079 1.00 13.43 C ATOM 1539 C ARG A 100 -13.358 -7.828 -10.017 1.00 33.40 C ATOM 1540 O ARG A 100 -12.773 -7.031 -10.752 1.00 43.54 O ATOM 1541 CB ARG A 100 -15.535 -6.595 -10.183 1.00 73.34 C ATOM 1542 CG ARG A 100 -16.923 -6.635 -10.802 1.00 15.11 C ATOM 1543 CD ARG A 100 -17.552 -5.254 -10.871 1.00 61.13 C ATOM 1544 NE ARG A 100 -18.722 -5.233 -11.750 1.00 50.31 N ATOM 1545 CZ ARG A 100 -19.810 -4.494 -11.539 1.00 64.32 C ATOM 1546 NH1 ARG A 100 -19.922 -3.764 -10.435 1.00 1.33 N ATOM 1547 NH2 ARG A 100 -20.793 -4.499 -12.432 1.00 73.10 N ATOM 0 H ARG A 100 -15.668 -8.102 -8.141 1.00 25.13 H new ATOM 0 HA ARG A 100 -15.111 -8.555 -10.969 1.00 13.43 H new ATOM 0 HB2 ARG A 100 -15.602 -6.156 -9.187 1.00 73.34 H new ATOM 0 HB3 ARG A 100 -14.898 -5.940 -10.778 1.00 73.34 H new ATOM 0 HG2 ARG A 100 -16.861 -7.056 -11.805 1.00 15.11 H new ATOM 0 HG3 ARG A 100 -17.562 -7.296 -10.217 1.00 15.11 H new ATOM 0 HD2 ARG A 100 -17.844 -4.937 -9.870 1.00 61.13 H new ATOM 0 HD3 ARG A 100 -16.815 -4.536 -11.230 1.00 61.13 H new ATOM 0 HE ARG A 100 -18.703 -5.825 -12.581 1.00 50.31 H new ATOM 0 HH11 ARG A 100 -19.172 -3.767 -9.743 1.00 1.33 H new ATOM 0 HH12 ARG A 100 -20.758 -3.200 -10.279 1.00 1.33 H new ATOM 0 HH21 ARG A 100 -20.713 -5.067 -13.275 1.00 73.10 H new ATOM 0 HH22 ARG A 100 -21.628 -3.935 -12.275 1.00 73.10 H new ATOM 1561 N GLY A 101 -12.722 -8.597 -9.147 1.00 52.10 N ATOM 1562 CA GLY A 101 -11.275 -8.592 -9.074 1.00 33.44 C ATOM 1563 C GLY A 101 -10.776 -8.848 -7.674 1.00 3.40 C ATOM 1564 O GLY A 101 -11.315 -9.697 -6.956 1.00 53.01 O ATOM 0 H GLY A 101 -13.182 -9.226 -8.489 1.00 52.10 H new ATOM 0 HA2 GLY A 101 -10.876 -9.353 -9.745 1.00 33.44 H new ATOM 0 HA3 GLY A 101 -10.898 -7.630 -9.422 1.00 33.44 H new ATOM 1568 N THR A 102 -9.771 -8.094 -7.273 1.00 32.10 N ATOM 1569 CA THR A 102 -9.183 -8.234 -5.958 1.00 13.11 C ATOM 1570 C THR A 102 -8.933 -6.860 -5.347 1.00 5.30 C ATOM 1571 O THR A 102 -8.368 -5.974 -5.991 1.00 41.41 O ATOM 1572 CB THR A 102 -7.859 -9.020 -6.026 1.00 41.44 C ATOM 1573 OG1 THR A 102 -8.074 -10.275 -6.680 1.00 15.33 O ATOM 1574 CG2 THR A 102 -7.297 -9.267 -4.635 1.00 74.31 C ATOM 0 H THR A 102 -9.341 -7.370 -7.849 1.00 32.10 H new ATOM 0 HA THR A 102 -9.883 -8.788 -5.332 1.00 13.11 H new ATOM 0 HB THR A 102 -7.140 -8.425 -6.590 1.00 41.44 H new ATOM 0 HG1 THR A 102 -7.262 -10.536 -7.162 1.00 15.33 H new ATOM 0 HG21 THR A 102 -6.363 -9.823 -4.713 1.00 74.31 H new ATOM 0 HG22 THR A 102 -7.110 -8.312 -4.143 1.00 74.31 H new ATOM 0 HG23 THR A 102 -8.014 -9.843 -4.050 1.00 74.31 H new ATOM 1582 N GLU A 103 -9.375 -6.677 -4.116 1.00 44.40 N ATOM 1583 CA GLU A 103 -9.161 -5.428 -3.416 1.00 74.15 C ATOM 1584 C GLU A 103 -7.863 -5.502 -2.623 1.00 32.34 C ATOM 1585 O GLU A 103 -7.717 -6.315 -1.706 1.00 22.25 O ATOM 1586 CB GLU A 103 -10.353 -5.109 -2.509 1.00 24.53 C ATOM 1587 CG GLU A 103 -10.224 -3.787 -1.775 1.00 34.43 C ATOM 1588 CD GLU A 103 -11.566 -3.226 -1.356 1.00 72.22 C ATOM 1589 OE1 GLU A 103 -12.205 -3.807 -0.456 1.00 1.35 O ATOM 1590 OE2 GLU A 103 -11.990 -2.206 -1.937 1.00 35.02 O ATOM 0 H GLU A 103 -9.885 -7.380 -3.581 1.00 44.40 H new ATOM 0 HA GLU A 103 -9.076 -4.618 -4.141 1.00 74.15 H new ATOM 0 HB2 GLU A 103 -11.262 -5.093 -3.110 1.00 24.53 H new ATOM 0 HB3 GLU A 103 -10.467 -5.910 -1.779 1.00 24.53 H new ATOM 0 HG2 GLU A 103 -9.599 -3.924 -0.893 1.00 34.43 H new ATOM 0 HG3 GLU A 103 -9.716 -3.067 -2.416 1.00 34.43 H new ATOM 1597 N VAL A 104 -6.915 -4.664 -3.006 1.00 42.45 N ATOM 1598 CA VAL A 104 -5.596 -4.663 -2.397 1.00 73.13 C ATOM 1599 C VAL A 104 -5.560 -3.746 -1.175 1.00 23.35 C ATOM 1600 O VAL A 104 -5.695 -2.525 -1.284 1.00 24.54 O ATOM 1601 CB VAL A 104 -4.505 -4.271 -3.429 1.00 31.11 C ATOM 1602 CG1 VAL A 104 -4.908 -3.059 -4.239 1.00 4.31 C ATOM 1603 CG2 VAL A 104 -3.172 -4.023 -2.750 1.00 63.34 C ATOM 0 H VAL A 104 -7.036 -3.969 -3.743 1.00 42.45 H new ATOM 0 HA VAL A 104 -5.380 -5.676 -2.059 1.00 73.13 H new ATOM 0 HB VAL A 104 -4.398 -5.114 -4.112 1.00 31.11 H new ATOM 0 HG11 VAL A 104 -4.118 -2.817 -4.950 1.00 4.31 H new ATOM 0 HG12 VAL A 104 -5.830 -3.273 -4.780 1.00 4.31 H new ATOM 0 HG13 VAL A 104 -5.068 -2.212 -3.572 1.00 4.31 H new ATOM 0 HG21 VAL A 104 -2.428 -3.750 -3.498 1.00 63.34 H new ATOM 0 HG22 VAL A 104 -3.276 -3.212 -2.029 1.00 63.34 H new ATOM 0 HG23 VAL A 104 -2.853 -4.928 -2.234 1.00 63.34 H new ATOM 1613 N VAL A 105 -5.413 -4.361 -0.010 1.00 52.24 N ATOM 1614 CA VAL A 105 -5.369 -3.638 1.252 1.00 43.44 C ATOM 1615 C VAL A 105 -3.925 -3.487 1.708 1.00 13.43 C ATOM 1616 O VAL A 105 -3.283 -4.471 2.075 1.00 53.15 O ATOM 1617 CB VAL A 105 -6.165 -4.383 2.348 1.00 30.21 C ATOM 1618 CG1 VAL A 105 -6.265 -3.548 3.612 1.00 31.34 C ATOM 1619 CG2 VAL A 105 -7.548 -4.771 1.848 1.00 34.32 C ATOM 0 H VAL A 105 -5.321 -5.372 0.086 1.00 52.24 H new ATOM 0 HA VAL A 105 -5.819 -2.658 1.095 1.00 43.44 H new ATOM 0 HB VAL A 105 -5.623 -5.297 2.589 1.00 30.21 H new ATOM 0 HG11 VAL A 105 -6.830 -4.096 4.366 1.00 31.34 H new ATOM 0 HG12 VAL A 105 -5.264 -3.338 3.989 1.00 31.34 H new ATOM 0 HG13 VAL A 105 -6.773 -2.610 3.389 1.00 31.34 H new ATOM 0 HG21 VAL A 105 -8.087 -5.294 2.638 1.00 34.32 H new ATOM 0 HG22 VAL A 105 -8.098 -3.873 1.566 1.00 34.32 H new ATOM 0 HG23 VAL A 105 -7.451 -5.425 0.981 1.00 34.32 H new ATOM 1629 N VAL A 106 -3.411 -2.267 1.672 1.00 24.54 N ATOM 1630 CA VAL A 106 -2.024 -2.023 2.043 1.00 32.43 C ATOM 1631 C VAL A 106 -1.933 -1.085 3.241 1.00 15.32 C ATOM 1632 O VAL A 106 -2.529 -0.007 3.251 1.00 40.43 O ATOM 1633 CB VAL A 106 -1.209 -1.424 0.874 1.00 3.43 C ATOM 1634 CG1 VAL A 106 0.279 -1.444 1.192 1.00 54.13 C ATOM 1635 CG2 VAL A 106 -1.482 -2.169 -0.423 1.00 62.32 C ATOM 0 H VAL A 106 -3.929 -1.434 1.392 1.00 24.54 H new ATOM 0 HA VAL A 106 -1.600 -2.993 2.304 1.00 32.43 H new ATOM 0 HB VAL A 106 -1.524 -0.389 0.744 1.00 3.43 H new ATOM 0 HG11 VAL A 106 0.835 -1.018 0.357 1.00 54.13 H new ATOM 0 HG12 VAL A 106 0.467 -0.856 2.090 1.00 54.13 H new ATOM 0 HG13 VAL A 106 0.602 -2.472 1.357 1.00 54.13 H new ATOM 0 HG21 VAL A 106 -0.895 -1.726 -1.228 1.00 62.32 H new ATOM 0 HG22 VAL A 106 -1.205 -3.217 -0.306 1.00 62.32 H new ATOM 0 HG23 VAL A 106 -2.542 -2.099 -0.666 1.00 62.32 H new ATOM 1645 N ARG A 107 -1.196 -1.508 4.254 1.00 45.00 N ATOM 1646 CA ARG A 107 -0.961 -0.683 5.427 1.00 71.51 C ATOM 1647 C ARG A 107 0.470 -0.159 5.423 1.00 72.44 C ATOM 1648 O ARG A 107 1.421 -0.938 5.369 1.00 43.51 O ATOM 1649 CB ARG A 107 -1.218 -1.480 6.707 1.00 42.53 C ATOM 1650 CG ARG A 107 -0.935 -0.690 7.971 1.00 3.35 C ATOM 1651 CD ARG A 107 -1.011 -1.566 9.208 1.00 22.11 C ATOM 1652 NE ARG A 107 -0.626 -0.831 10.413 1.00 72.11 N ATOM 1653 CZ ARG A 107 0.510 -1.039 11.079 1.00 74.42 C ATOM 1654 NH1 ARG A 107 1.350 -1.990 10.691 1.00 23.30 N ATOM 1655 NH2 ARG A 107 0.803 -0.302 12.144 1.00 50.54 N ATOM 0 H ARG A 107 -0.748 -2.424 4.287 1.00 45.00 H new ATOM 0 HA ARG A 107 -1.651 0.160 5.396 1.00 71.51 H new ATOM 0 HB2 ARG A 107 -2.256 -1.811 6.718 1.00 42.53 H new ATOM 0 HB3 ARG A 107 -0.597 -2.376 6.700 1.00 42.53 H new ATOM 0 HG2 ARG A 107 0.055 -0.239 7.904 1.00 3.35 H new ATOM 0 HG3 ARG A 107 -1.652 0.126 8.058 1.00 3.35 H new ATOM 0 HD2 ARG A 107 -2.026 -1.948 9.322 1.00 22.11 H new ATOM 0 HD3 ARG A 107 -0.358 -2.430 9.084 1.00 22.11 H new ATOM 0 HE ARG A 107 -1.264 -0.117 10.764 1.00 72.11 H new ATOM 0 HH11 ARG A 107 1.128 -2.566 9.879 1.00 23.30 H new ATOM 0 HH12 ARG A 107 2.218 -2.145 11.204 1.00 23.30 H new ATOM 0 HH21 ARG A 107 0.158 0.425 12.454 1.00 50.54 H new ATOM 0 HH22 ARG A 107 1.673 -0.463 12.652 1.00 50.54 H new ATOM 1669 N LEU A 108 0.614 1.157 5.459 1.00 34.12 N ATOM 1670 CA LEU A 108 1.925 1.790 5.515 1.00 21.52 C ATOM 1671 C LEU A 108 2.013 2.676 6.757 1.00 31.04 C ATOM 1672 O LEU A 108 0.990 3.128 7.267 1.00 63.12 O ATOM 1673 CB LEU A 108 2.204 2.625 4.258 1.00 23.55 C ATOM 1674 CG LEU A 108 2.124 1.891 2.918 1.00 70.32 C ATOM 1675 CD1 LEU A 108 0.682 1.787 2.445 1.00 13.11 C ATOM 1676 CD2 LEU A 108 2.982 2.601 1.882 1.00 5.32 C ATOM 0 H LEU A 108 -0.167 1.813 5.450 1.00 34.12 H new ATOM 0 HA LEU A 108 2.678 1.004 5.566 1.00 21.52 H new ATOM 0 HB2 LEU A 108 1.497 3.454 4.235 1.00 23.55 H new ATOM 0 HB3 LEU A 108 3.200 3.058 4.351 1.00 23.55 H new ATOM 0 HG LEU A 108 2.506 0.879 3.052 1.00 70.32 H new ATOM 0 HD11 LEU A 108 0.649 1.262 1.491 1.00 13.11 H new ATOM 0 HD12 LEU A 108 0.096 1.238 3.182 1.00 13.11 H new ATOM 0 HD13 LEU A 108 0.266 2.787 2.323 1.00 13.11 H new ATOM 0 HD21 LEU A 108 2.918 2.071 0.932 1.00 5.32 H new ATOM 0 HD22 LEU A 108 2.625 3.623 1.752 1.00 5.32 H new ATOM 0 HD23 LEU A 108 4.019 2.619 2.219 1.00 5.32 H new ATOM 1688 N THR A 109 3.224 2.902 7.252 1.00 30.03 N ATOM 1689 CA THR A 109 3.418 3.683 8.468 1.00 62.41 C ATOM 1690 C THR A 109 3.460 5.178 8.174 1.00 34.20 C ATOM 1691 O THR A 109 4.342 5.655 7.462 1.00 22.41 O ATOM 1692 CB THR A 109 4.738 3.300 9.137 1.00 33.21 C ATOM 1693 OG1 THR A 109 4.879 1.874 9.142 1.00 34.04 O ATOM 1694 CG2 THR A 109 4.805 3.826 10.562 1.00 34.24 C ATOM 0 H THR A 109 4.086 2.556 6.831 1.00 30.03 H new ATOM 0 HA THR A 109 2.575 3.466 9.124 1.00 62.41 H new ATOM 0 HB THR A 109 5.552 3.750 8.569 1.00 33.21 H new ATOM 0 HG1 THR A 109 5.445 1.604 9.895 1.00 34.04 H new ATOM 0 HG21 THR A 109 5.755 3.538 11.012 1.00 34.24 H new ATOM 0 HG22 THR A 109 4.723 4.913 10.553 1.00 34.24 H new ATOM 0 HG23 THR A 109 3.985 3.405 11.144 1.00 34.24 H new ATOM 1702 N TYR A 110 2.528 5.919 8.755 1.00 55.12 N ATOM 1703 CA TYR A 110 2.460 7.355 8.537 1.00 52.40 C ATOM 1704 C TYR A 110 2.470 8.119 9.857 1.00 14.42 C ATOM 1705 O TYR A 110 1.615 7.917 10.725 1.00 71.22 O ATOM 1706 CB TYR A 110 1.229 7.722 7.694 1.00 43.53 C ATOM 1707 CG TYR A 110 -0.076 7.115 8.174 1.00 14.31 C ATOM 1708 CD1 TYR A 110 -0.402 5.797 7.876 1.00 51.24 C ATOM 1709 CD2 TYR A 110 -0.982 7.860 8.916 1.00 4.34 C ATOM 1710 CE1 TYR A 110 -1.589 5.238 8.307 1.00 10.21 C ATOM 1711 CE2 TYR A 110 -2.172 7.308 9.350 1.00 41.13 C ATOM 1712 CZ TYR A 110 -2.471 5.997 9.044 1.00 43.41 C ATOM 1713 OH TYR A 110 -3.654 5.442 9.484 1.00 40.32 O ATOM 0 H TYR A 110 1.811 5.550 9.379 1.00 55.12 H new ATOM 0 HA TYR A 110 3.350 7.650 7.981 1.00 52.40 H new ATOM 0 HB2 TYR A 110 1.126 8.807 7.681 1.00 43.53 H new ATOM 0 HB3 TYR A 110 1.403 7.406 6.665 1.00 43.53 H new ATOM 0 HD1 TYR A 110 0.286 5.199 7.297 1.00 51.24 H new ATOM 0 HD2 TYR A 110 -0.753 8.887 9.158 1.00 4.34 H new ATOM 0 HE1 TYR A 110 -1.824 4.212 8.068 1.00 10.21 H new ATOM 0 HE2 TYR A 110 -2.866 7.901 9.927 1.00 41.13 H new ATOM 0 HH TYR A 110 -4.161 6.111 9.990 1.00 40.32 H new ATOM 1782 N GLY A 115 8.838 15.076 14.242 1.00 1.10 N ATOM 1783 CA GLY A 115 8.456 15.899 15.374 1.00 75.11 C ATOM 1784 C GLY A 115 9.216 17.213 15.413 1.00 4.41 C ATOM 1785 O GLY A 115 8.678 18.258 15.048 1.00 33.13 O ATOM 0 HA2 GLY A 115 7.386 16.102 15.328 1.00 75.11 H new ATOM 0 HA3 GLY A 115 8.637 15.349 16.298 1.00 75.11 H new ATOM 1789 N SER A 116 10.479 17.147 15.829 1.00 22.42 N ATOM 1790 CA SER A 116 11.332 18.329 15.944 1.00 30.03 C ATOM 1791 C SER A 116 11.743 18.857 14.569 1.00 65.32 C ATOM 1792 O SER A 116 12.220 19.987 14.438 1.00 3.25 O ATOM 1793 CB SER A 116 12.580 17.991 16.763 1.00 30.42 C ATOM 1794 OG SER A 116 12.231 17.405 18.005 1.00 12.31 O ATOM 0 H SER A 116 10.939 16.276 16.095 1.00 22.42 H new ATOM 0 HA SER A 116 10.761 19.109 16.449 1.00 30.03 H new ATOM 0 HB2 SER A 116 13.214 17.306 16.200 1.00 30.42 H new ATOM 0 HB3 SER A 116 13.162 18.896 16.935 1.00 30.42 H new ATOM 0 HG SER A 116 13.045 17.197 18.509 1.00 12.31 H new ATOM 1800 N ALA A 117 11.561 18.031 13.544 1.00 61.20 N ATOM 1801 CA ALA A 117 11.897 18.419 12.179 1.00 12.30 C ATOM 1802 C ALA A 117 10.891 19.429 11.635 1.00 35.32 C ATOM 1803 O ALA A 117 11.171 20.134 10.667 1.00 1.32 O ATOM 1804 CB ALA A 117 11.988 17.199 11.276 1.00 22.15 C ATOM 0 H ALA A 117 11.182 17.088 13.633 1.00 61.20 H new ATOM 0 HA ALA A 117 12.876 18.898 12.196 1.00 12.30 H new ATOM 0 HB1 ALA A 117 12.240 17.514 10.263 1.00 22.15 H new ATOM 0 HB2 ALA A 117 12.760 16.527 11.649 1.00 22.15 H new ATOM 0 HB3 ALA A 117 11.029 16.681 11.267 1.00 22.15 H new ATOM 1810 N GLY A 118 9.713 19.480 12.254 1.00 14.33 N ATOM 1811 CA GLY A 118 8.671 20.402 11.826 1.00 11.24 C ATOM 1812 C GLY A 118 9.133 21.850 11.808 1.00 72.42 C ATOM 1813 O GLY A 118 8.780 22.609 10.906 1.00 73.04 O ATOM 0 H GLY A 118 9.460 18.895 13.050 1.00 14.33 H new ATOM 0 HA2 GLY A 118 8.332 20.122 10.829 1.00 11.24 H new ATOM 0 HA3 GLY A 118 7.813 20.308 12.492 1.00 11.24 H new ATOM 1817 N ALA A 119 9.927 22.232 12.800 1.00 31.20 N ATOM 1818 CA ALA A 119 10.490 23.577 12.858 1.00 23.41 C ATOM 1819 C ALA A 119 11.404 23.840 11.663 1.00 24.12 C ATOM 1820 O ALA A 119 11.542 24.974 11.205 1.00 50.53 O ATOM 1821 CB ALA A 119 11.257 23.774 14.159 1.00 74.54 C ATOM 0 H ALA A 119 10.197 21.629 13.577 1.00 31.20 H new ATOM 0 HA ALA A 119 9.666 24.290 12.821 1.00 23.41 H new ATOM 0 HB1 ALA A 119 11.671 24.782 14.188 1.00 74.54 H new ATOM 0 HB2 ALA A 119 10.582 23.634 15.004 1.00 74.54 H new ATOM 0 HB3 ALA A 119 12.067 23.047 14.218 1.00 74.54 H new ATOM 1827 N VAL A 120 12.015 22.777 11.158 1.00 53.35 N ATOM 1828 CA VAL A 120 12.927 22.877 10.028 1.00 32.21 C ATOM 1829 C VAL A 120 12.151 22.958 8.717 1.00 10.43 C ATOM 1830 O VAL A 120 12.424 23.813 7.874 1.00 33.22 O ATOM 1831 CB VAL A 120 13.888 21.668 9.978 1.00 43.15 C ATOM 1832 CG1 VAL A 120 14.850 21.783 8.805 1.00 20.14 C ATOM 1833 CG2 VAL A 120 14.652 21.539 11.287 1.00 3.22 C ATOM 0 H VAL A 120 11.894 21.830 11.516 1.00 53.35 H new ATOM 0 HA VAL A 120 13.512 23.787 10.160 1.00 32.21 H new ATOM 0 HB VAL A 120 13.291 20.767 9.836 1.00 43.15 H new ATOM 0 HG11 VAL A 120 15.515 20.919 8.794 1.00 20.14 H new ATOM 0 HG12 VAL A 120 14.285 21.819 7.873 1.00 20.14 H new ATOM 0 HG13 VAL A 120 15.440 22.694 8.906 1.00 20.14 H new ATOM 0 HG21 VAL A 120 15.324 20.682 11.233 1.00 3.22 H new ATOM 0 HG22 VAL A 120 15.233 22.445 11.460 1.00 3.22 H new ATOM 0 HG23 VAL A 120 13.948 21.397 12.107 1.00 3.22 H new ATOM 1843 N ILE A 121 11.166 22.079 8.561 1.00 1.44 N ATOM 1844 CA ILE A 121 10.377 22.017 7.334 1.00 61.32 C ATOM 1845 C ILE A 121 9.560 23.300 7.143 1.00 2.53 C ATOM 1846 O ILE A 121 9.167 23.632 6.027 1.00 63.23 O ATOM 1847 CB ILE A 121 9.451 20.775 7.305 1.00 72.22 C ATOM 1848 CG1 ILE A 121 8.844 20.595 5.909 1.00 10.41 C ATOM 1849 CG2 ILE A 121 8.351 20.884 8.351 1.00 15.34 C ATOM 1850 CD1 ILE A 121 8.000 19.346 5.763 1.00 0.31 C ATOM 0 H ILE A 121 10.894 21.398 9.270 1.00 1.44 H new ATOM 0 HA ILE A 121 11.079 21.924 6.505 1.00 61.32 H new ATOM 0 HB ILE A 121 10.055 19.899 7.542 1.00 72.22 H new ATOM 0 HG12 ILE A 121 8.231 21.465 5.675 1.00 10.41 H new ATOM 0 HG13 ILE A 121 9.649 20.566 5.175 1.00 10.41 H new ATOM 0 HG21 ILE A 121 7.717 19.998 8.306 1.00 15.34 H new ATOM 0 HG22 ILE A 121 8.798 20.961 9.342 1.00 15.34 H new ATOM 0 HG23 ILE A 121 7.749 21.771 8.155 1.00 15.34 H new ATOM 0 HD11 ILE A 121 7.606 19.290 4.748 1.00 0.31 H new ATOM 0 HD12 ILE A 121 8.613 18.467 5.964 1.00 0.31 H new ATOM 0 HD13 ILE A 121 7.173 19.381 6.472 1.00 0.31 H new ATOM 1862 N ALA A 122 9.324 24.023 8.237 1.00 55.31 N ATOM 1863 CA ALA A 122 8.622 25.305 8.181 1.00 61.53 C ATOM 1864 C ALA A 122 9.360 26.300 7.279 1.00 1.21 C ATOM 1865 O ALA A 122 8.753 27.223 6.732 1.00 44.12 O ATOM 1866 CB ALA A 122 8.462 25.879 9.580 1.00 51.34 C ATOM 0 H ALA A 122 9.609 23.742 9.175 1.00 55.31 H new ATOM 0 HA ALA A 122 7.634 25.132 7.754 1.00 61.53 H new ATOM 0 HB1 ALA A 122 7.938 26.833 9.524 1.00 51.34 H new ATOM 0 HB2 ALA A 122 7.888 25.185 10.194 1.00 51.34 H new ATOM 0 HB3 ALA A 122 9.445 26.031 10.026 1.00 51.34 H new ATOM 1872 N ARG A 123 10.667 26.103 7.132 1.00 71.13 N ATOM 1873 CA ARG A 123 11.473 26.922 6.235 1.00 14.14 C ATOM 1874 C ARG A 123 11.210 26.525 4.783 1.00 70.03 C ATOM 1875 O ARG A 123 11.159 27.369 3.893 1.00 61.30 O ATOM 1876 CB ARG A 123 12.966 26.784 6.596 1.00 21.30 C ATOM 1877 CG ARG A 123 13.933 27.434 5.606 1.00 13.22 C ATOM 1878 CD ARG A 123 14.281 26.491 4.462 1.00 31.41 C ATOM 1879 NE ARG A 123 15.157 27.107 3.466 1.00 45.32 N ATOM 1880 CZ ARG A 123 14.943 27.040 2.153 1.00 24.52 C ATOM 1881 NH1 ARG A 123 13.831 26.484 1.688 1.00 21.43 N ATOM 1882 NH2 ARG A 123 15.829 27.544 1.308 1.00 5.52 N ATOM 0 H ARG A 123 11.191 25.380 7.625 1.00 71.13 H new ATOM 0 HA ARG A 123 11.194 27.969 6.351 1.00 14.14 H new ATOM 0 HB2 ARG A 123 13.128 27.223 7.581 1.00 21.30 H new ATOM 0 HB3 ARG A 123 13.209 25.724 6.675 1.00 21.30 H new ATOM 0 HG2 ARG A 123 13.487 28.344 5.205 1.00 13.22 H new ATOM 0 HG3 ARG A 123 14.845 27.728 6.126 1.00 13.22 H new ATOM 0 HD2 ARG A 123 14.766 25.602 4.865 1.00 31.41 H new ATOM 0 HD3 ARG A 123 13.362 26.161 3.977 1.00 31.41 H new ATOM 0 HE ARG A 123 15.977 27.616 3.795 1.00 45.32 H new ATOM 0 HH11 ARG A 123 13.139 26.108 2.336 1.00 21.43 H new ATOM 0 HH12 ARG A 123 13.668 26.433 0.682 1.00 21.43 H new ATOM 0 HH21 ARG A 123 16.678 27.985 1.662 1.00 5.52 H new ATOM 0 HH22 ARG A 123 15.663 27.491 0.303 1.00 5.52 H new ATOM 1896 N MET A 124 11.065 25.227 4.551 1.00 40.41 N ATOM 1897 CA MET A 124 10.795 24.712 3.215 1.00 3.30 C ATOM 1898 C MET A 124 9.359 25.014 2.790 1.00 22.41 C ATOM 1899 O MET A 124 9.080 25.200 1.602 1.00 62.12 O ATOM 1900 CB MET A 124 11.050 23.203 3.164 1.00 22.35 C ATOM 1901 CG MET A 124 10.877 22.603 1.779 1.00 3.10 C ATOM 1902 SD MET A 124 12.046 23.281 0.583 1.00 74.52 S ATOM 1903 CE MET A 124 11.485 22.474 -0.916 1.00 12.52 C ATOM 0 H MET A 124 11.130 24.510 5.273 1.00 40.41 H new ATOM 0 HA MET A 124 11.470 25.211 2.520 1.00 3.30 H new ATOM 0 HB2 MET A 124 12.063 23.002 3.514 1.00 22.35 H new ATOM 0 HB3 MET A 124 10.369 22.705 3.854 1.00 22.35 H new ATOM 0 HG2 MET A 124 11.006 21.522 1.836 1.00 3.10 H new ATOM 0 HG3 MET A 124 9.860 22.785 1.432 1.00 3.10 H new ATOM 0 HE1 MET A 124 12.108 22.789 -1.753 1.00 12.52 H new ATOM 0 HE2 MET A 124 11.557 21.393 -0.796 1.00 12.52 H new ATOM 0 HE3 MET A 124 10.448 22.749 -1.111 1.00 12.52 H new ATOM 2057 N ARG A 134 -7.588 9.390 0.762 1.00 11.52 N ATOM 2058 CA ARG A 134 -7.618 8.413 -0.326 1.00 24.14 C ATOM 2059 C ARG A 134 -7.601 9.097 -1.688 1.00 64.01 C ATOM 2060 O ARG A 134 -7.872 8.461 -2.704 1.00 14.11 O ATOM 2061 CB ARG A 134 -8.868 7.525 -0.238 1.00 24.04 C ATOM 2062 CG ARG A 134 -8.950 6.655 1.007 1.00 0.43 C ATOM 2063 CD ARG A 134 -9.481 7.424 2.208 1.00 1.44 C ATOM 2064 NE ARG A 134 -9.569 6.582 3.398 1.00 42.51 N ATOM 2065 CZ ARG A 134 -10.315 6.871 4.461 1.00 52.55 C ATOM 2066 NH1 ARG A 134 -11.086 7.949 4.466 1.00 45.41 N ATOM 2067 NH2 ARG A 134 -10.310 6.066 5.515 1.00 34.24 N ATOM 0 HA ARG A 134 -6.724 7.798 -0.220 1.00 24.14 H new ATOM 0 HB2 ARG A 134 -9.752 8.162 -0.277 1.00 24.04 H new ATOM 0 HB3 ARG A 134 -8.900 6.881 -1.116 1.00 24.04 H new ATOM 0 HG2 ARG A 134 -9.597 5.800 0.810 1.00 0.43 H new ATOM 0 HG3 ARG A 134 -7.961 6.260 1.238 1.00 0.43 H new ATOM 0 HD2 ARG A 134 -8.830 8.274 2.412 1.00 1.44 H new ATOM 0 HD3 ARG A 134 -10.467 7.827 1.974 1.00 1.44 H new ATOM 0 HE ARG A 134 -9.025 5.719 3.415 1.00 42.51 H new ATOM 0 HH11 ARG A 134 -11.110 8.563 3.652 1.00 45.41 H new ATOM 0 HH12 ARG A 134 -11.656 8.165 5.284 1.00 45.41 H new ATOM 0 HH21 ARG A 134 -9.734 5.224 5.511 1.00 34.24 H new ATOM 0 HH22 ARG A 134 -10.882 6.289 6.329 1.00 34.24 H new ATOM 2081 N ASP A 135 -7.260 10.378 -1.708 1.00 3.13 N ATOM 2082 CA ASP A 135 -7.322 11.173 -2.935 1.00 21.32 C ATOM 2083 C ASP A 135 -6.471 10.567 -4.047 1.00 3.42 C ATOM 2084 O ASP A 135 -6.971 10.270 -5.134 1.00 15.52 O ATOM 2085 CB ASP A 135 -6.859 12.605 -2.660 1.00 63.20 C ATOM 2086 CG ASP A 135 -6.897 13.478 -3.897 1.00 51.44 C ATOM 2087 OD1 ASP A 135 -8.008 13.771 -4.394 1.00 5.13 O ATOM 2088 OD2 ASP A 135 -5.819 13.891 -4.373 1.00 12.03 O ATOM 0 H ASP A 135 -6.937 10.893 -0.889 1.00 3.13 H new ATOM 0 HA ASP A 135 -8.360 11.178 -3.268 1.00 21.32 H new ATOM 0 HB2 ASP A 135 -7.492 13.046 -1.889 1.00 63.20 H new ATOM 0 HB3 ASP A 135 -5.843 12.585 -2.265 1.00 63.20 H new ATOM 2093 N ASP A 136 -5.192 10.369 -3.768 1.00 23.31 N ATOM 2094 CA ASP A 136 -4.268 9.864 -4.774 1.00 64.41 C ATOM 2095 C ASP A 136 -4.481 8.372 -5.012 1.00 3.10 C ATOM 2096 O ASP A 136 -4.331 7.884 -6.133 1.00 20.30 O ATOM 2097 CB ASP A 136 -2.823 10.141 -4.361 1.00 24.41 C ATOM 2098 CG ASP A 136 -1.885 10.168 -5.549 1.00 33.25 C ATOM 2099 OD1 ASP A 136 -2.203 10.864 -6.540 1.00 12.53 O ATOM 2100 OD2 ASP A 136 -0.816 9.529 -5.486 1.00 14.12 O ATOM 0 H ASP A 136 -4.770 10.549 -2.857 1.00 23.31 H new ATOM 0 HA ASP A 136 -4.467 10.387 -5.710 1.00 64.41 H new ATOM 0 HB2 ASP A 136 -2.773 11.096 -3.839 1.00 24.41 H new ATOM 0 HB3 ASP A 136 -2.495 9.376 -3.658 1.00 24.41 H new ATOM 2105 N LEU A 137 -4.874 7.658 -3.959 1.00 21.05 N ATOM 2106 CA LEU A 137 -5.062 6.218 -4.035 1.00 4.11 C ATOM 2107 C LEU A 137 -6.297 5.896 -4.879 1.00 73.45 C ATOM 2108 O LEU A 137 -6.398 4.822 -5.470 1.00 33.43 O ATOM 2109 CB LEU A 137 -5.192 5.634 -2.618 1.00 31.21 C ATOM 2110 CG LEU A 137 -5.083 4.107 -2.515 1.00 51.22 C ATOM 2111 CD1 LEU A 137 -3.764 3.623 -3.092 1.00 21.04 C ATOM 2112 CD2 LEU A 137 -5.219 3.647 -1.067 1.00 71.31 C ATOM 0 H LEU A 137 -5.068 8.059 -3.041 1.00 21.05 H new ATOM 0 HA LEU A 137 -4.195 5.763 -4.515 1.00 4.11 H new ATOM 0 HB2 LEU A 137 -4.420 6.078 -1.990 1.00 31.21 H new ATOM 0 HB3 LEU A 137 -6.154 5.940 -2.206 1.00 31.21 H new ATOM 0 HG LEU A 137 -5.899 3.675 -3.094 1.00 51.22 H new ATOM 0 HD11 LEU A 137 -3.707 2.538 -3.009 1.00 21.04 H new ATOM 0 HD12 LEU A 137 -3.698 3.911 -4.141 1.00 21.04 H new ATOM 0 HD13 LEU A 137 -2.939 4.073 -2.540 1.00 21.04 H new ATOM 0 HD21 LEU A 137 -5.138 2.561 -1.021 1.00 71.31 H new ATOM 0 HD22 LEU A 137 -4.427 4.095 -0.467 1.00 71.31 H new ATOM 0 HD23 LEU A 137 -6.189 3.955 -0.677 1.00 71.31 H new ATOM 2124 N MET A 138 -7.224 6.848 -4.949 1.00 22.21 N ATOM 2125 CA MET A 138 -8.426 6.693 -5.759 1.00 72.51 C ATOM 2126 C MET A 138 -8.067 6.706 -7.243 1.00 70.32 C ATOM 2127 O MET A 138 -8.533 5.865 -8.012 1.00 14.02 O ATOM 2128 CB MET A 138 -9.430 7.810 -5.456 1.00 14.11 C ATOM 2129 CG MET A 138 -10.822 7.563 -6.027 1.00 54.14 C ATOM 2130 SD MET A 138 -11.936 6.741 -4.861 1.00 72.41 S ATOM 2131 CE MET A 138 -11.045 5.230 -4.498 1.00 24.20 C ATOM 0 H MET A 138 -7.164 7.737 -4.452 1.00 22.21 H new ATOM 0 HA MET A 138 -8.885 5.736 -5.511 1.00 72.51 H new ATOM 0 HB2 MET A 138 -9.508 7.932 -4.376 1.00 14.11 H new ATOM 0 HB3 MET A 138 -9.046 8.748 -5.856 1.00 14.11 H new ATOM 0 HG2 MET A 138 -11.259 8.516 -6.327 1.00 54.14 H new ATOM 0 HG3 MET A 138 -10.736 6.955 -6.927 1.00 54.14 H new ATOM 0 HE1 MET A 138 -11.695 4.546 -3.953 1.00 24.20 H new ATOM 0 HE2 MET A 138 -10.726 4.763 -5.430 1.00 24.20 H new ATOM 0 HE3 MET A 138 -10.170 5.461 -3.890 1.00 24.20 H new ATOM 2141 N ARG A 139 -7.224 7.658 -7.633 1.00 34.44 N ATOM 2142 CA ARG A 139 -6.757 7.748 -9.015 1.00 10.33 C ATOM 2143 C ARG A 139 -5.875 6.553 -9.350 1.00 44.45 C ATOM 2144 O ARG A 139 -5.922 6.021 -10.461 1.00 64.45 O ATOM 2145 CB ARG A 139 -5.986 9.050 -9.238 1.00 71.23 C ATOM 2146 CG ARG A 139 -6.847 10.295 -9.107 1.00 10.13 C ATOM 2147 CD ARG A 139 -6.034 11.565 -9.303 1.00 21.21 C ATOM 2148 NE ARG A 139 -5.009 11.726 -8.274 1.00 44.13 N ATOM 2149 CZ ARG A 139 -5.098 12.591 -7.266 1.00 41.10 C ATOM 2150 NH1 ARG A 139 -6.176 13.348 -7.129 1.00 62.30 N ATOM 2151 NH2 ARG A 139 -4.120 12.686 -6.382 1.00 0.02 N ATOM 0 H ARG A 139 -6.850 8.377 -7.014 1.00 34.44 H new ATOM 0 HA ARG A 139 -7.625 7.743 -9.674 1.00 10.33 H new ATOM 0 HB2 ARG A 139 -5.168 9.106 -8.519 1.00 71.23 H new ATOM 0 HB3 ARG A 139 -5.537 9.031 -10.231 1.00 71.23 H new ATOM 0 HG2 ARG A 139 -7.651 10.260 -9.842 1.00 10.13 H new ATOM 0 HG3 ARG A 139 -7.316 10.311 -8.123 1.00 10.13 H new ATOM 0 HD2 ARG A 139 -5.561 11.544 -10.285 1.00 21.21 H new ATOM 0 HD3 ARG A 139 -6.700 12.427 -9.288 1.00 21.21 H new ATOM 0 HE ARG A 139 -4.176 11.141 -8.332 1.00 44.13 H new ATOM 0 HH11 ARG A 139 -6.943 13.270 -7.797 1.00 62.30 H new ATOM 0 HH12 ARG A 139 -6.240 14.009 -6.355 1.00 62.30 H new ATOM 0 HH21 ARG A 139 -3.293 12.095 -6.471 1.00 0.02 H new ATOM 0 HH22 ARG A 139 -4.192 13.350 -5.611 1.00 0.02 H new ATOM 2165 N PHE A 140 -5.073 6.145 -8.375 1.00 1.13 N ATOM 2166 CA PHE A 140 -4.249 4.950 -8.486 1.00 34.52 C ATOM 2167 C PHE A 140 -5.114 3.727 -8.785 1.00 75.42 C ATOM 2168 O PHE A 140 -4.759 2.892 -9.617 1.00 2.42 O ATOM 2169 CB PHE A 140 -3.468 4.754 -7.184 1.00 44.42 C ATOM 2170 CG PHE A 140 -2.693 3.471 -7.112 1.00 15.54 C ATOM 2171 CD1 PHE A 140 -1.476 3.343 -7.758 1.00 73.40 C ATOM 2172 CD2 PHE A 140 -3.183 2.397 -6.386 1.00 61.34 C ATOM 2173 CE1 PHE A 140 -0.763 2.165 -7.686 1.00 41.34 C ATOM 2174 CE2 PHE A 140 -2.473 1.216 -6.310 1.00 62.41 C ATOM 2175 CZ PHE A 140 -1.262 1.102 -6.959 1.00 23.13 C ATOM 0 H PHE A 140 -4.976 6.634 -7.485 1.00 1.13 H new ATOM 0 HA PHE A 140 -3.547 5.072 -9.311 1.00 34.52 H new ATOM 0 HB2 PHE A 140 -2.778 5.588 -7.060 1.00 44.42 H new ATOM 0 HB3 PHE A 140 -4.166 4.790 -6.347 1.00 44.42 H new ATOM 0 HD1 PHE A 140 -1.081 4.174 -8.324 1.00 73.40 H new ATOM 0 HD2 PHE A 140 -4.130 2.485 -5.875 1.00 61.34 H new ATOM 0 HE1 PHE A 140 0.184 2.074 -8.197 1.00 41.34 H new ATOM 0 HE2 PHE A 140 -2.865 0.384 -5.744 1.00 62.41 H new ATOM 0 HZ PHE A 140 -0.703 0.180 -6.899 1.00 23.13 H new ATOM 2185 N LYS A 141 -6.251 3.634 -8.102 1.00 43.13 N ATOM 2186 CA LYS A 141 -7.189 2.540 -8.314 1.00 24.03 C ATOM 2187 C LYS A 141 -7.626 2.480 -9.770 1.00 51.11 C ATOM 2188 O LYS A 141 -7.616 1.419 -10.389 1.00 62.54 O ATOM 2189 CB LYS A 141 -8.421 2.707 -7.415 1.00 53.22 C ATOM 2190 CG LYS A 141 -9.419 1.563 -7.522 1.00 61.44 C ATOM 2191 CD LYS A 141 -10.644 1.804 -6.656 1.00 42.13 C ATOM 2192 CE LYS A 141 -11.559 2.864 -7.253 1.00 23.04 C ATOM 2193 NZ LYS A 141 -12.333 2.349 -8.413 1.00 24.00 N ATOM 0 H LYS A 141 -6.545 4.307 -7.394 1.00 43.13 H new ATOM 0 HA LYS A 141 -6.683 1.609 -8.058 1.00 24.03 H new ATOM 0 HB2 LYS A 141 -8.094 2.796 -6.379 1.00 53.22 H new ATOM 0 HB3 LYS A 141 -8.923 3.640 -7.672 1.00 53.22 H new ATOM 0 HG2 LYS A 141 -9.726 1.443 -8.561 1.00 61.44 H new ATOM 0 HG3 LYS A 141 -8.939 0.632 -7.222 1.00 61.44 H new ATOM 0 HD2 LYS A 141 -11.196 0.871 -6.540 1.00 42.13 H new ATOM 0 HD3 LYS A 141 -10.329 2.115 -5.660 1.00 42.13 H new ATOM 0 HE2 LYS A 141 -12.249 3.219 -6.487 1.00 23.04 H new ATOM 0 HE3 LYS A 141 -10.963 3.721 -7.568 1.00 23.04 H new ATOM 0 HZ1 LYS A 141 -13.143 2.975 -8.595 1.00 24.00 H new ATOM 0 HZ2 LYS A 141 -11.721 2.321 -9.254 1.00 24.00 H new ATOM 0 HZ3 LYS A 141 -12.677 1.390 -8.203 1.00 24.00 H new ATOM 2207 N ARG A 142 -7.981 3.638 -10.308 1.00 13.32 N ATOM 2208 CA ARG A 142 -8.529 3.731 -11.656 1.00 3.12 C ATOM 2209 C ARG A 142 -7.555 3.220 -12.715 1.00 21.32 C ATOM 2210 O ARG A 142 -7.957 2.522 -13.642 1.00 4.42 O ATOM 2211 CB ARG A 142 -8.935 5.171 -11.967 1.00 51.03 C ATOM 2212 CG ARG A 142 -10.196 5.612 -11.246 1.00 21.23 C ATOM 2213 CD ARG A 142 -11.394 4.773 -11.665 1.00 23.43 C ATOM 2214 NE ARG A 142 -11.723 4.950 -13.082 1.00 62.31 N ATOM 2215 CZ ARG A 142 -12.449 4.090 -13.798 1.00 54.33 C ATOM 2216 NH1 ARG A 142 -12.853 2.943 -13.264 1.00 65.25 N ATOM 2217 NH2 ARG A 142 -12.752 4.368 -15.060 1.00 4.11 N ATOM 0 H ARG A 142 -7.899 4.534 -9.828 1.00 13.32 H new ATOM 0 HA ARG A 142 -9.410 3.090 -11.688 1.00 3.12 H new ATOM 0 HB2 ARG A 142 -8.117 5.838 -11.694 1.00 51.03 H new ATOM 0 HB3 ARG A 142 -9.085 5.274 -13.042 1.00 51.03 H new ATOM 0 HG2 ARG A 142 -10.050 5.529 -10.169 1.00 21.23 H new ATOM 0 HG3 ARG A 142 -10.392 6.663 -11.461 1.00 21.23 H new ATOM 0 HD2 ARG A 142 -11.185 3.721 -11.471 1.00 23.43 H new ATOM 0 HD3 ARG A 142 -12.257 5.044 -11.056 1.00 23.43 H new ATOM 0 HE ARG A 142 -11.374 5.786 -13.552 1.00 62.31 H new ATOM 0 HH11 ARG A 142 -12.608 2.715 -12.300 1.00 65.25 H new ATOM 0 HH12 ARG A 142 -13.408 2.290 -13.818 1.00 65.25 H new ATOM 0 HH21 ARG A 142 -12.430 5.239 -15.482 1.00 4.11 H new ATOM 0 HH22 ARG A 142 -13.307 3.711 -15.608 1.00 4.11 H new ATOM 2231 N GLU A 143 -6.279 3.555 -12.581 1.00 23.35 N ATOM 2232 CA GLU A 143 -5.294 3.133 -13.570 1.00 73.33 C ATOM 2233 C GLU A 143 -4.884 1.678 -13.346 1.00 73.03 C ATOM 2234 O GLU A 143 -4.455 0.999 -14.282 1.00 5.01 O ATOM 2235 CB GLU A 143 -4.072 4.054 -13.562 1.00 24.51 C ATOM 2236 CG GLU A 143 -3.365 4.144 -12.227 1.00 52.42 C ATOM 2237 CD GLU A 143 -2.147 5.040 -12.289 1.00 62.24 C ATOM 2238 OE1 GLU A 143 -2.312 6.278 -12.223 1.00 21.40 O ATOM 2239 OE2 GLU A 143 -1.025 4.516 -12.426 1.00 12.40 O ATOM 0 H GLU A 143 -5.905 4.109 -11.811 1.00 23.35 H new ATOM 0 HA GLU A 143 -5.758 3.205 -14.554 1.00 73.33 H new ATOM 0 HB2 GLU A 143 -3.363 3.703 -14.312 1.00 24.51 H new ATOM 0 HB3 GLU A 143 -4.384 5.054 -13.862 1.00 24.51 H new ATOM 0 HG2 GLU A 143 -4.057 4.524 -11.475 1.00 52.42 H new ATOM 0 HG3 GLU A 143 -3.065 3.146 -11.908 1.00 52.42 H new ATOM 2246 N GLN A 144 -5.028 1.199 -12.113 1.00 60.41 N ATOM 2247 CA GLN A 144 -4.756 -0.200 -11.800 1.00 42.01 C ATOM 2248 C GLN A 144 -5.834 -1.107 -12.378 1.00 74.13 C ATOM 2249 O GLN A 144 -5.533 -2.102 -13.041 1.00 25.32 O ATOM 2250 CB GLN A 144 -4.677 -0.423 -10.288 1.00 5.34 C ATOM 2251 CG GLN A 144 -3.325 -0.114 -9.673 1.00 25.31 C ATOM 2252 CD GLN A 144 -2.226 -1.061 -10.133 1.00 4.23 C ATOM 2253 OE1 GLN A 144 -2.252 -1.578 -11.248 1.00 32.24 O ATOM 2254 NE2 GLN A 144 -1.258 -1.307 -9.263 1.00 3.22 N ATOM 0 H GLN A 144 -5.331 1.759 -11.316 1.00 60.41 H new ATOM 0 HA GLN A 144 -3.794 -0.448 -12.249 1.00 42.01 H new ATOM 0 HB2 GLN A 144 -5.432 0.196 -9.803 1.00 5.34 H new ATOM 0 HB3 GLN A 144 -4.930 -1.461 -10.074 1.00 5.34 H new ATOM 0 HG2 GLN A 144 -3.044 0.908 -9.925 1.00 25.31 H new ATOM 0 HG3 GLN A 144 -3.407 -0.163 -8.587 1.00 25.31 H new ATOM 0 HE21 GLN A 144 -1.270 -0.859 -8.347 1.00 3.22 H new ATOM 0 HE22 GLN A 144 -0.501 -1.944 -9.509 1.00 3.22 H new ATOM 2263 N GLU A 145 -7.093 -0.762 -12.120 1.00 73.24 N ATOM 2264 CA GLU A 145 -8.217 -1.573 -12.578 1.00 23.43 C ATOM 2265 C GLU A 145 -8.323 -1.521 -14.096 1.00 25.33 C ATOM 2266 O GLU A 145 -8.753 -2.481 -14.734 1.00 50.42 O ATOM 2267 CB GLU A 145 -9.524 -1.108 -11.925 1.00 44.12 C ATOM 2268 CG GLU A 145 -9.857 0.345 -12.204 1.00 54.45 C ATOM 2269 CD GLU A 145 -11.162 0.787 -11.576 1.00 31.21 C ATOM 2270 OE1 GLU A 145 -12.233 0.387 -12.078 1.00 11.22 O ATOM 2271 OE2 GLU A 145 -11.124 1.546 -10.585 1.00 55.21 O ATOM 0 H GLU A 145 -7.360 0.072 -11.597 1.00 73.24 H new ATOM 0 HA GLU A 145 -8.041 -2.607 -12.280 1.00 23.43 H new ATOM 0 HB2 GLU A 145 -10.342 -1.735 -12.281 1.00 44.12 H new ATOM 0 HB3 GLU A 145 -9.455 -1.256 -10.847 1.00 44.12 H new ATOM 0 HG2 GLU A 145 -9.049 0.975 -11.831 1.00 54.45 H new ATOM 0 HG3 GLU A 145 -9.909 0.499 -13.282 1.00 54.45 H new ATOM 2278 N LEU A 146 -7.915 -0.395 -14.664 1.00 73.30 N ATOM 2279 CA LEU A 146 -7.856 -0.243 -16.109 1.00 45.34 C ATOM 2280 C LEU A 146 -6.713 -1.084 -16.667 1.00 60.52 C ATOM 2281 O LEU A 146 -6.858 -1.753 -17.694 1.00 51.32 O ATOM 2282 CB LEU A 146 -7.652 1.229 -16.476 1.00 74.32 C ATOM 2283 CG LEU A 146 -7.678 1.543 -17.973 1.00 44.04 C ATOM 2284 CD1 LEU A 146 -9.046 1.233 -18.559 1.00 0.21 C ATOM 2285 CD2 LEU A 146 -7.312 2.999 -18.218 1.00 74.41 C ATOM 0 H LEU A 146 -7.619 0.430 -14.142 1.00 73.30 H new ATOM 0 HA LEU A 146 -8.796 -0.584 -16.542 1.00 45.34 H new ATOM 0 HB2 LEU A 146 -8.426 1.819 -15.985 1.00 74.32 H new ATOM 0 HB3 LEU A 146 -6.695 1.558 -16.070 1.00 74.32 H new ATOM 0 HG LEU A 146 -6.940 0.913 -18.470 1.00 44.04 H new ATOM 0 HD11 LEU A 146 -9.046 1.462 -19.625 1.00 0.21 H new ATOM 0 HD12 LEU A 146 -9.272 0.177 -18.415 1.00 0.21 H new ATOM 0 HD13 LEU A 146 -9.802 1.837 -18.058 1.00 0.21 H new ATOM 0 HD21 LEU A 146 -7.335 3.205 -19.288 1.00 74.41 H new ATOM 0 HD22 LEU A 146 -8.027 3.645 -17.708 1.00 74.41 H new ATOM 0 HD23 LEU A 146 -6.311 3.192 -17.833 1.00 74.41 H new ATOM 2297 N GLY A 147 -5.585 -1.064 -15.958 1.00 71.45 N ATOM 2298 CA GLY A 147 -4.407 -1.782 -16.397 1.00 23.44 C ATOM 2299 C GLY A 147 -3.826 -1.171 -17.647 1.00 21.02 C ATOM 2300 O GLY A 147 -3.494 -1.885 -18.596 1.00 34.31 O ATOM 0 H GLY A 147 -5.470 -0.557 -15.080 1.00 71.45 H new ATOM 0 HA2 GLY A 147 -3.658 -1.775 -15.605 1.00 23.44 H new ATOM 0 HA3 GLY A 147 -4.663 -2.825 -16.585 1.00 23.44 H new