USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=12 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 Single : A 11 THR OG1 : rot 180:sc= 0.0892 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.152 K(o=-0.15,f=-7.9!) USER MOD Single : A 20 TYR OH : rot 8:sc= -1.07 USER MOD Single : A 67 THR OG1 : rot -26:sc= 0.401 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 179:sc= 0.886 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 30:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0.0467 USER MOD Single : A 124 MET CE :methyl -163:sc= -0.0921 (180deg=-0.516) USER MOD Single : A 138 MET CE :methyl 159:sc= -0.915 (180deg=-2.35!) USER MOD Single : A 141 LYS NZ :NH3+ -118:sc= 1.8 (180deg=-0.891) USER MOD Single : A 144 GLN : amide:sc= -2.22 K(o=-2.2,f=-5.8!) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 1.839 6.654 10.792 1.00 72.34 N ATOM 57 CA VAL A 5 1.632 5.511 9.926 1.00 2.43 C ATOM 58 C VAL A 5 0.850 5.921 8.684 1.00 12.15 C ATOM 59 O VAL A 5 -0.103 6.698 8.764 1.00 51.31 O ATOM 60 CB VAL A 5 0.897 4.370 10.672 1.00 43.14 C ATOM 61 CG1 VAL A 5 -0.479 4.821 11.136 1.00 13.01 C ATOM 62 CG2 VAL A 5 0.785 3.127 9.801 1.00 43.41 C ATOM 0 HA VAL A 5 2.610 5.139 9.620 1.00 2.43 H new ATOM 0 HB VAL A 5 1.489 4.116 11.551 1.00 43.14 H new ATOM 0 HG11 VAL A 5 -0.974 4.001 11.657 1.00 13.01 H new ATOM 0 HG12 VAL A 5 -0.375 5.670 11.812 1.00 13.01 H new ATOM 0 HG13 VAL A 5 -1.076 5.115 10.273 1.00 13.01 H new ATOM 0 HG21 VAL A 5 0.265 2.343 10.351 1.00 43.41 H new ATOM 0 HG22 VAL A 5 0.227 3.366 8.895 1.00 43.41 H new ATOM 0 HG23 VAL A 5 1.783 2.780 9.532 1.00 43.41 H new ATOM 72 N VAL A 6 1.275 5.422 7.538 1.00 30.43 N ATOM 73 CA VAL A 6 0.545 5.638 6.306 1.00 70.43 C ATOM 74 C VAL A 6 -0.361 4.451 6.046 1.00 63.42 C ATOM 75 O VAL A 6 0.109 3.321 5.886 1.00 12.34 O ATOM 76 CB VAL A 6 1.488 5.834 5.097 1.00 53.01 C ATOM 77 CG1 VAL A 6 0.692 5.983 3.806 1.00 64.33 C ATOM 78 CG2 VAL A 6 2.390 7.041 5.309 1.00 75.14 C ATOM 0 H VAL A 6 2.123 4.864 7.436 1.00 30.43 H new ATOM 0 HA VAL A 6 -0.040 6.550 6.423 1.00 70.43 H new ATOM 0 HB VAL A 6 2.115 4.946 5.011 1.00 53.01 H new ATOM 0 HG11 VAL A 6 1.377 6.120 2.970 1.00 64.33 H new ATOM 0 HG12 VAL A 6 0.094 5.087 3.642 1.00 64.33 H new ATOM 0 HG13 VAL A 6 0.035 6.849 3.882 1.00 64.33 H new ATOM 0 HG21 VAL A 6 3.046 7.161 4.447 1.00 75.14 H new ATOM 0 HG22 VAL A 6 1.779 7.936 5.427 1.00 75.14 H new ATOM 0 HG23 VAL A 6 2.993 6.892 6.205 1.00 75.14 H new ATOM 88 N ARG A 7 -1.659 4.696 6.046 1.00 64.34 N ATOM 89 CA ARG A 7 -2.612 3.662 5.703 1.00 24.15 C ATOM 90 C ARG A 7 -3.521 4.141 4.587 1.00 70.34 C ATOM 91 O ARG A 7 -4.389 4.992 4.794 1.00 72.34 O ATOM 92 CB ARG A 7 -3.454 3.247 6.912 1.00 62.24 C ATOM 93 CG ARG A 7 -4.497 2.194 6.567 1.00 51.44 C ATOM 94 CD ARG A 7 -5.388 1.860 7.750 1.00 5.20 C ATOM 95 NE ARG A 7 -6.447 0.926 7.376 1.00 24.43 N ATOM 96 CZ ARG A 7 -7.101 0.149 8.236 1.00 23.52 C ATOM 97 NH1 ARG A 7 -6.874 0.246 9.540 1.00 64.53 N ATOM 98 NH2 ARG A 7 -8.010 -0.706 7.793 1.00 14.22 N ATOM 0 H ARG A 7 -2.074 5.598 6.279 1.00 64.34 H new ATOM 0 HA ARG A 7 -2.049 2.791 5.369 1.00 24.15 H new ATOM 0 HB2 ARG A 7 -2.797 2.861 7.692 1.00 62.24 H new ATOM 0 HB3 ARG A 7 -3.952 4.126 7.322 1.00 62.24 H new ATOM 0 HG2 ARG A 7 -5.112 2.551 5.741 1.00 51.44 H new ATOM 0 HG3 ARG A 7 -3.997 1.288 6.224 1.00 51.44 H new ATOM 0 HD2 ARG A 7 -4.786 1.428 8.550 1.00 5.20 H new ATOM 0 HD3 ARG A 7 -5.831 2.775 8.143 1.00 5.20 H new ATOM 0 HE ARG A 7 -6.702 0.865 6.390 1.00 24.43 H new ATOM 0 HH11 ARG A 7 -6.194 0.920 9.890 1.00 64.53 H new ATOM 0 HH12 ARG A 7 -7.380 -0.354 10.192 1.00 64.53 H new ATOM 0 HH21 ARG A 7 -8.208 -0.768 6.794 1.00 14.22 H new ATOM 0 HH22 ARG A 7 -8.512 -1.302 8.450 1.00 14.22 H new ATOM 112 N ASP A 8 -3.316 3.577 3.414 1.00 4.12 N ATOM 113 CA ASP A 8 -4.143 3.859 2.256 1.00 64.21 C ATOM 114 C ASP A 8 -4.295 2.575 1.460 1.00 44.53 C ATOM 115 O ASP A 8 -3.490 1.654 1.605 1.00 35.42 O ATOM 116 CB ASP A 8 -3.533 4.970 1.382 1.00 74.30 C ATOM 117 CG ASP A 8 -3.690 6.362 1.977 1.00 30.12 C ATOM 118 OD1 ASP A 8 -4.795 6.933 1.880 1.00 1.13 O ATOM 119 OD2 ASP A 8 -2.704 6.896 2.539 1.00 20.22 O ATOM 0 H ASP A 8 -2.568 2.907 3.235 1.00 4.12 H new ATOM 0 HA ASP A 8 -5.118 4.217 2.587 1.00 64.21 H new ATOM 0 HB2 ASP A 8 -2.473 4.764 1.233 1.00 74.30 H new ATOM 0 HB3 ASP A 8 -4.003 4.948 0.399 1.00 74.30 H new ATOM 124 N ALA A 9 -5.316 2.499 0.635 1.00 73.54 N ATOM 125 CA ALA A 9 -5.617 1.268 -0.074 1.00 1.24 C ATOM 126 C ALA A 9 -6.069 1.564 -1.491 1.00 70.32 C ATOM 127 O ALA A 9 -7.056 2.264 -1.706 1.00 70.34 O ATOM 128 CB ALA A 9 -6.682 0.487 0.673 1.00 13.42 C ATOM 0 H ALA A 9 -5.952 3.271 0.437 1.00 73.54 H new ATOM 0 HA ALA A 9 -4.711 0.664 -0.127 1.00 1.24 H new ATOM 0 HB1 ALA A 9 -6.902 -0.435 0.135 1.00 13.42 H new ATOM 0 HB2 ALA A 9 -6.322 0.246 1.673 1.00 13.42 H new ATOM 0 HB3 ALA A 9 -7.588 1.088 0.749 1.00 13.42 H new ATOM 134 N VAL A 10 -5.354 1.030 -2.459 1.00 15.11 N ATOM 135 CA VAL A 10 -5.651 1.322 -3.846 1.00 13.04 C ATOM 136 C VAL A 10 -6.270 0.124 -4.554 1.00 4.43 C ATOM 137 O VAL A 10 -5.842 -1.017 -4.379 1.00 54.04 O ATOM 138 CB VAL A 10 -4.403 1.810 -4.602 1.00 31.41 C ATOM 139 CG1 VAL A 10 -4.054 3.217 -4.161 1.00 2.41 C ATOM 140 CG2 VAL A 10 -3.222 0.883 -4.374 1.00 15.41 C ATOM 0 H VAL A 10 -4.568 0.396 -2.313 1.00 15.11 H new ATOM 0 HA VAL A 10 -6.384 2.129 -3.848 1.00 13.04 H new ATOM 0 HB VAL A 10 -4.628 1.809 -5.668 1.00 31.41 H new ATOM 0 HG11 VAL A 10 -3.170 3.558 -4.699 1.00 2.41 H new ATOM 0 HG12 VAL A 10 -4.889 3.883 -4.376 1.00 2.41 H new ATOM 0 HG13 VAL A 10 -3.852 3.223 -3.090 1.00 2.41 H new ATOM 0 HG21 VAL A 10 -2.356 1.255 -4.922 1.00 15.41 H new ATOM 0 HG22 VAL A 10 -2.989 0.845 -3.310 1.00 15.41 H new ATOM 0 HG23 VAL A 10 -3.471 -0.118 -4.727 1.00 15.41 H new ATOM 150 N THR A 11 -7.298 0.401 -5.334 1.00 11.41 N ATOM 151 CA THR A 11 -8.035 -0.617 -6.036 1.00 65.30 C ATOM 152 C THR A 11 -7.603 -0.704 -7.497 1.00 62.21 C ATOM 153 O THR A 11 -7.857 0.207 -8.280 1.00 43.23 O ATOM 154 CB THR A 11 -9.528 -0.283 -5.966 1.00 23.50 C ATOM 155 OG1 THR A 11 -9.690 1.088 -5.569 1.00 33.03 O ATOM 156 CG2 THR A 11 -10.245 -1.191 -4.984 1.00 13.32 C ATOM 0 H THR A 11 -7.643 1.347 -5.495 1.00 11.41 H new ATOM 0 HA THR A 11 -7.836 -1.580 -5.566 1.00 65.30 H new ATOM 0 HB THR A 11 -9.966 -0.438 -6.952 1.00 23.50 H new ATOM 0 HG1 THR A 11 -10.645 1.305 -5.525 1.00 33.03 H new ATOM 0 HG21 THR A 11 -11.303 -0.932 -4.955 1.00 13.32 H new ATOM 0 HG22 THR A 11 -10.134 -2.228 -5.300 1.00 13.32 H new ATOM 0 HG23 THR A 11 -9.813 -1.066 -3.991 1.00 13.32 H new ATOM 164 N ILE A 12 -6.927 -1.781 -7.855 1.00 4.05 N ATOM 165 CA ILE A 12 -6.526 -1.997 -9.240 1.00 1.33 C ATOM 166 C ILE A 12 -7.044 -3.358 -9.695 1.00 44.11 C ATOM 167 O ILE A 12 -7.193 -4.270 -8.879 1.00 30.51 O ATOM 168 CB ILE A 12 -4.983 -1.921 -9.438 1.00 2.33 C ATOM 169 CG1 ILE A 12 -4.417 -0.568 -8.988 1.00 3.02 C ATOM 170 CG2 ILE A 12 -4.601 -2.176 -10.885 1.00 71.10 C ATOM 171 CD1 ILE A 12 -4.151 -0.481 -7.502 1.00 72.14 C ATOM 0 H ILE A 12 -6.643 -2.519 -7.211 1.00 4.05 H new ATOM 0 HA ILE A 12 -6.958 -1.198 -9.843 1.00 1.33 H new ATOM 0 HB ILE A 12 -4.549 -2.701 -8.813 1.00 2.33 H new ATOM 0 HG12 ILE A 12 -3.488 -0.376 -9.526 1.00 3.02 H new ATOM 0 HG13 ILE A 12 -5.116 0.219 -9.269 1.00 3.02 H new ATOM 0 HG21 ILE A 12 -3.518 -2.116 -10.991 1.00 71.10 H new ATOM 0 HG22 ILE A 12 -4.941 -3.168 -11.181 1.00 71.10 H new ATOM 0 HG23 ILE A 12 -5.070 -1.427 -11.523 1.00 71.10 H new ATOM 0 HD11 ILE A 12 -3.752 0.504 -7.261 1.00 72.14 H new ATOM 0 HD12 ILE A 12 -5.081 -0.640 -6.956 1.00 72.14 H new ATOM 0 HD13 ILE A 12 -3.428 -1.245 -7.217 1.00 72.14 H new ATOM 183 N GLY A 13 -7.344 -3.480 -10.984 1.00 53.12 N ATOM 184 CA GLY A 13 -7.858 -4.728 -11.520 1.00 22.04 C ATOM 185 C GLY A 13 -6.793 -5.802 -11.664 1.00 33.30 C ATOM 186 O GLY A 13 -6.572 -6.320 -12.758 1.00 55.32 O ATOM 0 H GLY A 13 -7.240 -2.733 -11.670 1.00 53.12 H new ATOM 0 HA2 GLY A 13 -8.650 -5.096 -10.869 1.00 22.04 H new ATOM 0 HA3 GLY A 13 -8.308 -4.539 -12.494 1.00 22.04 H new ATOM 190 N LYS A 14 -6.139 -6.133 -10.560 1.00 71.13 N ATOM 191 CA LYS A 14 -5.151 -7.204 -10.524 1.00 35.25 C ATOM 192 C LYS A 14 -5.630 -8.283 -9.556 1.00 33.43 C ATOM 193 O LYS A 14 -6.403 -7.988 -8.644 1.00 72.12 O ATOM 194 CB LYS A 14 -3.783 -6.670 -10.075 1.00 4.24 C ATOM 195 CG LYS A 14 -3.152 -5.636 -11.006 1.00 63.12 C ATOM 196 CD LYS A 14 -2.518 -6.269 -12.242 1.00 71.35 C ATOM 197 CE LYS A 14 -3.536 -6.522 -13.342 1.00 61.24 C ATOM 198 NZ LYS A 14 -2.914 -7.115 -14.555 1.00 44.31 N ATOM 0 H LYS A 14 -6.278 -5.667 -9.663 1.00 71.13 H new ATOM 0 HA LYS A 14 -5.039 -7.621 -11.525 1.00 35.25 H new ATOM 0 HB2 LYS A 14 -3.891 -6.227 -9.085 1.00 4.24 H new ATOM 0 HB3 LYS A 14 -3.097 -7.511 -9.974 1.00 4.24 H new ATOM 0 HG2 LYS A 14 -3.913 -4.921 -11.318 1.00 63.12 H new ATOM 0 HG3 LYS A 14 -2.393 -5.075 -10.460 1.00 63.12 H new ATOM 0 HD2 LYS A 14 -1.732 -5.616 -12.620 1.00 71.35 H new ATOM 0 HD3 LYS A 14 -2.044 -7.210 -11.964 1.00 71.35 H new ATOM 0 HE2 LYS A 14 -4.312 -7.190 -12.970 1.00 61.24 H new ATOM 0 HE3 LYS A 14 -4.023 -5.584 -13.607 1.00 61.24 H new ATOM 0 HZ1 LYS A 14 -3.644 -7.271 -15.279 1.00 44.31 H new ATOM 0 HZ2 LYS A 14 -2.191 -6.467 -14.927 1.00 44.31 H new ATOM 0 HZ3 LYS A 14 -2.471 -8.023 -14.309 1.00 44.31 H new ATOM 212 N PRO A 15 -5.191 -9.540 -9.738 1.00 4.14 N ATOM 213 CA PRO A 15 -5.640 -10.659 -8.897 1.00 72.44 C ATOM 214 C PRO A 15 -5.332 -10.453 -7.412 1.00 64.32 C ATOM 215 O PRO A 15 -6.249 -10.443 -6.593 1.00 52.45 O ATOM 216 CB PRO A 15 -4.860 -11.855 -9.450 1.00 31.45 C ATOM 217 CG PRO A 15 -4.494 -11.459 -10.839 1.00 65.22 C ATOM 218 CD PRO A 15 -4.253 -9.980 -10.782 1.00 31.44 C ATOM 0 HA PRO A 15 -6.722 -10.781 -8.936 1.00 72.44 H new ATOM 0 HB2 PRO A 15 -3.973 -12.061 -8.850 1.00 31.45 H new ATOM 0 HB3 PRO A 15 -5.467 -12.761 -9.443 1.00 31.45 H new ATOM 0 HG2 PRO A 15 -3.604 -11.989 -11.177 1.00 65.22 H new ATOM 0 HG3 PRO A 15 -5.293 -11.700 -11.540 1.00 65.22 H new ATOM 0 HD2 PRO A 15 -3.220 -9.748 -10.522 1.00 31.44 H new ATOM 0 HD3 PRO A 15 -4.457 -9.499 -11.739 1.00 31.44 H new ATOM 226 N ALA A 16 -4.052 -10.257 -7.073 1.00 30.13 N ATOM 227 CA ALA A 16 -3.655 -10.012 -5.680 1.00 12.30 C ATOM 228 C ALA A 16 -2.157 -9.776 -5.541 1.00 4.01 C ATOM 229 O ALA A 16 -1.727 -8.653 -5.314 1.00 61.44 O ATOM 230 CB ALA A 16 -4.077 -11.165 -4.773 1.00 54.10 C ATOM 0 H ALA A 16 -3.278 -10.263 -7.738 1.00 30.13 H new ATOM 0 HA ALA A 16 -4.172 -9.104 -5.369 1.00 12.30 H new ATOM 0 HB1 ALA A 16 -3.769 -10.954 -3.749 1.00 54.10 H new ATOM 0 HB2 ALA A 16 -5.160 -11.279 -4.810 1.00 54.10 H new ATOM 0 HB3 ALA A 16 -3.603 -12.086 -5.112 1.00 54.10 H new ATOM 236 N GLU A 17 -1.360 -10.829 -5.679 1.00 1.04 N ATOM 237 CA GLU A 17 0.072 -10.727 -5.420 1.00 55.35 C ATOM 238 C GLU A 17 0.752 -9.821 -6.438 1.00 24.21 C ATOM 239 O GLU A 17 1.734 -9.156 -6.127 1.00 0.21 O ATOM 240 CB GLU A 17 0.725 -12.111 -5.388 1.00 45.35 C ATOM 241 CG GLU A 17 2.178 -12.070 -4.942 1.00 4.43 C ATOM 242 CD GLU A 17 2.647 -13.372 -4.331 1.00 74.23 C ATOM 243 OE1 GLU A 17 2.329 -13.618 -3.148 1.00 43.04 O ATOM 244 OE2 GLU A 17 3.351 -14.138 -5.017 1.00 32.42 O ATOM 0 H GLU A 17 -1.676 -11.755 -5.966 1.00 1.04 H new ATOM 0 HA GLU A 17 0.201 -10.275 -4.437 1.00 55.35 H new ATOM 0 HB2 GLU A 17 0.162 -12.757 -4.715 1.00 45.35 H new ATOM 0 HB3 GLU A 17 0.667 -12.557 -6.381 1.00 45.35 H new ATOM 0 HG2 GLU A 17 2.808 -11.829 -5.798 1.00 4.43 H new ATOM 0 HG3 GLU A 17 2.307 -11.267 -4.216 1.00 4.43 H new ATOM 251 N GLN A 18 0.221 -9.796 -7.654 1.00 73.11 N ATOM 252 CA GLN A 18 0.710 -8.897 -8.692 1.00 63.32 C ATOM 253 C GLN A 18 0.648 -7.444 -8.217 1.00 63.32 C ATOM 254 O GLN A 18 1.492 -6.629 -8.580 1.00 53.32 O ATOM 255 CB GLN A 18 -0.097 -9.065 -9.989 1.00 60.33 C ATOM 256 CG GLN A 18 0.025 -10.447 -10.625 1.00 74.02 C ATOM 257 CD GLN A 18 -0.959 -11.465 -10.067 1.00 43.34 C ATOM 258 OE1 GLN A 18 -1.406 -11.371 -8.923 1.00 72.25 O ATOM 259 NE2 GLN A 18 -1.306 -12.448 -10.879 1.00 45.53 N ATOM 0 H GLN A 18 -0.553 -10.392 -7.947 1.00 73.11 H new ATOM 0 HA GLN A 18 1.749 -9.155 -8.898 1.00 63.32 H new ATOM 0 HB2 GLN A 18 -1.148 -8.865 -9.779 1.00 60.33 H new ATOM 0 HB3 GLN A 18 0.232 -8.315 -10.709 1.00 60.33 H new ATOM 0 HG2 GLN A 18 -0.129 -10.357 -11.700 1.00 74.02 H new ATOM 0 HG3 GLN A 18 1.040 -10.817 -10.478 1.00 74.02 H new ATOM 0 HE21 GLN A 18 -0.916 -12.494 -11.820 1.00 45.53 H new ATOM 0 HE22 GLN A 18 -1.964 -13.161 -10.565 1.00 45.53 H new ATOM 268 N LEU A 19 -0.347 -7.147 -7.383 1.00 15.21 N ATOM 269 CA LEU A 19 -0.491 -5.824 -6.780 1.00 74.13 C ATOM 270 C LEU A 19 0.706 -5.512 -5.888 1.00 44.44 C ATOM 271 O LEU A 19 1.214 -4.395 -5.874 1.00 22.41 O ATOM 272 CB LEU A 19 -1.781 -5.762 -5.950 1.00 40.10 C ATOM 273 CG LEU A 19 -3.082 -5.680 -6.746 1.00 15.15 C ATOM 274 CD1 LEU A 19 -4.276 -5.873 -5.826 1.00 52.14 C ATOM 275 CD2 LEU A 19 -3.181 -4.342 -7.457 1.00 25.04 C ATOM 0 H LEU A 19 -1.071 -7.811 -7.108 1.00 15.21 H new ATOM 0 HA LEU A 19 -0.539 -5.084 -7.579 1.00 74.13 H new ATOM 0 HB2 LEU A 19 -1.823 -6.645 -5.312 1.00 40.10 H new ATOM 0 HB3 LEU A 19 -1.725 -4.895 -5.291 1.00 40.10 H new ATOM 0 HG LEU A 19 -3.083 -6.474 -7.492 1.00 15.15 H new ATOM 0 HD11 LEU A 19 -5.196 -5.812 -6.407 1.00 52.14 H new ATOM 0 HD12 LEU A 19 -4.213 -6.850 -5.348 1.00 52.14 H new ATOM 0 HD13 LEU A 19 -4.277 -5.095 -5.063 1.00 52.14 H new ATOM 0 HD21 LEU A 19 -4.113 -4.297 -8.020 1.00 25.04 H new ATOM 0 HD22 LEU A 19 -3.162 -3.537 -6.722 1.00 25.04 H new ATOM 0 HD23 LEU A 19 -2.339 -4.230 -8.140 1.00 25.04 H new ATOM 287 N TYR A 20 1.136 -6.512 -5.131 1.00 51.01 N ATOM 288 CA TYR A 20 2.294 -6.387 -4.255 1.00 34.01 C ATOM 289 C TYR A 20 3.589 -6.365 -5.068 1.00 55.12 C ATOM 290 O TYR A 20 4.532 -5.646 -4.742 1.00 41.04 O ATOM 291 CB TYR A 20 2.305 -7.549 -3.260 1.00 71.21 C ATOM 292 CG TYR A 20 3.414 -7.490 -2.232 1.00 21.33 C ATOM 293 CD1 TYR A 20 3.291 -6.708 -1.091 1.00 42.21 C ATOM 294 CD2 TYR A 20 4.578 -8.232 -2.396 1.00 44.51 C ATOM 295 CE1 TYR A 20 4.298 -6.663 -0.145 1.00 44.11 C ATOM 296 CE2 TYR A 20 5.587 -8.190 -1.457 1.00 15.14 C ATOM 297 CZ TYR A 20 5.442 -7.407 -0.334 1.00 64.51 C ATOM 298 OH TYR A 20 6.441 -7.372 0.606 1.00 33.32 O ATOM 0 H TYR A 20 0.694 -7.431 -5.106 1.00 51.01 H new ATOM 0 HA TYR A 20 2.227 -5.446 -3.709 1.00 34.01 H new ATOM 0 HB2 TYR A 20 1.347 -7.574 -2.740 1.00 71.21 H new ATOM 0 HB3 TYR A 20 2.391 -8.484 -3.814 1.00 71.21 H new ATOM 0 HD1 TYR A 20 2.394 -6.126 -0.940 1.00 42.21 H new ATOM 0 HD2 TYR A 20 4.694 -8.851 -3.273 1.00 44.51 H new ATOM 0 HE1 TYR A 20 4.189 -6.049 0.736 1.00 44.11 H new ATOM 0 HE2 TYR A 20 6.487 -8.769 -1.602 1.00 15.14 H new ATOM 0 HH TYR A 20 6.131 -6.879 1.394 1.00 33.32 H new ATOM 308 N ALA A 21 3.608 -7.145 -6.139 1.00 32.00 N ATOM 309 CA ALA A 21 4.798 -7.313 -6.968 1.00 43.43 C ATOM 310 C ALA A 21 5.072 -6.089 -7.838 1.00 63.20 C ATOM 311 O ALA A 21 6.071 -6.045 -8.553 1.00 64.11 O ATOM 312 CB ALA A 21 4.647 -8.547 -7.839 1.00 75.21 C ATOM 0 H ALA A 21 2.801 -7.680 -6.460 1.00 32.00 H new ATOM 0 HA ALA A 21 5.651 -7.434 -6.300 1.00 43.43 H new ATOM 0 HB1 ALA A 21 5.537 -8.668 -8.456 1.00 75.21 H new ATOM 0 HB2 ALA A 21 4.521 -9.426 -7.206 1.00 75.21 H new ATOM 0 HB3 ALA A 21 3.773 -8.434 -8.481 1.00 75.21 H new ATOM 318 N VAL A 22 4.172 -5.111 -7.772 1.00 34.24 N ATOM 319 CA VAL A 22 4.271 -3.875 -8.553 1.00 22.53 C ATOM 320 C VAL A 22 5.624 -3.169 -8.357 1.00 55.11 C ATOM 321 O VAL A 22 6.028 -2.346 -9.186 1.00 52.21 O ATOM 322 CB VAL A 22 3.124 -2.902 -8.195 1.00 14.33 C ATOM 323 CG1 VAL A 22 3.287 -2.375 -6.780 1.00 72.32 C ATOM 324 CG2 VAL A 22 3.039 -1.761 -9.200 1.00 22.51 C ATOM 0 H VAL A 22 3.348 -5.151 -7.172 1.00 34.24 H new ATOM 0 HA VAL A 22 4.189 -4.163 -9.601 1.00 22.53 H new ATOM 0 HB VAL A 22 2.186 -3.454 -8.243 1.00 14.33 H new ATOM 0 HG11 VAL A 22 2.469 -1.692 -6.550 1.00 72.32 H new ATOM 0 HG12 VAL A 22 3.273 -3.208 -6.078 1.00 72.32 H new ATOM 0 HG13 VAL A 22 4.236 -1.846 -6.696 1.00 72.32 H new ATOM 0 HG21 VAL A 22 2.224 -1.092 -8.923 1.00 22.51 H new ATOM 0 HG22 VAL A 22 3.978 -1.207 -9.202 1.00 22.51 H new ATOM 0 HG23 VAL A 22 2.855 -2.166 -10.195 1.00 22.51 H new ATOM 334 N TRP A 23 6.308 -3.469 -7.249 1.00 73.12 N ATOM 335 CA TRP A 23 7.641 -2.923 -6.993 1.00 71.22 C ATOM 336 C TRP A 23 8.552 -3.200 -8.190 1.00 14.24 C ATOM 337 O TRP A 23 9.367 -2.366 -8.583 1.00 32.15 O ATOM 338 CB TRP A 23 8.236 -3.551 -5.725 1.00 42.54 C ATOM 339 CG TRP A 23 9.472 -2.856 -5.224 1.00 4.12 C ATOM 340 CD1 TRP A 23 10.717 -2.865 -5.789 1.00 60.04 C ATOM 341 CD2 TRP A 23 9.582 -2.066 -4.033 1.00 63.12 C ATOM 342 NE1 TRP A 23 11.584 -2.113 -5.034 1.00 22.43 N ATOM 343 CE2 TRP A 23 10.912 -1.618 -3.949 1.00 1.13 C ATOM 344 CE3 TRP A 23 8.681 -1.692 -3.032 1.00 31.22 C ATOM 345 CZ2 TRP A 23 11.362 -0.812 -2.905 1.00 30.13 C ATOM 346 CZ3 TRP A 23 9.130 -0.893 -1.996 1.00 74.44 C ATOM 347 CH2 TRP A 23 10.460 -0.462 -1.939 1.00 30.15 C ATOM 0 H TRP A 23 5.959 -4.087 -6.516 1.00 73.12 H new ATOM 0 HA TRP A 23 7.560 -1.846 -6.846 1.00 71.22 H new ATOM 0 HB2 TRP A 23 7.482 -3.542 -4.938 1.00 42.54 H new ATOM 0 HB3 TRP A 23 8.474 -4.595 -5.926 1.00 42.54 H new ATOM 0 HD1 TRP A 23 10.981 -3.387 -6.697 1.00 60.04 H new ATOM 0 HE1 TRP A 23 12.568 -1.950 -5.247 1.00 22.43 H new ATOM 0 HE3 TRP A 23 7.653 -2.021 -3.067 1.00 31.22 H new ATOM 0 HZ2 TRP A 23 12.387 -0.476 -2.861 1.00 30.13 H new ATOM 0 HZ3 TRP A 23 8.442 -0.597 -1.218 1.00 74.44 H new ATOM 0 HH2 TRP A 23 10.780 0.159 -1.116 1.00 30.15 H new ATOM 358 N ARG A 24 8.373 -4.370 -8.781 1.00 22.13 N ATOM 359 CA ARG A 24 9.115 -4.767 -9.951 1.00 44.52 C ATOM 360 C ARG A 24 8.154 -4.770 -11.136 1.00 24.44 C ATOM 361 O ARG A 24 6.940 -4.800 -10.949 1.00 54.53 O ATOM 362 CB ARG A 24 9.750 -6.153 -9.718 1.00 60.05 C ATOM 363 CG ARG A 24 10.798 -6.565 -10.748 1.00 72.24 C ATOM 364 CD ARG A 24 10.183 -7.316 -11.918 1.00 20.40 C ATOM 365 NE ARG A 24 11.161 -7.601 -12.965 1.00 15.34 N ATOM 366 CZ ARG A 24 11.015 -8.557 -13.881 1.00 5.12 C ATOM 367 NH1 ARG A 24 9.921 -9.299 -13.895 1.00 53.25 N ATOM 368 NH2 ARG A 24 11.956 -8.759 -14.792 1.00 2.01 N ATOM 0 H ARG A 24 7.705 -5.069 -8.456 1.00 22.13 H new ATOM 0 HA ARG A 24 9.929 -4.073 -10.158 1.00 44.52 H new ATOM 0 HB2 ARG A 24 10.210 -6.163 -8.730 1.00 60.05 H new ATOM 0 HB3 ARG A 24 8.958 -6.902 -9.709 1.00 60.05 H new ATOM 0 HG2 ARG A 24 11.312 -5.677 -11.117 1.00 72.24 H new ATOM 0 HG3 ARG A 24 11.550 -7.193 -10.269 1.00 72.24 H new ATOM 0 HD2 ARG A 24 9.752 -8.251 -11.561 1.00 20.40 H new ATOM 0 HD3 ARG A 24 9.366 -6.728 -12.336 1.00 20.40 H new ATOM 0 HE ARG A 24 12.008 -7.033 -12.997 1.00 15.34 H new ATOM 0 HH11 ARG A 24 9.188 -9.140 -13.204 1.00 53.25 H new ATOM 0 HH12 ARG A 24 9.810 -10.031 -14.597 1.00 53.25 H new ATOM 0 HH21 ARG A 24 12.797 -8.181 -14.794 1.00 2.01 H new ATOM 0 HH22 ARG A 24 11.840 -9.492 -15.491 1.00 2.01 H new ATOM 382 N ASP A 25 8.700 -4.700 -12.332 1.00 42.30 N ATOM 383 CA ASP A 25 7.911 -4.643 -13.566 1.00 74.00 C ATOM 384 C ASP A 25 7.137 -5.947 -13.831 1.00 63.41 C ATOM 385 O ASP A 25 7.484 -6.706 -14.735 1.00 12.04 O ATOM 386 CB ASP A 25 8.842 -4.325 -14.741 1.00 21.21 C ATOM 387 CG ASP A 25 8.114 -4.125 -16.056 1.00 1.43 C ATOM 388 OD1 ASP A 25 7.576 -3.018 -16.273 1.00 61.11 O ATOM 389 OD2 ASP A 25 8.112 -5.062 -16.890 1.00 44.24 O ATOM 0 H ASP A 25 9.708 -4.680 -12.487 1.00 42.30 H new ATOM 0 HA ASP A 25 7.165 -3.856 -13.453 1.00 74.00 H new ATOM 0 HB2 ASP A 25 9.411 -3.424 -14.510 1.00 21.21 H new ATOM 0 HB3 ASP A 25 9.561 -5.136 -14.853 1.00 21.21 H new ATOM 394 N LEU A 26 6.151 -6.228 -12.965 1.00 55.14 N ATOM 395 CA LEU A 26 5.150 -7.290 -13.167 1.00 43.54 C ATOM 396 C LEU A 26 5.757 -8.577 -13.724 1.00 10.34 C ATOM 397 O LEU A 26 5.644 -8.845 -14.917 1.00 62.25 O ATOM 398 CB LEU A 26 4.011 -6.808 -14.080 1.00 4.33 C ATOM 399 CG LEU A 26 3.023 -5.809 -13.456 1.00 4.15 C ATOM 400 CD1 LEU A 26 2.458 -6.352 -12.151 1.00 65.13 C ATOM 401 CD2 LEU A 26 3.672 -4.448 -13.236 1.00 25.31 C ATOM 0 H LEU A 26 6.024 -5.717 -12.091 1.00 55.14 H new ATOM 0 HA LEU A 26 4.747 -7.521 -12.181 1.00 43.54 H new ATOM 0 HB2 LEU A 26 4.451 -6.348 -14.965 1.00 4.33 H new ATOM 0 HB3 LEU A 26 3.450 -7.679 -14.419 1.00 4.33 H new ATOM 0 HG LEU A 26 2.201 -5.675 -14.159 1.00 4.15 H new ATOM 0 HD11 LEU A 26 1.761 -5.629 -11.727 1.00 65.13 H new ATOM 0 HD12 LEU A 26 1.936 -7.289 -12.343 1.00 65.13 H new ATOM 0 HD13 LEU A 26 3.272 -6.527 -11.447 1.00 65.13 H new ATOM 0 HD21 LEU A 26 2.946 -3.766 -12.794 1.00 25.31 H new ATOM 0 HD22 LEU A 26 4.524 -4.556 -12.565 1.00 25.31 H new ATOM 0 HD23 LEU A 26 4.011 -4.048 -14.192 1.00 25.31 H new ATOM 413 N PRO A 27 6.394 -9.399 -12.872 1.00 44.22 N ATOM 414 CA PRO A 27 7.158 -10.570 -13.328 1.00 23.41 C ATOM 415 C PRO A 27 6.331 -11.570 -14.130 1.00 2.24 C ATOM 416 O PRO A 27 6.629 -11.842 -15.292 1.00 0.44 O ATOM 417 CB PRO A 27 7.647 -11.214 -12.025 1.00 34.34 C ATOM 418 CG PRO A 27 7.572 -10.130 -11.004 1.00 42.43 C ATOM 419 CD PRO A 27 6.416 -9.264 -11.407 1.00 22.03 C ATOM 0 HA PRO A 27 7.955 -10.270 -14.008 1.00 23.41 H new ATOM 0 HB2 PRO A 27 7.022 -12.062 -11.746 1.00 34.34 H new ATOM 0 HB3 PRO A 27 8.665 -11.589 -12.128 1.00 34.34 H new ATOM 0 HG2 PRO A 27 7.421 -10.543 -10.007 1.00 42.43 H new ATOM 0 HG3 PRO A 27 8.498 -9.556 -10.975 1.00 42.43 H new ATOM 0 HD2 PRO A 27 5.483 -9.602 -10.957 1.00 22.03 H new ATOM 0 HD3 PRO A 27 6.561 -8.228 -11.100 1.00 22.03 H new ATOM 998 N ALA A 64 14.560 -13.037 1.930 1.00 23.15 N ATOM 999 CA ALA A 64 13.534 -12.216 2.518 1.00 53.41 C ATOM 1000 C ALA A 64 12.324 -13.072 2.833 1.00 41.42 C ATOM 1001 O ALA A 64 11.676 -13.601 1.931 1.00 52.15 O ATOM 1002 CB ALA A 64 13.160 -11.084 1.584 1.00 44.52 C ATOM 0 HA ALA A 64 13.910 -11.777 3.442 1.00 53.41 H new ATOM 0 HB1 ALA A 64 12.383 -10.474 2.045 1.00 44.52 H new ATOM 0 HB2 ALA A 64 14.038 -10.468 1.389 1.00 44.52 H new ATOM 0 HB3 ALA A 64 12.789 -11.495 0.645 1.00 44.52 H new ATOM 1008 N GLU A 65 12.030 -13.217 4.111 1.00 61.14 N ATOM 1009 CA GLU A 65 10.851 -13.944 4.521 1.00 12.25 C ATOM 1010 C GLU A 65 9.818 -12.977 5.049 1.00 44.25 C ATOM 1011 O GLU A 65 10.132 -12.091 5.841 1.00 50.24 O ATOM 1012 CB GLU A 65 11.190 -14.984 5.591 1.00 65.02 C ATOM 1013 CG GLU A 65 11.328 -16.397 5.044 1.00 43.40 C ATOM 1014 CD GLU A 65 9.997 -17.022 4.658 1.00 34.23 C ATOM 1015 OE1 GLU A 65 9.048 -16.279 4.325 1.00 22.31 O ATOM 1016 OE2 GLU A 65 9.897 -18.269 4.665 1.00 24.31 O ATOM 0 H GLU A 65 12.590 -12.842 4.877 1.00 61.14 H new ATOM 0 HA GLU A 65 10.450 -14.470 3.654 1.00 12.25 H new ATOM 0 HB2 GLU A 65 12.122 -14.700 6.080 1.00 65.02 H new ATOM 0 HB3 GLU A 65 10.413 -14.973 6.355 1.00 65.02 H new ATOM 0 HG2 GLU A 65 11.981 -16.380 4.171 1.00 43.40 H new ATOM 0 HG3 GLU A 65 11.813 -17.024 5.792 1.00 43.40 H new ATOM 1023 N LEU A 66 8.589 -13.152 4.619 1.00 1.12 N ATOM 1024 CA LEU A 66 7.518 -12.271 5.028 1.00 10.23 C ATOM 1025 C LEU A 66 6.899 -12.786 6.316 1.00 14.01 C ATOM 1026 O LEU A 66 6.686 -13.989 6.470 1.00 21.02 O ATOM 1027 CB LEU A 66 6.461 -12.160 3.919 1.00 21.10 C ATOM 1028 CG LEU A 66 6.872 -11.350 2.677 1.00 15.45 C ATOM 1029 CD1 LEU A 66 7.365 -9.974 3.082 1.00 21.44 C ATOM 1030 CD2 LEU A 66 7.935 -12.071 1.859 1.00 24.11 C ATOM 0 H LEU A 66 8.305 -13.898 3.984 1.00 1.12 H new ATOM 0 HA LEU A 66 7.922 -11.274 5.207 1.00 10.23 H new ATOM 0 HB2 LEU A 66 6.191 -13.166 3.599 1.00 21.10 H new ATOM 0 HB3 LEU A 66 5.564 -11.709 4.343 1.00 21.10 H new ATOM 0 HG LEU A 66 5.988 -11.242 2.049 1.00 15.45 H new ATOM 0 HD11 LEU A 66 7.652 -9.414 2.192 1.00 21.44 H new ATOM 0 HD12 LEU A 66 6.570 -9.442 3.605 1.00 21.44 H new ATOM 0 HD13 LEU A 66 8.228 -10.076 3.740 1.00 21.44 H new ATOM 0 HD21 LEU A 66 8.198 -11.467 0.991 1.00 24.11 H new ATOM 0 HD22 LEU A 66 8.821 -12.229 2.473 1.00 24.11 H new ATOM 0 HD23 LEU A 66 7.547 -13.034 1.527 1.00 24.11 H new ATOM 1042 N THR A 67 6.607 -11.881 7.245 1.00 31.30 N ATOM 1043 CA THR A 67 6.061 -12.285 8.540 1.00 15.52 C ATOM 1044 C THR A 67 4.602 -12.703 8.385 1.00 12.32 C ATOM 1045 O THR A 67 3.981 -13.232 9.311 1.00 22.12 O ATOM 1046 CB THR A 67 6.202 -11.180 9.616 1.00 43.30 C ATOM 1047 OG1 THR A 67 5.689 -11.640 10.873 1.00 12.15 O ATOM 1048 CG2 THR A 67 5.481 -9.909 9.206 1.00 45.04 C ATOM 0 H THR A 67 6.736 -10.876 7.130 1.00 31.30 H new ATOM 0 HA THR A 67 6.646 -13.136 8.888 1.00 15.52 H new ATOM 0 HB THR A 67 7.263 -10.954 9.717 1.00 43.30 H new ATOM 0 HG1 THR A 67 5.011 -12.330 10.717 1.00 12.15 H new ATOM 0 HG21 THR A 67 5.601 -9.155 9.984 1.00 45.04 H new ATOM 0 HG22 THR A 67 5.902 -9.537 8.272 1.00 45.04 H new ATOM 0 HG23 THR A 67 4.421 -10.121 9.066 1.00 45.04 H new ATOM 1056 N ALA A 68 4.070 -12.446 7.201 1.00 34.04 N ATOM 1057 CA ALA A 68 2.808 -13.009 6.781 1.00 22.02 C ATOM 1058 C ALA A 68 2.844 -13.218 5.285 1.00 74.21 C ATOM 1059 O ALA A 68 3.092 -12.281 4.526 1.00 31.33 O ATOM 1060 CB ALA A 68 1.645 -12.118 7.160 1.00 22.04 C ATOM 0 H ALA A 68 4.506 -11.839 6.507 1.00 34.04 H new ATOM 0 HA ALA A 68 2.662 -13.962 7.290 1.00 22.02 H new ATOM 0 HB1 ALA A 68 0.713 -12.575 6.827 1.00 22.04 H new ATOM 0 HB2 ALA A 68 1.621 -11.992 8.242 1.00 22.04 H new ATOM 0 HB3 ALA A 68 1.762 -11.145 6.684 1.00 22.04 H new ATOM 1066 N ASP A 69 2.613 -14.444 4.874 1.00 62.33 N ATOM 1067 CA ASP A 69 2.616 -14.801 3.465 1.00 14.32 C ATOM 1068 C ASP A 69 1.471 -15.759 3.203 1.00 33.42 C ATOM 1069 O ASP A 69 1.630 -16.980 3.249 1.00 44.03 O ATOM 1070 CB ASP A 69 3.963 -15.418 3.056 1.00 60.40 C ATOM 1071 CG ASP A 69 4.025 -15.782 1.580 1.00 14.35 C ATOM 1072 OD1 ASP A 69 3.609 -14.956 0.741 1.00 21.35 O ATOM 1073 OD2 ASP A 69 4.514 -16.888 1.256 1.00 75.44 O ATOM 0 H ASP A 69 2.418 -15.224 5.502 1.00 62.33 H new ATOM 0 HA ASP A 69 2.481 -13.904 2.861 1.00 14.32 H new ATOM 0 HB2 ASP A 69 4.763 -14.715 3.285 1.00 60.40 H new ATOM 0 HB3 ASP A 69 4.143 -16.312 3.653 1.00 60.40 H new ATOM 1078 N GLU A 70 0.300 -15.183 3.000 1.00 63.12 N ATOM 1079 CA GLU A 70 -0.915 -15.951 2.806 1.00 40.44 C ATOM 1080 C GLU A 70 -1.455 -15.706 1.404 1.00 31.11 C ATOM 1081 O GLU A 70 -1.359 -14.586 0.900 1.00 62.15 O ATOM 1082 CB GLU A 70 -1.940 -15.548 3.867 1.00 1.40 C ATOM 1083 CG GLU A 70 -1.459 -15.803 5.289 1.00 63.42 C ATOM 1084 CD GLU A 70 -2.400 -15.256 6.338 1.00 42.44 C ATOM 1085 OE1 GLU A 70 -3.590 -15.633 6.327 1.00 71.24 O ATOM 1086 OE2 GLU A 70 -1.955 -14.443 7.177 1.00 21.23 O ATOM 0 H GLU A 70 0.165 -14.173 2.965 1.00 63.12 H new ATOM 0 HA GLU A 70 -0.706 -17.016 2.910 1.00 40.44 H new ATOM 0 HB2 GLU A 70 -2.175 -14.490 3.753 1.00 1.40 H new ATOM 0 HB3 GLU A 70 -2.865 -16.100 3.698 1.00 1.40 H new ATOM 0 HG2 GLU A 70 -1.340 -16.876 5.440 1.00 63.42 H new ATOM 0 HG3 GLU A 70 -0.475 -15.352 5.420 1.00 63.42 H new ATOM 1093 N PRO A 71 -2.032 -16.741 0.764 1.00 50.32 N ATOM 1094 CA PRO A 71 -2.484 -16.668 -0.635 1.00 32.42 C ATOM 1095 C PRO A 71 -3.539 -15.590 -0.866 1.00 23.02 C ATOM 1096 O PRO A 71 -4.734 -15.816 -0.651 1.00 41.01 O ATOM 1097 CB PRO A 71 -3.078 -18.055 -0.908 1.00 40.05 C ATOM 1098 CG PRO A 71 -2.509 -18.938 0.150 1.00 31.43 C ATOM 1099 CD PRO A 71 -2.293 -18.066 1.353 1.00 22.10 C ATOM 0 HA PRO A 71 -1.660 -16.404 -1.298 1.00 32.42 H new ATOM 0 HB2 PRO A 71 -4.167 -18.034 -0.860 1.00 40.05 H new ATOM 0 HB3 PRO A 71 -2.810 -18.409 -1.903 1.00 40.05 H new ATOM 0 HG2 PRO A 71 -3.190 -19.757 0.381 1.00 31.43 H new ATOM 0 HG3 PRO A 71 -1.571 -19.386 -0.180 1.00 31.43 H new ATOM 0 HD2 PRO A 71 -3.168 -18.053 2.003 1.00 22.10 H new ATOM 0 HD3 PRO A 71 -1.453 -18.412 1.956 1.00 22.10 H new ATOM 1107 N GLY A 72 -3.079 -14.414 -1.278 1.00 5.25 N ATOM 1108 CA GLY A 72 -3.976 -13.312 -1.582 1.00 61.23 C ATOM 1109 C GLY A 72 -4.793 -12.851 -0.388 1.00 42.44 C ATOM 1110 O GLY A 72 -5.888 -12.317 -0.554 1.00 54.15 O ATOM 0 H GLY A 72 -2.090 -14.202 -1.408 1.00 5.25 H new ATOM 0 HA2 GLY A 72 -3.393 -12.472 -1.959 1.00 61.23 H new ATOM 0 HA3 GLY A 72 -4.653 -13.614 -2.381 1.00 61.23 H new ATOM 1114 N LYS A 73 -4.276 -13.061 0.817 1.00 33.52 N ATOM 1115 CA LYS A 73 -4.972 -12.633 2.025 1.00 14.21 C ATOM 1116 C LYS A 73 -4.311 -11.389 2.599 1.00 2.01 C ATOM 1117 O LYS A 73 -4.849 -10.284 2.514 1.00 33.22 O ATOM 1118 CB LYS A 73 -4.975 -13.747 3.076 1.00 1.25 C ATOM 1119 CG LYS A 73 -5.639 -15.044 2.628 1.00 11.42 C ATOM 1120 CD LYS A 73 -7.164 -14.983 2.696 1.00 70.14 C ATOM 1121 CE LYS A 73 -7.763 -14.117 1.602 1.00 32.15 C ATOM 1122 NZ LYS A 73 -9.247 -14.181 1.603 1.00 12.40 N ATOM 0 H LYS A 73 -3.382 -13.523 0.984 1.00 33.52 H new ATOM 0 HA LYS A 73 -6.003 -12.403 1.758 1.00 14.21 H new ATOM 0 HB2 LYS A 73 -3.945 -13.962 3.361 1.00 1.25 H new ATOM 0 HB3 LYS A 73 -5.484 -13.384 3.969 1.00 1.25 H new ATOM 0 HG2 LYS A 73 -5.334 -15.269 1.606 1.00 11.42 H new ATOM 0 HG3 LYS A 73 -5.285 -15.863 3.254 1.00 11.42 H new ATOM 0 HD2 LYS A 73 -7.568 -15.992 2.618 1.00 70.14 H new ATOM 0 HD3 LYS A 73 -7.465 -14.594 3.668 1.00 70.14 H new ATOM 0 HE2 LYS A 73 -7.443 -13.084 1.739 1.00 32.15 H new ATOM 0 HE3 LYS A 73 -7.385 -14.442 0.633 1.00 32.15 H new ATOM 0 HZ1 LYS A 73 -9.621 -13.578 0.843 1.00 12.40 H new ATOM 0 HZ2 LYS A 73 -9.552 -15.163 1.447 1.00 12.40 H new ATOM 0 HZ3 LYS A 73 -9.608 -13.847 2.519 1.00 12.40 H new ATOM 1136 N ARG A 74 -3.137 -11.577 3.177 1.00 3.12 N ATOM 1137 CA ARG A 74 -2.362 -10.473 3.710 1.00 54.20 C ATOM 1138 C ARG A 74 -0.883 -10.797 3.618 1.00 51.01 C ATOM 1139 O ARG A 74 -0.464 -11.927 3.878 1.00 34.42 O ATOM 1140 CB ARG A 74 -2.754 -10.172 5.162 1.00 2.11 C ATOM 1141 CG ARG A 74 -2.582 -11.355 6.096 1.00 71.41 C ATOM 1142 CD ARG A 74 -3.088 -11.061 7.499 1.00 61.42 C ATOM 1143 NE ARG A 74 -2.151 -10.253 8.277 1.00 14.42 N ATOM 1144 CZ ARG A 74 -1.240 -10.772 9.103 1.00 21.22 C ATOM 1145 NH1 ARG A 74 -1.082 -12.090 9.179 1.00 2.33 N ATOM 1146 NH2 ARG A 74 -0.475 -9.971 9.840 1.00 42.14 N ATOM 0 H ARG A 74 -2.698 -12.491 3.289 1.00 3.12 H new ATOM 0 HA ARG A 74 -2.574 -9.583 3.117 1.00 54.20 H new ATOM 0 HB2 ARG A 74 -2.151 -9.341 5.527 1.00 2.11 H new ATOM 0 HB3 ARG A 74 -3.794 -9.847 5.189 1.00 2.11 H new ATOM 0 HG2 ARG A 74 -3.117 -12.215 5.692 1.00 71.41 H new ATOM 0 HG3 ARG A 74 -1.528 -11.628 6.142 1.00 71.41 H new ATOM 0 HD2 ARG A 74 -4.044 -10.541 7.435 1.00 61.42 H new ATOM 0 HD3 ARG A 74 -3.271 -12.001 8.020 1.00 61.42 H new ATOM 0 HE ARG A 74 -2.196 -9.238 8.184 1.00 14.42 H new ATOM 0 HH11 ARG A 74 -1.658 -12.707 8.605 1.00 2.33 H new ATOM 0 HH12 ARG A 74 -0.385 -12.485 9.811 1.00 2.33 H new ATOM 0 HH21 ARG A 74 -0.584 -8.959 9.774 1.00 42.14 H new ATOM 0 HH22 ARG A 74 0.221 -10.369 10.471 1.00 42.14 H new ATOM 1160 N ILE A 75 -0.107 -9.815 3.219 1.00 64.34 N ATOM 1161 CA ILE A 75 1.330 -9.960 3.140 1.00 63.21 C ATOM 1162 C ILE A 75 1.992 -8.906 4.011 1.00 33.23 C ATOM 1163 O ILE A 75 1.936 -7.712 3.718 1.00 61.12 O ATOM 1164 CB ILE A 75 1.849 -9.847 1.686 1.00 74.35 C ATOM 1165 CG1 ILE A 75 1.202 -10.922 0.804 1.00 20.24 C ATOM 1166 CG2 ILE A 75 3.367 -9.979 1.651 1.00 44.33 C ATOM 1167 CD1 ILE A 75 1.623 -10.855 -0.649 1.00 23.21 C ATOM 0 H ILE A 75 -0.452 -8.896 2.941 1.00 64.34 H new ATOM 0 HA ILE A 75 1.586 -10.957 3.498 1.00 63.21 H new ATOM 0 HB ILE A 75 1.577 -8.866 1.297 1.00 74.35 H new ATOM 0 HG12 ILE A 75 1.455 -11.905 1.201 1.00 20.24 H new ATOM 0 HG13 ILE A 75 0.118 -10.824 0.863 1.00 20.24 H new ATOM 0 HG21 ILE A 75 3.716 -9.897 0.622 1.00 44.33 H new ATOM 0 HG22 ILE A 75 3.815 -9.186 2.250 1.00 44.33 H new ATOM 0 HG23 ILE A 75 3.657 -10.948 2.057 1.00 44.33 H new ATOM 0 HD11 ILE A 75 1.124 -11.646 -1.209 1.00 23.21 H new ATOM 0 HD12 ILE A 75 1.345 -9.886 -1.064 1.00 23.21 H new ATOM 0 HD13 ILE A 75 2.703 -10.984 -0.721 1.00 23.21 H new ATOM 1179 N ALA A 76 2.589 -9.351 5.097 1.00 13.42 N ATOM 1180 CA ALA A 76 3.257 -8.453 6.015 1.00 32.23 C ATOM 1181 C ALA A 76 4.760 -8.562 5.830 1.00 72.44 C ATOM 1182 O ALA A 76 5.317 -9.661 5.883 1.00 3.53 O ATOM 1183 CB ALA A 76 2.853 -8.763 7.443 1.00 70.23 C ATOM 0 H ALA A 76 2.625 -10.334 5.366 1.00 13.42 H new ATOM 0 HA ALA A 76 2.957 -7.427 5.802 1.00 32.23 H new ATOM 0 HB1 ALA A 76 3.363 -8.080 8.122 1.00 70.23 H new ATOM 0 HB2 ALA A 76 1.775 -8.643 7.550 1.00 70.23 H new ATOM 0 HB3 ALA A 76 3.130 -9.789 7.685 1.00 70.23 H new ATOM 1189 N TRP A 77 5.411 -7.427 5.628 1.00 54.12 N ATOM 1190 CA TRP A 77 6.803 -7.418 5.211 1.00 24.40 C ATOM 1191 C TRP A 77 7.736 -7.653 6.383 1.00 22.24 C ATOM 1192 O TRP A 77 7.503 -7.186 7.501 1.00 43.10 O ATOM 1193 CB TRP A 77 7.143 -6.100 4.513 1.00 10.03 C ATOM 1194 CG TRP A 77 8.459 -6.111 3.797 1.00 61.31 C ATOM 1195 CD1 TRP A 77 8.698 -6.603 2.550 1.00 12.34 C ATOM 1196 CD2 TRP A 77 9.708 -5.597 4.273 1.00 2.52 C ATOM 1197 NE1 TRP A 77 10.016 -6.433 2.220 1.00 73.32 N ATOM 1198 CE2 TRP A 77 10.659 -5.819 3.259 1.00 63.41 C ATOM 1199 CE3 TRP A 77 10.115 -4.973 5.456 1.00 2.41 C ATOM 1200 CZ2 TRP A 77 11.991 -5.440 3.394 1.00 2.35 C ATOM 1201 CZ3 TRP A 77 11.438 -4.597 5.588 1.00 11.24 C ATOM 1202 CH2 TRP A 77 12.362 -4.830 4.561 1.00 3.12 C ATOM 0 H TRP A 77 4.998 -6.502 5.746 1.00 54.12 H new ATOM 0 HA TRP A 77 6.944 -8.237 4.505 1.00 24.40 H new ATOM 0 HB2 TRP A 77 6.354 -5.865 3.798 1.00 10.03 H new ATOM 0 HB3 TRP A 77 7.151 -5.300 5.253 1.00 10.03 H new ATOM 0 HD1 TRP A 77 7.955 -7.061 1.913 1.00 12.34 H new ATOM 0 HE1 TRP A 77 10.448 -6.718 1.341 1.00 73.32 H new ATOM 0 HE3 TRP A 77 9.409 -4.788 6.252 1.00 2.41 H new ATOM 0 HZ2 TRP A 77 12.707 -5.621 2.606 1.00 2.35 H new ATOM 0 HZ3 TRP A 77 11.765 -4.116 6.498 1.00 11.24 H new ATOM 0 HH2 TRP A 77 13.389 -4.522 4.693 1.00 3.12 H new ATOM 1213 N ARG A 78 8.805 -8.371 6.104 1.00 31.31 N ATOM 1214 CA ARG A 78 9.748 -8.775 7.121 1.00 33.13 C ATOM 1215 C ARG A 78 11.012 -9.289 6.448 1.00 65.40 C ATOM 1216 O ARG A 78 11.086 -9.356 5.222 1.00 53.41 O ATOM 1217 CB ARG A 78 9.136 -9.868 8.010 1.00 32.31 C ATOM 1218 CG ARG A 78 9.747 -9.954 9.401 1.00 42.24 C ATOM 1219 CD ARG A 78 9.092 -8.976 10.374 1.00 61.33 C ATOM 1220 NE ARG A 78 9.077 -7.602 9.867 1.00 24.34 N ATOM 1221 CZ ARG A 78 9.432 -6.534 10.585 1.00 22.43 C ATOM 1222 NH1 ARG A 78 9.774 -6.665 11.859 1.00 45.55 N ATOM 1223 NH2 ARG A 78 9.417 -5.329 10.034 1.00 22.30 N ATOM 0 H ARG A 78 9.042 -8.690 5.165 1.00 31.31 H new ATOM 0 HA ARG A 78 9.993 -7.920 7.751 1.00 33.13 H new ATOM 0 HB2 ARG A 78 8.066 -9.686 8.106 1.00 32.31 H new ATOM 0 HB3 ARG A 78 9.252 -10.832 7.514 1.00 32.31 H new ATOM 0 HG2 ARG A 78 9.641 -10.970 9.782 1.00 42.24 H new ATOM 0 HG3 ARG A 78 10.815 -9.746 9.341 1.00 42.24 H new ATOM 0 HD2 ARG A 78 8.070 -9.297 10.573 1.00 61.33 H new ATOM 0 HD3 ARG A 78 9.625 -9.003 11.324 1.00 61.33 H new ATOM 0 HE ARG A 78 8.776 -7.452 8.904 1.00 24.34 H new ATOM 0 HH11 ARG A 78 9.767 -7.586 12.297 1.00 45.55 H new ATOM 0 HH12 ARG A 78 10.044 -5.845 12.401 1.00 45.55 H new ATOM 0 HH21 ARG A 78 9.134 -5.217 9.060 1.00 22.30 H new ATOM 0 HH22 ARG A 78 9.688 -4.514 10.583 1.00 22.30 H new ATOM 1237 N SER A 79 12.009 -9.609 7.244 1.00 64.03 N ATOM 1238 CA SER A 79 13.224 -10.219 6.754 1.00 31.51 C ATOM 1239 C SER A 79 13.680 -11.257 7.766 1.00 35.10 C ATOM 1240 O SER A 79 13.175 -11.279 8.891 1.00 54.14 O ATOM 1241 CB SER A 79 14.301 -9.155 6.531 1.00 50.10 C ATOM 1242 OG SER A 79 13.848 -8.168 5.619 1.00 63.44 O ATOM 0 H SER A 79 11.999 -9.453 8.252 1.00 64.03 H new ATOM 0 HA SER A 79 13.042 -10.704 5.795 1.00 31.51 H new ATOM 0 HB2 SER A 79 14.560 -8.688 7.481 1.00 50.10 H new ATOM 0 HB3 SER A 79 15.208 -9.623 6.148 1.00 50.10 H new ATOM 0 HG SER A 79 14.549 -7.495 5.490 1.00 63.44 H new ATOM 1248 N LEU A 80 14.602 -12.123 7.369 1.00 44.24 N ATOM 1249 CA LEU A 80 15.103 -13.157 8.263 1.00 63.43 C ATOM 1250 C LEU A 80 15.758 -12.536 9.494 1.00 4.40 C ATOM 1251 O LEU A 80 16.282 -11.425 9.429 1.00 2.34 O ATOM 1252 CB LEU A 80 16.096 -14.057 7.526 1.00 12.04 C ATOM 1253 CG LEU A 80 15.492 -14.899 6.404 1.00 12.23 C ATOM 1254 CD1 LEU A 80 16.525 -15.840 5.828 1.00 13.02 C ATOM 1255 CD2 LEU A 80 14.294 -15.684 6.895 1.00 24.40 C ATOM 0 H LEU A 80 15.017 -12.130 6.437 1.00 44.24 H new ATOM 0 HA LEU A 80 14.261 -13.764 8.595 1.00 63.43 H new ATOM 0 HB2 LEU A 80 16.887 -13.434 7.108 1.00 12.04 H new ATOM 0 HB3 LEU A 80 16.565 -14.724 8.249 1.00 12.04 H new ATOM 0 HG LEU A 80 15.160 -14.218 5.621 1.00 12.23 H new ATOM 0 HD11 LEU A 80 16.075 -16.431 5.030 1.00 13.02 H new ATOM 0 HD12 LEU A 80 17.358 -15.264 5.426 1.00 13.02 H new ATOM 0 HD13 LEU A 80 16.888 -16.505 6.611 1.00 13.02 H new ATOM 0 HD21 LEU A 80 13.885 -16.274 6.075 1.00 24.40 H new ATOM 0 HD22 LEU A 80 14.601 -16.349 7.703 1.00 24.40 H new ATOM 0 HD23 LEU A 80 13.533 -14.995 7.261 1.00 24.40 H new ATOM 1267 N PRO A 81 15.724 -13.245 10.635 1.00 33.14 N ATOM 1268 CA PRO A 81 16.284 -12.752 11.904 1.00 23.11 C ATOM 1269 C PRO A 81 17.780 -12.442 11.812 1.00 50.53 C ATOM 1270 O PRO A 81 18.312 -11.659 12.607 1.00 33.53 O ATOM 1271 CB PRO A 81 16.036 -13.906 12.881 1.00 71.14 C ATOM 1272 CG PRO A 81 14.940 -14.709 12.269 1.00 23.23 C ATOM 1273 CD PRO A 81 15.124 -14.583 10.786 1.00 54.54 C ATOM 0 HA PRO A 81 15.822 -11.812 12.206 1.00 23.11 H new ATOM 0 HB2 PRO A 81 16.935 -14.507 13.017 1.00 71.14 H new ATOM 0 HB3 PRO A 81 15.749 -13.534 13.865 1.00 71.14 H new ATOM 0 HG2 PRO A 81 14.996 -15.751 12.583 1.00 23.23 H new ATOM 0 HG3 PRO A 81 13.963 -14.336 12.575 1.00 23.23 H new ATOM 0 HD2 PRO A 81 15.776 -15.363 10.393 1.00 54.54 H new ATOM 0 HD3 PRO A 81 14.176 -14.662 10.254 1.00 54.54 H new ATOM 1281 N GLY A 82 18.455 -13.060 10.845 1.00 22.42 N ATOM 1282 CA GLY A 82 19.862 -12.782 10.618 1.00 14.23 C ATOM 1283 C GLY A 82 20.072 -11.576 9.722 1.00 1.10 C ATOM 1284 O GLY A 82 21.202 -11.232 9.382 1.00 34.43 O ATOM 0 H GLY A 82 18.050 -13.751 10.213 1.00 22.42 H new ATOM 0 HA2 GLY A 82 20.356 -12.612 11.575 1.00 14.23 H new ATOM 0 HA3 GLY A 82 20.334 -13.654 10.166 1.00 14.23 H new ATOM 1288 N ALA A 83 18.976 -10.938 9.336 1.00 64.45 N ATOM 1289 CA ALA A 83 19.030 -9.758 8.491 1.00 12.34 C ATOM 1290 C ALA A 83 18.640 -8.518 9.286 1.00 52.32 C ATOM 1291 O ALA A 83 18.524 -8.567 10.513 1.00 60.24 O ATOM 1292 CB ALA A 83 18.124 -9.930 7.279 1.00 71.44 C ATOM 0 H ALA A 83 18.032 -11.222 9.598 1.00 64.45 H new ATOM 0 HA ALA A 83 20.053 -9.629 8.137 1.00 12.34 H new ATOM 0 HB1 ALA A 83 18.176 -9.037 6.656 1.00 71.44 H new ATOM 0 HB2 ALA A 83 18.450 -10.795 6.701 1.00 71.44 H new ATOM 0 HB3 ALA A 83 17.097 -10.081 7.611 1.00 71.44 H new ATOM 1298 N ARG A 84 18.427 -7.413 8.590 1.00 3.13 N ATOM 1299 CA ARG A 84 18.165 -6.140 9.245 1.00 5.23 C ATOM 1300 C ARG A 84 16.725 -5.701 9.005 1.00 55.02 C ATOM 1301 O ARG A 84 16.312 -5.491 7.863 1.00 24.03 O ATOM 1302 CB ARG A 84 19.127 -5.076 8.716 1.00 11.41 C ATOM 1303 CG ARG A 84 20.523 -5.615 8.443 1.00 5.03 C ATOM 1304 CD ARG A 84 21.457 -4.534 7.931 1.00 52.10 C ATOM 1305 NE ARG A 84 22.020 -3.734 9.012 1.00 23.43 N ATOM 1306 CZ ARG A 84 22.408 -2.471 8.872 1.00 23.05 C ATOM 1307 NH1 ARG A 84 22.181 -1.826 7.732 1.00 42.22 N ATOM 1308 NH2 ARG A 84 22.995 -1.846 9.883 1.00 65.11 N ATOM 0 H ARG A 84 18.430 -7.371 7.571 1.00 3.13 H new ATOM 0 HA ARG A 84 18.317 -6.263 10.317 1.00 5.23 H new ATOM 0 HB2 ARG A 84 18.721 -4.653 7.797 1.00 11.41 H new ATOM 0 HB3 ARG A 84 19.193 -4.263 9.439 1.00 11.41 H new ATOM 0 HG2 ARG A 84 20.932 -6.044 9.358 1.00 5.03 H new ATOM 0 HG3 ARG A 84 20.464 -6.421 7.711 1.00 5.03 H new ATOM 0 HD2 ARG A 84 22.266 -4.994 7.363 1.00 52.10 H new ATOM 0 HD3 ARG A 84 20.915 -3.884 7.244 1.00 52.10 H new ATOM 0 HE ARG A 84 22.122 -4.169 9.929 1.00 23.43 H new ATOM 0 HH11 ARG A 84 21.708 -2.301 6.963 1.00 42.22 H new ATOM 0 HH12 ARG A 84 22.480 -0.856 7.626 1.00 42.22 H new ATOM 0 HH21 ARG A 84 23.148 -2.335 10.765 1.00 65.11 H new ATOM 0 HH22 ARG A 84 23.294 -0.876 9.779 1.00 65.11 H new ATOM 1322 N ILE A 85 15.963 -5.573 10.080 1.00 34.10 N ATOM 1323 CA ILE A 85 14.579 -5.126 9.983 1.00 51.13 C ATOM 1324 C ILE A 85 14.416 -3.726 10.568 1.00 72.32 C ATOM 1325 O ILE A 85 14.878 -3.442 11.676 1.00 24.53 O ATOM 1326 CB ILE A 85 13.605 -6.104 10.681 1.00 43.02 C ATOM 1327 CG1 ILE A 85 14.033 -6.367 12.130 1.00 62.31 C ATOM 1328 CG2 ILE A 85 13.527 -7.409 9.899 1.00 25.53 C ATOM 1329 CD1 ILE A 85 13.093 -7.278 12.890 1.00 12.04 C ATOM 0 H ILE A 85 16.278 -5.772 11.030 1.00 34.10 H new ATOM 0 HA ILE A 85 14.328 -5.101 8.923 1.00 51.13 H new ATOM 0 HB ILE A 85 12.616 -5.647 10.704 1.00 43.02 H new ATOM 0 HG12 ILE A 85 15.030 -6.808 12.130 1.00 62.31 H new ATOM 0 HG13 ILE A 85 14.105 -5.415 12.656 1.00 62.31 H new ATOM 0 HG21 ILE A 85 12.839 -8.092 10.398 1.00 25.53 H new ATOM 0 HG22 ILE A 85 13.170 -7.207 8.889 1.00 25.53 H new ATOM 0 HG23 ILE A 85 14.517 -7.863 9.850 1.00 25.53 H new ATOM 0 HD11 ILE A 85 13.463 -7.416 13.906 1.00 12.04 H new ATOM 0 HD12 ILE A 85 12.100 -6.830 12.923 1.00 12.04 H new ATOM 0 HD13 ILE A 85 13.039 -8.245 12.389 1.00 12.04 H new ATOM 1341 N GLU A 86 13.786 -2.843 9.804 1.00 64.02 N ATOM 1342 CA GLU A 86 13.570 -1.473 10.241 1.00 53.22 C ATOM 1343 C GLU A 86 12.117 -1.223 10.633 1.00 54.54 C ATOM 1344 O GLU A 86 11.748 -1.349 11.802 1.00 52.01 O ATOM 1345 CB GLU A 86 13.982 -0.492 9.143 1.00 63.11 C ATOM 1346 CG GLU A 86 15.483 -0.401 8.937 1.00 53.40 C ATOM 1347 CD GLU A 86 16.198 0.113 10.167 1.00 30.15 C ATOM 1348 OE1 GLU A 86 15.676 1.048 10.816 1.00 22.14 O ATOM 1349 OE2 GLU A 86 17.279 -0.414 10.499 1.00 22.21 O ATOM 0 H GLU A 86 13.416 -3.053 8.877 1.00 64.02 H new ATOM 0 HA GLU A 86 14.189 -1.315 11.124 1.00 53.22 H new ATOM 0 HB2 GLU A 86 13.513 -0.792 8.206 1.00 63.11 H new ATOM 0 HB3 GLU A 86 13.597 0.498 9.389 1.00 63.11 H new ATOM 0 HG2 GLU A 86 15.873 -1.385 8.677 1.00 53.40 H new ATOM 0 HG3 GLU A 86 15.693 0.258 8.095 1.00 53.40 H new ATOM 1356 N ASN A 87 11.290 -0.899 9.649 1.00 53.22 N ATOM 1357 CA ASN A 87 9.924 -0.460 9.909 1.00 54.25 C ATOM 1358 C ASN A 87 8.938 -1.612 9.794 1.00 44.44 C ATOM 1359 O ASN A 87 9.271 -2.681 9.284 1.00 43.43 O ATOM 1360 CB ASN A 87 9.531 0.661 8.939 1.00 53.31 C ATOM 1361 CG ASN A 87 10.413 1.889 9.067 1.00 20.23 C ATOM 1362 OD1 ASN A 87 10.922 2.200 10.146 1.00 51.23 O ATOM 1363 ND2 ASN A 87 10.596 2.599 7.966 1.00 45.21 N ATOM 0 H ASN A 87 11.541 -0.932 8.661 1.00 53.22 H new ATOM 0 HA ASN A 87 9.887 -0.082 10.931 1.00 54.25 H new ATOM 0 HB2 ASN A 87 9.585 0.286 7.917 1.00 53.31 H new ATOM 0 HB3 ASN A 87 8.494 0.944 9.120 1.00 53.31 H new ATOM 0 HD21 ASN A 87 11.176 3.438 7.990 1.00 45.21 H new ATOM 0 HD22 ASN A 87 10.157 2.308 7.093 1.00 45.21 H new ATOM 1370 N SER A 88 7.724 -1.389 10.277 1.00 34.35 N ATOM 1371 CA SER A 88 6.672 -2.388 10.210 1.00 73.14 C ATOM 1372 C SER A 88 5.683 -2.026 9.108 1.00 11.24 C ATOM 1373 O SER A 88 5.337 -0.853 8.939 1.00 20.03 O ATOM 1374 CB SER A 88 5.953 -2.488 11.557 1.00 62.43 C ATOM 1375 OG SER A 88 5.023 -3.558 11.569 1.00 52.02 O ATOM 0 H SER A 88 7.444 -0.516 10.723 1.00 34.35 H new ATOM 0 HA SER A 88 7.116 -3.357 9.981 1.00 73.14 H new ATOM 0 HB2 SER A 88 6.685 -2.631 12.352 1.00 62.43 H new ATOM 0 HB3 SER A 88 5.435 -1.552 11.765 1.00 62.43 H new ATOM 0 HG SER A 88 4.581 -3.597 12.443 1.00 52.02 H new ATOM 1381 N GLY A 89 5.242 -3.028 8.361 1.00 32.41 N ATOM 1382 CA GLY A 89 4.320 -2.796 7.271 1.00 32.41 C ATOM 1383 C GLY A 89 3.558 -4.048 6.893 1.00 32.33 C ATOM 1384 O GLY A 89 4.157 -5.105 6.680 1.00 1.45 O ATOM 0 H GLY A 89 5.509 -4.003 8.493 1.00 32.41 H new ATOM 0 HA2 GLY A 89 3.615 -2.014 7.554 1.00 32.41 H new ATOM 0 HA3 GLY A 89 4.870 -2.431 6.403 1.00 32.41 H new ATOM 1388 N GLU A 90 2.242 -3.932 6.818 1.00 64.33 N ATOM 1389 CA GLU A 90 1.391 -5.058 6.469 1.00 52.31 C ATOM 1390 C GLU A 90 0.448 -4.665 5.340 1.00 52.44 C ATOM 1391 O GLU A 90 -0.136 -3.580 5.361 1.00 21.03 O ATOM 1392 CB GLU A 90 0.585 -5.505 7.692 1.00 32.32 C ATOM 1393 CG GLU A 90 -0.201 -6.789 7.474 1.00 22.02 C ATOM 1394 CD GLU A 90 -1.078 -7.146 8.658 1.00 62.33 C ATOM 1395 OE1 GLU A 90 -0.604 -7.066 9.808 1.00 72.22 O ATOM 1396 OE2 GLU A 90 -2.243 -7.533 8.449 1.00 11.33 O ATOM 0 H GLU A 90 1.737 -3.064 6.995 1.00 64.33 H new ATOM 0 HA GLU A 90 2.017 -5.886 6.137 1.00 52.31 H new ATOM 0 HB2 GLU A 90 1.265 -5.645 8.532 1.00 32.32 H new ATOM 0 HB3 GLU A 90 -0.106 -4.710 7.970 1.00 32.32 H new ATOM 0 HG2 GLU A 90 -0.823 -6.683 6.585 1.00 22.02 H new ATOM 0 HG3 GLU A 90 0.493 -7.607 7.282 1.00 22.02 H new ATOM 1403 N VAL A 91 0.318 -5.531 4.348 1.00 35.12 N ATOM 1404 CA VAL A 91 -0.577 -5.278 3.233 1.00 23.54 C ATOM 1405 C VAL A 91 -1.702 -6.298 3.191 1.00 25.35 C ATOM 1406 O VAL A 91 -1.469 -7.503 3.235 1.00 62.32 O ATOM 1407 CB VAL A 91 0.168 -5.286 1.885 1.00 1.14 C ATOM 1408 CG1 VAL A 91 -0.808 -5.181 0.729 1.00 3.52 C ATOM 1409 CG2 VAL A 91 1.173 -4.153 1.838 1.00 24.25 C ATOM 0 H VAL A 91 0.822 -6.416 4.293 1.00 35.12 H new ATOM 0 HA VAL A 91 -0.997 -4.285 3.391 1.00 23.54 H new ATOM 0 HB VAL A 91 0.702 -6.232 1.791 1.00 1.14 H new ATOM 0 HG11 VAL A 91 -0.259 -5.189 -0.213 1.00 3.52 H new ATOM 0 HG12 VAL A 91 -1.495 -6.027 0.755 1.00 3.52 H new ATOM 0 HG13 VAL A 91 -1.372 -4.252 0.812 1.00 3.52 H new ATOM 0 HG21 VAL A 91 1.694 -4.168 0.881 1.00 24.25 H new ATOM 0 HG22 VAL A 91 0.654 -3.201 1.954 1.00 24.25 H new ATOM 0 HG23 VAL A 91 1.895 -4.273 2.646 1.00 24.25 H new ATOM 1419 N LEU A 92 -2.915 -5.796 3.112 1.00 35.22 N ATOM 1420 CA LEU A 92 -4.100 -6.637 3.021 1.00 74.55 C ATOM 1421 C LEU A 92 -4.621 -6.670 1.595 1.00 62.11 C ATOM 1422 O LEU A 92 -4.654 -5.646 0.919 1.00 52.11 O ATOM 1423 CB LEU A 92 -5.196 -6.117 3.951 1.00 34.15 C ATOM 1424 CG LEU A 92 -5.205 -6.705 5.364 1.00 74.22 C ATOM 1425 CD1 LEU A 92 -3.821 -6.671 5.984 1.00 11.11 C ATOM 1426 CD2 LEU A 92 -6.186 -5.941 6.235 1.00 22.21 C ATOM 0 H LEU A 92 -3.113 -4.795 3.109 1.00 35.22 H new ATOM 0 HA LEU A 92 -3.823 -7.647 3.323 1.00 74.55 H new ATOM 0 HB2 LEU A 92 -5.097 -5.034 4.029 1.00 34.15 H new ATOM 0 HB3 LEU A 92 -6.163 -6.316 3.489 1.00 34.15 H new ATOM 0 HG LEU A 92 -5.517 -7.747 5.296 1.00 74.22 H new ATOM 0 HD11 LEU A 92 -3.861 -7.096 6.987 1.00 11.11 H new ATOM 0 HD12 LEU A 92 -3.133 -7.253 5.371 1.00 11.11 H new ATOM 0 HD13 LEU A 92 -3.473 -5.640 6.040 1.00 11.11 H new ATOM 0 HD21 LEU A 92 -6.187 -6.365 7.239 1.00 22.21 H new ATOM 0 HD22 LEU A 92 -5.890 -4.893 6.284 1.00 22.21 H new ATOM 0 HD23 LEU A 92 -7.186 -6.016 5.808 1.00 22.21 H new ATOM 1438 N PHE A 93 -5.020 -7.844 1.140 1.00 31.45 N ATOM 1439 CA PHE A 93 -5.633 -7.974 -0.169 1.00 32.11 C ATOM 1440 C PHE A 93 -7.070 -8.435 -0.017 1.00 52.43 C ATOM 1441 O PHE A 93 -7.338 -9.589 0.317 1.00 32.42 O ATOM 1442 CB PHE A 93 -4.848 -8.948 -1.048 1.00 23.32 C ATOM 1443 CG PHE A 93 -3.470 -8.460 -1.387 1.00 72.21 C ATOM 1444 CD1 PHE A 93 -3.289 -7.482 -2.350 1.00 62.21 C ATOM 1445 CD2 PHE A 93 -2.357 -8.978 -0.746 1.00 60.54 C ATOM 1446 CE1 PHE A 93 -2.024 -7.028 -2.665 1.00 21.11 C ATOM 1447 CE2 PHE A 93 -1.091 -8.528 -1.058 1.00 22.24 C ATOM 1448 CZ PHE A 93 -0.925 -7.551 -2.020 1.00 14.21 C ATOM 0 H PHE A 93 -4.931 -8.719 1.656 1.00 31.45 H new ATOM 0 HA PHE A 93 -5.620 -7.000 -0.658 1.00 32.11 H new ATOM 0 HB2 PHE A 93 -4.771 -9.908 -0.537 1.00 23.32 H new ATOM 0 HB3 PHE A 93 -5.402 -9.122 -1.970 1.00 23.32 H new ATOM 0 HD1 PHE A 93 -4.147 -7.070 -2.860 1.00 62.21 H new ATOM 0 HD2 PHE A 93 -2.482 -9.743 0.006 1.00 60.54 H new ATOM 0 HE1 PHE A 93 -1.896 -6.263 -3.417 1.00 21.11 H new ATOM 0 HE2 PHE A 93 -0.231 -8.939 -0.551 1.00 22.24 H new ATOM 0 HZ PHE A 93 0.065 -7.197 -2.266 1.00 14.21 H new ATOM 1458 N ARG A 94 -7.997 -7.526 -0.236 1.00 3.44 N ATOM 1459 CA ARG A 94 -9.404 -7.837 -0.085 1.00 51.12 C ATOM 1460 C ARG A 94 -10.162 -7.524 -1.366 1.00 25.22 C ATOM 1461 O ARG A 94 -9.823 -6.573 -2.079 1.00 22.30 O ATOM 1462 CB ARG A 94 -9.996 -7.067 1.104 1.00 12.20 C ATOM 1463 CG ARG A 94 -9.842 -5.554 1.016 1.00 12.42 C ATOM 1464 CD ARG A 94 -10.490 -4.861 2.204 1.00 33.03 C ATOM 1465 NE ARG A 94 -10.710 -3.442 1.945 1.00 14.23 N ATOM 1466 CZ ARG A 94 -11.754 -2.749 2.405 1.00 52.31 C ATOM 1467 NH1 ARG A 94 -12.620 -3.303 3.245 1.00 2.41 N ATOM 1468 NH2 ARG A 94 -11.907 -1.483 2.043 1.00 51.52 N ATOM 0 H ARG A 94 -7.802 -6.566 -0.519 1.00 3.44 H new ATOM 0 HA ARG A 94 -9.505 -8.904 0.114 1.00 51.12 H new ATOM 0 HB2 ARG A 94 -11.056 -7.308 1.185 1.00 12.20 H new ATOM 0 HB3 ARG A 94 -9.519 -7.415 2.020 1.00 12.20 H new ATOM 0 HG2 ARG A 94 -8.784 -5.296 0.975 1.00 12.42 H new ATOM 0 HG3 ARG A 94 -10.294 -5.194 0.092 1.00 12.42 H new ATOM 0 HD2 ARG A 94 -11.442 -5.342 2.431 1.00 33.03 H new ATOM 0 HD3 ARG A 94 -9.856 -4.977 3.083 1.00 33.03 H new ATOM 0 HE ARG A 94 -10.022 -2.948 1.376 1.00 14.23 H new ATOM 0 HH11 ARG A 94 -12.492 -4.269 3.546 1.00 2.41 H new ATOM 0 HH12 ARG A 94 -13.414 -2.763 3.589 1.00 2.41 H new ATOM 0 HH21 ARG A 94 -11.230 -1.046 1.418 1.00 51.52 H new ATOM 0 HH22 ARG A 94 -12.702 -0.946 2.390 1.00 51.52 H new ATOM 1482 N PRO A 95 -11.176 -8.341 -1.693 1.00 21.43 N ATOM 1483 CA PRO A 95 -12.038 -8.104 -2.850 1.00 54.34 C ATOM 1484 C PRO A 95 -12.740 -6.756 -2.744 1.00 33.03 C ATOM 1485 O PRO A 95 -13.391 -6.462 -1.741 1.00 20.13 O ATOM 1486 CB PRO A 95 -13.055 -9.253 -2.802 1.00 52.14 C ATOM 1487 CG PRO A 95 -12.968 -9.802 -1.418 1.00 43.21 C ATOM 1488 CD PRO A 95 -11.560 -9.560 -0.962 1.00 3.24 C ATOM 0 HA PRO A 95 -11.479 -8.077 -3.785 1.00 54.34 H new ATOM 0 HB2 PRO A 95 -14.061 -8.896 -3.020 1.00 52.14 H new ATOM 0 HB3 PRO A 95 -12.820 -10.017 -3.543 1.00 52.14 H new ATOM 0 HG2 PRO A 95 -13.682 -9.309 -0.758 1.00 43.21 H new ATOM 0 HG3 PRO A 95 -13.204 -10.866 -1.405 1.00 43.21 H new ATOM 0 HD2 PRO A 95 -11.505 -9.417 0.117 1.00 3.24 H new ATOM 0 HD3 PRO A 95 -10.908 -10.398 -1.206 1.00 3.24 H new ATOM 1496 N ALA A 96 -12.598 -5.933 -3.770 1.00 1.02 N ATOM 1497 CA ALA A 96 -13.143 -4.590 -3.733 1.00 71.11 C ATOM 1498 C ALA A 96 -14.633 -4.592 -4.038 1.00 33.04 C ATOM 1499 O ALA A 96 -15.101 -5.367 -4.875 1.00 23.22 O ATOM 1500 CB ALA A 96 -12.412 -3.709 -4.724 1.00 14.44 C ATOM 0 H ALA A 96 -12.112 -6.172 -4.634 1.00 1.02 H new ATOM 0 HA ALA A 96 -13.005 -4.195 -2.727 1.00 71.11 H new ATOM 0 HB1 ALA A 96 -12.827 -2.702 -4.690 1.00 14.44 H new ATOM 0 HB2 ALA A 96 -11.353 -3.674 -4.468 1.00 14.44 H new ATOM 0 HB3 ALA A 96 -12.529 -4.116 -5.728 1.00 14.44 H new ATOM 1506 N PRO A 97 -15.393 -3.716 -3.365 1.00 51.12 N ATOM 1507 CA PRO A 97 -16.821 -3.541 -3.628 1.00 21.12 C ATOM 1508 C PRO A 97 -17.063 -2.981 -5.022 1.00 22.25 C ATOM 1509 O PRO A 97 -16.179 -2.358 -5.611 1.00 61.24 O ATOM 1510 CB PRO A 97 -17.270 -2.536 -2.562 1.00 0.45 C ATOM 1511 CG PRO A 97 -16.026 -1.833 -2.144 1.00 32.41 C ATOM 1512 CD PRO A 97 -14.921 -2.838 -2.281 1.00 45.30 C ATOM 0 HA PRO A 97 -17.367 -4.483 -3.586 1.00 21.12 H new ATOM 0 HB2 PRO A 97 -18.003 -1.836 -2.964 1.00 0.45 H new ATOM 0 HB3 PRO A 97 -17.741 -3.040 -1.718 1.00 0.45 H new ATOM 0 HG2 PRO A 97 -15.841 -0.961 -2.771 1.00 32.41 H new ATOM 0 HG3 PRO A 97 -16.105 -1.477 -1.117 1.00 32.41 H new ATOM 0 HD2 PRO A 97 -13.973 -2.362 -2.533 1.00 45.30 H new ATOM 0 HD3 PRO A 97 -14.764 -3.391 -1.355 1.00 45.30 H new ATOM 1520 N GLY A 98 -18.251 -3.221 -5.554 1.00 72.44 N ATOM 1521 CA GLY A 98 -18.592 -2.722 -6.874 1.00 4.44 C ATOM 1522 C GLY A 98 -17.731 -3.319 -7.973 1.00 71.32 C ATOM 1523 O GLY A 98 -17.614 -2.739 -9.054 1.00 44.53 O ATOM 0 H GLY A 98 -18.989 -3.754 -5.095 1.00 72.44 H new ATOM 0 HA2 GLY A 98 -19.639 -2.942 -7.080 1.00 4.44 H new ATOM 0 HA3 GLY A 98 -18.486 -1.637 -6.885 1.00 4.44 H new ATOM 1527 N ALA A 99 -17.120 -4.470 -7.687 1.00 55.41 N ATOM 1528 CA ALA A 99 -16.298 -5.190 -8.659 1.00 4.12 C ATOM 1529 C ALA A 99 -15.141 -4.334 -9.177 1.00 2.11 C ATOM 1530 O ALA A 99 -14.720 -4.478 -10.326 1.00 34.34 O ATOM 1531 CB ALA A 99 -17.159 -5.670 -9.818 1.00 63.21 C ATOM 0 H ALA A 99 -17.181 -4.928 -6.777 1.00 55.41 H new ATOM 0 HA ALA A 99 -15.864 -6.050 -8.150 1.00 4.12 H new ATOM 0 HB1 ALA A 99 -16.537 -6.205 -10.536 1.00 63.21 H new ATOM 0 HB2 ALA A 99 -17.935 -6.337 -9.443 1.00 63.21 H new ATOM 0 HB3 ALA A 99 -17.622 -4.813 -10.307 1.00 63.21 H new ATOM 1537 N ARG A 100 -14.611 -3.460 -8.324 1.00 64.45 N ATOM 1538 CA ARG A 100 -13.502 -2.590 -8.715 1.00 31.43 C ATOM 1539 C ARG A 100 -12.219 -3.391 -8.929 1.00 40.14 C ATOM 1540 O ARG A 100 -11.285 -2.925 -9.582 1.00 21.55 O ATOM 1541 CB ARG A 100 -13.264 -1.506 -7.658 1.00 40.04 C ATOM 1542 CG ARG A 100 -14.463 -0.600 -7.424 1.00 64.24 C ATOM 1543 CD ARG A 100 -14.913 0.076 -8.707 1.00 22.50 C ATOM 1544 NE ARG A 100 -16.097 0.903 -8.500 1.00 32.11 N ATOM 1545 CZ ARG A 100 -17.081 1.030 -9.388 1.00 0.02 C ATOM 1546 NH1 ARG A 100 -17.029 0.372 -10.542 1.00 50.32 N ATOM 1547 NH2 ARG A 100 -18.121 1.806 -9.120 1.00 21.53 N ATOM 0 H ARG A 100 -14.929 -3.335 -7.363 1.00 64.45 H new ATOM 0 HA ARG A 100 -13.775 -2.115 -9.657 1.00 31.43 H new ATOM 0 HB2 ARG A 100 -12.993 -1.984 -6.717 1.00 40.04 H new ATOM 0 HB3 ARG A 100 -12.414 -0.896 -7.963 1.00 40.04 H new ATOM 0 HG2 ARG A 100 -15.286 -1.184 -7.012 1.00 64.24 H new ATOM 0 HG3 ARG A 100 -14.208 0.158 -6.683 1.00 64.24 H new ATOM 0 HD2 ARG A 100 -14.103 0.693 -9.096 1.00 22.50 H new ATOM 0 HD3 ARG A 100 -15.127 -0.682 -9.461 1.00 22.50 H new ATOM 0 HE ARG A 100 -16.176 1.415 -7.621 1.00 32.11 H new ATOM 0 HH11 ARG A 100 -16.234 -0.232 -10.749 1.00 50.32 H new ATOM 0 HH12 ARG A 100 -17.784 0.471 -11.220 1.00 50.32 H new ATOM 0 HH21 ARG A 100 -18.168 2.307 -8.233 1.00 21.53 H new ATOM 0 HH22 ARG A 100 -18.874 1.903 -9.801 1.00 21.53 H new ATOM 1561 N GLY A 101 -12.184 -4.595 -8.377 1.00 44.15 N ATOM 1562 CA GLY A 101 -11.015 -5.439 -8.494 1.00 73.31 C ATOM 1563 C GLY A 101 -10.554 -5.929 -7.141 1.00 52.53 C ATOM 1564 O GLY A 101 -11.366 -6.387 -6.333 1.00 62.43 O ATOM 0 H GLY A 101 -12.952 -5.004 -7.846 1.00 44.15 H new ATOM 0 HA2 GLY A 101 -11.242 -6.292 -9.134 1.00 73.31 H new ATOM 0 HA3 GLY A 101 -10.210 -4.884 -8.976 1.00 73.31 H new ATOM 1568 N THR A 102 -9.263 -5.832 -6.886 1.00 54.10 N ATOM 1569 CA THR A 102 -8.719 -6.203 -5.596 1.00 53.14 C ATOM 1570 C THR A 102 -8.066 -4.987 -4.950 1.00 60.43 C ATOM 1571 O THR A 102 -7.322 -4.254 -5.605 1.00 1.54 O ATOM 1572 CB THR A 102 -7.696 -7.350 -5.731 1.00 14.33 C ATOM 1573 OG1 THR A 102 -8.297 -8.457 -6.421 1.00 53.53 O ATOM 1574 CG2 THR A 102 -7.202 -7.812 -4.367 1.00 23.53 C ATOM 0 H THR A 102 -8.571 -5.499 -7.557 1.00 54.10 H new ATOM 0 HA THR A 102 -9.534 -6.557 -4.965 1.00 53.14 H new ATOM 0 HB THR A 102 -6.843 -6.977 -6.298 1.00 14.33 H new ATOM 0 HG1 THR A 102 -7.641 -9.179 -6.516 1.00 53.53 H new ATOM 0 HG21 THR A 102 -6.483 -8.621 -4.495 1.00 23.53 H new ATOM 0 HG22 THR A 102 -6.723 -6.979 -3.852 1.00 23.53 H new ATOM 0 HG23 THR A 102 -8.046 -8.167 -3.776 1.00 23.53 H new ATOM 1582 N GLU A 103 -8.367 -4.755 -3.683 1.00 34.32 N ATOM 1583 CA GLU A 103 -7.832 -3.604 -2.985 1.00 23.42 C ATOM 1584 C GLU A 103 -6.591 -3.989 -2.194 1.00 15.23 C ATOM 1585 O GLU A 103 -6.652 -4.824 -1.289 1.00 43.43 O ATOM 1586 CB GLU A 103 -8.888 -2.999 -2.053 1.00 54.30 C ATOM 1587 CG GLU A 103 -8.458 -1.683 -1.430 1.00 53.53 C ATOM 1588 CD GLU A 103 -9.506 -1.095 -0.509 1.00 24.05 C ATOM 1589 OE1 GLU A 103 -9.495 -1.421 0.695 1.00 35.24 O ATOM 1590 OE2 GLU A 103 -10.340 -0.297 -0.985 1.00 14.20 O ATOM 0 H GLU A 103 -8.977 -5.348 -3.121 1.00 34.32 H new ATOM 0 HA GLU A 103 -7.554 -2.855 -3.726 1.00 23.42 H new ATOM 0 HB2 GLU A 103 -9.810 -2.843 -2.613 1.00 54.30 H new ATOM 0 HB3 GLU A 103 -9.113 -3.712 -1.260 1.00 54.30 H new ATOM 0 HG2 GLU A 103 -7.535 -1.836 -0.870 1.00 53.53 H new ATOM 0 HG3 GLU A 103 -8.235 -0.968 -2.222 1.00 53.53 H new ATOM 1597 N VAL A 104 -5.467 -3.394 -2.565 1.00 1.31 N ATOM 1598 CA VAL A 104 -4.224 -3.571 -1.831 1.00 31.13 C ATOM 1599 C VAL A 104 -4.134 -2.527 -0.721 1.00 41.42 C ATOM 1600 O VAL A 104 -3.896 -1.339 -0.962 1.00 71.43 O ATOM 1601 CB VAL A 104 -2.987 -3.520 -2.771 1.00 22.13 C ATOM 1602 CG1 VAL A 104 -3.093 -2.383 -3.767 1.00 15.10 C ATOM 1603 CG2 VAL A 104 -1.696 -3.401 -1.976 1.00 61.30 C ATOM 0 H VAL A 104 -5.391 -2.780 -3.376 1.00 1.31 H new ATOM 0 HA VAL A 104 -4.224 -4.563 -1.379 1.00 31.13 H new ATOM 0 HB VAL A 104 -2.967 -4.458 -3.325 1.00 22.13 H new ATOM 0 HG11 VAL A 104 -2.211 -2.377 -4.408 1.00 15.10 H new ATOM 0 HG12 VAL A 104 -3.985 -2.517 -4.378 1.00 15.10 H new ATOM 0 HG13 VAL A 104 -3.159 -1.436 -3.232 1.00 15.10 H new ATOM 0 HG21 VAL A 104 -0.849 -3.368 -2.661 1.00 61.30 H new ATOM 0 HG22 VAL A 104 -1.718 -2.488 -1.381 1.00 61.30 H new ATOM 0 HG23 VAL A 104 -1.595 -4.262 -1.315 1.00 61.30 H new ATOM 1613 N VAL A 105 -4.381 -2.990 0.492 1.00 71.53 N ATOM 1614 CA VAL A 105 -4.440 -2.134 1.662 1.00 11.43 C ATOM 1615 C VAL A 105 -3.065 -2.048 2.312 1.00 25.22 C ATOM 1616 O VAL A 105 -2.578 -3.021 2.883 1.00 33.21 O ATOM 1617 CB VAL A 105 -5.456 -2.685 2.687 1.00 62.00 C ATOM 1618 CG1 VAL A 105 -5.714 -1.687 3.800 1.00 24.21 C ATOM 1619 CG2 VAL A 105 -6.760 -3.070 1.999 1.00 44.13 C ATOM 0 H VAL A 105 -4.547 -3.976 0.693 1.00 71.53 H new ATOM 0 HA VAL A 105 -4.759 -1.141 1.345 1.00 11.43 H new ATOM 0 HB VAL A 105 -5.024 -3.580 3.135 1.00 62.00 H new ATOM 0 HG11 VAL A 105 -6.433 -2.105 4.504 1.00 24.21 H new ATOM 0 HG12 VAL A 105 -4.780 -1.472 4.320 1.00 24.21 H new ATOM 0 HG13 VAL A 105 -6.114 -0.766 3.377 1.00 24.21 H new ATOM 0 HG21 VAL A 105 -7.462 -3.456 2.739 1.00 44.13 H new ATOM 0 HG22 VAL A 105 -7.189 -2.193 1.515 1.00 44.13 H new ATOM 0 HG23 VAL A 105 -6.564 -3.838 1.250 1.00 44.13 H new ATOM 1629 N VAL A 106 -2.446 -0.885 2.217 1.00 40.15 N ATOM 1630 CA VAL A 106 -1.089 -0.698 2.709 1.00 30.33 C ATOM 1631 C VAL A 106 -1.085 -0.003 4.068 1.00 3.20 C ATOM 1632 O VAL A 106 -1.548 1.130 4.198 1.00 23.10 O ATOM 1633 CB VAL A 106 -0.239 0.125 1.714 1.00 33.12 C ATOM 1634 CG1 VAL A 106 1.197 0.253 2.203 1.00 23.15 C ATOM 1635 CG2 VAL A 106 -0.281 -0.500 0.326 1.00 14.23 C ATOM 0 H VAL A 106 -2.862 -0.051 1.802 1.00 40.15 H new ATOM 0 HA VAL A 106 -0.650 -1.690 2.814 1.00 30.33 H new ATOM 0 HB VAL A 106 -0.666 1.126 1.652 1.00 33.12 H new ATOM 0 HG11 VAL A 106 1.775 0.836 1.486 1.00 23.15 H new ATOM 0 HG12 VAL A 106 1.208 0.754 3.171 1.00 23.15 H new ATOM 0 HG13 VAL A 106 1.637 -0.739 2.303 1.00 23.15 H new ATOM 0 HG21 VAL A 106 0.323 0.094 -0.359 1.00 14.23 H new ATOM 0 HG22 VAL A 106 0.114 -1.515 0.372 1.00 14.23 H new ATOM 0 HG23 VAL A 106 -1.311 -0.528 -0.030 1.00 14.23 H new ATOM 1645 N ARG A 107 -0.574 -0.698 5.072 1.00 22.43 N ATOM 1646 CA ARG A 107 -0.418 -0.133 6.402 1.00 13.20 C ATOM 1647 C ARG A 107 1.052 -0.181 6.807 1.00 75.11 C ATOM 1648 O ARG A 107 1.555 -1.222 7.229 1.00 4.22 O ATOM 1649 CB ARG A 107 -1.277 -0.915 7.400 1.00 31.44 C ATOM 1650 CG ARG A 107 -1.275 -0.352 8.811 1.00 74.21 C ATOM 1651 CD ARG A 107 -2.047 -1.256 9.756 1.00 65.24 C ATOM 1652 NE ARG A 107 -2.166 -0.689 11.100 1.00 60.42 N ATOM 1653 CZ ARG A 107 -2.428 -1.412 12.191 1.00 73.22 C ATOM 1654 NH1 ARG A 107 -2.525 -2.734 12.112 1.00 63.30 N ATOM 1655 NH2 ARG A 107 -2.579 -0.818 13.370 1.00 2.33 N ATOM 0 H ARG A 107 -0.257 -1.664 4.989 1.00 22.43 H new ATOM 0 HA ARG A 107 -0.748 0.906 6.400 1.00 13.20 H new ATOM 0 HB2 ARG A 107 -2.303 -0.941 7.034 1.00 31.44 H new ATOM 0 HB3 ARG A 107 -0.925 -1.946 7.433 1.00 31.44 H new ATOM 0 HG2 ARG A 107 -0.249 -0.244 9.162 1.00 74.21 H new ATOM 0 HG3 ARG A 107 -1.719 0.644 8.810 1.00 74.21 H new ATOM 0 HD2 ARG A 107 -3.043 -1.434 9.351 1.00 65.24 H new ATOM 0 HD3 ARG A 107 -1.549 -2.224 9.816 1.00 65.24 H new ATOM 0 HE ARG A 107 -2.041 0.317 11.209 1.00 60.42 H new ATOM 0 HH11 ARG A 107 -2.399 -3.202 11.214 1.00 63.30 H new ATOM 0 HH12 ARG A 107 -2.725 -3.282 12.949 1.00 63.30 H new ATOM 0 HH21 ARG A 107 -2.495 0.196 13.445 1.00 2.33 H new ATOM 0 HH22 ARG A 107 -2.779 -1.376 14.200 1.00 2.33 H new ATOM 1669 N LEU A 108 1.747 0.938 6.652 1.00 34.10 N ATOM 1670 CA LEU A 108 3.182 0.985 6.907 1.00 3.11 C ATOM 1671 C LEU A 108 3.537 2.280 7.636 1.00 41.30 C ATOM 1672 O LEU A 108 3.028 3.348 7.296 1.00 61.44 O ATOM 1673 CB LEU A 108 3.937 0.884 5.572 1.00 70.20 C ATOM 1674 CG LEU A 108 5.301 0.179 5.610 1.00 33.23 C ATOM 1675 CD1 LEU A 108 5.774 -0.126 4.198 1.00 34.35 C ATOM 1676 CD2 LEU A 108 6.340 1.024 6.326 1.00 73.21 C ATOM 0 H LEU A 108 1.342 1.825 6.351 1.00 34.10 H new ATOM 0 HA LEU A 108 3.473 0.147 7.540 1.00 3.11 H new ATOM 0 HB2 LEU A 108 3.301 0.359 4.859 1.00 70.20 H new ATOM 0 HB3 LEU A 108 4.084 1.893 5.186 1.00 70.20 H new ATOM 0 HG LEU A 108 5.178 -0.753 6.162 1.00 33.23 H new ATOM 0 HD11 LEU A 108 6.742 -0.626 4.238 1.00 34.35 H new ATOM 0 HD12 LEU A 108 5.051 -0.775 3.704 1.00 34.35 H new ATOM 0 HD13 LEU A 108 5.869 0.804 3.637 1.00 34.35 H new ATOM 0 HD21 LEU A 108 7.294 0.497 6.336 1.00 73.21 H new ATOM 0 HD22 LEU A 108 6.456 1.975 5.806 1.00 73.21 H new ATOM 0 HD23 LEU A 108 6.017 1.207 7.351 1.00 73.21 H new ATOM 1688 N THR A 109 4.399 2.189 8.639 1.00 0.32 N ATOM 1689 CA THR A 109 4.765 3.356 9.429 1.00 52.42 C ATOM 1690 C THR A 109 5.891 4.148 8.760 1.00 34.12 C ATOM 1691 O THR A 109 6.827 3.578 8.197 1.00 54.34 O ATOM 1692 CB THR A 109 5.171 2.953 10.866 1.00 65.13 C ATOM 1693 OG1 THR A 109 5.464 4.114 11.658 1.00 44.11 O ATOM 1694 CG2 THR A 109 6.377 2.025 10.862 1.00 43.40 C ATOM 0 H THR A 109 4.856 1.323 8.924 1.00 0.32 H new ATOM 0 HA THR A 109 3.886 3.997 9.489 1.00 52.42 H new ATOM 0 HB THR A 109 4.325 2.423 11.304 1.00 65.13 H new ATOM 0 HG1 THR A 109 5.717 3.837 12.563 1.00 44.11 H new ATOM 0 HG21 THR A 109 6.636 1.761 11.887 1.00 43.40 H new ATOM 0 HG22 THR A 109 6.138 1.120 10.304 1.00 43.40 H new ATOM 0 HG23 THR A 109 7.222 2.528 10.392 1.00 43.40 H new ATOM 1702 N TYR A 110 5.778 5.466 8.812 1.00 41.21 N ATOM 1703 CA TYR A 110 6.751 6.354 8.199 1.00 11.33 C ATOM 1704 C TYR A 110 7.002 7.562 9.091 1.00 42.43 C ATOM 1705 O TYR A 110 6.418 7.689 10.167 1.00 71.34 O ATOM 1706 CB TYR A 110 6.263 6.837 6.829 1.00 31.15 C ATOM 1707 CG TYR A 110 6.384 5.814 5.720 1.00 54.53 C ATOM 1708 CD1 TYR A 110 7.564 5.691 4.998 1.00 3.40 C ATOM 1709 CD2 TYR A 110 5.318 4.990 5.379 1.00 75.21 C ATOM 1710 CE1 TYR A 110 7.682 4.775 3.971 1.00 14.10 C ATOM 1711 CE2 TYR A 110 5.429 4.070 4.356 1.00 64.51 C ATOM 1712 CZ TYR A 110 6.612 3.968 3.654 1.00 73.01 C ATOM 1713 OH TYR A 110 6.725 3.054 2.630 1.00 2.03 O ATOM 0 H TYR A 110 5.011 5.949 9.280 1.00 41.21 H new ATOM 0 HA TYR A 110 7.677 5.794 8.071 1.00 11.33 H new ATOM 0 HB2 TYR A 110 5.219 7.138 6.915 1.00 31.15 H new ATOM 0 HB3 TYR A 110 6.829 7.726 6.549 1.00 31.15 H new ATOM 0 HD1 TYR A 110 8.405 6.323 5.244 1.00 3.40 H new ATOM 0 HD2 TYR A 110 4.388 5.071 5.923 1.00 75.21 H new ATOM 0 HE1 TYR A 110 8.607 4.692 3.420 1.00 14.10 H new ATOM 0 HE2 TYR A 110 4.593 3.433 4.106 1.00 64.51 H new ATOM 0 HH TYR A 110 7.656 2.757 2.558 1.00 2.03 H new ATOM 1782 N GLY A 115 9.769 19.705 9.553 1.00 52.51 N ATOM 1783 CA GLY A 115 10.128 21.088 9.330 1.00 32.10 C ATOM 1784 C GLY A 115 8.981 21.913 8.790 1.00 60.22 C ATOM 1785 O GLY A 115 7.813 21.602 9.028 1.00 42.33 O ATOM 0 HA2 GLY A 115 10.473 21.524 10.267 1.00 32.10 H new ATOM 0 HA3 GLY A 115 10.963 21.133 8.631 1.00 32.10 H new ATOM 1789 N SER A 116 9.328 22.946 8.035 1.00 14.30 N ATOM 1790 CA SER A 116 8.365 23.913 7.517 1.00 22.24 C ATOM 1791 C SER A 116 7.341 23.257 6.582 1.00 62.11 C ATOM 1792 O SER A 116 6.231 23.763 6.414 1.00 51.22 O ATOM 1793 CB SER A 116 9.127 25.004 6.765 1.00 50.51 C ATOM 1794 OG SER A 116 10.367 25.284 7.399 1.00 33.14 O ATOM 0 H SER A 116 10.291 23.140 7.762 1.00 14.30 H new ATOM 0 HA SER A 116 7.813 24.336 8.356 1.00 22.24 H new ATOM 0 HB2 SER A 116 9.303 24.688 5.737 1.00 50.51 H new ATOM 0 HB3 SER A 116 8.523 25.911 6.721 1.00 50.51 H new ATOM 0 HG SER A 116 10.839 25.983 6.900 1.00 33.14 H new ATOM 1800 N ALA A 117 7.720 22.121 5.994 1.00 21.11 N ATOM 1801 CA ALA A 117 6.875 21.419 5.029 1.00 54.40 C ATOM 1802 C ALA A 117 5.501 21.091 5.611 1.00 0.15 C ATOM 1803 O ALA A 117 4.478 21.270 4.951 1.00 3.42 O ATOM 1804 CB ALA A 117 7.562 20.144 4.560 1.00 73.12 C ATOM 0 H ALA A 117 8.615 21.665 6.172 1.00 21.11 H new ATOM 0 HA ALA A 117 6.724 22.083 4.178 1.00 54.40 H new ATOM 0 HB1 ALA A 117 6.923 19.630 3.842 1.00 73.12 H new ATOM 0 HB2 ALA A 117 8.511 20.395 4.087 1.00 73.12 H new ATOM 0 HB3 ALA A 117 7.744 19.493 5.415 1.00 73.12 H new ATOM 1810 N GLY A 118 5.481 20.629 6.853 1.00 14.54 N ATOM 1811 CA GLY A 118 4.229 20.260 7.482 1.00 52.44 C ATOM 1812 C GLY A 118 3.455 21.466 7.976 1.00 11.24 C ATOM 1813 O GLY A 118 2.247 21.397 8.198 1.00 24.40 O ATOM 0 H GLY A 118 6.308 20.503 7.436 1.00 14.54 H new ATOM 0 HA2 GLY A 118 3.617 19.705 6.770 1.00 52.44 H new ATOM 0 HA3 GLY A 118 4.429 19.592 8.319 1.00 52.44 H new ATOM 1817 N ALA A 119 4.152 22.578 8.148 1.00 52.14 N ATOM 1818 CA ALA A 119 3.551 23.773 8.711 1.00 52.12 C ATOM 1819 C ALA A 119 2.794 24.575 7.656 1.00 52.10 C ATOM 1820 O ALA A 119 1.718 25.105 7.929 1.00 34.13 O ATOM 1821 CB ALA A 119 4.619 24.629 9.370 1.00 71.31 C ATOM 0 H ALA A 119 5.138 22.676 7.904 1.00 52.14 H new ATOM 0 HA ALA A 119 2.826 23.463 9.464 1.00 52.12 H new ATOM 0 HB1 ALA A 119 4.160 25.524 9.790 1.00 71.31 H new ATOM 0 HB2 ALA A 119 5.101 24.061 10.166 1.00 71.31 H new ATOM 0 HB3 ALA A 119 5.363 24.917 8.628 1.00 71.31 H new ATOM 1827 N VAL A 120 3.342 24.647 6.448 1.00 33.12 N ATOM 1828 CA VAL A 120 2.772 25.488 5.398 1.00 2.24 C ATOM 1829 C VAL A 120 1.375 25.028 4.968 1.00 32.45 C ATOM 1830 O VAL A 120 0.570 25.830 4.492 1.00 22.32 O ATOM 1831 CB VAL A 120 3.691 25.555 4.160 1.00 35.41 C ATOM 1832 CG1 VAL A 120 5.008 26.227 4.512 1.00 52.22 C ATOM 1833 CG2 VAL A 120 3.939 24.168 3.585 1.00 33.43 C ATOM 0 H VAL A 120 4.179 24.135 6.170 1.00 33.12 H new ATOM 0 HA VAL A 120 2.684 26.483 5.833 1.00 2.24 H new ATOM 0 HB VAL A 120 3.187 26.150 3.398 1.00 35.41 H new ATOM 0 HG11 VAL A 120 5.644 26.266 3.628 1.00 52.22 H new ATOM 0 HG12 VAL A 120 4.816 27.240 4.866 1.00 52.22 H new ATOM 0 HG13 VAL A 120 5.509 25.658 5.295 1.00 52.22 H new ATOM 0 HG21 VAL A 120 4.590 24.246 2.714 1.00 33.43 H new ATOM 0 HG22 VAL A 120 4.416 23.542 4.339 1.00 33.43 H new ATOM 0 HG23 VAL A 120 2.990 23.721 3.290 1.00 33.43 H new ATOM 1843 N ILE A 121 1.078 23.748 5.149 1.00 14.13 N ATOM 1844 CA ILE A 121 -0.212 23.205 4.734 1.00 50.52 C ATOM 1845 C ILE A 121 -1.325 23.629 5.699 1.00 30.34 C ATOM 1846 O ILE A 121 -2.500 23.665 5.333 1.00 34.54 O ATOM 1847 CB ILE A 121 -0.166 21.661 4.615 1.00 42.04 C ATOM 1848 CG1 ILE A 121 -1.458 21.130 3.982 1.00 10.33 C ATOM 1849 CG2 ILE A 121 0.069 21.016 5.974 1.00 70.54 C ATOM 1850 CD1 ILE A 121 -1.464 19.629 3.777 1.00 64.41 C ATOM 0 H ILE A 121 1.707 23.069 5.577 1.00 14.13 H new ATOM 0 HA ILE A 121 -0.433 23.615 3.748 1.00 50.52 H new ATOM 0 HB ILE A 121 0.670 21.397 3.967 1.00 42.04 H new ATOM 0 HG12 ILE A 121 -2.302 21.405 4.615 1.00 10.33 H new ATOM 0 HG13 ILE A 121 -1.609 21.620 3.020 1.00 10.33 H new ATOM 0 HG21 ILE A 121 0.097 19.932 5.862 1.00 70.54 H new ATOM 0 HG22 ILE A 121 1.018 21.363 6.382 1.00 70.54 H new ATOM 0 HG23 ILE A 121 -0.740 21.290 6.652 1.00 70.54 H new ATOM 0 HD11 ILE A 121 -2.409 19.327 3.326 1.00 64.41 H new ATOM 0 HD12 ILE A 121 -0.642 19.348 3.119 1.00 64.41 H new ATOM 0 HD13 ILE A 121 -1.346 19.130 4.739 1.00 64.41 H new ATOM 1862 N ALA A 122 -0.942 23.989 6.921 1.00 14.54 N ATOM 1863 CA ALA A 122 -1.906 24.330 7.965 1.00 33.41 C ATOM 1864 C ALA A 122 -2.649 25.629 7.652 1.00 53.11 C ATOM 1865 O ALA A 122 -3.716 25.892 8.207 1.00 4.42 O ATOM 1866 CB ALA A 122 -1.206 24.436 9.313 1.00 42.14 C ATOM 0 H ALA A 122 0.033 24.052 7.214 1.00 14.54 H new ATOM 0 HA ALA A 122 -2.645 23.530 8.004 1.00 33.41 H new ATOM 0 HB1 ALA A 122 -1.935 24.691 10.082 1.00 42.14 H new ATOM 0 HB2 ALA A 122 -0.739 23.482 9.557 1.00 42.14 H new ATOM 0 HB3 ALA A 122 -0.442 25.212 9.266 1.00 42.14 H new ATOM 1872 N ARG A 123 -2.091 26.437 6.757 1.00 62.41 N ATOM 1873 CA ARG A 123 -2.706 27.710 6.402 1.00 54.20 C ATOM 1874 C ARG A 123 -3.859 27.504 5.418 1.00 63.12 C ATOM 1875 O ARG A 123 -4.681 28.397 5.206 1.00 33.15 O ATOM 1876 CB ARG A 123 -1.666 28.667 5.814 1.00 63.30 C ATOM 1877 CG ARG A 123 -2.208 30.067 5.576 1.00 34.32 C ATOM 1878 CD ARG A 123 -1.114 31.033 5.165 1.00 74.44 C ATOM 1879 NE ARG A 123 -1.624 32.395 5.031 1.00 32.22 N ATOM 1880 CZ ARG A 123 -1.199 33.423 5.762 1.00 54.13 C ATOM 1881 NH1 ARG A 123 -0.253 33.252 6.678 1.00 24.44 N ATOM 1882 NH2 ARG A 123 -1.724 34.628 5.588 1.00 4.03 N ATOM 0 H ARG A 123 -1.220 26.235 6.267 1.00 62.41 H new ATOM 0 HA ARG A 123 -3.109 28.154 7.312 1.00 54.20 H new ATOM 0 HB2 ARG A 123 -0.812 28.725 6.489 1.00 63.30 H new ATOM 0 HB3 ARG A 123 -1.300 28.261 4.871 1.00 63.30 H new ATOM 0 HG2 ARG A 123 -2.973 30.033 4.800 1.00 34.32 H new ATOM 0 HG3 ARG A 123 -2.690 30.429 6.484 1.00 34.32 H new ATOM 0 HD2 ARG A 123 -0.314 31.014 5.905 1.00 74.44 H new ATOM 0 HD3 ARG A 123 -0.680 30.711 4.218 1.00 74.44 H new ATOM 0 HE ARG A 123 -2.349 32.569 4.335 1.00 32.22 H new ATOM 0 HH11 ARG A 123 0.153 32.328 6.825 1.00 24.44 H new ATOM 0 HH12 ARG A 123 0.068 34.045 7.234 1.00 24.44 H new ATOM 0 HH21 ARG A 123 -2.456 34.770 4.892 1.00 4.03 H new ATOM 0 HH22 ARG A 123 -1.396 35.413 6.150 1.00 4.03 H new ATOM 1896 N MET A 124 -3.923 26.317 4.830 1.00 10.41 N ATOM 1897 CA MET A 124 -4.986 25.993 3.886 1.00 23.40 C ATOM 1898 C MET A 124 -6.319 25.850 4.617 1.00 44.42 C ATOM 1899 O MET A 124 -7.380 26.056 4.028 1.00 72.24 O ATOM 1900 CB MET A 124 -4.662 24.701 3.127 1.00 2.21 C ATOM 1901 CG MET A 124 -5.671 24.362 2.039 1.00 32.03 C ATOM 1902 SD MET A 124 -5.341 22.774 1.246 1.00 11.13 S ATOM 1903 CE MET A 124 -3.711 23.067 0.561 1.00 11.34 C ATOM 0 H MET A 124 -3.254 25.564 4.989 1.00 10.41 H new ATOM 0 HA MET A 124 -5.063 26.808 3.166 1.00 23.40 H new ATOM 0 HB2 MET A 124 -3.673 24.792 2.678 1.00 2.21 H new ATOM 0 HB3 MET A 124 -4.615 23.875 3.837 1.00 2.21 H new ATOM 0 HG2 MET A 124 -6.672 24.346 2.471 1.00 32.03 H new ATOM 0 HG3 MET A 124 -5.662 25.148 1.284 1.00 32.03 H new ATOM 0 HE1 MET A 124 -3.495 22.316 -0.199 1.00 11.34 H new ATOM 0 HE2 MET A 124 -3.679 24.059 0.110 1.00 11.34 H new ATOM 0 HE3 MET A 124 -2.966 23.005 1.354 1.00 11.34 H new ATOM 2057 N ARG A 134 -6.136 9.048 0.841 1.00 73.13 N ATOM 2058 CA ARG A 134 -5.352 10.235 0.541 1.00 14.52 C ATOM 2059 C ARG A 134 -4.859 10.277 -0.906 1.00 22.12 C ATOM 2060 O ARG A 134 -4.833 9.268 -1.613 1.00 25.32 O ATOM 2061 CB ARG A 134 -4.172 10.352 1.501 1.00 53.23 C ATOM 2062 CG ARG A 134 -4.582 10.506 2.960 1.00 0.15 C ATOM 2063 CD ARG A 134 -3.432 11.037 3.801 1.00 71.43 C ATOM 2064 NE ARG A 134 -3.052 12.390 3.395 1.00 53.11 N ATOM 2065 CZ ARG A 134 -1.973 12.678 2.674 1.00 52.44 C ATOM 2066 NH1 ARG A 134 -1.131 11.717 2.314 1.00 41.33 N ATOM 2067 NH2 ARG A 134 -1.747 13.931 2.310 1.00 14.51 N ATOM 0 HA ARG A 134 -6.018 11.088 0.673 1.00 14.52 H new ATOM 0 HB2 ARG A 134 -3.544 9.466 1.401 1.00 53.23 H new ATOM 0 HB3 ARG A 134 -3.563 11.209 1.212 1.00 53.23 H new ATOM 0 HG2 ARG A 134 -5.432 11.184 3.032 1.00 0.15 H new ATOM 0 HG3 ARG A 134 -4.909 9.543 3.352 1.00 0.15 H new ATOM 0 HD2 ARG A 134 -3.719 11.039 4.853 1.00 71.43 H new ATOM 0 HD3 ARG A 134 -2.573 10.373 3.706 1.00 71.43 H new ATOM 0 HE ARG A 134 -3.653 13.162 3.684 1.00 53.11 H new ATOM 0 HH11 ARG A 134 -1.310 10.752 2.591 1.00 41.33 H new ATOM 0 HH12 ARG A 134 -0.305 11.944 1.761 1.00 41.33 H new ATOM 0 HH21 ARG A 134 -2.399 14.667 2.583 1.00 14.51 H new ATOM 0 HH22 ARG A 134 -0.921 14.160 1.757 1.00 14.51 H new ATOM 2081 N ASP A 135 -4.437 11.471 -1.310 1.00 62.42 N ATOM 2082 CA ASP A 135 -4.052 11.766 -2.690 1.00 3.22 C ATOM 2083 C ASP A 135 -2.750 11.074 -3.099 1.00 72.24 C ATOM 2084 O ASP A 135 -2.591 10.683 -4.260 1.00 5.22 O ATOM 2085 CB ASP A 135 -3.923 13.284 -2.851 1.00 64.22 C ATOM 2086 CG ASP A 135 -3.286 13.701 -4.162 1.00 3.12 C ATOM 2087 OD1 ASP A 135 -3.915 13.518 -5.223 1.00 73.34 O ATOM 2088 OD2 ASP A 135 -2.157 14.229 -4.134 1.00 5.21 O ATOM 0 H ASP A 135 -4.351 12.271 -0.683 1.00 62.42 H new ATOM 0 HA ASP A 135 -4.828 11.377 -3.349 1.00 3.22 H new ATOM 0 HB2 ASP A 135 -4.913 13.735 -2.778 1.00 64.22 H new ATOM 0 HB3 ASP A 135 -3.331 13.680 -2.026 1.00 64.22 H new ATOM 2093 N ASP A 136 -1.830 10.913 -2.149 1.00 14.55 N ATOM 2094 CA ASP A 136 -0.511 10.344 -2.446 1.00 24.45 C ATOM 2095 C ASP A 136 -0.614 8.967 -3.091 1.00 3.44 C ATOM 2096 O ASP A 136 -0.096 8.745 -4.187 1.00 2.11 O ATOM 2097 CB ASP A 136 0.335 10.227 -1.174 1.00 53.01 C ATOM 2098 CG ASP A 136 0.839 11.559 -0.670 1.00 72.32 C ATOM 2099 OD1 ASP A 136 0.079 12.259 0.024 1.00 64.41 O ATOM 2100 OD2 ASP A 136 2.004 11.903 -0.947 1.00 23.34 O ATOM 0 H ASP A 136 -1.970 11.166 -1.171 1.00 14.55 H new ATOM 0 HA ASP A 136 -0.033 11.027 -3.149 1.00 24.45 H new ATOM 0 HB2 ASP A 136 -0.258 9.751 -0.393 1.00 53.01 H new ATOM 0 HB3 ASP A 136 1.186 9.574 -1.370 1.00 53.01 H new ATOM 2105 N LEU A 137 -1.301 8.048 -2.427 1.00 32.40 N ATOM 2106 CA LEU A 137 -1.384 6.681 -2.916 1.00 62.43 C ATOM 2107 C LEU A 137 -2.439 6.555 -4.002 1.00 1.31 C ATOM 2108 O LEU A 137 -2.397 5.629 -4.805 1.00 21.12 O ATOM 2109 CB LEU A 137 -1.664 5.698 -1.775 1.00 2.21 C ATOM 2110 CG LEU A 137 -1.338 4.232 -2.091 1.00 43.42 C ATOM 2111 CD1 LEU A 137 0.154 4.057 -2.312 1.00 42.14 C ATOM 2112 CD2 LEU A 137 -1.815 3.315 -0.981 1.00 12.44 C ATOM 0 H LEU A 137 -1.804 8.222 -1.557 1.00 32.40 H new ATOM 0 HA LEU A 137 -0.416 6.427 -3.348 1.00 62.43 H new ATOM 0 HB2 LEU A 137 -1.087 6.003 -0.902 1.00 2.21 H new ATOM 0 HB3 LEU A 137 -2.717 5.770 -1.503 1.00 2.21 H new ATOM 0 HG LEU A 137 -1.864 3.960 -3.006 1.00 43.42 H new ATOM 0 HD11 LEU A 137 0.369 3.012 -2.535 1.00 42.14 H new ATOM 0 HD12 LEU A 137 0.473 4.679 -3.148 1.00 42.14 H new ATOM 0 HD13 LEU A 137 0.692 4.354 -1.412 1.00 42.14 H new ATOM 0 HD21 LEU A 137 -1.571 2.283 -1.232 1.00 12.44 H new ATOM 0 HD22 LEU A 137 -1.323 3.588 -0.047 1.00 12.44 H new ATOM 0 HD23 LEU A 137 -2.894 3.415 -0.865 1.00 12.44 H new ATOM 2124 N MET A 138 -3.366 7.501 -4.038 1.00 43.44 N ATOM 2125 CA MET A 138 -4.425 7.500 -5.039 1.00 72.23 C ATOM 2126 C MET A 138 -3.841 7.429 -6.451 1.00 74.12 C ATOM 2127 O MET A 138 -4.375 6.739 -7.318 1.00 4.11 O ATOM 2128 CB MET A 138 -5.282 8.758 -4.894 1.00 71.13 C ATOM 2129 CG MET A 138 -6.365 8.885 -5.950 1.00 22.15 C ATOM 2130 SD MET A 138 -6.539 10.579 -6.528 1.00 64.32 S ATOM 2131 CE MET A 138 -4.850 10.901 -7.028 1.00 2.05 C ATOM 0 H MET A 138 -3.407 8.282 -3.383 1.00 43.44 H new ATOM 0 HA MET A 138 -5.046 6.619 -4.879 1.00 72.23 H new ATOM 0 HB2 MET A 138 -5.747 8.758 -3.908 1.00 71.13 H new ATOM 0 HB3 MET A 138 -4.636 9.634 -4.942 1.00 71.13 H new ATOM 0 HG2 MET A 138 -6.129 8.236 -6.793 1.00 22.15 H new ATOM 0 HG3 MET A 138 -7.315 8.542 -5.540 1.00 22.15 H new ATOM 0 HE1 MET A 138 -4.832 11.730 -7.735 1.00 2.05 H new ATOM 0 HE2 MET A 138 -4.254 11.158 -6.152 1.00 2.05 H new ATOM 0 HE3 MET A 138 -4.435 10.011 -7.501 1.00 2.05 H new ATOM 2141 N ARG A 139 -2.731 8.128 -6.670 1.00 74.14 N ATOM 2142 CA ARG A 139 -2.081 8.123 -7.977 1.00 41.32 C ATOM 2143 C ARG A 139 -1.428 6.770 -8.251 1.00 43.03 C ATOM 2144 O ARG A 139 -1.371 6.318 -9.394 1.00 13.23 O ATOM 2145 CB ARG A 139 -1.026 9.226 -8.072 1.00 63.44 C ATOM 2146 CG ARG A 139 -0.409 9.326 -9.457 1.00 34.42 C ATOM 2147 CD ARG A 139 1.104 9.450 -9.399 1.00 53.22 C ATOM 2148 NE ARG A 139 1.700 9.325 -10.729 1.00 3.43 N ATOM 2149 CZ ARG A 139 2.515 10.225 -11.271 1.00 3.34 C ATOM 2150 NH1 ARG A 139 2.892 11.293 -10.577 1.00 45.24 N ATOM 2151 NH2 ARG A 139 2.973 10.038 -12.500 1.00 53.43 N ATOM 0 H ARG A 139 -2.266 8.701 -5.966 1.00 74.14 H new ATOM 0 HA ARG A 139 -2.851 8.308 -8.726 1.00 41.32 H new ATOM 0 HB2 ARG A 139 -1.480 10.182 -7.811 1.00 63.44 H new ATOM 0 HB3 ARG A 139 -0.240 9.036 -7.341 1.00 63.44 H new ATOM 0 HG2 ARG A 139 -0.678 8.444 -10.038 1.00 34.42 H new ATOM 0 HG3 ARG A 139 -0.824 10.189 -9.977 1.00 34.42 H new ATOM 0 HD2 ARG A 139 1.376 10.413 -8.966 1.00 53.22 H new ATOM 0 HD3 ARG A 139 1.509 8.680 -8.743 1.00 53.22 H new ATOM 0 HE ARG A 139 1.476 8.494 -11.276 1.00 3.43 H new ATOM 0 HH11 ARG A 139 2.556 11.426 -9.623 1.00 45.24 H new ATOM 0 HH12 ARG A 139 3.517 11.980 -10.998 1.00 45.24 H new ATOM 0 HH21 ARG A 139 2.700 9.207 -13.025 1.00 53.43 H new ATOM 0 HH22 ARG A 139 3.598 10.725 -12.921 1.00 53.43 H new ATOM 2165 N PHE A 140 -0.947 6.128 -7.192 1.00 21.11 N ATOM 2166 CA PHE A 140 -0.287 4.830 -7.301 1.00 63.32 C ATOM 2167 C PHE A 140 -1.241 3.795 -7.889 1.00 64.40 C ATOM 2168 O PHE A 140 -0.831 2.912 -8.646 1.00 10.44 O ATOM 2169 CB PHE A 140 0.215 4.391 -5.922 1.00 1.44 C ATOM 2170 CG PHE A 140 0.824 3.018 -5.892 1.00 25.02 C ATOM 2171 CD1 PHE A 140 2.109 2.803 -6.359 1.00 54.15 C ATOM 2172 CD2 PHE A 140 0.106 1.943 -5.392 1.00 5.51 C ATOM 2173 CE1 PHE A 140 2.668 1.542 -6.328 1.00 32.35 C ATOM 2174 CE2 PHE A 140 0.659 0.680 -5.358 1.00 23.23 C ATOM 2175 CZ PHE A 140 1.940 0.480 -5.826 1.00 41.23 C ATOM 0 H PHE A 140 -1.002 6.489 -6.240 1.00 21.11 H new ATOM 0 HA PHE A 140 0.567 4.917 -7.973 1.00 63.32 H new ATOM 0 HB2 PHE A 140 0.955 5.111 -5.572 1.00 1.44 H new ATOM 0 HB3 PHE A 140 -0.617 4.422 -5.219 1.00 1.44 H new ATOM 0 HD1 PHE A 140 2.680 3.631 -6.752 1.00 54.15 H new ATOM 0 HD2 PHE A 140 -0.898 2.096 -5.025 1.00 5.51 H new ATOM 0 HE1 PHE A 140 3.672 1.385 -6.695 1.00 32.35 H new ATOM 0 HE2 PHE A 140 0.090 -0.150 -4.966 1.00 23.23 H new ATOM 0 HZ PHE A 140 2.375 -0.508 -5.800 1.00 41.23 H new ATOM 2185 N LYS A 141 -2.516 3.921 -7.540 1.00 35.42 N ATOM 2186 CA LYS A 141 -3.559 3.101 -8.139 1.00 25.25 C ATOM 2187 C LYS A 141 -3.524 3.231 -9.653 1.00 12.41 C ATOM 2188 O LYS A 141 -3.488 2.238 -10.375 1.00 15.44 O ATOM 2189 CB LYS A 141 -4.934 3.524 -7.608 1.00 31.44 C ATOM 2190 CG LYS A 141 -6.117 3.033 -8.434 1.00 64.24 C ATOM 2191 CD LYS A 141 -7.425 3.560 -7.854 1.00 5.11 C ATOM 2192 CE LYS A 141 -8.543 3.644 -8.887 1.00 52.24 C ATOM 2193 NZ LYS A 141 -8.908 2.319 -9.451 1.00 71.53 N ATOM 0 H LYS A 141 -2.852 4.586 -6.843 1.00 35.42 H new ATOM 0 HA LYS A 141 -3.382 2.059 -7.871 1.00 25.25 H new ATOM 0 HB2 LYS A 141 -5.043 3.155 -6.588 1.00 31.44 H new ATOM 0 HB3 LYS A 141 -4.970 4.612 -7.559 1.00 31.44 H new ATOM 0 HG2 LYS A 141 -6.010 3.364 -9.467 1.00 64.24 H new ATOM 0 HG3 LYS A 141 -6.131 1.943 -8.449 1.00 64.24 H new ATOM 0 HD2 LYS A 141 -7.741 2.912 -7.037 1.00 5.11 H new ATOM 0 HD3 LYS A 141 -7.255 4.549 -7.429 1.00 5.11 H new ATOM 0 HE2 LYS A 141 -9.423 4.093 -8.427 1.00 52.24 H new ATOM 0 HE3 LYS A 141 -8.234 4.306 -9.696 1.00 52.24 H new ATOM 0 HZ1 LYS A 141 -8.725 2.315 -10.475 1.00 71.53 H new ATOM 0 HZ2 LYS A 141 -8.338 1.578 -8.994 1.00 71.53 H new ATOM 0 HZ3 LYS A 141 -9.917 2.135 -9.279 1.00 71.53 H new ATOM 2207 N ARG A 142 -3.489 4.466 -10.124 1.00 63.11 N ATOM 2208 CA ARG A 142 -3.547 4.738 -11.547 1.00 22.02 C ATOM 2209 C ARG A 142 -2.254 4.344 -12.251 1.00 42.13 C ATOM 2210 O ARG A 142 -2.269 4.047 -13.433 1.00 11.14 O ATOM 2211 CB ARG A 142 -3.867 6.209 -11.792 1.00 11.33 C ATOM 2212 CG ARG A 142 -5.292 6.580 -11.412 1.00 34.12 C ATOM 2213 CD ARG A 142 -6.297 5.718 -12.163 1.00 72.34 C ATOM 2214 NE ARG A 142 -7.677 6.007 -11.781 1.00 72.10 N ATOM 2215 CZ ARG A 142 -8.729 5.347 -12.266 1.00 21.45 C ATOM 2216 NH1 ARG A 142 -8.552 4.330 -13.096 1.00 73.14 N ATOM 2217 NH2 ARG A 142 -9.959 5.685 -11.908 1.00 15.30 N ATOM 0 H ARG A 142 -3.420 5.298 -9.538 1.00 63.11 H new ATOM 0 HA ARG A 142 -4.346 4.128 -11.969 1.00 22.02 H new ATOM 0 HB2 ARG A 142 -3.173 6.826 -11.221 1.00 11.33 H new ATOM 0 HB3 ARG A 142 -3.706 6.439 -12.845 1.00 11.33 H new ATOM 0 HG2 ARG A 142 -5.430 6.455 -10.338 1.00 34.12 H new ATOM 0 HG3 ARG A 142 -5.470 7.632 -11.636 1.00 34.12 H new ATOM 0 HD2 ARG A 142 -6.179 5.878 -13.235 1.00 72.34 H new ATOM 0 HD3 ARG A 142 -6.083 4.666 -11.972 1.00 72.34 H new ATOM 0 HE ARG A 142 -7.845 6.754 -11.107 1.00 72.10 H new ATOM 0 HH11 ARG A 142 -7.609 4.050 -13.366 1.00 73.14 H new ATOM 0 HH12 ARG A 142 -9.359 3.827 -13.465 1.00 73.14 H new ATOM 0 HH21 ARG A 142 -10.107 6.456 -11.256 1.00 15.30 H new ATOM 0 HH22 ARG A 142 -10.758 5.175 -12.284 1.00 15.30 H new ATOM 2231 N GLU A 143 -1.142 4.330 -11.525 1.00 62.35 N ATOM 2232 CA GLU A 143 0.135 3.903 -12.094 1.00 0.24 C ATOM 2233 C GLU A 143 0.085 2.439 -12.514 1.00 12.32 C ATOM 2234 O GLU A 143 0.548 2.076 -13.596 1.00 64.30 O ATOM 2235 CB GLU A 143 1.264 4.105 -11.083 1.00 10.40 C ATOM 2236 CG GLU A 143 1.585 5.561 -10.793 1.00 44.14 C ATOM 2237 CD GLU A 143 2.243 6.256 -11.966 1.00 1.23 C ATOM 2238 OE1 GLU A 143 3.392 5.896 -12.304 1.00 20.04 O ATOM 2239 OE2 GLU A 143 1.627 7.175 -12.541 1.00 3.43 O ATOM 0 H GLU A 143 -1.096 4.608 -10.545 1.00 62.35 H new ATOM 0 HA GLU A 143 0.326 4.514 -12.976 1.00 0.24 H new ATOM 0 HB2 GLU A 143 0.994 3.611 -10.150 1.00 10.40 H new ATOM 0 HB3 GLU A 143 2.163 3.613 -11.455 1.00 10.40 H new ATOM 0 HG2 GLU A 143 0.667 6.087 -10.532 1.00 44.14 H new ATOM 0 HG3 GLU A 143 2.243 5.619 -9.926 1.00 44.14 H new ATOM 2246 N GLN A 144 -0.480 1.606 -11.654 1.00 30.13 N ATOM 2247 CA GLN A 144 -0.562 0.178 -11.921 1.00 22.02 C ATOM 2248 C GLN A 144 -1.753 -0.144 -12.823 1.00 73.21 C ATOM 2249 O GLN A 144 -1.631 -0.911 -13.779 1.00 1.44 O ATOM 2250 CB GLN A 144 -0.647 -0.590 -10.601 1.00 61.35 C ATOM 2251 CG GLN A 144 -0.873 -2.083 -10.764 1.00 1.15 C ATOM 2252 CD GLN A 144 -0.586 -2.863 -9.495 1.00 41.53 C ATOM 2253 OE1 GLN A 144 -0.229 -4.035 -9.547 1.00 22.23 O ATOM 2254 NE2 GLN A 144 -0.725 -2.216 -8.347 1.00 22.44 N ATOM 0 H GLN A 144 -0.889 1.894 -10.765 1.00 30.13 H new ATOM 0 HA GLN A 144 0.339 -0.133 -12.449 1.00 22.02 H new ATOM 0 HB2 GLN A 144 0.275 -0.432 -10.042 1.00 61.35 H new ATOM 0 HB3 GLN A 144 -1.458 -0.174 -10.003 1.00 61.35 H new ATOM 0 HG2 GLN A 144 -1.905 -2.259 -11.067 1.00 1.15 H new ATOM 0 HG3 GLN A 144 -0.237 -2.457 -11.566 1.00 1.15 H new ATOM 0 HE21 GLN A 144 -1.024 -1.241 -8.344 1.00 22.44 H new ATOM 0 HE22 GLN A 144 -0.533 -2.693 -7.466 1.00 22.44 H new ATOM 2263 N GLU A 145 -2.896 0.461 -12.523 1.00 22.51 N ATOM 2264 CA GLU A 145 -4.103 0.269 -13.286 1.00 74.25 C ATOM 2265 C GLU A 145 -3.982 0.837 -14.704 1.00 42.50 C ATOM 2266 O GLU A 145 -4.743 0.461 -15.596 1.00 50.14 O ATOM 2267 CB GLU A 145 -5.250 0.927 -12.536 1.00 2.52 C ATOM 2268 CG GLU A 145 -6.494 0.091 -12.515 1.00 54.10 C ATOM 2269 CD GLU A 145 -7.676 0.825 -11.925 1.00 21.53 C ATOM 2270 OE1 GLU A 145 -7.551 2.039 -11.663 1.00 63.40 O ATOM 2271 OE2 GLU A 145 -8.726 0.190 -11.701 1.00 41.32 O ATOM 0 H GLU A 145 -3.002 1.101 -11.736 1.00 22.51 H new ATOM 0 HA GLU A 145 -4.288 -0.799 -13.397 1.00 74.25 H new ATOM 0 HB2 GLU A 145 -4.938 1.129 -11.511 1.00 2.52 H new ATOM 0 HB3 GLU A 145 -5.473 1.889 -12.997 1.00 2.52 H new ATOM 0 HG2 GLU A 145 -6.735 -0.221 -13.531 1.00 54.10 H new ATOM 0 HG3 GLU A 145 -6.309 -0.815 -11.938 1.00 54.10 H new ATOM 2278 N LEU A 146 -3.033 1.748 -14.905 1.00 40.20 N ATOM 2279 CA LEU A 146 -2.754 2.284 -16.234 1.00 51.25 C ATOM 2280 C LEU A 146 -2.233 1.172 -17.132 1.00 11.35 C ATOM 2281 O LEU A 146 -2.599 1.074 -18.305 1.00 14.01 O ATOM 2282 CB LEU A 146 -1.713 3.408 -16.159 1.00 73.34 C ATOM 2283 CG LEU A 146 -1.559 4.250 -17.428 1.00 34.32 C ATOM 2284 CD1 LEU A 146 -2.812 5.076 -17.679 1.00 60.34 C ATOM 2285 CD2 LEU A 146 -0.333 5.149 -17.329 1.00 4.10 C ATOM 0 H LEU A 146 -2.445 2.130 -14.165 1.00 40.20 H new ATOM 0 HA LEU A 146 -3.678 2.691 -16.645 1.00 51.25 H new ATOM 0 HB2 LEU A 146 -1.978 4.070 -15.335 1.00 73.34 H new ATOM 0 HB3 LEU A 146 -0.746 2.968 -15.916 1.00 73.34 H new ATOM 0 HG LEU A 146 -1.421 3.575 -18.272 1.00 34.32 H new ATOM 0 HD11 LEU A 146 -2.682 5.667 -18.585 1.00 60.34 H new ATOM 0 HD12 LEU A 146 -3.668 4.412 -17.798 1.00 60.34 H new ATOM 0 HD13 LEU A 146 -2.985 5.742 -16.833 1.00 60.34 H new ATOM 0 HD21 LEU A 146 -0.240 5.740 -18.240 1.00 4.10 H new ATOM 0 HD22 LEU A 146 -0.439 5.816 -16.473 1.00 4.10 H new ATOM 0 HD23 LEU A 146 0.559 4.535 -17.202 1.00 4.10 H new ATOM 2297 N GLY A 147 -1.378 0.337 -16.561 1.00 73.31 N ATOM 2298 CA GLY A 147 -0.823 -0.780 -17.297 1.00 25.53 C ATOM 2299 C GLY A 147 0.617 -0.530 -17.672 1.00 54.14 C ATOM 2300 O GLY A 147 0.898 0.123 -18.678 1.00 54.22 O ATOM 0 H GLY A 147 -1.057 0.414 -15.596 1.00 73.31 H new ATOM 0 HA2 GLY A 147 -0.892 -1.685 -16.694 1.00 25.53 H new ATOM 0 HA3 GLY A 147 -1.411 -0.952 -18.199 1.00 25.53 H new