USER MOD reduce.3.24.130724 H: found=0, std=0, add=596, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 600 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 95 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 126 THR OG1 : rot -145:sc= 0.14 USER MOD Single : A 94 MET CE :methyl 173:sc= 0 (180deg=-0.0514) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HE2:sc= 0.26 K(o=0.26,f=-0.94) USER MOD Single : A 146 SER OG : rot -174:sc= -0.991 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 164 MET CE :methyl -121:sc= -3.08! (180deg=-4.71!) USER MOD Single : A 167 GLN : amide:sc= -0.672 K(o=-0.67,f=-5.9!) USER MOD Single : A 169 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 94 -14.812 0.173 8.800 1.00 43.33 N ATOM 2 CA MET A 94 -14.132 0.277 7.490 1.00 11.44 C ATOM 3 C MET A 94 -13.176 -0.916 7.341 1.00 54.21 C ATOM 4 O MET A 94 -12.281 -1.091 8.174 1.00 1.44 O ATOM 5 CB MET A 94 -13.368 1.621 7.374 1.00 13.24 C ATOM 6 CG MET A 94 -14.261 2.871 7.394 1.00 64.14 C ATOM 7 SD MET A 94 -15.186 3.092 8.933 1.00 54.20 S ATOM 8 CE MET A 94 -13.896 3.482 10.117 1.00 11.44 C ATOM 0 HA MET A 94 -14.869 0.255 6.688 1.00 11.44 H new ATOM 0 HB2 MET A 94 -12.653 1.689 8.194 1.00 13.24 H new ATOM 0 HB3 MET A 94 -12.792 1.617 6.449 1.00 13.24 H new ATOM 0 HG2 MET A 94 -13.640 3.751 7.226 1.00 64.14 H new ATOM 0 HG3 MET A 94 -14.965 2.815 6.564 1.00 64.14 H new ATOM 0 HE1 MET A 94 -14.348 3.761 11.069 1.00 11.44 H new ATOM 0 HE2 MET A 94 -13.258 2.610 10.260 1.00 11.44 H new ATOM 0 HE3 MET A 94 -13.298 4.313 9.743 1.00 11.44 H new ATOM 20 N SER A 95 -13.369 -1.721 6.274 1.00 15.41 N ATOM 21 CA SER A 95 -12.665 -3.010 6.083 1.00 44.14 C ATOM 22 C SER A 95 -11.138 -2.814 5.950 1.00 51.21 C ATOM 23 O SER A 95 -10.675 -1.939 5.203 1.00 13.42 O ATOM 24 CB SER A 95 -13.232 -3.735 4.836 1.00 21.15 C ATOM 25 OG SER A 95 -14.649 -3.804 4.887 1.00 41.21 O ATOM 0 H SER A 95 -14.018 -1.496 5.520 1.00 15.41 H new ATOM 0 HA SER A 95 -12.836 -3.624 6.967 1.00 44.14 H new ATOM 0 HB2 SER A 95 -12.922 -3.209 3.933 1.00 21.15 H new ATOM 0 HB3 SER A 95 -12.817 -4.741 4.776 1.00 21.15 H new ATOM 0 HG SER A 95 -14.983 -4.264 4.089 1.00 41.21 H new ATOM 31 N THR A 96 -10.381 -3.626 6.705 1.00 14.53 N ATOM 32 CA THR A 96 -8.913 -3.640 6.668 1.00 52.50 C ATOM 33 C THR A 96 -8.419 -4.388 5.419 1.00 44.43 C ATOM 34 O THR A 96 -9.106 -5.280 4.907 1.00 31.41 O ATOM 35 CB THR A 96 -8.347 -4.293 7.970 1.00 73.52 C ATOM 36 OG1 THR A 96 -8.897 -3.614 9.102 1.00 62.50 O ATOM 37 CG2 THR A 96 -6.809 -4.235 8.046 1.00 73.32 C ATOM 0 H THR A 96 -10.776 -4.297 7.364 1.00 14.53 H new ATOM 0 HA THR A 96 -8.550 -2.613 6.615 1.00 52.50 H new ATOM 0 HB THR A 96 -8.631 -5.345 7.961 1.00 73.52 H new ATOM 0 HG1 THR A 96 -8.550 -4.017 9.925 1.00 62.50 H new ATOM 0 HG21 THR A 96 -6.473 -4.703 8.971 1.00 73.32 H new ATOM 0 HG22 THR A 96 -6.382 -4.766 7.195 1.00 73.32 H new ATOM 0 HG23 THR A 96 -6.483 -3.195 8.026 1.00 73.32 H new ATOM 45 N ILE A 97 -7.230 -4.015 4.928 1.00 72.24 N ATOM 46 CA ILE A 97 -6.678 -4.541 3.672 1.00 52.04 C ATOM 47 C ILE A 97 -5.430 -5.418 3.939 1.00 31.11 C ATOM 48 O ILE A 97 -4.857 -5.391 5.042 1.00 44.43 O ATOM 49 CB ILE A 97 -6.340 -3.354 2.695 1.00 14.13 C ATOM 50 CG1 ILE A 97 -5.128 -2.511 3.207 1.00 2.11 C ATOM 51 CG2 ILE A 97 -7.584 -2.438 2.491 1.00 42.33 C ATOM 52 CD1 ILE A 97 -4.680 -1.416 2.261 1.00 73.32 C ATOM 0 H ILE A 97 -6.623 -3.339 5.391 1.00 72.24 H new ATOM 0 HA ILE A 97 -7.428 -5.175 3.199 1.00 52.04 H new ATOM 0 HB ILE A 97 -6.062 -3.792 1.736 1.00 14.13 H new ATOM 0 HG12 ILE A 97 -5.393 -2.061 4.164 1.00 2.11 H new ATOM 0 HG13 ILE A 97 -4.288 -3.181 3.391 1.00 2.11 H new ATOM 0 HG21 ILE A 97 -7.329 -1.624 1.813 1.00 42.33 H new ATOM 0 HG22 ILE A 97 -8.400 -3.022 2.066 1.00 42.33 H new ATOM 0 HG23 ILE A 97 -7.894 -2.026 3.451 1.00 42.33 H new ATOM 0 HD11 ILE A 97 -3.835 -0.882 2.696 1.00 73.32 H new ATOM 0 HD12 ILE A 97 -4.380 -1.857 1.310 1.00 73.32 H new ATOM 0 HD13 ILE A 97 -5.502 -0.720 2.095 1.00 73.32 H new ATOM 64 N ALA A 98 -5.027 -6.199 2.916 1.00 75.42 N ATOM 65 CA ALA A 98 -3.863 -7.113 2.982 1.00 12.33 C ATOM 66 C ALA A 98 -3.020 -6.971 1.692 1.00 22.03 C ATOM 67 O ALA A 98 -3.534 -7.157 0.597 1.00 22.13 O ATOM 68 CB ALA A 98 -4.331 -8.571 3.200 1.00 11.15 C ATOM 0 H ALA A 98 -5.502 -6.215 2.013 1.00 75.42 H new ATOM 0 HA ALA A 98 -3.236 -6.843 3.832 1.00 12.33 H new ATOM 0 HB1 ALA A 98 -3.463 -9.229 3.246 1.00 11.15 H new ATOM 0 HB2 ALA A 98 -4.887 -8.639 4.135 1.00 11.15 H new ATOM 0 HB3 ALA A 98 -4.973 -8.875 2.373 1.00 11.15 H new ATOM 74 N LEU A 99 -1.723 -6.652 1.850 1.00 40.13 N ATOM 75 CA LEU A 99 -0.788 -6.309 0.739 1.00 32.23 C ATOM 76 C LEU A 99 -0.348 -7.595 -0.008 1.00 14.01 C ATOM 77 O LEU A 99 -0.241 -8.649 0.613 1.00 62.42 O ATOM 78 CB LEU A 99 0.443 -5.581 1.357 1.00 60.50 C ATOM 79 CG LEU A 99 1.284 -4.663 0.458 1.00 52.24 C ATOM 80 CD1 LEU A 99 0.436 -3.534 -0.157 1.00 34.13 C ATOM 81 CD2 LEU A 99 2.484 -4.090 1.253 1.00 73.31 C ATOM 0 H LEU A 99 -1.277 -6.622 2.767 1.00 40.13 H new ATOM 0 HA LEU A 99 -1.279 -5.659 0.015 1.00 32.23 H new ATOM 0 HB2 LEU A 99 0.087 -4.985 2.197 1.00 60.50 H new ATOM 0 HB3 LEU A 99 1.107 -6.343 1.765 1.00 60.50 H new ATOM 0 HG LEU A 99 1.667 -5.261 -0.369 1.00 52.24 H new ATOM 0 HD11 LEU A 99 1.067 -2.906 -0.786 1.00 34.13 H new ATOM 0 HD12 LEU A 99 -0.363 -3.966 -0.760 1.00 34.13 H new ATOM 0 HD13 LEU A 99 0.002 -2.929 0.640 1.00 34.13 H new ATOM 0 HD21 LEU A 99 3.073 -3.441 0.605 1.00 73.31 H new ATOM 0 HD22 LEU A 99 2.116 -3.517 2.104 1.00 73.31 H new ATOM 0 HD23 LEU A 99 3.108 -4.909 1.610 1.00 73.31 H new ATOM 93 N ALA A 100 -0.062 -7.492 -1.320 1.00 71.14 N ATOM 94 CA ALA A 100 0.275 -8.659 -2.164 1.00 3.41 C ATOM 95 C ALA A 100 1.681 -9.195 -1.834 1.00 11.10 C ATOM 96 O ALA A 100 1.841 -10.387 -1.555 1.00 34.34 O ATOM 97 CB ALA A 100 0.173 -8.285 -3.648 1.00 24.21 C ATOM 0 H ALA A 100 -0.057 -6.605 -1.824 1.00 71.14 H new ATOM 0 HA ALA A 100 -0.442 -9.453 -1.952 1.00 3.41 H new ATOM 0 HB1 ALA A 100 0.423 -9.152 -4.260 1.00 24.21 H new ATOM 0 HB2 ALA A 100 -0.844 -7.963 -3.873 1.00 24.21 H new ATOM 0 HB3 ALA A 100 0.867 -7.474 -3.867 1.00 24.21 H new ATOM 103 N LEU A 101 2.674 -8.271 -1.835 1.00 71.40 N ATOM 104 CA LEU A 101 4.111 -8.587 -1.654 1.00 31.33 C ATOM 105 C LEU A 101 4.605 -9.589 -2.728 1.00 33.11 C ATOM 106 O LEU A 101 4.650 -10.809 -2.510 1.00 13.33 O ATOM 107 CB LEU A 101 4.430 -9.067 -0.202 1.00 50.35 C ATOM 108 CG LEU A 101 4.274 -8.007 0.948 1.00 3.15 C ATOM 109 CD1 LEU A 101 4.736 -8.583 2.313 1.00 1.35 C ATOM 110 CD2 LEU A 101 5.032 -6.695 0.617 1.00 53.51 C ATOM 0 H LEU A 101 2.496 -7.275 -1.963 1.00 71.40 H new ATOM 0 HA LEU A 101 4.669 -7.661 -1.797 1.00 31.33 H new ATOM 0 HB2 LEU A 101 3.781 -9.913 0.026 1.00 50.35 H new ATOM 0 HB3 LEU A 101 5.455 -9.438 -0.185 1.00 50.35 H new ATOM 0 HG LEU A 101 3.213 -7.768 1.026 1.00 3.15 H new ATOM 0 HD11 LEU A 101 4.615 -7.825 3.087 1.00 1.35 H new ATOM 0 HD12 LEU A 101 4.133 -9.456 2.562 1.00 1.35 H new ATOM 0 HD13 LEU A 101 5.785 -8.873 2.249 1.00 1.35 H new ATOM 0 HD21 LEU A 101 4.903 -5.984 1.433 1.00 53.51 H new ATOM 0 HD22 LEU A 101 6.093 -6.910 0.488 1.00 53.51 H new ATOM 0 HD23 LEU A 101 4.634 -6.267 -0.303 1.00 53.51 H new ATOM 122 N LEU A 102 4.928 -9.035 -3.902 1.00 22.34 N ATOM 123 CA LEU A 102 5.429 -9.784 -5.075 1.00 0.44 C ATOM 124 C LEU A 102 6.972 -9.719 -5.113 1.00 62.25 C ATOM 125 O LEU A 102 7.551 -8.726 -4.650 1.00 24.34 O ATOM 126 CB LEU A 102 4.847 -9.178 -6.387 1.00 30.05 C ATOM 127 CG LEU A 102 3.297 -8.994 -6.436 1.00 53.04 C ATOM 128 CD1 LEU A 102 2.866 -8.275 -7.732 1.00 71.42 C ATOM 129 CD2 LEU A 102 2.551 -10.340 -6.251 1.00 64.12 C ATOM 0 H LEU A 102 4.849 -8.033 -4.074 1.00 22.34 H new ATOM 0 HA LEU A 102 5.111 -10.823 -4.993 1.00 0.44 H new ATOM 0 HB2 LEU A 102 5.312 -8.206 -6.551 1.00 30.05 H new ATOM 0 HB3 LEU A 102 5.142 -9.817 -7.219 1.00 30.05 H new ATOM 0 HG LEU A 102 3.014 -8.360 -5.596 1.00 53.04 H new ATOM 0 HD11 LEU A 102 1.782 -8.160 -7.741 1.00 71.42 H new ATOM 0 HD12 LEU A 102 3.336 -7.293 -7.777 1.00 71.42 H new ATOM 0 HD13 LEU A 102 3.175 -8.864 -8.595 1.00 71.42 H new ATOM 0 HD21 LEU A 102 1.475 -10.168 -6.291 1.00 64.12 H new ATOM 0 HD22 LEU A 102 2.839 -11.028 -7.046 1.00 64.12 H new ATOM 0 HD23 LEU A 102 2.814 -10.772 -5.285 1.00 64.12 H new ATOM 141 N PRO A 103 7.666 -10.765 -5.675 1.00 32.33 N ATOM 142 CA PRO A 103 9.129 -10.752 -5.819 1.00 10.13 C ATOM 143 C PRO A 103 9.598 -10.000 -7.088 1.00 52.02 C ATOM 144 O PRO A 103 8.789 -9.426 -7.833 1.00 34.12 O ATOM 145 CB PRO A 103 9.480 -12.259 -5.878 1.00 70.41 C ATOM 146 CG PRO A 103 8.279 -12.936 -6.485 1.00 62.13 C ATOM 147 CD PRO A 103 7.077 -12.030 -6.209 1.00 63.24 C ATOM 0 HA PRO A 103 9.626 -10.222 -5.007 1.00 10.13 H new ATOM 0 HB2 PRO A 103 10.372 -12.430 -6.481 1.00 70.41 H new ATOM 0 HB3 PRO A 103 9.689 -12.651 -4.883 1.00 70.41 H new ATOM 0 HG2 PRO A 103 8.417 -13.080 -7.557 1.00 62.13 H new ATOM 0 HG3 PRO A 103 8.128 -13.923 -6.047 1.00 62.13 H new ATOM 0 HD2 PRO A 103 6.503 -11.846 -7.117 1.00 63.24 H new ATOM 0 HD3 PRO A 103 6.397 -12.484 -5.489 1.00 63.24 H new ATOM 274 N ARG A 117 16.791 -2.749 -2.248 1.00 13.03 N ATOM 275 CA ARG A 117 15.926 -3.596 -3.094 1.00 43.12 C ATOM 276 C ARG A 117 14.494 -3.047 -3.205 1.00 34.24 C ATOM 277 O ARG A 117 13.831 -2.791 -2.200 1.00 4.25 O ATOM 278 CB ARG A 117 15.894 -5.031 -2.518 1.00 43.55 C ATOM 279 CG ARG A 117 14.990 -6.042 -3.273 1.00 1.22 C ATOM 280 CD ARG A 117 14.889 -7.382 -2.536 1.00 2.11 C ATOM 281 NE ARG A 117 13.977 -8.340 -3.193 1.00 10.44 N ATOM 282 CZ ARG A 117 13.447 -9.426 -2.596 1.00 73.24 C ATOM 283 NH1 ARG A 117 13.707 -9.697 -1.318 1.00 30.12 N ATOM 284 NH2 ARG A 117 12.679 -10.248 -3.291 1.00 31.11 N ATOM 0 HA ARG A 117 16.348 -3.599 -4.099 1.00 43.12 H new ATOM 0 HB2 ARG A 117 16.912 -5.421 -2.507 1.00 43.55 H new ATOM 0 HB3 ARG A 117 15.561 -4.979 -1.481 1.00 43.55 H new ATOM 0 HG2 ARG A 117 13.993 -5.618 -3.393 1.00 1.22 H new ATOM 0 HG3 ARG A 117 15.388 -6.208 -4.274 1.00 1.22 H new ATOM 0 HD2 ARG A 117 15.882 -7.826 -2.465 1.00 2.11 H new ATOM 0 HD3 ARG A 117 14.546 -7.204 -1.517 1.00 2.11 H new ATOM 0 HE ARG A 117 13.731 -8.168 -4.168 1.00 10.44 H new ATOM 0 HH11 ARG A 117 14.314 -9.079 -0.779 1.00 30.12 H new ATOM 0 HH12 ARG A 117 13.299 -10.522 -0.878 1.00 30.12 H new ATOM 0 HH21 ARG A 117 12.490 -10.059 -4.275 1.00 31.11 H new ATOM 0 HH22 ARG A 117 12.276 -11.071 -2.843 1.00 31.11 H new ATOM 298 N ASP A 118 14.038 -2.900 -4.443 1.00 43.33 N ATOM 299 CA ASP A 118 12.656 -2.507 -4.759 1.00 33.24 C ATOM 300 C ASP A 118 11.733 -3.721 -4.574 1.00 3.23 C ATOM 301 O ASP A 118 12.165 -4.865 -4.745 1.00 22.04 O ATOM 302 CB ASP A 118 12.568 -1.951 -6.202 1.00 63.35 C ATOM 303 CG ASP A 118 13.014 -2.962 -7.283 1.00 20.20 C ATOM 304 OD1 ASP A 118 14.236 -3.213 -7.402 1.00 44.15 O ATOM 305 OD2 ASP A 118 12.150 -3.495 -8.020 1.00 35.44 O ATOM 0 H ASP A 118 14.617 -3.050 -5.269 1.00 43.33 H new ATOM 0 HA ASP A 118 12.336 -1.715 -4.082 1.00 33.24 H new ATOM 0 HB2 ASP A 118 11.541 -1.646 -6.403 1.00 63.35 H new ATOM 0 HB3 ASP A 118 13.186 -1.056 -6.276 1.00 63.35 H new ATOM 310 N LEU A 119 10.482 -3.479 -4.185 1.00 14.53 N ATOM 311 CA LEU A 119 9.498 -4.554 -3.962 1.00 34.41 C ATOM 312 C LEU A 119 8.139 -4.081 -4.491 1.00 22.44 C ATOM 313 O LEU A 119 7.701 -2.965 -4.193 1.00 34.02 O ATOM 314 CB LEU A 119 9.447 -4.944 -2.449 1.00 63.12 C ATOM 315 CG LEU A 119 8.864 -6.364 -2.070 1.00 24.21 C ATOM 316 CD1 LEU A 119 9.229 -6.734 -0.611 1.00 43.14 C ATOM 317 CD2 LEU A 119 7.331 -6.451 -2.276 1.00 40.14 C ATOM 0 H LEU A 119 10.117 -2.542 -4.015 1.00 14.53 H new ATOM 0 HA LEU A 119 9.786 -5.456 -4.502 1.00 34.41 H new ATOM 0 HB2 LEU A 119 10.461 -4.882 -2.053 1.00 63.12 H new ATOM 0 HB3 LEU A 119 8.856 -4.190 -1.929 1.00 63.12 H new ATOM 0 HG LEU A 119 9.323 -7.083 -2.749 1.00 24.21 H new ATOM 0 HD11 LEU A 119 8.818 -7.715 -0.371 1.00 43.14 H new ATOM 0 HD12 LEU A 119 10.313 -6.758 -0.502 1.00 43.14 H new ATOM 0 HD13 LEU A 119 8.813 -5.990 0.068 1.00 43.14 H new ATOM 0 HD21 LEU A 119 6.983 -7.447 -2.001 1.00 40.14 H new ATOM 0 HD22 LEU A 119 6.837 -5.708 -1.650 1.00 40.14 H new ATOM 0 HD23 LEU A 119 7.093 -6.260 -3.322 1.00 40.14 H new ATOM 329 N ARG A 120 7.492 -4.940 -5.291 1.00 52.54 N ATOM 330 CA ARG A 120 6.203 -4.642 -5.923 1.00 24.52 C ATOM 331 C ARG A 120 5.078 -5.166 -5.026 1.00 42.03 C ATOM 332 O ARG A 120 4.978 -6.359 -4.797 1.00 62.32 O ATOM 333 CB ARG A 120 6.129 -5.300 -7.330 1.00 72.30 C ATOM 334 CG ARG A 120 4.876 -4.907 -8.148 1.00 63.42 C ATOM 335 CD ARG A 120 4.792 -3.392 -8.401 1.00 53.34 C ATOM 336 NE ARG A 120 3.563 -3.019 -9.109 1.00 41.11 N ATOM 337 CZ ARG A 120 3.388 -1.887 -9.804 1.00 14.20 C ATOM 338 NH1 ARG A 120 4.365 -0.990 -9.900 1.00 73.02 N ATOM 339 NH2 ARG A 120 2.226 -1.667 -10.398 1.00 15.54 N ATOM 0 H ARG A 120 7.852 -5.867 -5.518 1.00 52.54 H new ATOM 0 HA ARG A 120 6.095 -3.565 -6.048 1.00 24.52 H new ATOM 0 HB2 ARG A 120 7.019 -5.024 -7.895 1.00 72.30 H new ATOM 0 HB3 ARG A 120 6.148 -6.384 -7.214 1.00 72.30 H new ATOM 0 HG2 ARG A 120 4.890 -5.432 -9.103 1.00 63.42 H new ATOM 0 HG3 ARG A 120 3.982 -5.234 -7.617 1.00 63.42 H new ATOM 0 HD2 ARG A 120 4.837 -2.863 -7.449 1.00 53.34 H new ATOM 0 HD3 ARG A 120 5.657 -3.074 -8.984 1.00 53.34 H new ATOM 0 HE ARG A 120 2.781 -3.672 -9.069 1.00 41.11 H new ATOM 0 HH11 ARG A 120 5.260 -1.160 -9.442 1.00 73.02 H new ATOM 0 HH12 ARG A 120 4.219 -0.132 -10.432 1.00 73.02 H new ATOM 0 HH21 ARG A 120 1.477 -2.355 -10.324 1.00 15.54 H new ATOM 0 HH22 ARG A 120 2.080 -0.809 -10.930 1.00 15.54 H new ATOM 353 N ALA A 121 4.253 -4.266 -4.508 1.00 72.32 N ATOM 354 CA ALA A 121 3.183 -4.614 -3.567 1.00 14.30 C ATOM 355 C ALA A 121 1.865 -4.010 -4.053 1.00 24.44 C ATOM 356 O ALA A 121 1.853 -2.920 -4.631 1.00 14.13 O ATOM 357 CB ALA A 121 3.566 -4.128 -2.178 1.00 43.40 C ATOM 0 H ALA A 121 4.302 -3.271 -4.725 1.00 72.32 H new ATOM 0 HA ALA A 121 3.047 -5.694 -3.515 1.00 14.30 H new ATOM 0 HB1 ALA A 121 2.775 -4.383 -1.472 1.00 43.40 H new ATOM 0 HB2 ALA A 121 4.496 -4.605 -1.869 1.00 43.40 H new ATOM 0 HB3 ALA A 121 3.702 -3.047 -2.195 1.00 43.40 H new ATOM 363 N GLU A 122 0.763 -4.731 -3.841 1.00 1.10 N ATOM 364 CA GLU A 122 -0.574 -4.318 -4.319 1.00 42.43 C ATOM 365 C GLU A 122 -1.517 -4.319 -3.130 1.00 1.32 C ATOM 366 O GLU A 122 -1.667 -5.360 -2.479 1.00 22.14 O ATOM 367 CB GLU A 122 -1.095 -5.294 -5.403 1.00 1.40 C ATOM 368 CG GLU A 122 -0.133 -5.516 -6.582 1.00 21.23 C ATOM 369 CD GLU A 122 -0.697 -6.481 -7.625 1.00 41.30 C ATOM 370 OE1 GLU A 122 -0.553 -7.705 -7.448 1.00 74.55 O ATOM 371 OE2 GLU A 122 -1.304 -6.017 -8.619 1.00 35.33 O ATOM 0 H GLU A 122 0.763 -5.617 -3.335 1.00 1.10 H new ATOM 0 HA GLU A 122 -0.515 -3.324 -4.763 1.00 42.43 H new ATOM 0 HB2 GLU A 122 -1.304 -6.256 -4.936 1.00 1.40 H new ATOM 0 HB3 GLU A 122 -2.041 -4.915 -5.790 1.00 1.40 H new ATOM 0 HG2 GLU A 122 0.082 -4.559 -7.056 1.00 21.23 H new ATOM 0 HG3 GLU A 122 0.813 -5.905 -6.206 1.00 21.23 H new ATOM 378 N LEU A 123 -2.116 -3.162 -2.806 1.00 42.32 N ATOM 379 CA LEU A 123 -3.078 -3.073 -1.718 1.00 63.31 C ATOM 380 C LEU A 123 -4.490 -3.067 -2.345 1.00 0.50 C ATOM 381 O LEU A 123 -4.819 -2.168 -3.099 1.00 55.35 O ATOM 382 CB LEU A 123 -2.740 -1.847 -0.773 1.00 32.42 C ATOM 383 CG LEU A 123 -2.903 -0.348 -1.266 1.00 33.22 C ATOM 384 CD1 LEU A 123 -4.364 0.151 -1.167 1.00 24.34 C ATOM 385 CD2 LEU A 123 -1.973 0.607 -0.475 1.00 73.41 C ATOM 0 H LEU A 123 -1.945 -2.280 -3.288 1.00 42.32 H new ATOM 0 HA LEU A 123 -3.031 -3.933 -1.050 1.00 63.31 H new ATOM 0 HB2 LEU A 123 -3.357 -1.956 0.119 1.00 32.42 H new ATOM 0 HB3 LEU A 123 -1.703 -1.966 -0.459 1.00 32.42 H new ATOM 0 HG LEU A 123 -2.616 -0.341 -2.317 1.00 33.22 H new ATOM 0 HD11 LEU A 123 -4.421 1.182 -1.516 1.00 24.34 H new ATOM 0 HD12 LEU A 123 -5.006 -0.477 -1.785 1.00 24.34 H new ATOM 0 HD13 LEU A 123 -4.696 0.100 -0.130 1.00 24.34 H new ATOM 0 HD21 LEU A 123 -2.107 1.627 -0.835 1.00 73.41 H new ATOM 0 HD22 LEU A 123 -2.221 0.561 0.585 1.00 73.41 H new ATOM 0 HD23 LEU A 123 -0.935 0.305 -0.618 1.00 73.41 H new ATOM 397 N PRO A 124 -5.290 -4.166 -2.158 1.00 43.34 N ATOM 398 CA PRO A 124 -6.728 -4.177 -2.500 1.00 60.42 C ATOM 399 C PRO A 124 -7.495 -3.331 -1.461 1.00 14.11 C ATOM 400 O PRO A 124 -7.596 -3.722 -0.298 1.00 60.44 O ATOM 401 CB PRO A 124 -7.095 -5.688 -2.407 1.00 24.23 C ATOM 402 CG PRO A 124 -6.129 -6.234 -1.396 1.00 73.41 C ATOM 403 CD PRO A 124 -4.844 -5.479 -1.637 1.00 64.24 C ATOM 0 HA PRO A 124 -6.971 -3.757 -3.476 1.00 60.42 H new ATOM 0 HB2 PRO A 124 -8.128 -5.829 -2.089 1.00 24.23 H new ATOM 0 HB3 PRO A 124 -6.987 -6.185 -3.371 1.00 24.23 H new ATOM 0 HG2 PRO A 124 -6.492 -6.081 -0.380 1.00 73.41 H new ATOM 0 HG3 PRO A 124 -5.987 -7.307 -1.525 1.00 73.41 H new ATOM 0 HD2 PRO A 124 -4.268 -5.369 -0.718 1.00 64.24 H new ATOM 0 HD3 PRO A 124 -4.206 -5.996 -2.353 1.00 64.24 H new ATOM 411 N LEU A 125 -8.056 -2.194 -1.880 1.00 61.21 N ATOM 412 CA LEU A 125 -8.594 -1.190 -0.946 1.00 43.34 C ATOM 413 C LEU A 125 -10.119 -1.292 -0.924 1.00 31.43 C ATOM 414 O LEU A 125 -10.723 -1.524 -1.967 1.00 60.11 O ATOM 415 CB LEU A 125 -8.143 0.223 -1.404 1.00 20.45 C ATOM 416 CG LEU A 125 -8.353 1.387 -0.390 1.00 31.33 C ATOM 417 CD1 LEU A 125 -7.543 1.150 0.905 1.00 24.43 C ATOM 418 CD2 LEU A 125 -8.009 2.750 -1.030 1.00 72.23 C ATOM 0 H LEU A 125 -8.152 -1.941 -2.863 1.00 61.21 H new ATOM 0 HA LEU A 125 -8.218 -1.368 0.061 1.00 43.34 H new ATOM 0 HB2 LEU A 125 -7.083 0.177 -1.655 1.00 20.45 H new ATOM 0 HB3 LEU A 125 -8.677 0.470 -2.321 1.00 20.45 H new ATOM 0 HG LEU A 125 -9.408 1.409 -0.118 1.00 31.33 H new ATOM 0 HD11 LEU A 125 -7.709 1.978 1.594 1.00 24.43 H new ATOM 0 HD12 LEU A 125 -7.866 0.219 1.371 1.00 24.43 H new ATOM 0 HD13 LEU A 125 -6.482 1.085 0.664 1.00 24.43 H new ATOM 0 HD21 LEU A 125 -8.165 3.544 -0.300 1.00 72.23 H new ATOM 0 HD22 LEU A 125 -6.967 2.749 -1.349 1.00 72.23 H new ATOM 0 HD23 LEU A 125 -8.653 2.919 -1.893 1.00 72.23 H new ATOM 430 N THR A 126 -10.731 -1.145 0.262 1.00 35.00 N ATOM 431 CA THR A 126 -12.191 -1.229 0.404 1.00 40.55 C ATOM 432 C THR A 126 -12.848 0.093 -0.063 1.00 22.31 C ATOM 433 O THR A 126 -12.173 1.129 -0.150 1.00 51.50 O ATOM 434 CB THR A 126 -12.601 -1.576 1.880 1.00 25.20 C ATOM 435 OG1 THR A 126 -13.967 -2.029 1.910 1.00 60.50 O ATOM 436 CG2 THR A 126 -12.443 -0.392 2.842 1.00 2.33 C ATOM 0 H THR A 126 -10.236 -0.967 1.136 1.00 35.00 H new ATOM 0 HA THR A 126 -12.552 -2.038 -0.231 1.00 40.55 H new ATOM 0 HB THR A 126 -11.924 -2.361 2.217 1.00 25.20 H new ATOM 0 HG1 THR A 126 -14.396 -1.720 2.735 1.00 60.50 H new ATOM 0 HG21 THR A 126 -12.742 -0.696 3.845 1.00 2.33 H new ATOM 0 HG22 THR A 126 -11.402 -0.071 2.856 1.00 2.33 H new ATOM 0 HG23 THR A 126 -13.073 0.433 2.510 1.00 2.33 H new ATOM 444 N LEU A 127 -14.167 0.034 -0.329 1.00 43.44 N ATOM 445 CA LEU A 127 -14.949 1.157 -0.897 1.00 32.44 C ATOM 446 C LEU A 127 -14.995 2.365 0.052 1.00 0.31 C ATOM 447 O LEU A 127 -14.951 3.517 -0.394 1.00 54.42 O ATOM 448 CB LEU A 127 -16.391 0.689 -1.235 1.00 73.41 C ATOM 449 CG LEU A 127 -16.491 -0.527 -2.215 1.00 21.22 C ATOM 450 CD1 LEU A 127 -17.966 -0.883 -2.494 1.00 22.33 C ATOM 451 CD2 LEU A 127 -15.704 -0.270 -3.533 1.00 54.53 C ATOM 0 H LEU A 127 -14.728 -0.800 -0.155 1.00 43.44 H new ATOM 0 HA LEU A 127 -14.447 1.476 -1.810 1.00 32.44 H new ATOM 0 HB2 LEU A 127 -16.897 0.427 -0.306 1.00 73.41 H new ATOM 0 HB3 LEU A 127 -16.935 1.528 -1.668 1.00 73.41 H new ATOM 0 HG LEU A 127 -16.025 -1.385 -1.731 1.00 21.22 H new ATOM 0 HD11 LEU A 127 -18.013 -1.731 -3.177 1.00 22.33 H new ATOM 0 HD12 LEU A 127 -18.461 -1.144 -1.558 1.00 22.33 H new ATOM 0 HD13 LEU A 127 -18.468 -0.026 -2.944 1.00 22.33 H new ATOM 0 HD21 LEU A 127 -15.797 -1.137 -4.187 1.00 54.53 H new ATOM 0 HD22 LEU A 127 -16.110 0.609 -4.034 1.00 54.53 H new ATOM 0 HD23 LEU A 127 -14.652 -0.102 -3.302 1.00 54.53 H new ATOM 463 N GLU A 128 -15.071 2.075 1.358 1.00 43.33 N ATOM 464 CA GLU A 128 -15.154 3.100 2.416 1.00 51.45 C ATOM 465 C GLU A 128 -13.888 3.968 2.401 1.00 1.24 C ATOM 466 O GLU A 128 -13.961 5.198 2.403 1.00 73.15 O ATOM 467 CB GLU A 128 -15.328 2.456 3.824 1.00 50.43 C ATOM 468 CG GLU A 128 -16.512 1.471 3.987 1.00 50.20 C ATOM 469 CD GLU A 128 -16.194 0.046 3.506 1.00 42.45 C ATOM 470 OE1 GLU A 128 -16.538 -0.309 2.355 1.00 11.31 O ATOM 471 OE2 GLU A 128 -15.559 -0.725 4.269 1.00 42.32 O ATOM 0 H GLU A 128 -15.077 1.120 1.715 1.00 43.33 H new ATOM 0 HA GLU A 128 -16.029 3.717 2.215 1.00 51.45 H new ATOM 0 HB2 GLU A 128 -14.408 1.929 4.075 1.00 50.43 H new ATOM 0 HB3 GLU A 128 -15.446 3.257 4.554 1.00 50.43 H new ATOM 0 HG2 GLU A 128 -16.803 1.435 5.037 1.00 50.20 H new ATOM 0 HG3 GLU A 128 -17.369 1.851 3.431 1.00 50.20 H new ATOM 478 N GLU A 129 -12.745 3.277 2.321 1.00 70.01 N ATOM 479 CA GLU A 129 -11.413 3.884 2.320 1.00 2.12 C ATOM 480 C GLU A 129 -11.117 4.614 0.996 1.00 13.34 C ATOM 481 O GLU A 129 -10.537 5.698 1.004 1.00 25.25 O ATOM 482 CB GLU A 129 -10.352 2.782 2.607 1.00 63.02 C ATOM 483 CG GLU A 129 -10.386 2.226 4.042 1.00 14.03 C ATOM 484 CD GLU A 129 -10.144 3.301 5.117 1.00 60.41 C ATOM 485 OE1 GLU A 129 -9.030 3.848 5.171 1.00 11.45 O ATOM 486 OE2 GLU A 129 -11.053 3.570 5.928 1.00 42.41 O ATOM 0 H GLU A 129 -12.722 2.259 2.254 1.00 70.01 H new ATOM 0 HA GLU A 129 -11.371 4.639 3.105 1.00 2.12 H new ATOM 0 HB2 GLU A 129 -10.502 1.959 1.908 1.00 63.02 H new ATOM 0 HB3 GLU A 129 -9.360 3.190 2.412 1.00 63.02 H new ATOM 0 HG2 GLU A 129 -11.353 1.756 4.219 1.00 14.03 H new ATOM 0 HG3 GLU A 129 -9.630 1.447 4.140 1.00 14.03 H new ATOM 493 N ALA A 130 -11.536 4.011 -0.129 1.00 74.40 N ATOM 494 CA ALA A 130 -11.330 4.577 -1.480 1.00 34.33 C ATOM 495 C ALA A 130 -12.002 5.957 -1.614 1.00 24.32 C ATOM 496 O ALA A 130 -11.344 6.978 -1.863 1.00 25.43 O ATOM 497 CB ALA A 130 -11.871 3.609 -2.549 1.00 71.25 C ATOM 0 H ALA A 130 -12.027 3.117 -0.131 1.00 74.40 H new ATOM 0 HA ALA A 130 -10.259 4.710 -1.633 1.00 34.33 H new ATOM 0 HB1 ALA A 130 -11.714 4.036 -3.539 1.00 71.25 H new ATOM 0 HB2 ALA A 130 -11.345 2.657 -2.477 1.00 71.25 H new ATOM 0 HB3 ALA A 130 -12.937 3.448 -2.388 1.00 71.25 H new ATOM 503 N PHE A 131 -13.318 5.956 -1.382 1.00 25.50 N ATOM 504 CA PHE A 131 -14.176 7.129 -1.536 1.00 41.54 C ATOM 505 C PHE A 131 -13.842 8.204 -0.482 1.00 55.34 C ATOM 506 O PHE A 131 -13.507 9.335 -0.834 1.00 12.23 O ATOM 507 CB PHE A 131 -15.661 6.688 -1.432 1.00 3.11 C ATOM 508 CG PHE A 131 -16.695 7.785 -1.702 1.00 20.51 C ATOM 509 CD1 PHE A 131 -17.155 8.032 -2.994 1.00 33.30 C ATOM 510 CD2 PHE A 131 -17.192 8.584 -0.666 1.00 1.32 C ATOM 511 CE1 PHE A 131 -18.097 9.021 -3.237 1.00 44.02 C ATOM 512 CE2 PHE A 131 -18.128 9.573 -0.913 1.00 65.40 C ATOM 513 CZ PHE A 131 -18.569 9.799 -2.199 1.00 32.13 C ATOM 0 H PHE A 131 -13.823 5.124 -1.077 1.00 25.50 H new ATOM 0 HA PHE A 131 -14.001 7.575 -2.515 1.00 41.54 H new ATOM 0 HB2 PHE A 131 -15.830 5.873 -2.136 1.00 3.11 H new ATOM 0 HB3 PHE A 131 -15.834 6.288 -0.433 1.00 3.11 H new ATOM 0 HD1 PHE A 131 -16.773 7.446 -3.817 1.00 33.30 H new ATOM 0 HD2 PHE A 131 -16.839 8.426 0.343 1.00 1.32 H new ATOM 0 HE1 PHE A 131 -18.462 9.183 -4.241 1.00 44.02 H new ATOM 0 HE2 PHE A 131 -18.513 10.168 -0.098 1.00 65.40 H new ATOM 0 HZ PHE A 131 -19.284 10.585 -2.395 1.00 32.13 H new ATOM 523 N HIS A 132 -13.909 7.833 0.810 1.00 43.22 N ATOM 524 CA HIS A 132 -13.810 8.810 1.919 1.00 43.45 C ATOM 525 C HIS A 132 -12.345 9.241 2.159 1.00 73.11 C ATOM 526 O HIS A 132 -12.072 10.426 2.381 1.00 3.33 O ATOM 527 CB HIS A 132 -14.427 8.233 3.217 1.00 24.14 C ATOM 528 CG HIS A 132 -15.904 7.937 3.135 1.00 34.13 C ATOM 529 ND1 HIS A 132 -16.421 6.657 3.096 1.00 34.05 N ATOM 530 CD2 HIS A 132 -16.976 8.764 3.100 1.00 50.24 C ATOM 531 CE1 HIS A 132 -17.735 6.711 3.040 1.00 34.41 C ATOM 532 NE2 HIS A 132 -18.096 7.975 3.044 1.00 20.32 N ATOM 0 H HIS A 132 -14.031 6.867 1.115 1.00 43.22 H new ATOM 0 HA HIS A 132 -14.377 9.695 1.631 1.00 43.45 H new ATOM 0 HB2 HIS A 132 -13.900 7.315 3.477 1.00 24.14 H new ATOM 0 HB3 HIS A 132 -14.256 8.939 4.030 1.00 24.14 H new ATOM 0 HD1 HIS A 132 -15.868 5.800 3.109 1.00 34.05 H new ATOM 0 HD2 HIS A 132 -16.953 9.844 3.114 1.00 50.24 H new ATOM 0 HE1 HIS A 132 -18.402 5.863 2.998 1.00 34.41 H new ATOM 541 N GLY A 133 -11.407 8.271 2.101 1.00 53.11 N ATOM 542 CA GLY A 133 -9.983 8.532 2.382 1.00 10.14 C ATOM 543 C GLY A 133 -9.649 8.477 3.872 1.00 11.23 C ATOM 544 O GLY A 133 -10.552 8.506 4.722 1.00 44.33 O ATOM 0 H GLY A 133 -11.613 7.301 1.862 1.00 53.11 H new ATOM 0 HA2 GLY A 133 -9.374 7.800 1.851 1.00 10.14 H new ATOM 0 HA3 GLY A 133 -9.715 9.514 1.991 1.00 10.14 H new ATOM 548 N GLY A 134 -8.346 8.393 4.187 1.00 51.20 N ATOM 549 CA GLY A 134 -7.875 8.333 5.571 1.00 44.24 C ATOM 550 C GLY A 134 -6.586 7.552 5.692 1.00 21.14 C ATOM 551 O GLY A 134 -5.795 7.526 4.754 1.00 30.51 O ATOM 0 H GLY A 134 -7.599 8.365 3.493 1.00 51.20 H new ATOM 0 HA2 GLY A 134 -7.724 9.345 5.948 1.00 44.24 H new ATOM 0 HA3 GLY A 134 -8.640 7.871 6.196 1.00 44.24 H new ATOM 555 N GLU A 135 -6.325 6.981 6.881 1.00 33.23 N ATOM 556 CA GLU A 135 -5.191 6.059 7.086 1.00 33.20 C ATOM 557 C GLU A 135 -5.738 4.639 7.195 1.00 43.24 C ATOM 558 O GLU A 135 -6.561 4.367 8.076 1.00 2.04 O ATOM 559 CB GLU A 135 -4.357 6.412 8.352 1.00 73.12 C ATOM 560 CG GLU A 135 -3.538 7.725 8.278 1.00 30.12 C ATOM 561 CD GLU A 135 -4.391 8.998 8.402 1.00 74.12 C ATOM 562 OE1 GLU A 135 -4.799 9.563 7.369 1.00 52.13 O ATOM 563 OE2 GLU A 135 -4.662 9.436 9.540 1.00 34.35 O ATOM 0 H GLU A 135 -6.885 7.142 7.718 1.00 33.23 H new ATOM 0 HA GLU A 135 -4.516 6.149 6.235 1.00 33.20 H new ATOM 0 HB2 GLU A 135 -5.035 6.477 9.203 1.00 73.12 H new ATOM 0 HB3 GLU A 135 -3.671 5.589 8.552 1.00 73.12 H new ATOM 0 HG2 GLU A 135 -2.791 7.721 9.072 1.00 30.12 H new ATOM 0 HG3 GLU A 135 -2.998 7.752 7.332 1.00 30.12 H new ATOM 570 N ARG A 136 -5.289 3.742 6.303 1.00 33.25 N ATOM 571 CA ARG A 136 -5.730 2.346 6.293 1.00 64.43 C ATOM 572 C ARG A 136 -4.557 1.435 6.663 1.00 1.00 C ATOM 573 O ARG A 136 -3.508 1.458 6.016 1.00 63.31 O ATOM 574 CB ARG A 136 -6.322 1.979 4.902 1.00 3.13 C ATOM 575 CG ARG A 136 -6.807 0.514 4.732 1.00 32.34 C ATOM 576 CD ARG A 136 -7.525 -0.088 5.968 1.00 14.14 C ATOM 577 NE ARG A 136 -8.583 0.766 6.536 1.00 1.25 N ATOM 578 CZ ARG A 136 -9.275 0.490 7.657 1.00 42.21 C ATOM 579 NH1 ARG A 136 -9.026 -0.614 8.356 1.00 61.11 N ATOM 580 NH2 ARG A 136 -10.206 1.328 8.084 1.00 35.42 N ATOM 0 H ARG A 136 -4.613 3.967 5.573 1.00 33.25 H new ATOM 0 HA ARG A 136 -6.518 2.206 7.033 1.00 64.43 H new ATOM 0 HB2 ARG A 136 -7.162 2.644 4.700 1.00 3.13 H new ATOM 0 HB3 ARG A 136 -5.566 2.181 4.143 1.00 3.13 H new ATOM 0 HG2 ARG A 136 -7.485 0.468 3.879 1.00 32.34 H new ATOM 0 HG3 ARG A 136 -5.948 -0.111 4.490 1.00 32.34 H new ATOM 0 HD2 ARG A 136 -7.961 -1.047 5.688 1.00 14.14 H new ATOM 0 HD3 ARG A 136 -6.783 -0.289 6.741 1.00 14.14 H new ATOM 0 HE ARG A 136 -8.808 1.630 6.043 1.00 1.25 H new ATOM 0 HH11 ARG A 136 -8.304 -1.263 8.044 1.00 61.11 H new ATOM 0 HH12 ARG A 136 -9.558 -0.812 9.204 1.00 61.11 H new ATOM 0 HH21 ARG A 136 -10.400 2.184 7.564 1.00 35.42 H new ATOM 0 HH22 ARG A 136 -10.730 1.118 8.934 1.00 35.42 H new ATOM 594 N VAL A 137 -4.756 0.656 7.732 1.00 62.23 N ATOM 595 CA VAL A 137 -3.806 -0.344 8.204 1.00 23.14 C ATOM 596 C VAL A 137 -3.802 -1.565 7.260 1.00 63.11 C ATOM 597 O VAL A 137 -4.846 -1.963 6.720 1.00 64.23 O ATOM 598 CB VAL A 137 -4.156 -0.774 9.676 1.00 34.31 C ATOM 599 CG1 VAL A 137 -3.281 -1.950 10.158 1.00 2.53 C ATOM 600 CG2 VAL A 137 -4.040 0.436 10.640 1.00 12.32 C ATOM 0 H VAL A 137 -5.601 0.708 8.301 1.00 62.23 H new ATOM 0 HA VAL A 137 -2.806 0.090 8.204 1.00 23.14 H new ATOM 0 HB VAL A 137 -5.189 -1.122 9.678 1.00 34.31 H new ATOM 0 HG11 VAL A 137 -3.557 -2.214 11.179 1.00 2.53 H new ATOM 0 HG12 VAL A 137 -3.436 -2.810 9.506 1.00 2.53 H new ATOM 0 HG13 VAL A 137 -2.231 -1.658 10.129 1.00 2.53 H new ATOM 0 HG21 VAL A 137 -4.286 0.119 11.653 1.00 12.32 H new ATOM 0 HG22 VAL A 137 -3.021 0.822 10.618 1.00 12.32 H new ATOM 0 HG23 VAL A 137 -4.731 1.218 10.327 1.00 12.32 H new ATOM 610 N VAL A 138 -2.605 -2.109 7.055 1.00 11.11 N ATOM 611 CA VAL A 138 -2.363 -3.318 6.288 1.00 15.21 C ATOM 612 C VAL A 138 -1.377 -4.198 7.081 1.00 44.42 C ATOM 613 O VAL A 138 -0.317 -3.728 7.515 1.00 42.41 O ATOM 614 CB VAL A 138 -1.826 -2.987 4.845 1.00 43.52 C ATOM 615 CG1 VAL A 138 -0.615 -2.017 4.851 1.00 30.00 C ATOM 616 CG2 VAL A 138 -1.511 -4.278 4.077 1.00 24.21 C ATOM 0 H VAL A 138 -1.750 -1.702 7.434 1.00 11.11 H new ATOM 0 HA VAL A 138 -3.298 -3.860 6.143 1.00 15.21 H new ATOM 0 HB VAL A 138 -2.625 -2.459 4.325 1.00 43.52 H new ATOM 0 HG11 VAL A 138 -0.294 -1.830 3.826 1.00 30.00 H new ATOM 0 HG12 VAL A 138 -0.905 -1.076 5.318 1.00 30.00 H new ATOM 0 HG13 VAL A 138 0.206 -2.463 5.413 1.00 30.00 H new ATOM 0 HG21 VAL A 138 -1.141 -4.029 3.082 1.00 24.21 H new ATOM 0 HG22 VAL A 138 -0.751 -4.845 4.615 1.00 24.21 H new ATOM 0 HG23 VAL A 138 -2.416 -4.878 3.988 1.00 24.21 H new ATOM 626 N GLU A 139 -1.781 -5.452 7.311 1.00 3.21 N ATOM 627 CA GLU A 139 -1.018 -6.433 8.093 1.00 42.05 C ATOM 628 C GLU A 139 -0.558 -7.582 7.169 1.00 32.31 C ATOM 629 O GLU A 139 -1.379 -8.355 6.666 1.00 0.05 O ATOM 630 CB GLU A 139 -1.885 -6.952 9.290 1.00 63.34 C ATOM 631 CG GLU A 139 -3.327 -7.401 8.922 1.00 63.12 C ATOM 632 CD GLU A 139 -4.103 -8.028 10.093 1.00 74.23 C ATOM 633 OE1 GLU A 139 -4.936 -7.330 10.725 1.00 1.43 O ATOM 634 OE2 GLU A 139 -3.891 -9.227 10.375 1.00 1.31 O ATOM 0 H GLU A 139 -2.662 -5.821 6.953 1.00 3.21 H new ATOM 0 HA GLU A 139 -0.128 -5.966 8.514 1.00 42.05 H new ATOM 0 HB2 GLU A 139 -1.368 -7.792 9.754 1.00 63.34 H new ATOM 0 HB3 GLU A 139 -1.948 -6.163 10.040 1.00 63.34 H new ATOM 0 HG2 GLU A 139 -3.882 -6.539 8.551 1.00 63.12 H new ATOM 0 HG3 GLU A 139 -3.275 -8.122 8.106 1.00 63.12 H new ATOM 641 N VAL A 140 0.759 -7.637 6.907 1.00 1.23 N ATOM 642 CA VAL A 140 1.399 -8.673 6.059 1.00 54.24 C ATOM 643 C VAL A 140 2.757 -9.052 6.633 1.00 50.34 C ATOM 644 O VAL A 140 3.471 -8.188 7.151 1.00 20.42 O ATOM 645 CB VAL A 140 1.565 -8.216 4.561 1.00 24.24 C ATOM 646 CG1 VAL A 140 0.234 -8.366 3.801 1.00 23.22 C ATOM 647 CG2 VAL A 140 2.124 -6.762 4.471 1.00 4.34 C ATOM 0 H VAL A 140 1.422 -6.958 7.280 1.00 1.23 H new ATOM 0 HA VAL A 140 0.736 -9.538 6.062 1.00 54.24 H new ATOM 0 HB VAL A 140 2.297 -8.867 4.082 1.00 24.24 H new ATOM 0 HG11 VAL A 140 0.367 -8.046 2.768 1.00 23.22 H new ATOM 0 HG12 VAL A 140 -0.080 -9.410 3.820 1.00 23.22 H new ATOM 0 HG13 VAL A 140 -0.528 -7.749 4.277 1.00 23.22 H new ATOM 0 HG21 VAL A 140 2.227 -6.476 3.424 1.00 4.34 H new ATOM 0 HG22 VAL A 140 1.438 -6.077 4.968 1.00 4.34 H new ATOM 0 HG23 VAL A 140 3.098 -6.716 4.957 1.00 4.34 H new ATOM 657 N ALA A 141 3.076 -10.364 6.549 1.00 53.34 N ATOM 658 CA ALA A 141 4.335 -10.953 7.053 1.00 72.01 C ATOM 659 C ALA A 141 4.436 -10.839 8.600 1.00 0.23 C ATOM 660 O ALA A 141 5.522 -10.988 9.175 1.00 42.51 O ATOM 661 CB ALA A 141 5.557 -10.325 6.336 1.00 32.21 C ATOM 0 H ALA A 141 2.456 -11.052 6.123 1.00 53.34 H new ATOM 0 HA ALA A 141 4.333 -12.018 6.820 1.00 72.01 H new ATOM 0 HB1 ALA A 141 6.474 -10.772 6.721 1.00 32.21 H new ATOM 0 HB2 ALA A 141 5.485 -10.511 5.264 1.00 32.21 H new ATOM 0 HB3 ALA A 141 5.573 -9.250 6.518 1.00 32.21 H new ATOM 667 N GLY A 142 3.267 -10.628 9.261 1.00 13.02 N ATOM 668 CA GLY A 142 3.199 -10.378 10.708 1.00 43.31 C ATOM 669 C GLY A 142 3.531 -8.931 11.084 1.00 63.13 C ATOM 670 O GLY A 142 3.696 -8.610 12.264 1.00 64.13 O ATOM 0 H GLY A 142 2.357 -10.628 8.801 1.00 13.02 H new ATOM 0 HA2 GLY A 142 2.198 -10.620 11.066 1.00 43.31 H new ATOM 0 HA3 GLY A 142 3.890 -11.048 11.219 1.00 43.31 H new ATOM 674 N ARG A 143 3.601 -8.048 10.069 1.00 71.53 N ATOM 675 CA ARG A 143 4.051 -6.649 10.210 1.00 42.32 C ATOM 676 C ARG A 143 2.906 -5.676 9.872 1.00 22.23 C ATOM 677 O ARG A 143 2.322 -5.754 8.786 1.00 42.44 O ATOM 678 CB ARG A 143 5.275 -6.425 9.281 1.00 33.33 C ATOM 679 CG ARG A 143 5.900 -5.011 9.325 1.00 73.33 C ATOM 680 CD ARG A 143 7.249 -4.946 8.587 1.00 2.12 C ATOM 681 NE ARG A 143 8.234 -5.868 9.186 1.00 31.44 N ATOM 682 CZ ARG A 143 9.564 -5.756 9.087 1.00 32.43 C ATOM 683 NH1 ARG A 143 10.112 -4.758 8.412 1.00 14.14 N ATOM 684 NH2 ARG A 143 10.340 -6.642 9.688 1.00 22.54 N ATOM 0 H ARG A 143 3.342 -8.290 9.113 1.00 71.53 H new ATOM 0 HA ARG A 143 4.345 -6.455 11.242 1.00 42.32 H new ATOM 0 HB2 ARG A 143 6.045 -7.151 9.543 1.00 33.33 H new ATOM 0 HB3 ARG A 143 4.973 -6.637 8.255 1.00 33.33 H new ATOM 0 HG2 ARG A 143 5.209 -4.297 8.878 1.00 73.33 H new ATOM 0 HG3 ARG A 143 6.041 -4.711 10.363 1.00 73.33 H new ATOM 0 HD2 ARG A 143 7.104 -5.198 7.537 1.00 2.12 H new ATOM 0 HD3 ARG A 143 7.635 -3.927 8.620 1.00 2.12 H new ATOM 0 HE ARG A 143 7.870 -6.657 9.720 1.00 31.44 H new ATOM 0 HH11 ARG A 143 9.519 -4.062 7.959 1.00 14.14 H new ATOM 0 HH12 ARG A 143 11.127 -4.685 8.345 1.00 14.14 H new ATOM 0 HH21 ARG A 143 9.924 -7.405 10.223 1.00 22.54 H new ATOM 0 HH22 ARG A 143 11.354 -6.563 9.617 1.00 22.54 H new ATOM 698 N ARG A 144 2.595 -4.772 10.820 1.00 52.35 N ATOM 699 CA ARG A 144 1.516 -3.773 10.683 1.00 51.45 C ATOM 700 C ARG A 144 2.102 -2.416 10.245 1.00 71.21 C ATOM 701 O ARG A 144 3.112 -1.962 10.798 1.00 3.30 O ATOM 702 CB ARG A 144 0.767 -3.614 12.037 1.00 15.31 C ATOM 703 CG ARG A 144 -0.253 -2.446 12.087 1.00 42.13 C ATOM 704 CD ARG A 144 -0.893 -2.240 13.474 1.00 62.31 C ATOM 705 NE ARG A 144 -1.776 -3.351 13.860 1.00 1.42 N ATOM 706 CZ ARG A 144 -2.338 -3.518 15.072 1.00 3.33 C ATOM 707 NH1 ARG A 144 -2.124 -2.652 16.064 1.00 61.53 N ATOM 708 NH2 ARG A 144 -3.130 -4.563 15.269 1.00 62.34 N ATOM 0 H ARG A 144 3.089 -4.713 11.710 1.00 52.35 H new ATOM 0 HA ARG A 144 0.813 -4.115 9.924 1.00 51.45 H new ATOM 0 HB2 ARG A 144 0.243 -4.544 12.257 1.00 15.31 H new ATOM 0 HB3 ARG A 144 1.503 -3.468 12.828 1.00 15.31 H new ATOM 0 HG2 ARG A 144 0.248 -1.525 11.788 1.00 42.13 H new ATOM 0 HG3 ARG A 144 -1.041 -2.632 11.357 1.00 42.13 H new ATOM 0 HD2 ARG A 144 -0.106 -2.130 14.220 1.00 62.31 H new ATOM 0 HD3 ARG A 144 -1.463 -1.311 13.473 1.00 62.31 H new ATOM 0 HE ARG A 144 -1.980 -4.054 13.150 1.00 1.42 H new ATOM 0 HH11 ARG A 144 -1.523 -1.842 15.913 1.00 61.53 H new ATOM 0 HH12 ARG A 144 -2.561 -2.800 16.974 1.00 61.53 H new ATOM 0 HH21 ARG A 144 -3.303 -5.222 14.510 1.00 62.34 H new ATOM 0 HH22 ARG A 144 -3.566 -4.708 16.180 1.00 62.34 H new ATOM 722 N VAL A 145 1.454 -1.784 9.253 1.00 63.23 N ATOM 723 CA VAL A 145 1.753 -0.399 8.835 1.00 63.22 C ATOM 724 C VAL A 145 0.455 0.281 8.333 1.00 34.24 C ATOM 725 O VAL A 145 -0.375 -0.358 7.691 1.00 32.54 O ATOM 726 CB VAL A 145 2.884 -0.344 7.737 1.00 40.44 C ATOM 727 CG1 VAL A 145 2.505 -1.160 6.474 1.00 24.13 C ATOM 728 CG2 VAL A 145 3.251 1.129 7.400 1.00 23.30 C ATOM 0 H VAL A 145 0.705 -2.219 8.714 1.00 63.23 H new ATOM 0 HA VAL A 145 2.132 0.145 9.700 1.00 63.22 H new ATOM 0 HB VAL A 145 3.775 -0.818 8.148 1.00 40.44 H new ATOM 0 HG11 VAL A 145 3.311 -1.095 5.743 1.00 24.13 H new ATOM 0 HG12 VAL A 145 2.347 -2.203 6.749 1.00 24.13 H new ATOM 0 HG13 VAL A 145 1.590 -0.756 6.041 1.00 24.13 H new ATOM 0 HG21 VAL A 145 4.033 1.145 6.641 1.00 23.30 H new ATOM 0 HG22 VAL A 145 2.369 1.647 7.023 1.00 23.30 H new ATOM 0 HG23 VAL A 145 3.609 1.630 8.300 1.00 23.30 H new ATOM 738 N SER A 146 0.273 1.574 8.657 1.00 21.22 N ATOM 739 CA SER A 146 -0.909 2.352 8.243 1.00 0.11 C ATOM 740 C SER A 146 -0.504 3.358 7.146 1.00 10.20 C ATOM 741 O SER A 146 0.442 4.136 7.336 1.00 22.22 O ATOM 742 CB SER A 146 -1.503 3.064 9.475 1.00 22.33 C ATOM 743 OG SER A 146 -2.757 3.652 9.175 1.00 32.14 O ATOM 0 H SER A 146 0.941 2.109 9.213 1.00 21.22 H new ATOM 0 HA SER A 146 -1.672 1.693 7.829 1.00 0.11 H new ATOM 0 HB2 SER A 146 -1.620 2.349 10.290 1.00 22.33 H new ATOM 0 HB3 SER A 146 -0.812 3.833 9.822 1.00 22.33 H new ATOM 0 HG SER A 146 -3.066 4.175 9.944 1.00 32.14 H new ATOM 749 N VAL A 147 -1.199 3.313 5.994 1.00 5.52 N ATOM 750 CA VAL A 147 -0.897 4.165 4.832 1.00 55.40 C ATOM 751 C VAL A 147 -1.965 5.269 4.670 1.00 5.52 C ATOM 752 O VAL A 147 -3.166 4.985 4.619 1.00 5.12 O ATOM 753 CB VAL A 147 -0.750 3.313 3.506 1.00 34.31 C ATOM 754 CG1 VAL A 147 -2.003 2.454 3.186 1.00 31.02 C ATOM 755 CG2 VAL A 147 -0.363 4.213 2.318 1.00 74.10 C ATOM 0 H VAL A 147 -1.987 2.683 5.844 1.00 5.52 H new ATOM 0 HA VAL A 147 0.064 4.646 5.015 1.00 55.40 H new ATOM 0 HB VAL A 147 0.059 2.603 3.680 1.00 34.31 H new ATOM 0 HG11 VAL A 147 -1.836 1.895 2.265 1.00 31.02 H new ATOM 0 HG12 VAL A 147 -2.186 1.758 4.005 1.00 31.02 H new ATOM 0 HG13 VAL A 147 -2.869 3.105 3.063 1.00 31.02 H new ATOM 0 HG21 VAL A 147 -0.268 3.606 1.418 1.00 74.10 H new ATOM 0 HG22 VAL A 147 -1.135 4.968 2.167 1.00 74.10 H new ATOM 0 HG23 VAL A 147 0.588 4.703 2.528 1.00 74.10 H new ATOM 765 N ARG A 148 -1.501 6.530 4.611 1.00 33.12 N ATOM 766 CA ARG A 148 -2.369 7.699 4.400 1.00 41.13 C ATOM 767 C ARG A 148 -2.740 7.807 2.910 1.00 11.14 C ATOM 768 O ARG A 148 -1.918 8.189 2.063 1.00 31.03 O ATOM 769 CB ARG A 148 -1.694 8.997 4.936 1.00 42.12 C ATOM 770 CG ARG A 148 -2.383 10.325 4.530 1.00 12.42 C ATOM 771 CD ARG A 148 -1.969 11.521 5.409 1.00 20.23 C ATOM 772 NE ARG A 148 -2.573 11.434 6.748 1.00 64.00 N ATOM 773 CZ ARG A 148 -2.066 11.934 7.891 1.00 63.10 C ATOM 774 NH1 ARG A 148 -0.910 12.588 7.913 1.00 3.22 N ATOM 775 NH2 ARG A 148 -2.741 11.760 9.022 1.00 64.31 N ATOM 0 H ARG A 148 -0.513 6.766 4.708 1.00 33.12 H new ATOM 0 HA ARG A 148 -3.291 7.571 4.967 1.00 41.13 H new ATOM 0 HB2 ARG A 148 -1.659 8.944 6.024 1.00 42.12 H new ATOM 0 HB3 ARG A 148 -0.663 9.021 4.584 1.00 42.12 H new ATOM 0 HG2 ARG A 148 -2.143 10.547 3.490 1.00 12.42 H new ATOM 0 HG3 ARG A 148 -3.464 10.198 4.588 1.00 12.42 H new ATOM 0 HD2 ARG A 148 -0.883 11.551 5.499 1.00 20.23 H new ATOM 0 HD3 ARG A 148 -2.275 12.451 4.929 1.00 20.23 H new ATOM 0 HE ARG A 148 -3.466 10.946 6.817 1.00 64.00 H new ATOM 0 HH11 ARG A 148 -0.383 12.722 7.050 1.00 3.22 H new ATOM 0 HH12 ARG A 148 -0.549 12.956 8.793 1.00 3.22 H new ATOM 0 HH21 ARG A 148 -3.627 11.255 9.015 1.00 64.31 H new ATOM 0 HH22 ARG A 148 -2.373 12.131 9.898 1.00 64.31 H new ATOM 789 N ILE A 149 -3.964 7.380 2.614 1.00 5.33 N ATOM 790 CA ILE A 149 -4.578 7.486 1.287 1.00 72.51 C ATOM 791 C ILE A 149 -5.391 8.809 1.192 1.00 70.34 C ATOM 792 O ILE A 149 -5.963 9.259 2.201 1.00 22.14 O ATOM 793 CB ILE A 149 -5.494 6.225 1.011 1.00 42.41 C ATOM 794 CG1 ILE A 149 -6.707 6.182 1.998 1.00 33.52 C ATOM 795 CG2 ILE A 149 -4.663 4.912 1.101 1.00 70.14 C ATOM 796 CD1 ILE A 149 -7.539 4.926 1.954 1.00 73.54 C ATOM 0 H ILE A 149 -4.574 6.940 3.303 1.00 5.33 H new ATOM 0 HA ILE A 149 -3.800 7.507 0.524 1.00 72.51 H new ATOM 0 HB ILE A 149 -5.889 6.312 -0.001 1.00 42.41 H new ATOM 0 HG12 ILE A 149 -6.331 6.312 3.013 1.00 33.52 H new ATOM 0 HG13 ILE A 149 -7.355 7.033 1.787 1.00 33.52 H new ATOM 0 HG21 ILE A 149 -5.311 4.057 0.908 1.00 70.14 H new ATOM 0 HG22 ILE A 149 -3.864 4.936 0.360 1.00 70.14 H new ATOM 0 HG23 ILE A 149 -4.231 4.822 2.098 1.00 70.14 H new ATOM 0 HD11 ILE A 149 -8.351 5.002 2.677 1.00 73.54 H new ATOM 0 HD12 ILE A 149 -7.954 4.799 0.954 1.00 73.54 H new ATOM 0 HD13 ILE A 149 -6.914 4.067 2.199 1.00 73.54 H new ATOM 808 N PRO A 150 -5.419 9.480 -0.004 1.00 64.32 N ATOM 809 CA PRO A 150 -6.233 10.702 -0.217 1.00 21.32 C ATOM 810 C PRO A 150 -7.751 10.376 -0.396 1.00 3.05 C ATOM 811 O PRO A 150 -8.106 9.217 -0.652 1.00 30.34 O ATOM 812 CB PRO A 150 -5.601 11.301 -1.502 1.00 53.33 C ATOM 813 CG PRO A 150 -5.093 10.122 -2.273 1.00 4.43 C ATOM 814 CD PRO A 150 -4.648 9.108 -1.234 1.00 14.25 C ATOM 0 HA PRO A 150 -6.217 11.388 0.630 1.00 21.32 H new ATOM 0 HB2 PRO A 150 -6.337 11.862 -2.079 1.00 53.33 H new ATOM 0 HB3 PRO A 150 -4.793 11.991 -1.259 1.00 53.33 H new ATOM 0 HG2 PRO A 150 -5.872 9.709 -2.914 1.00 4.43 H new ATOM 0 HG3 PRO A 150 -4.264 10.407 -2.921 1.00 4.43 H new ATOM 0 HD2 PRO A 150 -4.871 8.089 -1.551 1.00 14.25 H new ATOM 0 HD3 PRO A 150 -3.573 9.160 -1.061 1.00 14.25 H new ATOM 822 N PRO A 151 -8.674 11.386 -0.231 1.00 52.11 N ATOM 823 CA PRO A 151 -10.128 11.192 -0.470 1.00 10.55 C ATOM 824 C PRO A 151 -10.444 11.005 -1.976 1.00 34.44 C ATOM 825 O PRO A 151 -10.030 11.826 -2.807 1.00 73.03 O ATOM 826 CB PRO A 151 -10.759 12.492 0.109 1.00 13.55 C ATOM 827 CG PRO A 151 -9.678 13.528 0.012 1.00 55.55 C ATOM 828 CD PRO A 151 -8.377 12.781 0.219 1.00 0.32 C ATOM 0 HA PRO A 151 -10.522 10.290 -0.002 1.00 10.55 H new ATOM 0 HB2 PRO A 151 -11.641 12.789 -0.458 1.00 13.55 H new ATOM 0 HB3 PRO A 151 -11.077 12.350 1.142 1.00 13.55 H new ATOM 0 HG2 PRO A 151 -9.695 14.023 -0.959 1.00 55.55 H new ATOM 0 HG3 PRO A 151 -9.809 14.303 0.767 1.00 55.55 H new ATOM 0 HD2 PRO A 151 -7.568 13.223 -0.363 1.00 0.32 H new ATOM 0 HD3 PRO A 151 -8.067 12.804 1.264 1.00 0.32 H new ATOM 836 N GLY A 152 -11.135 9.897 -2.319 1.00 71.04 N ATOM 837 CA GLY A 152 -11.501 9.604 -3.710 1.00 0.23 C ATOM 838 C GLY A 152 -10.352 8.962 -4.484 1.00 50.24 C ATOM 839 O GLY A 152 -10.296 9.079 -5.710 1.00 71.50 O ATOM 0 H GLY A 152 -11.448 9.195 -1.648 1.00 71.04 H new ATOM 0 HA2 GLY A 152 -12.364 8.938 -3.725 1.00 0.23 H new ATOM 0 HA3 GLY A 152 -11.802 10.526 -4.207 1.00 0.23 H new ATOM 843 N VAL A 153 -9.441 8.279 -3.750 1.00 61.43 N ATOM 844 CA VAL A 153 -8.284 7.574 -4.339 1.00 64.21 C ATOM 845 C VAL A 153 -8.769 6.418 -5.252 1.00 12.53 C ATOM 846 O VAL A 153 -9.462 5.501 -4.806 1.00 73.35 O ATOM 847 CB VAL A 153 -7.288 7.061 -3.219 1.00 42.15 C ATOM 848 CG1 VAL A 153 -8.009 6.242 -2.121 1.00 75.11 C ATOM 849 CG2 VAL A 153 -6.087 6.273 -3.816 1.00 22.31 C ATOM 0 H VAL A 153 -9.490 8.203 -2.734 1.00 61.43 H new ATOM 0 HA VAL A 153 -7.727 8.280 -4.955 1.00 64.21 H new ATOM 0 HB VAL A 153 -6.884 7.953 -2.741 1.00 42.15 H new ATOM 0 HG11 VAL A 153 -7.283 5.913 -1.377 1.00 75.11 H new ATOM 0 HG12 VAL A 153 -8.765 6.863 -1.641 1.00 75.11 H new ATOM 0 HG13 VAL A 153 -8.487 5.372 -2.571 1.00 75.11 H new ATOM 0 HG21 VAL A 153 -5.432 5.942 -3.010 1.00 22.31 H new ATOM 0 HG22 VAL A 153 -6.457 5.406 -4.363 1.00 22.31 H new ATOM 0 HG23 VAL A 153 -5.529 6.919 -4.494 1.00 22.31 H new ATOM 859 N ARG A 154 -8.397 6.496 -6.539 1.00 2.22 N ATOM 860 CA ARG A 154 -8.895 5.602 -7.599 1.00 15.30 C ATOM 861 C ARG A 154 -7.834 4.562 -7.957 1.00 31.34 C ATOM 862 O ARG A 154 -6.661 4.725 -7.612 1.00 64.00 O ATOM 863 CB ARG A 154 -9.252 6.449 -8.842 1.00 33.43 C ATOM 864 CG ARG A 154 -10.556 7.253 -8.701 1.00 12.11 C ATOM 865 CD ARG A 154 -10.694 8.335 -9.787 1.00 65.40 C ATOM 866 NE ARG A 154 -10.566 7.794 -11.155 1.00 25.21 N ATOM 867 CZ ARG A 154 -10.574 8.521 -12.288 1.00 5.11 C ATOM 868 NH1 ARG A 154 -10.710 9.852 -12.253 1.00 24.41 N ATOM 869 NH2 ARG A 154 -10.403 7.899 -13.453 1.00 54.21 N ATOM 0 H ARG A 154 -7.732 7.191 -6.879 1.00 2.22 H new ATOM 0 HA ARG A 154 -9.782 5.077 -7.246 1.00 15.30 H new ATOM 0 HB2 ARG A 154 -8.433 7.139 -9.046 1.00 33.43 H new ATOM 0 HB3 ARG A 154 -9.336 5.790 -9.706 1.00 33.43 H new ATOM 0 HG2 ARG A 154 -11.407 6.574 -8.757 1.00 12.11 H new ATOM 0 HG3 ARG A 154 -10.587 7.722 -7.718 1.00 12.11 H new ATOM 0 HD2 ARG A 154 -11.662 8.825 -9.684 1.00 65.40 H new ATOM 0 HD3 ARG A 154 -9.932 9.099 -9.631 1.00 65.40 H new ATOM 0 HE ARG A 154 -10.463 6.784 -11.250 1.00 25.21 H new ATOM 0 HH11 ARG A 154 -10.810 10.331 -11.358 1.00 24.41 H new ATOM 0 HH12 ARG A 154 -10.714 10.387 -13.121 1.00 24.41 H new ATOM 0 HH21 ARG A 154 -10.269 6.888 -13.477 1.00 54.21 H new ATOM 0 HH22 ARG A 154 -10.406 8.433 -14.322 1.00 54.21 H new ATOM 883 N GLU A 155 -8.295 3.530 -8.689 1.00 4.53 N ATOM 884 CA GLU A 155 -7.483 2.406 -9.192 1.00 32.01 C ATOM 885 C GLU A 155 -6.197 2.898 -9.901 1.00 1.34 C ATOM 886 O GLU A 155 -6.246 3.839 -10.702 1.00 44.42 O ATOM 887 CB GLU A 155 -8.352 1.551 -10.178 1.00 32.40 C ATOM 888 CG GLU A 155 -7.574 0.527 -11.050 1.00 74.03 C ATOM 889 CD GLU A 155 -6.814 -0.535 -10.241 1.00 4.33 C ATOM 890 OE1 GLU A 155 -5.573 -0.640 -10.371 1.00 14.13 O ATOM 891 OE2 GLU A 155 -7.456 -1.272 -9.492 1.00 12.44 O ATOM 0 H GLU A 155 -9.277 3.453 -8.955 1.00 4.53 H new ATOM 0 HA GLU A 155 -7.171 1.798 -8.343 1.00 32.01 H new ATOM 0 HB2 GLU A 155 -9.101 1.011 -9.598 1.00 32.40 H new ATOM 0 HB3 GLU A 155 -8.890 2.229 -10.840 1.00 32.40 H new ATOM 0 HG2 GLU A 155 -8.276 0.027 -11.717 1.00 74.03 H new ATOM 0 HG3 GLU A 155 -6.865 1.066 -11.679 1.00 74.03 H new ATOM 898 N GLY A 156 -5.059 2.254 -9.582 1.00 64.04 N ATOM 899 CA GLY A 156 -3.789 2.518 -10.261 1.00 22.44 C ATOM 900 C GLY A 156 -2.892 3.518 -9.547 1.00 23.54 C ATOM 901 O GLY A 156 -1.714 3.636 -9.908 1.00 75.24 O ATOM 0 H GLY A 156 -5.000 1.544 -8.853 1.00 64.04 H new ATOM 0 HA2 GLY A 156 -3.248 1.578 -10.373 1.00 22.44 H new ATOM 0 HA3 GLY A 156 -3.997 2.887 -11.265 1.00 22.44 H new ATOM 905 N SER A 157 -3.431 4.228 -8.529 1.00 14.22 N ATOM 906 CA SER A 157 -2.657 5.194 -7.743 1.00 41.41 C ATOM 907 C SER A 157 -1.563 4.451 -6.953 1.00 1.33 C ATOM 908 O SER A 157 -1.863 3.548 -6.165 1.00 23.44 O ATOM 909 CB SER A 157 -3.574 5.982 -6.774 1.00 20.35 C ATOM 910 OG SER A 157 -2.906 7.108 -6.239 1.00 32.30 O ATOM 0 H SER A 157 -4.405 4.143 -8.238 1.00 14.22 H new ATOM 0 HA SER A 157 -2.194 5.909 -8.423 1.00 41.41 H new ATOM 0 HB2 SER A 157 -4.472 6.305 -7.301 1.00 20.35 H new ATOM 0 HB3 SER A 157 -3.898 5.329 -5.964 1.00 20.35 H new ATOM 0 HG SER A 157 -3.508 7.588 -5.633 1.00 32.30 H new ATOM 916 N VAL A 158 -0.299 4.821 -7.191 1.00 12.12 N ATOM 917 CA VAL A 158 0.858 4.211 -6.522 1.00 75.42 C ATOM 918 C VAL A 158 1.323 5.135 -5.393 1.00 20.13 C ATOM 919 O VAL A 158 1.805 6.247 -5.649 1.00 52.02 O ATOM 920 CB VAL A 158 2.051 3.928 -7.514 1.00 32.01 C ATOM 921 CG1 VAL A 158 3.242 3.237 -6.787 1.00 21.33 C ATOM 922 CG2 VAL A 158 1.574 3.099 -8.735 1.00 74.35 C ATOM 0 H VAL A 158 -0.048 5.554 -7.855 1.00 12.12 H new ATOM 0 HA VAL A 158 0.545 3.246 -6.123 1.00 75.42 H new ATOM 0 HB VAL A 158 2.410 4.888 -7.885 1.00 32.01 H new ATOM 0 HG11 VAL A 158 4.047 3.056 -7.499 1.00 21.33 H new ATOM 0 HG12 VAL A 158 3.604 3.882 -5.987 1.00 21.33 H new ATOM 0 HG13 VAL A 158 2.910 2.288 -6.366 1.00 21.33 H new ATOM 0 HG21 VAL A 158 2.416 2.918 -9.403 1.00 74.35 H new ATOM 0 HG22 VAL A 158 1.171 2.146 -8.393 1.00 74.35 H new ATOM 0 HG23 VAL A 158 0.799 3.650 -9.269 1.00 74.35 H new ATOM 932 N ILE A 159 1.135 4.683 -4.154 1.00 74.34 N ATOM 933 CA ILE A 159 1.698 5.305 -2.960 1.00 54.31 C ATOM 934 C ILE A 159 3.076 4.687 -2.734 1.00 74.10 C ATOM 935 O ILE A 159 3.184 3.533 -2.320 1.00 74.14 O ATOM 936 CB ILE A 159 0.797 5.080 -1.692 1.00 40.23 C ATOM 937 CG1 ILE A 159 -0.672 5.534 -1.976 1.00 43.32 C ATOM 938 CG2 ILE A 159 1.395 5.809 -0.451 1.00 32.15 C ATOM 939 CD1 ILE A 159 -1.652 5.212 -0.872 1.00 55.35 C ATOM 0 H ILE A 159 0.574 3.856 -3.950 1.00 74.34 H new ATOM 0 HA ILE A 159 1.761 6.383 -3.111 1.00 54.31 H new ATOM 0 HB ILE A 159 0.776 4.014 -1.465 1.00 40.23 H new ATOM 0 HG12 ILE A 159 -0.679 6.610 -2.149 1.00 43.32 H new ATOM 0 HG13 ILE A 159 -1.013 5.061 -2.897 1.00 43.32 H new ATOM 0 HG21 ILE A 159 0.754 5.639 0.414 1.00 32.15 H new ATOM 0 HG22 ILE A 159 2.392 5.420 -0.246 1.00 32.15 H new ATOM 0 HG23 ILE A 159 1.457 6.878 -0.652 1.00 32.15 H new ATOM 0 HD11 ILE A 159 -2.645 5.562 -1.153 1.00 55.35 H new ATOM 0 HD12 ILE A 159 -1.679 4.134 -0.712 1.00 55.35 H new ATOM 0 HD13 ILE A 159 -1.340 5.707 0.047 1.00 55.35 H new ATOM 951 N ARG A 160 4.124 5.428 -3.066 1.00 14.22 N ATOM 952 CA ARG A 160 5.499 4.936 -2.975 1.00 54.03 C ATOM 953 C ARG A 160 6.063 5.265 -1.587 1.00 52.52 C ATOM 954 O ARG A 160 6.007 6.422 -1.154 1.00 25.13 O ATOM 955 CB ARG A 160 6.353 5.566 -4.101 1.00 42.31 C ATOM 956 CG ARG A 160 7.745 4.940 -4.279 1.00 31.35 C ATOM 957 CD ARG A 160 8.476 5.447 -5.531 1.00 73.43 C ATOM 958 NE ARG A 160 9.623 4.590 -5.880 1.00 2.35 N ATOM 959 CZ ARG A 160 10.390 4.734 -6.969 1.00 71.11 C ATOM 960 NH1 ARG A 160 10.154 5.718 -7.836 1.00 12.13 N ATOM 961 NH2 ARG A 160 11.363 3.862 -7.199 1.00 52.43 N ATOM 0 H ARG A 160 4.049 6.387 -3.406 1.00 14.22 H new ATOM 0 HA ARG A 160 5.522 3.854 -3.105 1.00 54.03 H new ATOM 0 HB2 ARG A 160 5.809 5.481 -5.042 1.00 42.31 H new ATOM 0 HB3 ARG A 160 6.472 6.630 -3.896 1.00 42.31 H new ATOM 0 HG2 ARG A 160 8.350 5.157 -3.399 1.00 31.35 H new ATOM 0 HG3 ARG A 160 7.645 3.856 -4.337 1.00 31.35 H new ATOM 0 HD2 ARG A 160 7.780 5.482 -6.369 1.00 73.43 H new ATOM 0 HD3 ARG A 160 8.822 6.467 -5.362 1.00 73.43 H new ATOM 0 HE ARG A 160 9.851 3.827 -5.242 1.00 2.35 H new ATOM 0 HH11 ARG A 160 9.385 6.368 -7.673 1.00 12.13 H new ATOM 0 HH12 ARG A 160 10.742 5.821 -8.663 1.00 12.13 H new ATOM 0 HH21 ARG A 160 11.521 3.091 -6.550 1.00 52.43 H new ATOM 0 HH22 ARG A 160 11.953 3.962 -8.025 1.00 52.43 H new ATOM 975 N VAL A 161 6.542 4.242 -0.877 1.00 73.15 N ATOM 976 CA VAL A 161 7.221 4.401 0.411 1.00 55.14 C ATOM 977 C VAL A 161 8.618 3.731 0.345 1.00 35.25 C ATOM 978 O VAL A 161 8.728 2.504 0.275 1.00 62.44 O ATOM 979 CB VAL A 161 6.339 3.860 1.606 1.00 0.22 C ATOM 980 CG1 VAL A 161 5.902 2.383 1.419 1.00 45.23 C ATOM 981 CG2 VAL A 161 7.046 4.092 2.971 1.00 41.20 C ATOM 0 H VAL A 161 6.469 3.271 -1.182 1.00 73.15 H new ATOM 0 HA VAL A 161 7.366 5.463 0.611 1.00 55.14 H new ATOM 0 HB VAL A 161 5.417 4.441 1.604 1.00 0.22 H new ATOM 0 HG11 VAL A 161 5.300 2.071 2.272 1.00 45.23 H new ATOM 0 HG12 VAL A 161 5.314 2.290 0.506 1.00 45.23 H new ATOM 0 HG13 VAL A 161 6.785 1.749 1.347 1.00 45.23 H new ATOM 0 HG21 VAL A 161 6.418 3.711 3.776 1.00 41.20 H new ATOM 0 HG22 VAL A 161 8.003 3.569 2.979 1.00 41.20 H new ATOM 0 HG23 VAL A 161 7.214 5.159 3.117 1.00 41.20 H new ATOM 991 N PRO A 162 9.720 4.545 0.290 1.00 60.12 N ATOM 992 CA PRO A 162 11.103 4.021 0.394 1.00 55.44 C ATOM 993 C PRO A 162 11.422 3.541 1.830 1.00 55.24 C ATOM 994 O PRO A 162 10.784 3.978 2.802 1.00 4.43 O ATOM 995 CB PRO A 162 11.971 5.234 -0.023 1.00 22.04 C ATOM 996 CG PRO A 162 11.144 6.439 0.317 1.00 2.41 C ATOM 997 CD PRO A 162 9.706 6.026 0.095 1.00 0.33 C ATOM 0 HA PRO A 162 11.279 3.145 -0.230 1.00 55.44 H new ATOM 0 HB2 PRO A 162 12.920 5.243 0.513 1.00 22.04 H new ATOM 0 HB3 PRO A 162 12.206 5.204 -1.087 1.00 22.04 H new ATOM 0 HG2 PRO A 162 11.308 6.747 1.350 1.00 2.41 H new ATOM 0 HG3 PRO A 162 11.410 7.287 -0.315 1.00 2.41 H new ATOM 0 HD2 PRO A 162 9.037 6.515 0.803 1.00 0.33 H new ATOM 0 HD3 PRO A 162 9.364 6.294 -0.905 1.00 0.33 H new ATOM 1005 N GLY A 163 12.383 2.615 1.946 1.00 23.33 N ATOM 1006 CA GLY A 163 12.818 2.087 3.245 1.00 71.11 C ATOM 1007 C GLY A 163 11.972 0.921 3.776 1.00 32.53 C ATOM 1008 O GLY A 163 12.265 0.397 4.856 1.00 44.25 O ATOM 0 H GLY A 163 12.877 2.214 1.149 1.00 23.33 H new ATOM 0 HA2 GLY A 163 13.854 1.758 3.161 1.00 71.11 H new ATOM 0 HA3 GLY A 163 12.799 2.895 3.976 1.00 71.11 H new ATOM 1012 N MET A 164 10.934 0.495 3.011 1.00 65.20 N ATOM 1013 CA MET A 164 9.948 -0.516 3.467 1.00 54.13 C ATOM 1014 C MET A 164 9.870 -1.761 2.554 1.00 73.43 C ATOM 1015 O MET A 164 9.185 -2.733 2.903 1.00 33.42 O ATOM 1016 CB MET A 164 8.548 0.135 3.620 1.00 21.01 C ATOM 1017 CG MET A 164 8.379 1.025 4.862 1.00 53.05 C ATOM 1018 SD MET A 164 6.663 1.517 5.122 1.00 2.53 S ATOM 1019 CE MET A 164 5.847 -0.082 5.156 1.00 20.43 C ATOM 0 H MET A 164 10.759 0.841 2.067 1.00 65.20 H new ATOM 0 HA MET A 164 10.297 -0.874 4.435 1.00 54.13 H new ATOM 0 HB2 MET A 164 8.343 0.733 2.732 1.00 21.01 H new ATOM 0 HB3 MET A 164 7.798 -0.655 3.653 1.00 21.01 H new ATOM 0 HG2 MET A 164 8.739 0.490 5.741 1.00 53.05 H new ATOM 0 HG3 MET A 164 8.998 1.916 4.755 1.00 53.05 H new ATOM 0 HE1 MET A 164 5.096 -0.124 4.367 1.00 20.43 H new ATOM 0 HE2 MET A 164 6.584 -0.870 4.998 1.00 20.43 H new ATOM 0 HE3 MET A 164 5.365 -0.224 6.123 1.00 20.43 H new ATOM 1029 N GLY A 165 10.559 -1.742 1.401 1.00 12.00 N ATOM 1030 CA GLY A 165 10.566 -2.887 0.478 1.00 75.42 C ATOM 1031 C GLY A 165 11.567 -3.950 0.875 1.00 32.33 C ATOM 1032 O GLY A 165 11.236 -4.866 1.637 1.00 53.52 O ATOM 0 H GLY A 165 11.117 -0.948 1.087 1.00 12.00 H new ATOM 0 HA2 GLY A 165 9.569 -3.327 0.443 1.00 75.42 H new ATOM 0 HA3 GLY A 165 10.795 -2.536 -0.528 1.00 75.42 H new ATOM 1036 N GLY A 166 12.795 -3.829 0.339 1.00 4.14 N ATOM 1037 CA GLY A 166 13.912 -4.683 0.730 1.00 72.44 C ATOM 1038 C GLY A 166 14.321 -4.441 2.180 1.00 14.55 C ATOM 1039 O GLY A 166 15.037 -3.478 2.479 1.00 60.43 O ATOM 0 H GLY A 166 13.032 -3.138 -0.373 1.00 4.14 H new ATOM 0 HA2 GLY A 166 13.635 -5.729 0.599 1.00 72.44 H new ATOM 0 HA3 GLY A 166 14.762 -4.494 0.075 1.00 72.44 H new ATOM 1043 N GLN A 167 13.785 -5.275 3.086 1.00 35.21 N ATOM 1044 CA GLN A 167 14.070 -5.197 4.523 1.00 74.30 C ATOM 1045 C GLN A 167 15.379 -5.932 4.850 1.00 72.30 C ATOM 1046 O GLN A 167 15.457 -7.162 4.758 1.00 32.03 O ATOM 1047 CB GLN A 167 12.869 -5.746 5.342 1.00 75.30 C ATOM 1048 CG GLN A 167 11.528 -4.997 5.088 1.00 30.11 C ATOM 1049 CD GLN A 167 11.600 -3.499 5.421 1.00 54.42 C ATOM 1050 OE1 GLN A 167 11.147 -3.056 6.472 1.00 72.25 O ATOM 1051 NE2 GLN A 167 12.167 -2.707 4.522 1.00 63.22 N ATOM 0 H GLN A 167 13.139 -6.025 2.838 1.00 35.21 H new ATOM 0 HA GLN A 167 14.206 -4.153 4.806 1.00 74.30 H new ATOM 0 HB2 GLN A 167 12.734 -6.801 5.104 1.00 75.30 H new ATOM 0 HB3 GLN A 167 13.110 -5.687 6.403 1.00 75.30 H new ATOM 0 HG2 GLN A 167 11.244 -5.117 4.042 1.00 30.11 H new ATOM 0 HG3 GLN A 167 10.742 -5.458 5.686 1.00 30.11 H new ATOM 0 HE21 GLN A 167 12.536 -3.100 3.656 1.00 63.22 H new ATOM 0 HE22 GLN A 167 12.234 -1.704 4.696 1.00 63.22 H new ATOM 1060 N GLY A 168 16.393 -5.146 5.220 1.00 42.40 N ATOM 1061 CA GLY A 168 17.728 -5.645 5.513 1.00 61.12 C ATOM 1062 C GLY A 168 18.600 -4.536 6.069 1.00 3.00 C ATOM 1063 O GLY A 168 18.099 -3.650 6.779 1.00 44.33 O ATOM 0 H GLY A 168 16.304 -4.135 5.324 1.00 42.40 H new ATOM 0 HA2 GLY A 168 17.667 -6.463 6.231 1.00 61.12 H new ATOM 0 HA3 GLY A 168 18.178 -6.050 4.607 1.00 61.12 H new ATOM 1067 N ASN A 169 19.909 -4.577 5.747 1.00 54.04 N ATOM 1068 CA ASN A 169 20.860 -3.512 6.136 1.00 53.12 C ATOM 1069 C ASN A 169 20.669 -2.251 5.229 1.00 53.41 C ATOM 1070 O ASN A 169 20.523 -1.142 5.768 1.00 31.44 O ATOM 1071 CB ASN A 169 22.337 -4.013 6.116 1.00 33.14 C ATOM 1072 CG ASN A 169 22.584 -5.273 6.956 1.00 33.11 C ATOM 1073 OD1 ASN A 169 21.892 -5.543 7.940 1.00 52.54 O ATOM 1074 ND2 ASN A 169 23.575 -6.065 6.564 1.00 75.24 N ATOM 0 H ASN A 169 20.334 -5.338 5.217 1.00 54.04 H new ATOM 0 HA ASN A 169 20.641 -3.229 7.165 1.00 53.12 H new ATOM 0 HB2 ASN A 169 22.627 -4.215 5.085 1.00 33.14 H new ATOM 0 HB3 ASN A 169 22.985 -3.215 6.479 1.00 33.14 H new ATOM 0 HD21 ASN A 169 23.779 -6.920 7.081 1.00 75.24 H new ATOM 0 HD22 ASN A 169 24.132 -5.818 5.746 1.00 75.24 H new ATOM 1081 N PRO A 170 20.654 -2.362 3.836 1.00 23.43 N ATOM 1082 CA PRO A 170 20.275 -1.222 2.974 1.00 11.50 C ATOM 1083 C PRO A 170 18.730 -1.128 2.833 1.00 54.54 C ATOM 1084 O PRO A 170 18.098 -2.078 2.335 1.00 51.44 O ATOM 1085 CB PRO A 170 20.991 -1.539 1.636 1.00 21.44 C ATOM 1086 CG PRO A 170 21.037 -3.040 1.557 1.00 62.41 C ATOM 1087 CD PRO A 170 21.018 -3.553 2.994 1.00 11.25 C ATOM 0 HA PRO A 170 20.568 -0.249 3.368 1.00 11.50 H new ATOM 0 HB2 PRO A 170 20.449 -1.117 0.790 1.00 21.44 H new ATOM 0 HB3 PRO A 170 21.994 -1.113 1.616 1.00 21.44 H new ATOM 0 HG2 PRO A 170 20.185 -3.425 0.997 1.00 62.41 H new ATOM 0 HG3 PRO A 170 21.936 -3.373 1.038 1.00 62.41 H new ATOM 0 HD2 PRO A 170 20.292 -4.357 3.115 1.00 11.25 H new ATOM 0 HD3 PRO A 170 21.990 -3.955 3.281 1.00 11.25 H new ATOM 1095 N PRO A 171 18.086 -0.011 3.320 1.00 63.42 N ATOM 1096 CA PRO A 171 16.615 0.151 3.247 1.00 74.54 C ATOM 1097 C PRO A 171 16.118 0.147 1.777 1.00 1.00 C ATOM 1098 O PRO A 171 16.615 0.911 0.945 1.00 74.24 O ATOM 1099 CB PRO A 171 16.362 1.521 3.947 1.00 64.14 C ATOM 1100 CG PRO A 171 17.676 2.245 3.881 1.00 73.22 C ATOM 1101 CD PRO A 171 18.721 1.163 3.995 1.00 71.33 C ATOM 0 HA PRO A 171 16.072 -0.665 3.725 1.00 74.54 H new ATOM 0 HB2 PRO A 171 15.577 2.083 3.441 1.00 64.14 H new ATOM 0 HB3 PRO A 171 16.040 1.382 4.979 1.00 64.14 H new ATOM 0 HG2 PRO A 171 17.777 2.795 2.946 1.00 73.22 H new ATOM 0 HG3 PRO A 171 17.769 2.970 4.689 1.00 73.22 H new ATOM 0 HD2 PRO A 171 19.652 1.451 3.506 1.00 71.33 H new ATOM 0 HD3 PRO A 171 18.961 0.946 5.036 1.00 71.33 H new ATOM 1109 N GLY A 172 15.154 -0.736 1.469 1.00 60.42 N ATOM 1110 CA GLY A 172 14.677 -0.918 0.095 1.00 64.13 C ATOM 1111 C GLY A 172 13.384 -0.182 -0.209 1.00 74.21 C ATOM 1112 O GLY A 172 12.655 0.182 0.703 1.00 35.44 O ATOM 0 H GLY A 172 14.692 -1.333 2.155 1.00 60.42 H new ATOM 0 HA2 GLY A 172 15.449 -0.577 -0.595 1.00 64.13 H new ATOM 0 HA3 GLY A 172 14.530 -1.982 -0.091 1.00 64.13 H new ATOM 1116 N ASP A 173 13.077 -0.013 -1.500 1.00 12.21 N ATOM 1117 CA ASP A 173 11.902 0.744 -1.966 1.00 20.10 C ATOM 1118 C ASP A 173 10.655 -0.165 -2.019 1.00 63.11 C ATOM 1119 O ASP A 173 10.763 -1.342 -2.349 1.00 25.24 O ATOM 1120 CB ASP A 173 12.204 1.349 -3.361 1.00 12.05 C ATOM 1121 CG ASP A 173 10.996 2.066 -3.994 1.00 72.30 C ATOM 1122 OD1 ASP A 173 10.353 2.892 -3.306 1.00 0.30 O ATOM 1123 OD2 ASP A 173 10.713 1.839 -5.192 1.00 12.44 O ATOM 0 H ASP A 173 13.639 -0.399 -2.259 1.00 12.21 H new ATOM 0 HA ASP A 173 11.692 1.552 -1.265 1.00 20.10 H new ATOM 0 HB2 ASP A 173 13.029 2.055 -3.271 1.00 12.05 H new ATOM 0 HB3 ASP A 173 12.536 0.554 -4.029 1.00 12.05 H new ATOM 1128 N LEU A 174 9.472 0.397 -1.698 1.00 51.24 N ATOM 1129 CA LEU A 174 8.198 -0.345 -1.701 1.00 1.25 C ATOM 1130 C LEU A 174 7.141 0.451 -2.487 1.00 60.42 C ATOM 1131 O LEU A 174 6.855 1.608 -2.167 1.00 41.30 O ATOM 1132 CB LEU A 174 7.732 -0.609 -0.245 1.00 53.54 C ATOM 1133 CG LEU A 174 6.517 -1.576 -0.067 1.00 70.55 C ATOM 1134 CD1 LEU A 174 6.810 -2.986 -0.629 1.00 62.40 C ATOM 1135 CD2 LEU A 174 6.085 -1.655 1.415 1.00 3.33 C ATOM 0 H LEU A 174 9.375 1.376 -1.430 1.00 51.24 H new ATOM 0 HA LEU A 174 8.338 -1.310 -2.189 1.00 1.25 H new ATOM 0 HB2 LEU A 174 8.575 -1.013 0.315 1.00 53.54 H new ATOM 0 HB3 LEU A 174 7.476 0.348 0.210 1.00 53.54 H new ATOM 0 HG LEU A 174 5.691 -1.162 -0.645 1.00 70.55 H new ATOM 0 HD11 LEU A 174 5.938 -3.624 -0.484 1.00 62.40 H new ATOM 0 HD12 LEU A 174 7.034 -2.914 -1.693 1.00 62.40 H new ATOM 0 HD13 LEU A 174 7.665 -3.415 -0.107 1.00 62.40 H new ATOM 0 HD21 LEU A 174 5.238 -2.334 1.511 1.00 3.33 H new ATOM 0 HD22 LEU A 174 6.916 -2.023 2.017 1.00 3.33 H new ATOM 0 HD23 LEU A 174 5.796 -0.663 1.763 1.00 3.33 H new ATOM 1147 N LEU A 175 6.585 -0.183 -3.527 1.00 70.11 N ATOM 1148 CA LEU A 175 5.522 0.398 -4.365 1.00 61.11 C ATOM 1149 C LEU A 175 4.175 -0.162 -3.907 1.00 15.13 C ATOM 1150 O LEU A 175 3.962 -1.365 -4.011 1.00 3.51 O ATOM 1151 CB LEU A 175 5.764 0.031 -5.857 1.00 74.35 C ATOM 1152 CG LEU A 175 7.162 0.416 -6.439 1.00 32.44 C ATOM 1153 CD1 LEU A 175 7.327 -0.123 -7.871 1.00 51.14 C ATOM 1154 CD2 LEU A 175 7.399 1.942 -6.383 1.00 62.50 C ATOM 0 H LEU A 175 6.861 -1.122 -3.815 1.00 70.11 H new ATOM 0 HA LEU A 175 5.526 1.483 -4.266 1.00 61.11 H new ATOM 0 HB2 LEU A 175 5.628 -1.044 -5.973 1.00 74.35 H new ATOM 0 HB3 LEU A 175 4.996 0.516 -6.459 1.00 74.35 H new ATOM 0 HG LEU A 175 7.922 -0.052 -5.814 1.00 32.44 H new ATOM 0 HD11 LEU A 175 8.308 0.158 -8.255 1.00 51.14 H new ATOM 0 HD12 LEU A 175 7.238 -1.209 -7.863 1.00 51.14 H new ATOM 0 HD13 LEU A 175 6.553 0.300 -8.511 1.00 51.14 H new ATOM 0 HD21 LEU A 175 8.381 2.173 -6.796 1.00 62.50 H new ATOM 0 HD22 LEU A 175 6.631 2.451 -6.966 1.00 62.50 H new ATOM 0 HD23 LEU A 175 7.352 2.280 -5.348 1.00 62.50 H new ATOM 1166 N LEU A 176 3.290 0.691 -3.370 1.00 34.40 N ATOM 1167 CA LEU A 176 1.925 0.277 -2.989 1.00 32.31 C ATOM 1168 C LEU A 176 0.942 0.756 -4.068 1.00 62.44 C ATOM 1169 O LEU A 176 0.587 1.929 -4.088 1.00 4.35 O ATOM 1170 CB LEU A 176 1.540 0.901 -1.612 1.00 12.24 C ATOM 1171 CG LEU A 176 2.575 0.734 -0.458 1.00 25.33 C ATOM 1172 CD1 LEU A 176 2.125 1.480 0.821 1.00 74.40 C ATOM 1173 CD2 LEU A 176 2.853 -0.750 -0.176 1.00 32.34 C ATOM 0 H LEU A 176 3.493 1.674 -3.188 1.00 34.40 H new ATOM 0 HA LEU A 176 1.884 -0.809 -2.904 1.00 32.31 H new ATOM 0 HB2 LEU A 176 1.361 1.966 -1.758 1.00 12.24 H new ATOM 0 HB3 LEU A 176 0.596 0.461 -1.290 1.00 12.24 H new ATOM 0 HG LEU A 176 3.510 1.190 -0.784 1.00 25.33 H new ATOM 0 HD11 LEU A 176 2.870 1.342 1.604 1.00 74.40 H new ATOM 0 HD12 LEU A 176 2.020 2.543 0.604 1.00 74.40 H new ATOM 0 HD13 LEU A 176 1.168 1.082 1.157 1.00 74.40 H new ATOM 0 HD21 LEU A 176 3.578 -0.837 0.633 1.00 32.34 H new ATOM 0 HD22 LEU A 176 1.926 -1.245 0.113 1.00 32.34 H new ATOM 0 HD23 LEU A 176 3.252 -1.222 -1.073 1.00 32.34 H new ATOM 1185 N VAL A 177 0.517 -0.131 -4.978 1.00 22.23 N ATOM 1186 CA VAL A 177 -0.490 0.221 -5.998 1.00 64.13 C ATOM 1187 C VAL A 177 -1.887 -0.203 -5.505 1.00 61.42 C ATOM 1188 O VAL A 177 -2.094 -1.356 -5.107 1.00 61.11 O ATOM 1189 CB VAL A 177 -0.157 -0.397 -7.409 1.00 22.24 C ATOM 1190 CG1 VAL A 177 0.048 -1.928 -7.353 1.00 3.44 C ATOM 1191 CG2 VAL A 177 -1.225 -0.004 -8.466 1.00 50.24 C ATOM 0 H VAL A 177 0.850 -1.093 -5.032 1.00 22.23 H new ATOM 0 HA VAL A 177 -0.474 1.302 -6.136 1.00 64.13 H new ATOM 0 HB VAL A 177 0.795 0.032 -7.721 1.00 22.24 H new ATOM 0 HG11 VAL A 177 0.275 -2.302 -8.352 1.00 3.44 H new ATOM 0 HG12 VAL A 177 0.875 -2.160 -6.682 1.00 3.44 H new ATOM 0 HG13 VAL A 177 -0.861 -2.404 -6.986 1.00 3.44 H new ATOM 0 HG21 VAL A 177 -0.965 -0.447 -9.428 1.00 50.24 H new ATOM 0 HG22 VAL A 177 -2.202 -0.370 -8.150 1.00 50.24 H new ATOM 0 HG23 VAL A 177 -1.259 1.081 -8.563 1.00 50.24 H new ATOM 1201 N VAL A 178 -2.824 0.756 -5.500 1.00 60.45 N ATOM 1202 CA VAL A 178 -4.204 0.529 -5.065 1.00 73.10 C ATOM 1203 C VAL A 178 -4.967 -0.289 -6.120 1.00 74.13 C ATOM 1204 O VAL A 178 -4.844 -0.049 -7.338 1.00 24.42 O ATOM 1205 CB VAL A 178 -4.939 1.881 -4.768 1.00 71.33 C ATOM 1206 CG1 VAL A 178 -5.023 2.744 -6.025 1.00 63.21 C ATOM 1207 CG2 VAL A 178 -6.341 1.667 -4.163 1.00 53.54 C ATOM 0 H VAL A 178 -2.642 1.714 -5.799 1.00 60.45 H new ATOM 0 HA VAL A 178 -4.177 -0.040 -4.136 1.00 73.10 H new ATOM 0 HB VAL A 178 -4.343 2.406 -4.022 1.00 71.33 H new ATOM 0 HG11 VAL A 178 -5.537 3.676 -5.792 1.00 63.21 H new ATOM 0 HG12 VAL A 178 -4.017 2.964 -6.383 1.00 63.21 H new ATOM 0 HG13 VAL A 178 -5.574 2.208 -6.798 1.00 63.21 H new ATOM 0 HG21 VAL A 178 -6.808 2.634 -3.976 1.00 53.54 H new ATOM 0 HG22 VAL A 178 -6.955 1.096 -4.860 1.00 53.54 H new ATOM 0 HG23 VAL A 178 -6.253 1.119 -3.225 1.00 53.54 H new ATOM 1217 N ARG A 179 -5.727 -1.274 -5.633 1.00 12.15 N ATOM 1218 CA ARG A 179 -6.482 -2.222 -6.454 1.00 64.42 C ATOM 1219 C ARG A 179 -7.947 -2.138 -6.028 1.00 2.21 C ATOM 1220 O ARG A 179 -8.308 -2.590 -4.937 1.00 70.32 O ATOM 1221 CB ARG A 179 -5.914 -3.667 -6.295 1.00 43.00 C ATOM 1222 CG ARG A 179 -4.381 -3.776 -6.496 1.00 40.31 C ATOM 1223 CD ARG A 179 -3.916 -3.398 -7.922 1.00 73.11 C ATOM 1224 NE ARG A 179 -3.983 -4.538 -8.854 1.00 71.40 N ATOM 1225 CZ ARG A 179 -4.409 -4.496 -10.126 1.00 51.14 C ATOM 1226 NH1 ARG A 179 -4.831 -3.365 -10.683 1.00 4.41 N ATOM 1227 NH2 ARG A 179 -4.387 -5.610 -10.842 1.00 32.00 N ATOM 0 H ARG A 179 -5.836 -1.437 -4.632 1.00 12.15 H new ATOM 0 HA ARG A 179 -6.393 -1.971 -7.511 1.00 64.42 H new ATOM 0 HB2 ARG A 179 -6.165 -4.036 -5.301 1.00 43.00 H new ATOM 0 HB3 ARG A 179 -6.410 -4.321 -7.012 1.00 43.00 H new ATOM 0 HG2 ARG A 179 -3.881 -3.128 -5.776 1.00 40.31 H new ATOM 0 HG3 ARG A 179 -4.066 -4.797 -6.278 1.00 40.31 H new ATOM 0 HD2 ARG A 179 -4.536 -2.586 -8.300 1.00 73.11 H new ATOM 0 HD3 ARG A 179 -2.893 -3.025 -7.881 1.00 73.11 H new ATOM 0 HE ARG A 179 -3.677 -5.444 -8.499 1.00 71.40 H new ATOM 0 HH11 ARG A 179 -4.836 -2.501 -10.141 1.00 4.41 H new ATOM 0 HH12 ARG A 179 -5.149 -3.362 -11.652 1.00 4.41 H new ATOM 0 HH21 ARG A 179 -4.051 -6.478 -10.425 1.00 32.00 H new ATOM 0 HH22 ARG A 179 -4.706 -5.600 -11.811 1.00 32.00 H new ATOM 1241 N LEU A 180 -8.769 -1.474 -6.846 1.00 64.44 N ATOM 1242 CA LEU A 180 -10.212 -1.321 -6.614 1.00 12.03 C ATOM 1243 C LEU A 180 -11.008 -2.221 -7.565 1.00 14.11 C ATOM 1244 O LEU A 180 -10.562 -2.481 -8.687 1.00 42.40 O ATOM 1245 CB LEU A 180 -10.613 0.164 -6.762 1.00 12.24 C ATOM 1246 CG LEU A 180 -9.994 1.125 -5.699 1.00 44.32 C ATOM 1247 CD1 LEU A 180 -10.407 2.583 -5.948 1.00 11.43 C ATOM 1248 CD2 LEU A 180 -10.368 0.683 -4.267 1.00 33.35 C ATOM 0 H LEU A 180 -8.448 -1.020 -7.701 1.00 64.44 H new ATOM 0 HA LEU A 180 -10.448 -1.634 -5.597 1.00 12.03 H new ATOM 0 HB2 LEU A 180 -10.319 0.507 -7.754 1.00 12.24 H new ATOM 0 HB3 LEU A 180 -11.699 0.238 -6.708 1.00 12.24 H new ATOM 0 HG LEU A 180 -8.910 1.068 -5.799 1.00 44.32 H new ATOM 0 HD11 LEU A 180 -9.958 3.223 -5.189 1.00 11.43 H new ATOM 0 HD12 LEU A 180 -10.064 2.895 -6.935 1.00 11.43 H new ATOM 0 HD13 LEU A 180 -11.493 2.667 -5.897 1.00 11.43 H new ATOM 0 HD21 LEU A 180 -9.924 1.370 -3.547 1.00 33.35 H new ATOM 0 HD22 LEU A 180 -11.452 0.691 -4.155 1.00 33.35 H new ATOM 0 HD23 LEU A 180 -9.992 -0.324 -4.087 1.00 33.35 H new ATOM 1260 N LEU A 181 -12.179 -2.698 -7.088 1.00 61.31 N ATOM 1261 CA LEU A 181 -13.061 -3.630 -7.820 1.00 3.24 C ATOM 1262 C LEU A 181 -13.424 -3.083 -9.223 1.00 5.55 C ATOM 1263 O LEU A 181 -13.595 -1.869 -9.375 1.00 4.25 O ATOM 1264 CB LEU A 181 -14.347 -3.900 -6.992 1.00 72.22 C ATOM 1265 CG LEU A 181 -14.136 -4.687 -5.661 1.00 0.05 C ATOM 1266 CD1 LEU A 181 -15.429 -4.720 -4.818 1.00 12.44 C ATOM 1267 CD2 LEU A 181 -13.595 -6.113 -5.941 1.00 24.31 C ATOM 0 H LEU A 181 -12.542 -2.442 -6.170 1.00 61.31 H new ATOM 0 HA LEU A 181 -12.523 -4.567 -7.962 1.00 3.24 H new ATOM 0 HB2 LEU A 181 -14.815 -2.944 -6.758 1.00 72.22 H new ATOM 0 HB3 LEU A 181 -15.049 -4.455 -7.614 1.00 72.22 H new ATOM 0 HG LEU A 181 -13.384 -4.161 -5.073 1.00 0.05 H new ATOM 0 HD11 LEU A 181 -15.249 -5.275 -3.898 1.00 12.44 H new ATOM 0 HD12 LEU A 181 -15.730 -3.701 -4.574 1.00 12.44 H new ATOM 0 HD13 LEU A 181 -16.222 -5.207 -5.386 1.00 12.44 H new ATOM 0 HD21 LEU A 181 -13.456 -6.641 -4.998 1.00 24.31 H new ATOM 0 HD22 LEU A 181 -14.308 -6.657 -6.560 1.00 24.31 H new ATOM 0 HD23 LEU A 181 -12.640 -6.044 -6.462 1.00 24.31 H new