Browse entries in the PDBbind-CN Database
HEADER 4TXC_COMPLEX COMPND 4TXC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 276 THR VAL PHE ARG GLN GLU ASN VAL ASP ASP TYR TYR ASP SEQRES 2 A 276 THR GLY GLU GLU LEU GLY SER GLY GLN PHE ALA VAL VAL SEQRES 3 A 276 LYS LYS CYS ARG GLU LYS SER THR GLY LEU GLN TYR ALA SEQRES 4 A 276 ALA LYS PHE ILE LYS LYS ARG ARG THR LYS SER SER ARG SEQRES 5 A 276 ARG GLY VAL SER ARG GLU ASP ILE GLU ARG GLU VAL SER SEQRES 6 A 276 ILE LEU LYS GLU ILE GLN HIS PRO ASN VAL ILE THR LEU SEQRES 7 A 276 HIS GLU VAL TYR GLU ASN LYS THR ASP VAL ILE LEU ILE SEQRES 8 A 276 LEU GLU LEU VAL ALA GLY GLY GLU LEU PHE ASP PHE LEU SEQRES 9 A 276 ALA GLU LYS GLU SER LEU THR GLU GLU GLU ALA THR GLU SEQRES 10 A 276 PHE LEU LYS GLN ILE LEU ASN GLY VAL TYR TYR LEU HIS SEQRES 11 A 276 SER LEU GLN ILE ALA HIS PHE ASP LEU LYS PRO GLU ASN SEQRES 12 A 276 ILE MET LEU LEU ASP ARG ASN VAL PRO LYS PRO ARG ILE SEQRES 13 A 276 LYS ILE ILE ASP PHE GLY LEU ALA HIS LYS ILE ASP PHE SEQRES 14 A 276 GLY ASN GLU PHE LYS ASN ILE PHE GLY THR PRO GLU PHE SEQRES 15 A 276 VAL ALA PRO GLU ILE VAL ASN TYR GLU PRO LEU GLY LEU SEQRES 16 A 276 GLU ALA ASP MET TRP SER ILE GLY VAL ILE THR TYR ILE SEQRES 17 A 276 LEU LEU SER GLY ALA SER PRO PHE LEU GLY ASP THR LYS SEQRES 18 A 276 GLN GLU THR LEU ALA ASN VAL SER ALA VAL ASN TYR GLU SEQRES 19 A 276 PHE GLU ASP GLU TYR PHE SER ASN THR SER ALA LEU ALA SEQRES 20 A 276 LYS ASP PHE ILE ARG ARG LEU LEU VAL LYS ASP PRO LYS SEQRES 21 A 276 LYS ARG MET THR ILE GLN ASP SER LEU GLN HIS PRO TRP SEQRES 22 A 276 ILE LYS PRO HET UNN A 552 62 ATOM 1 N THR A 2 67.722 109.640 17.408 1.00 54.35 N ATOM 2 CA THR A 2 67.105 110.960 17.350 1.00 55.50 C ATOM 3 C THR A 2 66.216 111.047 16.108 1.00 58.04 C ATOM 4 O THR A 2 66.502 110.396 15.099 1.00 62.07 O ATOM 5 CB THR A 2 68.174 112.090 17.334 1.00 62.16 C ATOM 6 OG1 THR A 2 69.024 111.942 16.189 1.00 60.23 O ATOM 7 CG2 THR A 2 69.031 112.045 18.604 1.00 57.99 C ATOM 8 HG1 THR A 2 69.478 111.063 16.228 1.00 0.00 H ATOM 9 HN3 THR A 2 68.298 109.490 16.555 1.00 0.00 H ATOM 10 HN2 THR A 2 66.980 108.914 17.458 1.00 0.00 H ATOM 11 HN1 THR A 2 68.327 109.578 18.252 1.00 0.00 H ATOM 12 N VAL A 3 65.132 111.821 16.213 1.00 55.84 N ATOM 13 CA VAL A 3 64.168 112.068 15.126 1.00 54.84 C ATOM 14 C VAL A 3 63.274 110.866 14.773 1.00 53.65 C ATOM 15 O VAL A 3 63.067 110.558 13.591 1.00 58.04 O ATOM 16 CB VAL A 3 64.874 112.540 13.827 1.00 55.65 C ATOM 17 H VAL A 3 64.956 112.283 17.128 1.00 0.00 H ATOM 18 N PHE A 4 62.739 110.199 15.795 1.00 48.31 N ATOM 19 CA PHE A 4 61.747 109.141 15.603 1.00 38.85 C ATOM 20 C PHE A 4 60.348 109.731 15.795 1.00 37.21 C ATOM 21 O PHE A 4 60.211 110.761 16.450 1.00 42.07 O ATOM 22 CB PHE A 4 61.983 107.996 16.585 1.00 33.46 C ATOM 23 CG PHE A 4 63.309 107.308 16.416 1.00 34.05 C ATOM 24 CD1 PHE A 4 63.891 107.184 15.162 1.00 38.64 C ATOM 25 CD2 PHE A 4 63.973 106.779 17.513 1.00 31.98 C ATOM 26 CE1 PHE A 4 65.111 106.546 15.008 1.00 35.40 C ATOM 27 CE2 PHE A 4 65.190 106.138 17.366 1.00 31.17 C ATOM 28 CZ PHE A 4 65.760 106.025 16.112 1.00 31.72 C ATOM 29 H PHE A 4 63.037 110.439 16.762 1.00 0.00 H ATOM 30 N ARG A 5 59.320 109.089 15.237 1.00 32.03 N ATOM 31 CA ARG A 5 57.940 109.592 15.330 1.00 31.11 C ATOM 32 C ARG A 5 57.461 109.736 16.784 1.00 31.88 C ATOM 33 O ARG A 5 57.522 108.783 17.570 1.00 23.46 O ATOM 34 CB ARG A 5 56.972 108.673 14.570 1.00 29.83 C ATOM 35 CG ARG A 5 57.141 108.638 13.049 1.00 33.20 C ATOM 36 CD ARG A 5 56.430 109.796 12.365 1.00 42.23 C ATOM 37 NE ARG A 5 54.977 109.743 12.546 1.00 46.66 N ATOM 38 CZ ARG A 5 54.118 109.245 11.658 1.00 45.95 C ATOM 39 NH1 ARG A 5 54.557 108.746 10.502 1.00 43.13 N ATOM 40 NH2 ARG A 5 52.817 109.249 11.926 1.00 40.66 N ATOM 41 HE ARG A 5 54.588 110.122 13.433 1.00 0.00 H ATOM 42 HH12 ARG A 5 53.881 108.359 9.813 1.00 0.00 H ATOM 43 HH11 ARG A 5 55.575 108.744 10.290 1.00 0.00 H ATOM 44 HH22 ARG A 5 52.143 108.861 11.236 1.00 0.00 H ATOM 45 HH21 ARG A 5 52.473 109.640 12.826 1.00 0.00 H ATOM 46 H ARG A 5 59.500 108.205 14.720 1.00 0.00 H ATOM 47 N GLN A 6 56.949 110.918 17.122 1.00 32.12 N ATOM 48 CA GLN A 6 56.568 111.240 18.499 1.00 32.56 C ATOM 49 C GLN A 6 55.102 110.956 18.818 1.00 37.83 C ATOM 50 O GLN A 6 54.693 110.984 19.985 1.00 36.62 O ATOM 51 CB GLN A 6 56.876 112.710 18.787 1.00 38.93 C ATOM 52 CG GLN A 6 58.355 113.056 18.668 1.00 42.23 C ATOM 53 CD GLN A 6 59.196 112.331 19.693 1.00 45.45 C ATOM 54 OE1 GLN A 6 58.867 112.317 20.879 1.00 52.33 O ATOM 55 NE2 GLN A 6 60.289 111.722 19.244 1.00 43.86 N ATOM 56 HE22 GLN A 6 60.527 111.761 18.232 1.00 0.00 H ATOM 57 HE21 GLN A 6 60.906 111.207 19.904 1.00 0.00 H ATOM 58 H GLN A 6 56.815 111.637 16.383 1.00 0.00 H ATOM 59 N GLU A 7 54.309 110.688 17.786 1.00 37.15 N ATOM 60 CA GLU A 7 52.887 110.429 17.974 1.00 35.48 C ATOM 61 C GLU A 7 52.676 109.131 18.730 1.00 30.60 C ATOM 62 O GLU A 7 53.567 108.294 18.799 1.00 31.30 O ATOM 63 CB GLU A 7 52.157 110.380 16.623 1.00 35.42 C ATOM 64 CG GLU A 7 52.158 111.696 15.867 1.00 39.71 C ATOM 65 CD GLU A 7 53.300 111.795 14.876 1.00 45.96 C ATOM 66 OE1 GLU A 7 54.327 111.109 15.061 1.00 43.13 O ATOM 67 OE2 GLU A 7 53.176 112.573 13.913 1.00 47.45 O ATOM 68 H GLU A 7 54.710 110.663 16.827 1.00 0.00 H ATOM 69 N ASN A 8 51.497 108.970 19.309 1.00 32.05 N ATOM 70 CA ASN A 8 51.149 107.709 19.935 1.00 31.07 C ATOM 71 C ASN A 8 50.954 106.650 18.848 1.00 29.03 C ATOM 72 O ASN A 8 50.097 106.800 17.976 1.00 25.72 O ATOM 73 CB ASN A 8 49.886 107.862 20.779 1.00 30.04 C ATOM 74 CG ASN A 8 49.616 106.655 21.654 1.00 31.36 C ATOM 75 OD1 ASN A 8 50.201 105.586 21.473 1.00 32.18 O ATOM 76 ND2 ASN A 8 48.723 106.825 22.626 1.00 40.09 N ATOM 77 HD22 ASN A 8 48.252 107.744 22.744 1.00 0.00 H ATOM 78 HD21 ASN A 8 48.496 106.038 23.267 1.00 0.00 H ATOM 79 H ASN A 8 50.814 109.754 19.315 1.00 0.00 H ATOM 80 N VAL A 9 51.757 105.594 18.898 1.00 27.01 N ATOM 81 CA VAL A 9 51.656 104.524 17.915 1.00 26.45 C ATOM 82 C VAL A 9 50.228 103.944 17.909 1.00 26.37 C ATOM 83 O VAL A 9 49.731 103.541 16.860 1.00 24.57 O ATOM 84 CB VAL A 9 52.704 103.421 18.180 1.00 23.44 C ATOM 85 CG1 VAL A 9 52.371 102.648 19.440 1.00 26.40 C ATOM 86 CG2 VAL A 9 52.798 102.469 16.972 1.00 26.94 C ATOM 87 H VAL A 9 52.470 105.530 19.652 1.00 0.00 H ATOM 88 N ASP A 10 49.550 103.967 19.061 1.00 23.78 N ATOM 89 CA ASP A 10 48.184 103.447 19.171 1.00 29.04 C ATOM 90 C ASP A 10 47.168 104.279 18.401 1.00 27.72 C ATOM 91 O ASP A 10 46.041 103.833 18.171 1.00 27.00 O ATOM 92 CB ASP A 10 47.728 103.373 20.632 1.00 29.09 C ATOM 93 CG ASP A 10 48.490 102.343 21.438 1.00 36.63 C ATOM 94 OD1 ASP A 10 48.876 101.298 20.876 1.00 33.29 O ATOM 95 OD2 ASP A 10 48.694 102.584 22.649 1.00 42.34 O ATOM 96 H ASP A 10 50.006 104.367 19.906 1.00 0.00 H ATOM 97 N ASP A 11 47.543 105.494 18.023 1.00 26.69 N ATOM 98 CA ASP A 11 46.659 106.279 17.180 1.00 26.79 C ATOM 99 C ASP A 11 46.748 105.814 15.716 1.00 27.02 C ATOM 100 O ASP A 11 45.859 106.113 14.921 1.00 26.47 O ATOM 101 CB ASP A 11 46.983 107.772 17.290 1.00 27.73 C ATOM 102 CG ASP A 11 46.563 108.365 18.634 1.00 31.73 C ATOM 103 OD1 ASP A 11 45.588 107.867 19.242 1.00 36.19 O ATOM 104 OD2 ASP A 11 47.216 109.321 19.086 1.00 33.40 O ATOM 105 H ASP A 11 48.460 105.880 18.327 1.00 0.00 H ATOM 106 N TYR A 12 47.788 105.055 15.366 1.00 24.49 N ATOM 107 CA TYR A 12 48.005 104.677 13.957 1.00 22.46 C ATOM 108 C TYR A 12 47.926 103.172 13.679 1.00 20.37 C ATOM 109 O TYR A 12 47.759 102.752 12.522 1.00 20.03 O ATOM 110 CB TYR A 12 49.360 105.225 13.481 1.00 21.94 C ATOM 111 CG TYR A 12 49.368 106.730 13.427 1.00 25.77 C ATOM 112 CD1 TYR A 12 48.962 107.404 12.279 1.00 29.27 C ATOM 113 CD2 TYR A 12 49.724 107.484 14.541 1.00 32.26 C ATOM 114 CE1 TYR A 12 48.945 108.784 12.225 1.00 33.98 C ATOM 115 CE2 TYR A 12 49.705 108.869 14.499 1.00 34.64 C ATOM 116 CZ TYR A 12 49.315 109.511 13.337 1.00 37.67 C ATOM 117 OH TYR A 12 49.298 110.884 13.286 1.00 39.02 O ATOM 118 HH TYR A 12 48.997 111.176 12.389 1.00 0.00 H ATOM 119 H TYR A 12 48.453 104.726 16.095 1.00 0.00 H ATOM 120 N TYR A 13 48.039 102.371 14.737 1.00 20.36 N ATOM 121 CA TYR A 13 48.044 100.916 14.648 1.00 19.72 C ATOM 122 C TYR A 13 47.117 100.297 15.682 1.00 25.03 C ATOM 123 O TYR A 13 46.979 100.810 16.790 1.00 23.86 O ATOM 124 CB TYR A 13 49.473 100.357 14.850 1.00 16.44 C ATOM 125 CG TYR A 13 50.409 100.765 13.745 1.00 22.02 C ATOM 126 CD1 TYR A 13 51.020 102.008 13.757 1.00 18.11 C ATOM 127 CD2 TYR A 13 50.643 99.925 12.663 1.00 19.60 C ATOM 128 CE1 TYR A 13 51.857 102.401 12.722 1.00 19.91 C ATOM 129 CE2 TYR A 13 51.471 100.309 11.623 1.00 18.51 C ATOM 130 CZ TYR A 13 52.079 101.542 11.661 1.00 16.23 C ATOM 131 OH TYR A 13 52.897 101.940 10.633 1.00 17.01 O ATOM 132 HH TYR A 13 53.247 102.846 10.823 1.00 0.00 H ATOM 133 H TYR A 13 48.128 102.807 15.677 1.00 0.00 H ATOM 134 N ASP A 14 46.483 99.190 15.323 1.00 24.50 N ATOM 135 CA ASP A 14 45.888 98.314 16.329 1.00 26.82 C ATOM 136 C ASP A 14 46.887 97.201 16.623 1.00 26.13 C ATOM 137 O ASP A 14 47.552 96.724 15.716 1.00 24.50 O ATOM 138 CB ASP A 14 44.550 97.758 15.846 1.00 29.84 C ATOM 139 CG ASP A 14 43.472 98.827 15.787 1.00 30.44 C ATOM 140 OD1 ASP A 14 43.260 99.520 16.804 1.00 37.06 O ATOM 141 OD2 ASP A 14 42.858 98.996 14.725 1.00 31.29 O ATOM 142 H ASP A 14 46.408 98.943 14.316 1.00 0.00 H ATOM 143 N THR A 15 47.029 96.802 17.886 1.00 25.63 N ATOM 144 CA THR A 15 48.020 95.784 18.225 1.00 29.06 C ATOM 145 C THR A 15 47.346 94.464 18.546 1.00 30.16 C ATOM 146 O THR A 15 46.223 94.432 19.047 1.00 34.23 O ATOM 147 CB THR A 15 48.907 96.205 19.416 1.00 35.16 C ATOM 148 OG1 THR A 15 48.085 96.446 20.556 1.00 43.66 O ATOM 149 CG2 THR A 15 49.675 97.463 19.083 1.00 29.38 C ATOM 150 HG1 THR A 15 47.441 97.169 20.350 1.00 0.00 H ATOM 151 H THR A 15 46.434 97.216 18.632 1.00 0.00 H ATOM 152 N GLY A 16 48.034 93.373 18.238 1.00 28.00 N ATOM 153 CA GLY A 16 47.470 92.048 18.414 1.00 33.28 C ATOM 154 C GLY A 16 48.352 91.147 19.251 1.00 29.04 C ATOM 155 O GLY A 16 49.012 91.605 20.184 1.00 30.57 O ATOM 156 H GLY A 16 48.999 93.469 17.862 1.00 0.00 H ATOM 157 N GLU A 17 48.388 89.871 18.889 1.00 33.15 N ATOM 158 CA GLU A 17 49.079 88.860 19.688 1.00 36.56 C ATOM 159 C GLU A 17 50.599 89.057 19.732 1.00 33.00 C ATOM 160 O GLU A 17 51.227 89.497 18.758 1.00 26.07 O ATOM 161 CB GLU A 17 48.756 87.457 19.158 1.00 35.40 C ATOM 162 CG GLU A 17 49.195 87.217 17.717 1.00 41.89 C ATOM 163 CD GLU A 17 49.120 85.750 17.299 1.00 49.35 C ATOM 164 OE1 GLU A 17 48.886 84.886 18.172 1.00 59.71 O ATOM 165 OE2 GLU A 17 49.304 85.461 16.093 1.00 50.58 O ATOM 166 H GLU A 17 47.911 89.582 18.011 1.00 0.00 H ATOM 167 N GLU A 18 51.181 88.719 20.877 1.00 29.16 N ATOM 168 CA GLU A 18 52.627 88.660 21.018 1.00 26.92 C ATOM 169 C GLU A 18 53.217 87.526 20.179 1.00 31.13 C ATOM 170 O GLU A 18 52.726 86.399 20.195 1.00 28.71 O ATOM 171 CB GLU A 18 53.011 88.485 22.488 1.00 29.43 C ATOM 172 CG GLU A 18 54.504 88.312 22.704 1.00 30.68 C ATOM 173 CD GLU A 18 54.872 88.239 24.176 1.00 36.27 C ATOM 174 OE1 GLU A 18 54.276 88.996 24.976 1.00 33.49 O ATOM 175 OE2 GLU A 18 55.746 87.412 24.521 1.00 38.83 O ATOM 176 H GLU A 18 50.585 88.490 21.697 1.00 0.00 H ATOM 177 N LEU A 19 54.274 87.831 19.441 1.00 25.15 N ATOM 178 CA LEU A 19 54.877 86.864 18.533 1.00 25.23 C ATOM 179 C LEU A 19 56.151 86.275 19.119 1.00 28.54 C ATOM 180 O LEU A 19 56.504 85.126 18.857 1.00 29.81 O ATOM 181 CB LEU A 19 55.170 87.522 17.182 1.00 27.93 C ATOM 182 CG LEU A 19 53.955 88.047 16.413 1.00 27.77 C ATOM 183 CD1 LEU A 19 54.384 88.848 15.184 1.00 23.29 C ATOM 184 CD2 LEU A 19 53.045 86.881 16.023 1.00 30.16 C ATOM 185 H LEU A 19 54.684 88.784 19.511 1.00 0.00 H ATOM 186 N GLY A 20 56.841 87.075 19.916 1.00 27.55 N ATOM 187 CA GLY A 20 58.086 86.651 20.521 1.00 32.75 C ATOM 188 C GLY A 20 58.527 87.693 21.524 1.00 32.77 C ATOM 189 O GLY A 20 58.004 88.807 21.539 1.00 28.49 O ATOM 190 H GLY A 20 56.480 88.031 20.112 1.00 0.00 H ATOM 191 N SER A 21 59.485 87.338 22.369 1.00 33.59 N ATOM 192 CA SER A 21 59.989 88.291 23.351 1.00 36.89 C ATOM 193 C SER A 21 61.419 87.957 23.753 1.00 44.79 C ATOM 194 O SER A 21 61.788 86.787 23.875 1.00 46.78 O ATOM 195 CB SER A 21 59.088 88.320 24.586 1.00 36.71 C ATOM 196 OG SER A 21 59.115 87.071 25.247 1.00 46.44 O ATOM 197 HG SER A 21 60.042 86.868 25.529 1.00 0.00 H ATOM 198 H SER A 21 59.879 86.376 22.331 1.00 0.00 H ATOM 199 N GLY A 22 62.221 88.999 23.937 1.00 41.53 N ATOM 200 CA GLY A 22 63.598 88.841 24.355 1.00 45.71 C ATOM 201 C GLY A 22 63.766 89.463 25.720 1.00 44.22 C ATOM 202 O GLY A 22 62.777 89.795 26.381 1.00 45.96 O ATOM 203 H GLY A 22 61.849 89.957 23.776 1.00 0.00 H ATOM 204 N GLN A 23 65.010 89.627 26.153 1.00 41.67 N ATOM 205 CA GLN A 23 65.252 90.208 27.466 1.00 45.62 C ATOM 206 C GLN A 23 64.779 91.660 27.528 1.00 39.03 C ATOM 207 O GLN A 23 64.225 92.091 28.538 1.00 41.40 O ATOM 208 CB GLN A 23 66.734 90.126 27.836 1.00 46.49 C ATOM 209 CG GLN A 23 67.015 90.593 29.257 1.00 48.31 C ATOM 210 CD GLN A 23 68.466 90.414 29.663 1.00 54.04 C ATOM 211 OE1 GLN A 23 69.305 90.015 28.852 1.00 54.79 O ATOM 212 NE2 GLN A 23 68.769 90.706 30.928 1.00 52.50 N ATOM 213 HE22 GLN A 23 68.028 91.040 31.577 1.00 0.00 H ATOM 214 HE21 GLN A 23 69.747 90.600 31.266 1.00 0.00 H ATOM 215 H GLN A 23 65.811 89.341 25.555 1.00 0.00 H ATOM 216 N PHE A 24 64.993 92.407 26.448 1.00 29.37 N ATOM 217 CA PHE A 24 64.651 93.829 26.443 1.00 33.11 C ATOM 218 C PHE A 24 63.692 94.225 25.318 1.00 29.95 C ATOM 219 O PHE A 24 63.552 95.406 25.004 1.00 27.63 O ATOM 220 CB PHE A 24 65.925 94.663 26.341 1.00 34.39 C ATOM 221 CG PHE A 24 66.887 94.445 27.484 1.00 39.56 C ATOM 222 CD1 PHE A 24 66.433 94.434 28.794 1.00 36.25 C ATOM 223 CD2 PHE A 24 68.237 94.229 27.242 1.00 43.08 C ATOM 224 CE1 PHE A 24 67.313 94.226 29.850 1.00 41.95 C ATOM 225 CE2 PHE A 24 69.122 94.021 28.291 1.00 44.24 C ATOM 226 CZ PHE A 24 68.655 94.015 29.595 1.00 39.96 C ATOM 227 H PHE A 24 65.408 91.975 25.598 1.00 0.00 H ATOM 228 N ALA A 25 63.028 93.245 24.718 1.00 28.38 N ATOM 229 CA ALA A 25 62.126 93.535 23.608 1.00 25.64 C ATOM 230 C ALA A 25 60.958 92.559 23.544 1.00 27.45 C ATOM 231 O ALA A 25 61.059 91.420 24.010 1.00 24.54 O ATOM 232 CB ALA A 25 62.907 93.528 22.291 1.00 24.89 C ATOM 233 H ALA A 25 63.151 92.264 25.041 1.00 0.00 H ATOM 234 N VAL A 26 59.840 93.027 22.988 1.00 22.60 N ATOM 235 CA VAL A 26 58.696 92.175 22.686 1.00 24.56 C ATOM 236 C VAL A 26 58.224 92.508 21.263 1.00 24.99 C ATOM 237 O VAL A 26 58.157 93.679 20.889 1.00 21.28 O ATOM 238 CB VAL A 26 57.536 92.347 23.703 1.00 25.31 C ATOM 239 CG1 VAL A 26 57.047 93.786 23.774 1.00 27.69 C ATOM 240 CG2 VAL A 26 56.374 91.421 23.378 1.00 28.29 C ATOM 241 H VAL A 26 59.782 94.040 22.761 1.00 0.00 H ATOM 242 N VAL A 27 57.952 91.478 20.466 1.00 22.54 N ATOM 243 CA VAL A 27 57.407 91.674 19.123 1.00 21.85 C ATOM 244 C VAL A 27 55.927 91.271 19.098 1.00 24.35 C ATOM 245 O VAL A 27 55.571 90.169 19.549 1.00 23.94 O ATOM 246 CB VAL A 27 58.188 90.863 18.059 1.00 24.94 C ATOM 247 CG1 VAL A 27 57.592 91.083 16.649 1.00 20.09 C ATOM 248 CG2 VAL A 27 59.669 91.232 18.072 1.00 24.26 C ATOM 249 H VAL A 27 58.131 90.511 20.806 1.00 0.00 H ATOM 250 N LYS A 28 55.070 92.164 18.598 1.00 22.36 N ATOM 251 CA LYS A 28 53.634 91.887 18.472 1.00 22.27 C ATOM 252 C LYS A 28 53.126 92.117 17.049 1.00 24.09 C ATOM 253 O LYS A 28 53.685 92.923 16.307 1.00 20.35 O ATOM 254 CB LYS A 28 52.819 92.760 19.427 1.00 22.16 C ATOM 255 CG LYS A 28 53.168 92.557 20.899 1.00 28.43 C ATOM 256 CD LYS A 28 52.282 93.421 21.777 1.00 33.75 C ATOM 257 CE LYS A 28 52.425 93.038 23.250 1.00 42.58 C ATOM 258 NZ LYS A 28 51.462 93.800 24.097 1.00 43.98 N ATOM 259 HZ1 LYS A 28 51.646 94.819 23.998 1.00 0.00 H ATOM 260 HZ2 LYS A 28 50.491 93.590 23.790 1.00 0.00 H ATOM 261 HZ3 LYS A 28 51.581 93.521 25.092 1.00 0.00 H ATOM 262 H LYS A 28 55.432 93.088 18.287 1.00 0.00 H ATOM 263 N LYS A 29 52.053 91.421 16.685 1.00 19.11 N ATOM 264 CA LYS A 29 51.409 91.652 15.395 1.00 22.66 C ATOM 265 C LYS A 29 50.651 92.965 15.502 1.00 23.41 C ATOM 266 O LYS A 29 50.153 93.306 16.567 1.00 23.73 O ATOM 267 CB LYS A 29 50.474 90.494 15.023 1.00 27.15 C ATOM 268 CG LYS A 29 50.125 90.423 13.538 1.00 32.77 C ATOM 269 CD LYS A 29 49.323 89.157 13.202 1.00 35.10 C ATOM 270 H LYS A 29 51.667 90.701 17.329 1.00 0.00 H ATOM 271 N CYS A 30 50.598 93.732 14.423 1.00 20.77 N ATOM 272 CA CYS A 30 49.830 94.967 14.457 1.00 20.34 C ATOM 273 C CYS A 30 49.216 95.223 13.090 1.00 20.15 C ATOM 274 O CYS A 30 49.593 94.575 12.102 1.00 20.48 O ATOM 275 CB CYS A 30 50.691 96.160 14.914 1.00 18.83 C ATOM 276 SG CYS A 30 52.022 96.648 13.814 1.00 21.41 S ATOM 277 H CYS A 30 51.102 93.453 13.557 1.00 0.00 H ATOM 278 N ARG A 31 48.252 96.142 13.043 1.00 21.69 N ATOM 279 CA ARG A 31 47.550 96.467 11.805 1.00 19.78 C ATOM 280 C ARG A 31 47.500 97.985 11.626 1.00 19.32 C ATOM 281 O ARG A 31 47.027 98.721 12.499 1.00 19.30 O ATOM 282 CB ARG A 31 46.128 95.862 11.812 1.00 23.06 C ATOM 283 CG ARG A 31 45.302 96.060 10.520 1.00 23.08 C ATOM 284 CD ARG A 31 43.865 95.529 10.721 1.00 32.18 C ATOM 285 NE ARG A 31 43.009 95.700 9.548 1.00 38.34 N ATOM 286 CZ ARG A 31 42.256 96.774 9.316 1.00 38.21 C ATOM 287 NH1 ARG A 31 42.261 97.789 10.174 1.00 36.03 N ATOM 288 NH2 ARG A 31 41.502 96.841 8.218 1.00 39.67 N ATOM 289 HE ARG A 31 42.987 94.931 8.848 1.00 0.00 H ATOM 290 HH12 ARG A 31 41.673 98.627 9.992 1.00 0.00 H ATOM 291 HH11 ARG A 31 42.853 97.745 11.028 1.00 0.00 H ATOM 292 HH22 ARG A 31 40.915 97.681 8.040 1.00 0.00 H ATOM 293 HH21 ARG A 31 41.501 96.053 7.539 1.00 0.00 H ATOM 294 H ARG A 31 47.992 96.644 13.916 1.00 0.00 H ATOM 295 N GLU A 32 48.032 98.456 10.502 1.00 18.39 N ATOM 296 CA GLU A 32 48.036 99.877 10.203 1.00 16.69 C ATOM 297 C GLU A 32 46.611 100.338 9.875 1.00 19.42 C ATOM 298 O GLU A 32 45.976 99.774 8.984 1.00 19.17 O ATOM 299 CB GLU A 32 48.976 100.172 9.026 1.00 17.42 C ATOM 300 CG GLU A 32 49.227 101.646 8.803 1.00 17.83 C ATOM 301 CD GLU A 32 50.203 101.912 7.652 1.00 18.04 C ATOM 302 OE1 GLU A 32 50.135 101.204 6.619 1.00 18.57 O ATOM 303 OE2 GLU A 32 51.031 102.833 7.779 1.00 20.90 O ATOM 304 H GLU A 32 48.455 97.792 9.822 1.00 0.00 H ATOM 305 N LYS A 33 46.124 101.359 10.579 1.00 19.81 N ATOM 306 CA LYS A 33 44.729 101.799 10.437 1.00 22.34 C ATOM 307 C LYS A 33 44.419 102.400 9.061 1.00 20.54 C ATOM 308 O LYS A 33 43.361 102.148 8.495 1.00 25.32 O ATOM 309 CB LYS A 33 44.374 102.819 11.522 1.00 22.83 C ATOM 310 CG LYS A 33 44.270 102.237 12.949 1.00 24.50 C ATOM 311 CD LYS A 33 44.005 103.350 13.951 1.00 27.55 C ATOM 312 CE LYS A 33 44.039 102.849 15.386 1.00 30.70 C ATOM 313 NZ LYS A 33 42.977 101.839 15.589 1.00 39.52 N ATOM 314 HZ1 LYS A 33 42.050 102.269 15.396 1.00 0.00 H ATOM 315 HZ2 LYS A 33 43.132 101.040 14.941 1.00 0.00 H ATOM 316 HZ3 LYS A 33 43.006 101.500 16.572 1.00 0.00 H ATOM 317 H LYS A 33 46.747 101.857 11.246 1.00 0.00 H ATOM 318 N SER A 34 45.337 103.199 8.532 1.00 20.76 N ATOM 319 CA SER A 34 45.123 103.883 7.259 1.00 23.23 C ATOM 320 C SER A 34 45.033 102.945 6.054 1.00 22.14 C ATOM 321 O SER A 34 44.372 103.272 5.063 1.00 21.01 O ATOM 322 CB SER A 34 46.243 104.893 7.012 1.00 27.61 C ATOM 323 OG SER A 34 47.492 104.227 6.866 1.00 21.34 O ATOM 324 HG SER A 34 48.205 104.896 6.707 1.00 0.00 H ATOM 325 H SER A 34 46.234 103.342 9.038 1.00 0.00 H ATOM 326 N THR A 35 45.707 101.799 6.129 1.00 18.03 N ATOM 327 CA THR A 35 45.809 100.888 4.991 1.00 20.24 C ATOM 328 C THR A 35 45.122 99.559 5.230 1.00 21.58 C ATOM 329 O THR A 35 44.865 98.807 4.287 1.00 24.56 O ATOM 330 CB THR A 35 47.280 100.571 4.646 1.00 19.86 C ATOM 331 OG1 THR A 35 47.911 99.985 5.793 1.00 17.71 O ATOM 332 CG2 THR A 35 48.023 101.837 4.226 1.00 18.39 C ATOM 333 HG1 THR A 35 48.855 99.779 5.579 1.00 0.00 H ATOM 334 H THR A 35 46.174 101.545 7.023 1.00 0.00 H ATOM 335 N GLY A 36 44.897 99.239 6.499 1.00 20.53 N ATOM 336 CA GLY A 36 44.486 97.904 6.889 1.00 20.67 C ATOM 337 C GLY A 36 45.556 96.828 6.769 1.00 21.18 C ATOM 338 O GLY A 36 45.260 95.643 6.916 1.00 20.69 O ATOM 339 H GLY A 36 45.019 99.965 7.233 1.00 0.00 H ATOM 340 N LEU A 37 46.804 97.208 6.495 1.00 17.08 N ATOM 341 CA LEU A 37 47.832 96.188 6.246 1.00 17.03 C ATOM 342 C LEU A 37 48.491 95.736 7.553 1.00 19.15 C ATOM 343 O LEU A 37 48.685 96.546 8.447 1.00 17.69 O ATOM 344 CB LEU A 37 48.893 96.717 5.278 1.00 19.79 C ATOM 345 CG LEU A 37 48.329 97.066 3.892 1.00 19.01 C ATOM 346 CD1 LEU A 37 49.396 97.774 3.047 1.00 20.45 C ATOM 347 CD2 LEU A 37 47.830 95.803 3.192 1.00 20.74 C ATOM 348 H LEU A 37 47.048 98.218 6.458 1.00 0.00 H ATOM 349 N GLN A 38 48.838 94.453 7.648 1.00 18.17 N ATOM 350 CA GLN A 38 49.472 93.916 8.861 1.00 21.07 C ATOM 351 C GLN A 38 50.987 94.092 8.848 1.00 18.74 C ATOM 352 O GLN A 38 51.634 93.910 7.817 1.00 16.88 O ATOM 353 CB GLN A 38 49.160 92.431 9.040 1.00 22.50 C ATOM 354 CG GLN A 38 47.706 92.113 9.344 1.00 29.72 C ATOM 355 CD GLN A 38 47.523 90.661 9.739 1.00 40.10 C ATOM 356 OE1 GLN A 38 48.068 89.756 9.100 1.00 43.85 O ATOM 357 NE2 GLN A 38 46.778 90.430 10.812 1.00 42.04 N ATOM 358 HE22 GLN A 38 46.338 91.224 11.320 1.00 0.00 H ATOM 359 HE21 GLN A 38 46.634 89.455 11.145 1.00 0.00 H ATOM 360 H GLN A 38 48.656 93.817 6.846 1.00 0.00 H ATOM 361 N TYR A 39 51.526 94.420 10.021 1.00 16.55 N ATOM 362 CA TYR A 39 52.952 94.609 10.246 1.00 15.70 C ATOM 363 C TYR A 39 53.315 93.923 11.558 1.00 18.62 C ATOM 364 O TYR A 39 52.442 93.399 12.244 1.00 17.95 O ATOM 365 CB TYR A 39 53.311 96.103 10.310 1.00 14.20 C ATOM 366 CG TYR A 39 53.309 96.785 8.944 1.00 17.19 C ATOM 367 CD1 TYR A 39 54.402 96.676 8.088 1.00 17.22 C ATOM 368 CD2 TYR A 39 52.202 97.525 8.507 1.00 18.41 C ATOM 369 CE1 TYR A 39 54.402 97.293 6.828 1.00 19.12 C ATOM 370 CE2 TYR A 39 52.189 98.140 7.252 1.00 17.43 C ATOM 371 CZ TYR A 39 53.294 98.021 6.422 1.00 22.71 C ATOM 372 OH TYR A 39 53.298 98.638 5.182 1.00 21.76 O ATOM 373 HH TYR A 39 53.191 99.615 5.300 1.00 0.00 H ATOM 374 H TYR A 39 50.886 94.550 10.830 1.00 0.00 H ATOM 375 N ALA A 40 54.600 93.924 11.885 1.00 16.08 N ATOM 376 CA ALA A 40 55.080 93.522 13.202 1.00 17.28 C ATOM 377 C ALA A 40 55.591 94.763 13.940 1.00 18.50 C ATOM 378 O ALA A 40 56.175 95.662 13.319 1.00 20.40 O ATOM 379 CB ALA A 40 56.202 92.470 13.078 1.00 19.23 C ATOM 380 H ALA A 40 55.295 94.224 11.172 1.00 0.00 H ATOM 381 N ALA A 41 55.353 94.833 15.245 1.00 17.70 N ATOM 382 CA ALA A 41 55.864 95.948 16.045 1.00 17.99 C ATOM 383 C ALA A 41 56.859 95.421 17.089 1.00 19.37 C ATOM 384 O ALA A 41 56.502 94.586 17.927 1.00 20.24 O ATOM 385 CB ALA A 41 54.711 96.705 16.720 1.00 17.59 C ATOM 386 H ALA A 41 54.796 94.085 15.705 1.00 0.00 H ATOM 387 N LYS A 42 58.115 95.856 16.998 1.00 15.44 N ATOM 388 CA LYS A 42 59.111 95.500 18.009 1.00 17.76 C ATOM 389 C LYS A 42 59.261 96.631 19.029 1.00 19.42 C ATOM 390 O LYS A 42 59.746 97.715 18.691 1.00 16.70 O ATOM 391 CB LYS A 42 60.476 95.199 17.383 1.00 18.15 C ATOM 392 CG LYS A 42 61.518 94.676 18.411 1.00 20.12 C ATOM 393 CD LYS A 42 62.927 94.608 17.795 1.00 22.70 C ATOM 394 CE LYS A 42 63.942 93.973 18.765 1.00 24.86 C ATOM 395 NZ LYS A 42 65.294 93.876 18.116 1.00 26.91 N ATOM 396 HZ1 LYS A 42 65.226 93.287 17.262 1.00 0.00 H ATOM 397 HZ2 LYS A 42 65.622 94.828 17.856 1.00 0.00 H ATOM 398 HZ3 LYS A 42 65.967 93.446 18.782 1.00 0.00 H ATOM 399 H LYS A 42 58.392 96.458 16.196 1.00 0.00 H ATOM 400 N PHE A 43 58.852 96.363 20.269 1.00 17.18 N ATOM 401 CA PHE A 43 58.932 97.352 21.341 1.00 20.53 C ATOM 402 C PHE A 43 60.245 97.148 22.074 1.00 23.43 C ATOM 403 O PHE A 43 60.443 96.110 22.704 1.00 19.72 O ATOM 404 CB PHE A 43 57.770 97.211 22.327 1.00 22.07 C ATOM 405 CG PHE A 43 56.415 97.461 21.724 1.00 24.06 C ATOM 406 CD1 PHE A 43 55.795 96.491 20.946 1.00 23.28 C ATOM 407 CD2 PHE A 43 55.747 98.656 21.958 1.00 25.73 C ATOM 408 CE1 PHE A 43 54.541 96.711 20.404 1.00 23.35 C ATOM 409 CE2 PHE A 43 54.494 98.883 21.409 1.00 24.82 C ATOM 410 CZ PHE A 43 53.896 97.914 20.632 1.00 25.89 C ATOM 411 H PHE A 43 58.464 95.421 20.480 1.00 0.00 H ATOM 412 N ILE A 44 61.145 98.117 21.978 1.00 22.86 N ATOM 413 CA ILE A 44 62.450 97.993 22.625 1.00 19.63 C ATOM 414 C ILE A 44 62.526 98.886 23.858 1.00 24.64 C ATOM 415 O ILE A 44 62.369 100.095 23.751 1.00 19.96 O ATOM 416 CB ILE A 44 63.589 98.372 21.670 1.00 19.28 C ATOM 417 CG1 ILE A 44 63.468 97.604 20.347 1.00 17.75 C ATOM 418 CG2 ILE A 44 64.943 98.107 22.312 1.00 19.46 C ATOM 419 CD1 ILE A 44 64.419 98.123 19.286 1.00 18.66 C ATOM 420 H ILE A 44 60.920 98.976 21.436 1.00 0.00 H ATOM 421 N LYS A 45 62.777 98.297 25.024 1.00 23.28 N ATOM 422 CA LYS A 45 62.903 99.090 26.252 1.00 25.98 C ATOM 423 C LYS A 45 64.196 99.912 26.291 1.00 20.93 C ATOM 424 O LYS A 45 65.302 99.366 26.213 1.00 21.11 O ATOM 425 CB LYS A 45 62.837 98.180 27.491 1.00 27.93 C ATOM 426 CG LYS A 45 62.467 98.926 28.775 1.00 27.23 C ATOM 427 CD LYS A 45 62.550 98.025 29.998 1.00 33.21 C ATOM 428 H LYS A 45 62.885 97.263 25.066 1.00 0.00 H ATOM 429 N LYS A 46 64.059 101.228 26.414 1.00 22.80 N ATOM 430 CA LYS A 46 65.220 102.099 26.611 1.00 21.78 C ATOM 431 C LYS A 46 65.809 101.921 28.022 1.00 22.68 C ATOM 432 O LYS A 46 65.071 101.727 28.975 1.00 23.77 O ATOM 433 CB LYS A 46 64.830 103.567 26.378 1.00 24.00 C ATOM 434 CG LYS A 46 64.408 103.863 24.934 1.00 19.56 C ATOM 435 CD LYS A 46 64.116 105.342 24.690 1.00 26.24 C ATOM 436 CE LYS A 46 62.856 105.813 25.387 1.00 27.90 C ATOM 437 NZ LYS A 46 62.517 107.206 24.935 1.00 30.34 N ATOM 438 HZ1 LYS A 46 63.302 107.846 25.171 1.00 0.00 H ATOM 439 HZ2 LYS A 46 62.364 107.208 23.906 1.00 0.00 H ATOM 440 HZ3 LYS A 46 61.652 107.524 25.416 1.00 0.00 H ATOM 441 H LYS A 46 63.109 101.648 26.370 1.00 0.00 H ATOM 442 N ARG A 47 67.128 101.963 28.165 1.00 22.91 N ATOM 443 CA ARG A 47 67.675 101.833 29.517 1.00 27.58 C ATOM 444 C ARG A 47 67.459 103.131 30.312 1.00 28.02 C ATOM 445 O ARG A 47 67.309 103.091 31.535 1.00 32.58 O ATOM 446 CB ARG A 47 69.154 101.434 29.491 1.00 26.33 C ATOM 447 CG ARG A 47 70.113 102.459 28.947 1.00 26.33 C ATOM 448 CD ARG A 47 71.557 101.977 29.145 1.00 25.44 C ATOM 449 NE ARG A 47 72.504 102.886 28.507 1.00 28.58 N ATOM 450 CZ ARG A 47 73.810 102.664 28.415 1.00 30.89 C ATOM 451 NH1 ARG A 47 74.343 101.549 28.916 1.00 26.24 N ATOM 452 NH2 ARG A 47 74.581 103.561 27.820 1.00 28.46 N ATOM 453 HE ARG A 47 72.131 103.766 28.097 1.00 0.00 H ATOM 454 HH12 ARG A 47 75.367 101.382 28.840 1.00 0.00 H ATOM 455 HH11 ARG A 47 73.735 100.846 29.383 1.00 0.00 H ATOM 456 HH22 ARG A 47 75.605 103.397 27.743 1.00 0.00 H ATOM 457 HH21 ARG A 47 74.163 104.430 27.430 1.00 0.00 H ATOM 458 H ARG A 47 67.753 102.084 27.343 1.00 0.00 H ATOM 459 N ARG A 48 67.410 104.260 29.605 1.00 26.30 N ATOM 460 CA ARG A 48 67.078 105.582 30.189 1.00 30.88 C ATOM 461 C ARG A 48 68.179 106.174 31.078 1.00 26.62 C ATOM 462 O ARG A 48 68.494 107.352 30.953 1.00 28.87 O ATOM 463 CB ARG A 48 65.770 105.528 30.988 1.00 33.99 C ATOM 464 CG ARG A 48 64.539 105.150 30.170 1.00 36.76 C ATOM 465 CD ARG A 48 63.323 105.067 31.078 1.00 38.65 C ATOM 466 NE ARG A 48 62.568 106.311 31.075 1.00 43.39 N ATOM 467 CZ ARG A 48 61.573 106.580 31.913 1.00 44.64 C ATOM 468 NH1 ARG A 48 61.227 105.688 32.833 1.00 42.31 N ATOM 469 NH2 ARG A 48 60.931 107.742 31.833 1.00 46.06 N ATOM 470 HE ARG A 48 62.823 107.035 30.373 1.00 0.00 H ATOM 471 HH12 ARG A 48 60.449 105.895 33.491 1.00 0.00 H ATOM 472 HH11 ARG A 48 61.734 104.782 32.896 1.00 0.00 H ATOM 473 HH22 ARG A 48 60.152 107.952 32.489 1.00 0.00 H ATOM 474 HH21 ARG A 48 61.208 108.441 31.114 1.00 0.00 H ATOM 475 H ARG A 48 67.616 104.211 28.587 1.00 0.00 H ATOM 476 N THR A 49 68.749 105.378 31.975 1.00 25.60 N ATOM 477 CA THR A 49 69.953 105.804 32.692 1.00 28.40 C ATOM 478 C THR A 49 71.146 104.910 32.347 1.00 29.72 C ATOM 479 O THR A 49 71.001 103.693 32.229 1.00 29.35 O ATOM 480 CB THR A 49 69.730 105.812 34.224 1.00 29.40 C ATOM 481 OG1 THR A 49 69.149 104.566 34.635 1.00 33.71 O ATOM 482 CG2 THR A 49 68.785 106.939 34.610 1.00 29.19 C ATOM 483 HG1 THR A 49 69.008 104.576 35.615 1.00 0.00 H ATOM 484 H THR A 49 68.337 104.443 32.170 1.00 0.00 H ATOM 485 N LYS A 50 72.324 105.515 32.198 1.00 27.95 N ATOM 486 CA LYS A 50 73.527 104.782 31.792 1.00 29.75 C ATOM 487 C LYS A 50 73.939 103.678 32.756 1.00 36.31 C ATOM 488 O LYS A 50 74.608 102.723 32.361 1.00 38.29 O ATOM 489 CB LYS A 50 74.701 105.743 31.607 1.00 30.85 C ATOM 490 CG LYS A 50 74.563 106.644 30.402 1.00 32.72 C ATOM 491 CD LYS A 50 75.788 107.520 30.212 1.00 33.45 C ATOM 492 CE LYS A 50 76.475 107.252 28.883 1.00 39.87 C ATOM 493 NZ LYS A 50 75.560 107.341 27.692 1.00 38.69 N ATOM 494 HZ1 LYS A 50 74.796 106.642 27.790 1.00 0.00 H ATOM 495 HZ2 LYS A 50 75.152 108.296 27.640 1.00 0.00 H ATOM 496 HZ3 LYS A 50 76.101 107.146 26.825 1.00 0.00 H ATOM 497 H LYS A 50 72.392 106.538 32.375 1.00 0.00 H ATOM 498 N SER A 51 73.532 103.807 34.013 1.00 35.73 N ATOM 499 CA SER A 51 73.874 102.833 35.037 1.00 38.84 C ATOM 500 C SER A 51 72.876 101.685 35.094 1.00 39.74 C ATOM 501 O SER A 51 73.100 100.705 35.797 1.00 42.98 O ATOM 502 CB SER A 51 73.945 103.510 36.408 1.00 38.42 C ATOM 503 OG SER A 51 72.652 103.913 36.822 1.00 35.14 O ATOM 504 HG SER A 51 72.712 104.349 37.709 1.00 0.00 H ATOM 505 H SER A 51 72.951 104.629 34.273 1.00 0.00 H ATOM 506 N SER A 52 71.765 101.809 34.376 1.00 37.36 N ATOM 507 CA SER A 52 70.760 100.757 34.393 1.00 38.04 C ATOM 508 C SER A 52 71.140 99.618 33.462 1.00 40.70 C ATOM 509 O SER A 52 71.658 99.846 32.372 1.00 38.52 O ATOM 510 CB SER A 52 69.387 101.304 34.009 1.00 37.98 C ATOM 511 OG SER A 52 68.433 100.253 33.948 1.00 40.99 O ATOM 512 HG SER A 52 67.550 100.624 33.698 1.00 0.00 H ATOM 513 H SER A 52 71.613 102.661 33.800 1.00 0.00 H ATOM 514 N ARG A 53 70.880 98.393 33.911 1.00 41.34 N ATOM 515 CA ARG A 53 71.084 97.201 33.097 1.00 41.81 C ATOM 516 C ARG A 53 69.764 96.642 32.565 1.00 37.12 C ATOM 517 O ARG A 53 69.748 95.573 31.965 1.00 41.61 O ATOM 518 CB ARG A 53 71.806 96.118 33.908 1.00 45.18 C ATOM 519 CG ARG A 53 73.186 96.518 34.402 1.00 49.42 C ATOM 520 CD ARG A 53 74.234 96.348 33.320 1.00 54.50 C ATOM 521 NE ARG A 53 75.575 96.697 33.787 1.00 64.36 N ATOM 522 CZ ARG A 53 76.307 95.943 34.603 1.00 59.34 C ATOM 523 NH1 ARG A 53 75.827 94.794 35.059 1.00 61.44 N ATOM 524 NH2 ARG A 53 77.520 96.341 34.970 1.00 56.13 N ATOM 525 HE ARG A 53 75.984 97.595 33.459 1.00 0.00 H ATOM 526 HH12 ARG A 53 76.402 94.207 35.697 1.00 0.00 H ATOM 527 HH11 ARG A 53 74.876 94.480 34.779 1.00 0.00 H ATOM 528 HH22 ARG A 53 78.090 95.750 35.608 1.00 0.00 H ATOM 529 HH21 ARG A 53 77.899 97.244 34.619 1.00 0.00 H ATOM 530 H ARG A 53 70.517 98.282 34.879 1.00 0.00 H ATOM 531 N ARG A 54 68.664 97.355 32.790 1.00 33.66 N ATOM 532 CA ARG A 54 67.332 96.850 32.444 1.00 38.29 C ATOM 533 C ARG A 54 66.755 97.395 31.130 1.00 40.06 C ATOM 534 O ARG A 54 65.542 97.539 31.004 1.00 41.01 O ATOM 535 CB ARG A 54 66.343 97.158 33.572 1.00 38.70 C ATOM 536 CG ARG A 54 66.433 96.220 34.773 1.00 45.40 C ATOM 537 CD ARG A 54 65.787 96.840 36.004 1.00 47.72 C ATOM 538 NE ARG A 54 66.467 98.073 36.391 1.00 53.56 N ATOM 539 CZ ARG A 54 65.874 99.257 36.511 1.00 54.45 C ATOM 540 NH1 ARG A 54 64.570 99.381 36.294 1.00 59.82 N ATOM 541 NH2 ARG A 54 66.585 100.323 36.852 1.00 46.38 N ATOM 542 HE ARG A 54 67.487 98.021 36.587 1.00 0.00 H ATOM 543 HH12 ARG A 54 64.113 100.310 36.390 1.00 0.00 H ATOM 544 HH11 ARG A 54 64.006 98.549 36.028 1.00 0.00 H ATOM 545 HH22 ARG A 54 66.121 101.249 36.946 1.00 0.00 H ATOM 546 HH21 ARG A 54 67.606 100.233 37.026 1.00 0.00 H ATOM 547 H ARG A 54 68.751 98.296 33.223 1.00 0.00 H ATOM 548 N GLY A 55 67.610 97.686 30.157 1.00 35.48 N ATOM 549 CA GLY A 55 67.152 98.197 28.874 1.00 28.05 C ATOM 550 C GLY A 55 68.293 98.318 27.882 1.00 27.49 C ATOM 551 O GLY A 55 69.434 97.981 28.188 1.00 27.50 O ATOM 552 H GLY A 55 68.628 97.546 30.315 1.00 0.00 H ATOM 553 N VAL A 56 67.987 98.799 26.682 1.00 23.75 N ATOM 554 CA VAL A 56 68.978 98.883 25.613 1.00 24.20 C ATOM 555 C VAL A 56 69.509 100.302 25.524 1.00 22.26 C ATOM 556 O VAL A 56 68.739 101.250 25.656 1.00 23.41 O ATOM 557 CB VAL A 56 68.370 98.461 24.237 1.00 19.31 C ATOM 558 CG1 VAL A 56 69.448 98.398 23.150 1.00 23.27 C ATOM 559 CG2 VAL A 56 67.671 97.119 24.370 1.00 27.15 C ATOM 560 H VAL A 56 67.016 99.124 26.499 1.00 0.00 H ATOM 561 N SER A 57 70.814 100.450 25.301 1.00 22.10 N ATOM 562 CA SER A 57 71.412 101.773 25.143 1.00 24.64 C ATOM 563 C SER A 57 70.905 102.391 23.861 1.00 27.17 C ATOM 564 O SER A 57 70.590 101.664 22.904 1.00 22.78 O ATOM 565 CB SER A 57 72.943 101.705 25.123 1.00 23.74 C ATOM 566 OG SER A 57 73.411 101.284 23.858 1.00 26.88 O ATOM 567 HG SER A 57 74.400 101.248 23.869 1.00 0.00 H ATOM 568 H SER A 57 71.419 99.606 25.238 1.00 0.00 H ATOM 569 N ARG A 58 70.831 103.722 23.825 1.00 24.69 N ATOM 570 CA ARG A 58 70.329 104.390 22.631 1.00 24.66 C ATOM 571 C ARG A 58 71.279 104.211 21.456 1.00 25.56 C ATOM 572 O ARG A 58 70.844 104.164 20.304 1.00 23.41 O ATOM 573 CB ARG A 58 70.091 105.884 22.869 1.00 27.79 C ATOM 574 CG ARG A 58 69.284 106.508 21.712 1.00 32.09 C ATOM 575 CD ARG A 58 68.863 107.941 21.951 1.00 33.55 C ATOM 576 NE ARG A 58 67.995 108.432 20.881 1.00 36.80 N ATOM 577 CZ ARG A 58 66.662 108.419 20.925 1.00 38.32 C ATOM 578 NH1 ARG A 58 66.027 107.947 21.994 1.00 29.65 N ATOM 579 NH2 ARG A 58 65.963 108.892 19.902 1.00 33.28 N ATOM 580 HE ARG A 58 68.448 108.817 20.028 1.00 0.00 H ATOM 581 HH12 ARG A 58 64.987 107.940 22.020 1.00 0.00 H ATOM 582 HH11 ARG A 58 66.570 107.585 22.804 1.00 0.00 H ATOM 583 HH22 ARG A 58 64.924 108.883 19.934 1.00 0.00 H ATOM 584 HH21 ARG A 58 66.454 109.272 19.068 1.00 0.00 H ATOM 585 H ARG A 58 71.131 104.283 24.648 1.00 0.00 H ATOM 586 N GLU A 59 72.573 104.116 21.750 1.00 24.29 N ATOM 587 CA GLU A 59 73.569 103.851 20.722 1.00 24.50 C ATOM 588 C GLU A 59 73.244 102.554 19.964 1.00 22.88 C ATOM 589 O GLU A 59 73.284 102.521 18.727 1.00 22.37 O ATOM 590 CB GLU A 59 74.967 103.756 21.338 1.00 28.97 C ATOM 591 CG GLU A 59 76.095 103.659 20.318 1.00 34.25 C ATOM 592 CD GLU A 59 77.433 103.283 20.954 1.00 42.55 C ATOM 593 OE1 GLU A 59 77.576 103.425 22.189 1.00 37.29 O ATOM 594 OE2 GLU A 59 78.340 102.838 20.217 1.00 46.12 O ATOM 595 H GLU A 59 72.880 104.234 22.737 1.00 0.00 H ATOM 596 N ASP A 60 72.942 101.502 20.721 1.00 20.76 N ATOM 597 CA ASP A 60 72.586 100.203 20.161 1.00 24.78 C ATOM 598 C ASP A 60 71.286 100.279 19.377 1.00 21.91 C ATOM 599 O ASP A 60 71.195 99.735 18.281 1.00 18.33 O ATOM 600 CB ASP A 60 72.468 99.144 21.264 1.00 21.53 C ATOM 601 CG ASP A 60 73.828 98.752 21.843 1.00 27.20 C ATOM 602 OD1 ASP A 60 74.855 99.142 21.251 1.00 27.16 O ATOM 603 OD2 ASP A 60 73.859 98.053 22.873 1.00 25.28 O ATOM 604 H ASP A 60 72.961 101.611 21.755 1.00 0.00 H ATOM 605 N ILE A 61 70.278 100.936 19.943 1.00 18.98 N ATOM 606 CA ILE A 61 69.017 101.098 19.217 1.00 19.63 C ATOM 607 C ILE A 61 69.216 101.853 17.898 1.00 21.03 C ATOM 608 O ILE A 61 68.748 101.407 16.847 1.00 16.96 O ATOM 609 CB ILE A 61 67.950 101.838 20.063 1.00 19.25 C ATOM 610 CG1 ILE A 61 67.632 101.042 21.335 1.00 18.14 C ATOM 611 CG2 ILE A 61 66.686 102.039 19.239 1.00 17.76 C ATOM 612 CD1 ILE A 61 66.613 101.728 22.255 1.00 20.21 C ATOM 613 H ILE A 61 70.385 101.333 20.898 1.00 0.00 H ATOM 614 N GLU A 62 69.904 102.993 17.948 1.00 19.77 N ATOM 615 CA GLU A 62 70.139 103.774 16.736 1.00 19.91 C ATOM 616 C GLU A 62 70.963 102.994 15.699 1.00 21.83 C ATOM 617 O GLU A 62 70.755 103.144 14.489 1.00 18.78 O ATOM 618 CB GLU A 62 70.835 105.102 17.074 1.00 23.15 C ATOM 619 CG GLU A 62 69.892 106.095 17.764 1.00 28.85 C ATOM 620 CD GLU A 62 70.511 107.466 17.986 1.00 40.46 C ATOM 621 OE1 GLU A 62 71.664 107.688 17.559 1.00 43.94 O ATOM 622 OE2 GLU A 62 69.835 108.326 18.587 1.00 38.87 O ATOM 623 H GLU A 62 70.277 103.330 18.858 1.00 0.00 H ATOM 624 N ARG A 63 71.896 102.168 16.168 1.00 19.34 N ATOM 625 CA ARG A 63 72.698 101.375 15.236 1.00 21.68 C ATOM 626 C ARG A 63 71.811 100.387 14.487 1.00 17.16 C ATOM 627 O ARG A 63 71.926 100.241 13.264 1.00 16.73 O ATOM 628 CB ARG A 63 73.822 100.625 15.951 1.00 20.19 C ATOM 629 CG ARG A 63 74.831 99.998 14.982 1.00 25.74 C ATOM 630 CD ARG A 63 75.874 99.145 15.700 1.00 23.61 C ATOM 631 NE ARG A 63 75.203 98.098 16.457 1.00 29.03 N ATOM 632 CZ ARG A 63 75.134 98.044 17.785 1.00 30.44 C ATOM 633 NH1 ARG A 63 75.738 98.971 18.531 1.00 27.99 N ATOM 634 NH2 ARG A 63 74.462 97.054 18.367 1.00 29.86 N ATOM 635 HE ARG A 63 74.743 97.335 15.920 1.00 0.00 H ATOM 636 HH12 ARG A 63 75.680 98.923 19.568 1.00 0.00 H ATOM 637 HH11 ARG A 63 76.267 99.742 18.075 1.00 0.00 H ATOM 638 HH22 ARG A 63 74.403 97.005 19.404 1.00 0.00 H ATOM 639 HH21 ARG A 63 73.995 96.330 17.785 1.00 0.00 H ATOM 640 H ARG A 63 72.054 102.087 17.193 1.00 0.00 H ATOM 641 N GLU A 64 70.928 99.704 15.209 1.00 18.21 N ATOM 642 CA GLU A 64 70.025 98.768 14.530 1.00 16.97 C ATOM 643 C GLU A 64 69.096 99.494 13.560 1.00 17.87 C ATOM 644 O GLU A 64 68.892 99.031 12.440 1.00 17.28 O ATOM 645 CB GLU A 64 69.187 97.944 15.511 1.00 16.75 C ATOM 646 CG GLU A 64 68.121 97.136 14.748 1.00 17.50 C ATOM 647 CD GLU A 64 67.416 96.070 15.549 1.00 20.42 C ATOM 648 OE1 GLU A 64 67.474 96.096 16.789 1.00 22.54 O ATOM 649 OE2 GLU A 64 66.778 95.207 14.910 1.00 24.47 O ATOM 650 H GLU A 64 70.878 99.831 16.240 1.00 0.00 H ATOM 651 N VAL A 65 68.531 100.624 13.979 1.00 15.81 N ATOM 652 CA VAL A 65 67.636 101.376 13.094 1.00 15.94 C ATOM 653 C VAL A 65 68.371 101.847 11.837 1.00 17.70 C ATOM 654 O VAL A 65 67.851 101.757 10.721 1.00 16.74 O ATOM 655 CB VAL A 65 67.014 102.597 13.823 1.00 20.18 C ATOM 656 CG1 VAL A 65 66.239 103.491 12.830 1.00 21.06 C ATOM 657 CG2 VAL A 65 66.099 102.127 14.972 1.00 18.98 C ATOM 658 H VAL A 65 68.725 100.975 14.938 1.00 0.00 H ATOM 659 N SER A 66 69.586 102.348 12.029 1.00 15.76 N ATOM 660 CA SER A 66 70.397 102.845 10.923 1.00 19.01 C ATOM 661 C SER A 66 70.661 101.763 9.858 1.00 19.45 C ATOM 662 O SER A 66 70.617 102.021 8.655 1.00 20.94 O ATOM 663 CB SER A 66 71.724 103.392 11.462 1.00 22.75 C ATOM 664 OG SER A 66 72.490 103.943 10.413 1.00 36.63 O ATOM 665 HG SER A 66 72.679 103.242 9.740 1.00 0.00 H ATOM 666 H SER A 66 69.970 102.387 12.995 1.00 0.00 H ATOM 667 N ILE A 67 70.906 100.543 10.306 1.00 16.47 N ATOM 668 CA ILE A 67 71.138 99.435 9.384 1.00 17.30 C ATOM 669 C ILE A 67 69.848 98.982 8.673 1.00 19.25 C ATOM 670 O ILE A 67 69.825 98.818 7.450 1.00 17.07 O ATOM 671 CB ILE A 67 71.782 98.269 10.137 1.00 17.02 C ATOM 672 CG1 ILE A 67 73.242 98.626 10.473 1.00 17.75 C ATOM 673 CG2 ILE A 67 71.686 96.972 9.340 1.00 16.10 C ATOM 674 CD1 ILE A 67 73.847 97.759 11.563 1.00 17.44 C ATOM 675 H ILE A 67 70.934 100.370 11.331 1.00 0.00 H ATOM 676 N LEU A 68 68.774 98.808 9.439 1.00 16.60 N ATOM 677 CA LEU A 68 67.478 98.423 8.880 1.00 16.87 C ATOM 678 C LEU A 68 66.987 99.421 7.837 1.00 19.50 C ATOM 679 O LEU A 68 66.372 99.030 6.839 1.00 19.73 O ATOM 680 CB LEU A 68 66.434 98.286 10.004 1.00 16.20 C ATOM 681 CG LEU A 68 66.610 97.130 10.985 1.00 18.46 C ATOM 682 CD1 LEU A 68 65.620 97.251 12.159 1.00 20.41 C ATOM 683 CD2 LEU A 68 66.439 95.814 10.283 1.00 20.15 C ATOM 684 H LEU A 68 68.858 98.950 10.466 1.00 0.00 H ATOM 685 N LYS A 69 67.260 100.707 8.053 1.00 18.75 N ATOM 686 CA LYS A 69 66.838 101.733 7.094 1.00 23.42 C ATOM 687 C LYS A 69 67.402 101.499 5.684 1.00 26.45 C ATOM 688 O LYS A 69 66.729 101.797 4.701 1.00 26.54 O ATOM 689 CB LYS A 69 67.243 103.133 7.578 1.00 23.94 C ATOM 690 CG LYS A 69 66.211 103.791 8.471 1.00 29.07 C ATOM 691 H LYS A 69 67.778 100.986 8.911 1.00 0.00 H ATOM 692 N GLU A 70 68.624 100.971 5.594 1.00 24.74 N ATOM 693 CA GLU A 70 69.289 100.745 4.301 1.00 30.00 C ATOM 694 C GLU A 70 68.737 99.552 3.529 1.00 27.34 C ATOM 695 O GLU A 70 68.857 99.493 2.311 1.00 31.01 O ATOM 696 CB GLU A 70 70.797 100.509 4.478 1.00 29.06 C ATOM 697 CG GLU A 70 71.557 101.523 5.318 1.00 35.61 C ATOM 698 CD GLU A 70 73.049 101.181 5.405 1.00 43.21 C ATOM 699 OE1 GLU A 70 73.599 100.656 4.406 1.00 39.02 O ATOM 700 OE2 GLU A 70 73.664 101.417 6.473 1.00 42.49 O ATOM 701 H GLU A 70 69.124 100.710 6.468 1.00 0.00 H ATOM 702 N ILE A 71 68.163 98.592 4.247 1.00 23.92 N ATOM 703 CA ILE A 71 67.887 97.262 3.703 1.00 19.74 C ATOM 704 C ILE A 71 66.597 97.106 2.889 1.00 23.30 C ATOM 705 O ILE A 71 65.491 97.407 3.357 1.00 25.71 O ATOM 706 CB ILE A 71 67.839 96.220 4.847 1.00 21.86 C ATOM 707 CG1 ILE A 71 69.239 96.009 5.434 1.00 24.57 C ATOM 708 CG2 ILE A 71 67.264 94.902 4.348 1.00 24.43 C ATOM 709 CD1 ILE A 71 69.200 95.153 6.708 1.00 27.51 C ATOM 710 H ILE A 71 67.900 98.794 5.233 1.00 0.00 H ATOM 711 N GLN A 72 66.750 96.590 1.675 1.00 20.94 N ATOM 712 CA GLN A 72 65.615 96.194 0.843 1.00 23.33 C ATOM 713 C GLN A 72 66.006 94.968 0.016 1.00 22.13 C ATOM 714 O GLN A 72 66.743 95.080 -0.960 1.00 20.37 O ATOM 715 CB GLN A 72 65.182 97.352 -0.063 1.00 30.43 C ATOM 716 CG GLN A 72 64.040 97.012 -1.009 1.00 37.07 C ATOM 717 CD GLN A 72 63.715 98.151 -1.969 1.00 49.76 C ATOM 718 OE1 GLN A 72 63.014 99.100 -1.608 1.00 52.77 O ATOM 719 NE2 GLN A 72 64.234 98.064 -3.196 1.00 45.32 N ATOM 720 HE22 GLN A 72 64.820 97.245 -3.456 1.00 0.00 H ATOM 721 HE21 GLN A 72 64.053 98.815 -3.892 1.00 0.00 H ATOM 722 H GLN A 72 67.713 96.463 1.302 1.00 0.00 H ATOM 723 N HIS A 73 65.528 93.800 0.423 1.00 21.01 N ATOM 724 CA HIS A 73 65.873 92.547 -0.241 1.00 21.51 C ATOM 725 C HIS A 73 64.823 91.495 0.127 1.00 18.07 C ATOM 726 O HIS A 73 64.328 91.480 1.256 1.00 20.78 O ATOM 727 CB HIS A 73 67.300 92.087 0.161 1.00 16.97 C ATOM 728 CG HIS A 73 67.779 90.875 -0.584 1.00 15.68 C ATOM 729 ND1 HIS A 73 67.447 89.593 -0.208 1.00 15.53 N ATOM 730 CD2 HIS A 73 68.533 90.760 -1.703 1.00 17.83 C ATOM 731 CE1 HIS A 73 67.992 88.735 -1.058 1.00 19.66 C ATOM 732 NE2 HIS A 73 68.651 89.415 -1.977 1.00 17.29 N ATOM 733 H HIS A 73 64.887 93.776 1.241 1.00 0.00 H ATOM 734 N PRO A 74 64.486 90.601 -0.813 1.00 19.06 N ATOM 735 CA PRO A 74 63.457 89.581 -0.566 1.00 20.33 C ATOM 736 C PRO A 74 63.721 88.665 0.653 1.00 21.21 C ATOM 737 O PRO A 74 62.758 88.174 1.247 1.00 19.68 O ATOM 738 CB PRO A 74 63.464 88.764 -1.859 1.00 23.57 C ATOM 739 CG PRO A 74 63.970 89.726 -2.915 1.00 24.80 C ATOM 740 CD PRO A 74 64.976 90.577 -2.204 1.00 22.40 C ATOM 741 N ASN A 75 64.981 88.429 1.012 1.00 16.05 N ATOM 742 CA ASN A 75 65.276 87.501 2.094 1.00 15.88 C ATOM 743 C ASN A 75 65.690 88.199 3.405 1.00 19.38 C ATOM 744 O ASN A 75 66.217 87.565 4.319 1.00 17.78 O ATOM 745 CB ASN A 75 66.355 86.492 1.659 1.00 16.40 C ATOM 746 CG ASN A 75 65.931 85.674 0.433 1.00 19.53 C ATOM 747 OD1 ASN A 75 66.573 85.734 -0.611 1.00 18.81 O ATOM 748 ND2 ASN A 75 64.837 84.927 0.557 1.00 17.71 N ATOM 749 HD22 ASN A 75 64.322 84.905 1.460 1.00 0.00 H ATOM 750 HD21 ASN A 75 64.497 84.365 -0.249 1.00 0.00 H ATOM 751 H ASN A 75 65.759 88.910 0.517 1.00 0.00 H ATOM 752 N VAL A 76 65.444 89.501 3.502 1.00 17.46 N ATOM 753 CA VAL A 76 65.704 90.211 4.753 1.00 17.30 C ATOM 754 C VAL A 76 64.484 91.055 5.108 1.00 21.48 C ATOM 755 O VAL A 76 63.833 91.599 4.231 1.00 16.78 O ATOM 756 CB VAL A 76 66.962 91.109 4.659 1.00 18.46 C ATOM 757 CG1 VAL A 76 67.284 91.731 6.002 1.00 20.45 C ATOM 758 CG2 VAL A 76 68.155 90.298 4.175 1.00 19.39 C ATOM 759 H VAL A 76 65.064 90.018 2.683 1.00 0.00 H ATOM 760 N ILE A 77 64.176 91.128 6.396 1.00 19.08 N ATOM 761 CA ILE A 77 63.099 91.966 6.908 1.00 20.95 C ATOM 762 C ILE A 77 63.262 93.458 6.537 1.00 21.72 C ATOM 763 O ILE A 77 64.376 93.983 6.456 1.00 22.30 O ATOM 764 CB ILE A 77 62.997 91.788 8.455 1.00 23.61 C ATOM 765 CG1 ILE A 77 61.566 91.987 8.908 1.00 26.27 C ATOM 766 CG2 ILE A 77 64.047 92.619 9.241 1.00 19.63 C ATOM 767 CD1 ILE A 77 60.756 90.803 8.530 1.00 29.05 C ATOM 768 H ILE A 77 64.728 90.562 7.071 1.00 0.00 H ATOM 769 N THR A 78 62.148 94.132 6.277 1.00 20.20 N ATOM 770 CA THR A 78 62.196 95.556 5.956 1.00 21.73 C ATOM 771 C THR A 78 61.547 96.383 7.070 1.00 19.67 C ATOM 772 O THR A 78 60.611 95.936 7.731 1.00 21.88 O ATOM 773 CB THR A 78 61.493 95.876 4.630 1.00 27.04 C ATOM 774 OG1 THR A 78 60.091 95.677 4.789 1.00 31.63 O ATOM 775 CG2 THR A 78 61.996 94.969 3.518 1.00 30.72 C ATOM 776 HG1 THR A 78 59.752 96.276 5.500 1.00 0.00 H ATOM 777 H THR A 78 61.232 93.641 6.302 1.00 0.00 H ATOM 778 N LEU A 79 62.074 97.582 7.259 1.00 17.69 N ATOM 779 CA LEU A 79 61.608 98.530 8.265 1.00 20.09 C ATOM 780 C LEU A 79 60.600 99.499 7.658 1.00 20.43 C ATOM 781 O LEU A 79 60.855 100.074 6.591 1.00 18.30 O ATOM 782 CB LEU A 79 62.794 99.311 8.830 1.00 19.82 C ATOM 783 CG LEU A 79 62.510 100.407 9.867 1.00 19.05 C ATOM 784 CD1 LEU A 79 62.000 99.793 11.160 1.00 16.61 C ATOM 785 CD2 LEU A 79 63.786 101.211 10.111 1.00 21.95 C ATOM 786 H LEU A 79 62.870 97.866 6.653 1.00 0.00 H ATOM 787 N HIS A 80 59.474 99.705 8.342 1.00 15.67 N ATOM 788 CA HIS A 80 58.407 100.557 7.804 1.00 16.58 C ATOM 789 C HIS A 80 58.350 101.930 8.494 1.00 18.97 C ATOM 790 O HIS A 80 58.316 102.967 7.823 1.00 20.88 O ATOM 791 CB HIS A 80 57.065 99.824 7.930 1.00 18.07 C ATOM 792 CG HIS A 80 55.883 100.636 7.508 1.00 22.17 C ATOM 793 ND1 HIS A 80 55.822 101.300 6.299 1.00 20.33 N ATOM 794 CD2 HIS A 80 54.706 100.886 8.135 1.00 19.08 C ATOM 795 CE1 HIS A 80 54.661 101.922 6.201 1.00 21.97 C ATOM 796 NE2 HIS A 80 53.964 101.687 7.301 1.00 21.43 N ATOM 797 H HIS A 80 59.350 99.255 9.271 1.00 0.00 H ATOM 798 N GLU A 81 58.364 101.932 9.828 1.00 17.83 N ATOM 799 CA GLU A 81 58.298 103.164 10.624 1.00 20.49 C ATOM 800 C GLU A 81 58.999 103.003 11.971 1.00 17.53 C ATOM 801 O GLU A 81 59.169 101.885 12.453 1.00 16.17 O ATOM 802 CB GLU A 81 56.847 103.577 10.898 1.00 20.12 C ATOM 803 CG GLU A 81 56.045 104.052 9.715 1.00 20.29 C ATOM 804 CD GLU A 81 54.780 104.767 10.164 1.00 25.74 C ATOM 805 OE1 GLU A 81 53.916 104.155 10.833 1.00 23.29 O ATOM 806 OE2 GLU A 81 54.671 105.961 9.879 1.00 29.68 O ATOM 807 H GLU A 81 58.424 101.021 10.326 1.00 0.00 H ATOM 808 N VAL A 82 59.398 104.119 12.579 1.00 14.87 N ATOM 809 CA VAL A 82 59.920 104.079 13.950 1.00 19.21 C ATOM 810 C VAL A 82 59.203 105.105 14.829 1.00 19.42 C ATOM 811 O VAL A 82 59.086 106.280 14.455 1.00 21.03 O ATOM 812 CB VAL A 82 61.444 104.337 13.994 1.00 20.94 C ATOM 813 CG1 VAL A 82 61.977 104.247 15.427 1.00 17.73 C ATOM 814 CG2 VAL A 82 62.168 103.343 13.087 1.00 20.91 C ATOM 815 H VAL A 82 59.339 105.028 12.077 1.00 0.00 H ATOM 816 N TYR A 83 58.718 104.650 15.983 1.00 16.68 N ATOM 817 CA TYR A 83 58.087 105.526 16.964 1.00 18.91 C ATOM 818 C TYR A 83 58.902 105.537 18.250 1.00 21.69 C ATOM 819 O TYR A 83 59.696 104.626 18.509 1.00 19.09 O ATOM 820 CB TYR A 83 56.653 105.079 17.257 1.00 19.07 C ATOM 821 CG TYR A 83 55.710 105.271 16.084 1.00 23.35 C ATOM 822 CD1 TYR A 83 55.741 104.407 14.982 1.00 19.40 C ATOM 823 CD2 TYR A 83 54.792 106.321 16.078 1.00 22.51 C ATOM 824 CE1 TYR A 83 54.881 104.594 13.906 1.00 19.55 C ATOM 825 CE2 TYR A 83 53.944 106.525 15.014 1.00 24.65 C ATOM 826 CZ TYR A 83 53.983 105.661 13.935 1.00 24.51 C ATOM 827 OH TYR A 83 53.115 105.884 12.899 1.00 23.21 O ATOM 828 HH TYR A 83 53.252 105.195 12.201 1.00 0.00 H ATOM 829 H TYR A 83 58.792 103.634 16.192 1.00 0.00 H ATOM 830 N GLU A 84 58.694 106.562 19.067 1.00 20.45 N ATOM 831 CA GLU A 84 59.372 106.618 20.351 1.00 20.93 C ATOM 832 C GLU A 84 58.470 107.249 21.394 1.00 26.08 C ATOM 833 O GLU A 84 57.812 108.250 21.126 1.00 24.38 O ATOM 834 CB GLU A 84 60.683 107.409 20.231 1.00 25.61 C ATOM 835 CG GLU A 84 61.431 107.545 21.530 1.00 30.28 C ATOM 836 CD GLU A 84 62.791 108.193 21.367 1.00 31.19 C ATOM 837 OE1 GLU A 84 63.557 108.166 22.347 1.00 36.47 O ATOM 838 OE2 GLU A 84 63.093 108.719 20.273 1.00 34.67 O ATOM 839 H GLU A 84 58.045 107.326 18.788 1.00 0.00 H ATOM 840 N ASN A 85 58.432 106.664 22.580 1.00 21.77 N ATOM 841 CA ASN A 85 57.759 107.326 23.682 1.00 26.76 C ATOM 842 C ASN A 85 58.726 107.409 24.858 1.00 28.03 C ATOM 843 O ASN A 85 59.936 107.297 24.669 1.00 24.65 O ATOM 844 CB ASN A 85 56.449 106.614 24.045 1.00 23.70 C ATOM 845 CG ASN A 85 56.640 105.166 24.447 1.00 28.13 C ATOM 846 OD1 ASN A 85 57.660 104.784 25.022 1.00 25.46 O ATOM 847 ND2 ASN A 85 55.629 104.348 24.170 1.00 30.23 N ATOM 848 HD22 ASN A 85 54.785 104.711 23.683 1.00 0.00 H ATOM 849 HD21 ASN A 85 55.682 103.345 24.441 1.00 0.00 H ATOM 850 H ASN A 85 58.881 105.737 22.721 1.00 0.00 H ATOM 851 N LYS A 86 58.204 107.596 26.062 1.00 28.20 N ATOM 852 CA LYS A 86 59.067 107.791 27.221 1.00 29.31 C ATOM 853 C LYS A 86 59.885 106.555 27.595 1.00 26.99 C ATOM 854 O LYS A 86 61.020 106.684 28.049 1.00 28.60 O ATOM 855 CB LYS A 86 58.234 108.249 28.418 1.00 31.96 C ATOM 856 CG LYS A 86 57.941 109.743 28.393 1.00 33.02 C ATOM 857 H LYS A 86 57.171 107.604 26.181 1.00 0.00 H ATOM 858 N THR A 87 59.327 105.365 27.391 1.00 25.01 N ATOM 859 CA THR A 87 59.996 104.141 27.820 1.00 26.32 C ATOM 860 C THR A 87 60.515 103.246 26.701 1.00 26.20 C ATOM 861 O THR A 87 61.390 102.414 26.950 1.00 23.49 O ATOM 862 CB THR A 87 59.068 103.262 28.680 1.00 32.04 C ATOM 863 OG1 THR A 87 57.949 102.832 27.893 1.00 31.37 O ATOM 864 CG2 THR A 87 58.583 104.029 29.906 1.00 36.34 C ATOM 865 HG1 THR A 87 57.449 103.624 27.572 1.00 0.00 H ATOM 866 H THR A 87 58.402 105.306 26.920 1.00 0.00 H ATOM 867 N ASP A 88 59.960 103.384 25.495 1.00 25.04 N ATOM 868 CA ASP A 88 60.251 102.454 24.395 1.00 24.87 C ATOM 869 C ASP A 88 60.597 103.143 23.081 1.00 23.12 C ATOM 870 O ASP A 88 60.118 104.252 22.799 1.00 21.02 O ATOM 871 CB ASP A 88 59.050 101.533 24.116 1.00 25.14 C ATOM 872 CG ASP A 88 58.706 100.612 25.289 1.00 32.13 C ATOM 873 OD1 ASP A 88 59.600 100.247 26.071 1.00 36.99 O ATOM 874 OD2 ASP A 88 57.527 100.243 25.414 1.00 37.02 O ATOM 875 H ASP A 88 59.303 104.173 25.329 1.00 0.00 H ATOM 876 N VAL A 89 61.408 102.461 22.275 1.00 18.08 N ATOM 877 CA VAL A 89 61.480 102.732 20.844 1.00 19.29 C ATOM 878 C VAL A 89 60.729 101.600 20.160 1.00 21.76 C ATOM 879 O VAL A 89 60.921 100.418 20.496 1.00 19.52 O ATOM 880 CB VAL A 89 62.916 102.824 20.313 1.00 19.45 C ATOM 881 CG1 VAL A 89 62.920 102.932 18.784 1.00 18.27 C ATOM 882 CG2 VAL A 89 63.642 104.046 20.928 1.00 20.54 C ATOM 883 H VAL A 89 62.008 101.713 22.678 1.00 0.00 H ATOM 884 N ILE A 90 59.857 101.969 19.221 1.00 19.23 N ATOM 885 CA ILE A 90 58.969 101.010 18.588 1.00 18.01 C ATOM 886 C ILE A 90 59.249 100.946 17.089 1.00 17.11 C ATOM 887 O ILE A 90 59.060 101.937 16.372 1.00 17.87 O ATOM 888 CB ILE A 90 57.494 101.374 18.836 1.00 18.37 C ATOM 889 CG1 ILE A 90 57.230 101.491 20.336 1.00 23.34 C ATOM 890 CG2 ILE A 90 56.568 100.315 18.232 1.00 19.12 C ATOM 891 CD1 ILE A 90 56.288 102.580 20.684 1.00 26.82 C ATOM 892 H ILE A 90 59.812 102.968 18.935 1.00 0.00 H ATOM 893 N LEU A 91 59.717 99.783 16.638 1.00 15.50 N ATOM 894 CA LEU A 91 60.001 99.536 15.228 1.00 15.06 C ATOM 895 C LEU A 91 58.797 98.871 14.559 1.00 15.55 C ATOM 896 O LEU A 91 58.394 97.777 14.961 1.00 16.65 O ATOM 897 CB LEU A 91 61.233 98.632 15.049 1.00 16.57 C ATOM 898 CG LEU A 91 62.549 98.973 15.761 1.00 20.40 C ATOM 899 CD1 LEU A 91 63.704 98.110 15.233 1.00 17.92 C ATOM 900 CD2 LEU A 91 62.883 100.437 15.609 1.00 18.68 C ATOM 901 H LEU A 91 59.887 99.017 17.321 1.00 0.00 H ATOM 902 N ILE A 92 58.248 99.509 13.531 1.00 14.47 N ATOM 903 CA ILE A 92 57.221 98.860 12.723 1.00 14.44 C ATOM 904 C ILE A 92 57.902 98.189 11.546 1.00 14.63 C ATOM 905 O ILE A 92 58.531 98.845 10.713 1.00 15.80 O ATOM 906 CB ILE A 92 56.144 99.846 12.232 1.00 14.52 C ATOM 907 CG1 ILE A 92 55.619 100.692 13.402 1.00 15.60 C ATOM 908 CG2 ILE A 92 54.996 99.080 11.534 1.00 13.49 C ATOM 909 CD1 ILE A 92 54.942 99.877 14.493 1.00 16.00 C ATOM 910 H ILE A 92 58.552 100.477 13.301 1.00 0.00 H ATOM 911 N LEU A 93 57.763 96.871 11.490 1.00 16.73 N ATOM 912 CA LEU A 93 58.524 96.038 10.567 1.00 15.71 C ATOM 913 C LEU A 93 57.611 95.194 9.689 1.00 17.51 C ATOM 914 O LEU A 93 56.490 94.868 10.092 1.00 15.50 O ATOM 915 CB LEU A 93 59.456 95.106 11.350 1.00 17.86 C ATOM 916 CG LEU A 93 60.438 95.800 12.301 1.00 17.21 C ATOM 917 CD1 LEU A 93 60.598 94.988 13.576 1.00 19.59 C ATOM 918 CD2 LEU A 93 61.777 95.973 11.582 1.00 18.17 C ATOM 919 H LEU A 93 57.083 96.413 12.131 1.00 0.00 H ATOM 920 N GLU A 94 58.108 94.839 8.505 1.00 16.30 N ATOM 921 CA GLU A 94 57.444 93.853 7.640 1.00 16.43 C ATOM 922 C GLU A 94 57.094 92.618 8.470 1.00 21.26 C ATOM 923 O GLU A 94 57.937 92.110 9.203 1.00 20.85 O ATOM 924 CB GLU A 94 58.350 93.469 6.463 1.00 21.56 C ATOM 925 CG GLU A 94 57.800 92.339 5.560 1.00 23.22 C ATOM 926 CD GLU A 94 58.789 91.917 4.469 1.00 30.76 C ATOM 927 OE1 GLU A 94 60.001 92.168 4.635 1.00 28.27 O ATOM 928 OE2 GLU A 94 58.357 91.345 3.442 1.00 28.85 O ATOM 929 H GLU A 94 58.996 95.274 8.182 1.00 0.00 H ATOM 930 N LEU A 95 55.857 92.140 8.375 1.00 18.19 N ATOM 931 CA LEU A 95 55.454 90.950 9.127 1.00 18.40 C ATOM 932 C LEU A 95 55.916 89.657 8.465 1.00 22.56 C ATOM 933 O LEU A 95 55.725 89.470 7.259 1.00 22.44 O ATOM 934 CB LEU A 95 53.930 90.918 9.302 1.00 16.89 C ATOM 935 CG LEU A 95 53.317 89.682 9.977 1.00 20.66 C ATOM 936 CD1 LEU A 95 53.707 89.587 11.457 1.00 22.54 C ATOM 937 CD2 LEU A 95 51.792 89.704 9.823 1.00 25.82 C ATOM 938 H LEU A 95 55.168 92.617 7.759 1.00 0.00 H ATOM 939 N VAL A 96 56.520 88.767 9.252 1.00 20.96 N ATOM 940 CA VAL A 96 56.796 87.416 8.777 1.00 24.52 C ATOM 941 C VAL A 96 56.044 86.427 9.677 1.00 24.94 C ATOM 942 O VAL A 96 56.384 86.221 10.837 1.00 27.03 O ATOM 943 CB VAL A 96 58.326 87.106 8.713 1.00 27.44 C ATOM 944 CG1 VAL A 96 58.969 87.978 7.654 1.00 29.63 C ATOM 945 CG2 VAL A 96 59.014 87.346 10.033 1.00 31.57 C ATOM 946 H VAL A 96 56.798 89.039 10.217 1.00 0.00 H ATOM 947 N ALA A 97 54.992 85.834 9.128 1.00 25.10 N ATOM 948 CA ALA A 97 54.026 85.106 9.949 1.00 32.24 C ATOM 949 C ALA A 97 54.186 83.589 9.914 1.00 33.58 C ATOM 950 O ALA A 97 53.398 82.875 10.531 1.00 34.10 O ATOM 951 CB ALA A 97 52.601 85.484 9.516 1.00 35.76 C ATOM 952 H ALA A 97 54.852 85.888 8.099 1.00 0.00 H ATOM 953 N GLY A 98 55.199 83.093 9.211 1.00 26.06 N ATOM 954 CA GLY A 98 55.306 81.664 8.977 1.00 26.58 C ATOM 955 C GLY A 98 56.085 80.864 10.005 1.00 26.29 C ATOM 956 O GLY A 98 56.242 79.659 9.847 1.00 28.70 O ATOM 957 H GLY A 98 55.921 83.734 8.825 1.00 0.00 H ATOM 958 N GLY A 99 56.584 81.524 11.047 1.00 25.52 N ATOM 959 CA GLY A 99 57.361 80.847 12.068 1.00 25.85 C ATOM 960 C GLY A 99 58.791 80.535 11.654 1.00 26.18 C ATOM 961 O GLY A 99 59.243 80.922 10.565 1.00 23.37 O ATOM 962 H GLY A 99 56.413 82.546 11.131 1.00 0.00 H ATOM 963 N GLU A 100 59.503 79.823 12.525 1.00 23.35 N ATOM 964 CA GLU A 100 60.906 79.479 12.291 1.00 25.51 C ATOM 965 C GLU A 100 61.031 78.413 11.205 1.00 28.98 C ATOM 966 O GLU A 100 60.233 77.473 11.142 1.00 25.12 O ATOM 967 CB GLU A 100 61.566 79.000 13.591 1.00 25.86 C ATOM 968 CG GLU A 100 61.499 80.033 14.702 1.00 28.22 C ATOM 969 CD GLU A 100 62.034 79.527 16.039 1.00 33.30 C ATOM 970 OE1 GLU A 100 62.874 78.600 16.049 1.00 29.15 O ATOM 971 OE2 GLU A 100 61.615 80.074 17.084 1.00 32.91 O ATOM 972 H GLU A 100 59.046 79.500 13.402 1.00 0.00 H ATOM 973 N LEU A 101 62.031 78.569 10.346 1.00 22.45 N ATOM 974 CA LEU A 101 62.281 77.595 9.282 1.00 24.74 C ATOM 975 C LEU A 101 62.386 76.152 9.799 1.00 30.40 C ATOM 976 O LEU A 101 61.793 75.234 9.226 1.00 27.18 O ATOM 977 CB LEU A 101 63.563 77.944 8.529 1.00 22.21 C ATOM 978 CG LEU A 101 64.017 76.882 7.521 1.00 25.41 C ATOM 979 CD1 LEU A 101 63.004 76.744 6.392 1.00 25.68 C ATOM 980 CD2 LEU A 101 65.412 77.185 6.969 1.00 26.56 C ATOM 981 H LEU A 101 62.650 79.401 10.431 1.00 0.00 H ATOM 982 N PHE A 102 63.136 75.949 10.876 1.00 26.46 N ATOM 983 CA PHE A 102 63.407 74.587 11.326 1.00 30.93 C ATOM 984 C PHE A 102 62.174 73.926 11.959 1.00 34.12 C ATOM 985 O PHE A 102 62.059 72.698 11.945 1.00 37.81 O ATOM 986 CB PHE A 102 64.588 74.556 12.299 1.00 27.67 C ATOM 987 CG PHE A 102 65.939 74.624 11.624 1.00 29.51 C ATOM 988 CD1 PHE A 102 66.077 75.175 10.360 1.00 31.27 C ATOM 989 CD2 PHE A 102 67.068 74.127 12.254 1.00 30.11 C ATOM 990 CE1 PHE A 102 67.320 75.238 9.739 1.00 34.19 C ATOM 991 CE2 PHE A 102 68.312 74.182 11.637 1.00 30.96 C ATOM 992 CZ PHE A 102 68.441 74.736 10.383 1.00 27.78 C ATOM 993 H PHE A 102 63.529 76.758 11.398 1.00 0.00 H ATOM 994 N ASP A 103 61.253 74.721 12.498 1.00 32.75 N ATOM 995 CA ASP A 103 59.987 74.168 12.991 1.00 34.83 C ATOM 996 C ASP A 103 59.150 73.648 11.813 1.00 40.57 C ATOM 997 O ASP A 103 58.533 72.584 11.891 1.00 40.70 O ATOM 998 CB ASP A 103 59.194 75.206 13.780 1.00 29.56 C ATOM 999 CG ASP A 103 59.785 75.479 15.153 1.00 38.76 C ATOM 1000 OD1 ASP A 103 60.490 74.598 15.696 1.00 37.33 O ATOM 1001 OD2 ASP A 103 59.530 76.576 15.697 1.00 38.09 O ATOM 1002 H ASP A 103 61.432 75.743 12.570 1.00 0.00 H ATOM 1003 N PHE A 104 59.138 74.406 10.722 1.00 32.19 N ATOM 1004 CA PHE A 104 58.477 73.991 9.491 1.00 33.64 C ATOM 1005 C PHE A 104 59.087 72.701 8.949 1.00 39.31 C ATOM 1006 O PHE A 104 58.368 71.769 8.590 1.00 40.43 O ATOM 1007 CB PHE A 104 58.571 75.103 8.451 1.00 33.14 C ATOM 1008 CG PHE A 104 57.987 74.754 7.103 1.00 33.74 C ATOM 1009 CD1 PHE A 104 56.614 74.679 6.921 1.00 37.16 C ATOM 1010 CD2 PHE A 104 58.814 74.557 6.006 1.00 35.24 C ATOM 1011 CE1 PHE A 104 56.074 74.382 5.678 1.00 36.92 C ATOM 1012 CE2 PHE A 104 58.283 74.261 4.754 1.00 37.29 C ATOM 1013 CZ PHE A 104 56.910 74.173 4.591 1.00 38.04 C ATOM 1014 H PHE A 104 59.617 75.329 10.747 1.00 0.00 H ATOM 1015 N LEU A 105 60.414 72.646 8.895 1.00 35.22 N ATOM 1016 CA LEU A 105 61.096 71.478 8.352 1.00 38.57 C ATOM 1017 C LEU A 105 60.859 70.243 9.231 1.00 42.38 C ATOM 1018 O LEU A 105 60.694 69.133 8.722 1.00 45.61 O ATOM 1019 CB LEU A 105 62.591 71.753 8.199 1.00 33.04 C ATOM 1020 CG LEU A 105 62.936 72.881 7.220 1.00 36.08 C ATOM 1021 CD1 LEU A 105 64.435 72.981 7.007 1.00 31.51 C ATOM 1022 CD2 LEU A 105 62.212 72.723 5.878 1.00 36.24 C ATOM 1023 H LEU A 105 60.974 73.449 9.246 1.00 0.00 H ATOM 1024 N ALA A 106 60.813 70.451 10.544 1.00 39.99 N ATOM 1025 CA ALA A 106 60.602 69.372 11.510 1.00 45.13 C ATOM 1026 C ALA A 106 59.244 68.683 11.357 1.00 50.03 C ATOM 1027 O ALA A 106 59.035 67.583 11.869 1.00 51.70 O ATOM 1028 CB ALA A 106 60.749 69.905 12.920 1.00 39.23 C ATOM 1029 H ALA A 106 60.932 71.421 10.899 1.00 0.00 H ATOM 1030 N GLU A 107 58.321 69.335 10.661 1.00 48.14 N ATOM 1031 CA GLU A 107 56.988 68.784 10.467 1.00 49.59 C ATOM 1032 C GLU A 107 56.875 68.035 9.142 1.00 50.23 C ATOM 1033 O GLU A 107 55.856 67.399 8.876 1.00 56.25 O ATOM 1034 CB GLU A 107 55.937 69.894 10.532 1.00 46.34 C ATOM 1035 CG GLU A 107 55.793 70.544 11.904 1.00 48.44 C ATOM 1036 CD GLU A 107 54.965 71.821 11.864 1.00 53.12 C ATOM 1037 OE1 GLU A 107 54.681 72.317 10.752 1.00 51.36 O ATOM 1038 OE2 GLU A 107 54.595 72.330 12.947 1.00 59.63 O ATOM 1039 H GLU A 107 58.555 70.259 10.245 1.00 0.00 H ATOM 1040 N LYS A 108 57.915 68.114 8.314 1.00 47.19 N ATOM 1041 CA LYS A 108 57.929 67.404 7.038 1.00 47.45 C ATOM 1042 C LYS A 108 58.181 65.918 7.257 1.00 51.77 C ATOM 1043 O LYS A 108 58.790 65.531 8.253 1.00 53.10 O ATOM 1044 CB LYS A 108 58.992 67.980 6.099 1.00 46.79 C ATOM 1045 CG LYS A 108 58.624 69.313 5.465 1.00 46.48 C ATOM 1046 CD LYS A 108 59.713 69.773 4.500 1.00 43.55 C ATOM 1047 CE LYS A 108 59.357 71.098 3.841 1.00 45.34 C ATOM 1048 NZ LYS A 108 58.162 71.000 2.959 1.00 42.78 N ATOM 1049 HZ1 LYS A 108 58.345 70.308 2.205 1.00 0.00 H ATOM 1050 HZ2 LYS A 108 57.342 70.693 3.521 1.00 0.00 H ATOM 1051 HZ3 LYS A 108 57.966 71.930 2.538 1.00 0.00 H ATOM 1052 H LYS A 108 58.735 68.694 8.582 1.00 0.00 H ATOM 1053 N GLU A 109 57.708 65.091 6.325 1.00 54.43 N ATOM 1054 CA GLU A 109 57.866 63.640 6.423 1.00 59.36 C ATOM 1055 C GLU A 109 59.331 63.249 6.279 1.00 54.26 C ATOM 1056 O GLU A 109 59.848 62.417 7.023 1.00 55.79 O ATOM 1057 CB GLU A 109 57.022 62.931 5.360 1.00 57.64 C ATOM 1058 H GLU A 109 57.211 65.490 5.503 1.00 0.00 H ATOM 1059 N SER A 110 59.987 63.855 5.300 1.00 56.89 N ATOM 1060 CA SER A 110 61.421 63.702 5.111 1.00 56.39 C ATOM 1061 C SER A 110 61.905 64.906 4.321 1.00 53.79 C ATOM 1062 O SER A 110 61.096 65.720 3.868 1.00 56.78 O ATOM 1063 CB SER A 110 61.752 62.394 4.384 1.00 56.74 C ATOM 1064 OG SER A 110 61.054 62.301 3.154 1.00 57.74 O ATOM 1065 HG SER A 110 61.310 63.060 2.572 1.00 0.00 H ATOM 1066 H SER A 110 59.457 64.462 4.643 1.00 0.00 H ATOM 1067 N LEU A 111 63.215 65.030 4.157 1.00 49.27 N ATOM 1068 CA LEU A 111 63.763 66.152 3.406 1.00 44.90 C ATOM 1069 C LEU A 111 65.044 65.741 2.718 1.00 40.13 C ATOM 1070 O LEU A 111 66.006 65.347 3.378 1.00 41.27 O ATOM 1071 CB LEU A 111 64.021 67.345 4.326 1.00 42.68 C ATOM 1072 CG LEU A 111 64.460 68.649 3.655 1.00 37.73 C ATOM 1073 CD1 LEU A 111 63.262 69.408 3.094 1.00 40.80 C ATOM 1074 CD2 LEU A 111 65.231 69.512 4.632 1.00 41.37 C ATOM 1075 H LEU A 111 63.856 64.321 4.567 1.00 0.00 H ATOM 1076 N THR A 112 65.065 65.826 1.394 1.00 37.63 N ATOM 1077 CA THR A 112 66.278 65.493 0.662 1.00 36.57 C ATOM 1078 C THR A 112 67.305 66.608 0.789 1.00 38.46 C ATOM 1079 O THR A 112 66.982 67.741 1.151 1.00 34.68 O ATOM 1080 CB THR A 112 66.016 65.239 -0.833 1.00 39.66 C ATOM 1081 OG1 THR A 112 65.656 66.467 -1.483 1.00 36.13 O ATOM 1082 CG2 THR A 112 64.909 64.200 -1.021 1.00 40.13 C ATOM 1083 HG1 THR A 112 65.489 66.294 -2.443 1.00 0.00 H ATOM 1084 H THR A 112 64.214 66.131 0.879 1.00 0.00 H ATOM 1085 N GLU A 113 68.548 66.265 0.488 1.00 33.86 N ATOM 1086 CA GLU A 113 69.628 67.227 0.477 1.00 34.08 C ATOM 1087 C GLU A 113 69.345 68.349 -0.513 1.00 39.12 C ATOM 1088 O GLU A 113 69.539 69.529 -0.201 1.00 33.48 O ATOM 1089 CB GLU A 113 70.936 66.522 0.137 1.00 36.01 C ATOM 1090 CG GLU A 113 72.128 67.092 0.832 1.00 30.74 C ATOM 1091 CD GLU A 113 73.378 66.282 0.607 1.00 32.05 C ATOM 1092 OE1 GLU A 113 73.658 65.402 1.442 1.00 32.99 O ATOM 1093 OE2 GLU A 113 74.096 66.549 -0.381 1.00 29.81 O ATOM 1094 H GLU A 113 68.754 65.273 0.252 1.00 0.00 H ATOM 1095 N GLU A 114 68.873 67.979 -1.704 1.00 33.25 N ATOM 1096 CA GLU A 114 68.540 68.951 -2.737 1.00 34.52 C ATOM 1097 C GLU A 114 67.492 69.942 -2.235 1.00 34.36 C ATOM 1098 O GLU A 114 67.593 71.147 -2.480 1.00 35.22 O ATOM 1099 CB GLU A 114 68.038 68.243 -4.006 1.00 37.83 C ATOM 1100 H GLU A 114 68.739 66.967 -1.901 1.00 0.00 H ATOM 1101 N GLU A 115 66.496 69.424 -1.520 1.00 34.18 N ATOM 1102 CA GLU A 115 65.434 70.244 -0.940 1.00 34.56 C ATOM 1103 C GLU A 115 65.972 71.147 0.174 1.00 35.07 C ATOM 1104 O GLU A 115 65.562 72.303 0.311 1.00 30.83 O ATOM 1105 CB GLU A 115 64.305 69.353 -0.398 1.00 37.22 C ATOM 1106 CG GLU A 115 63.451 68.690 -1.483 1.00 38.42 C ATOM 1107 CD GLU A 115 62.628 67.501 -0.973 1.00 46.79 C ATOM 1108 OE1 GLU A 115 62.764 67.122 0.211 1.00 42.36 O ATOM 1109 OE2 GLU A 115 61.848 66.936 -1.772 1.00 47.65 O ATOM 1110 H GLU A 115 66.472 68.395 -1.368 1.00 0.00 H ATOM 1111 N ALA A 116 66.880 70.608 0.981 1.00 30.83 N ATOM 1112 CA ALA A 116 67.524 71.407 2.017 1.00 33.27 C ATOM 1113 C ALA A 116 68.308 72.571 1.406 1.00 27.35 C ATOM 1114 O ALA A 116 68.248 73.691 1.911 1.00 26.59 O ATOM 1115 CB ALA A 116 68.439 70.538 2.875 1.00 31.65 C ATOM 1116 H ALA A 116 67.134 69.605 0.872 1.00 0.00 H ATOM 1117 N THR A 117 69.026 72.321 0.312 1.00 30.18 N ATOM 1118 CA THR A 117 69.847 73.379 -0.278 1.00 30.41 C ATOM 1119 C THR A 117 68.989 74.486 -0.883 1.00 28.81 C ATOM 1120 O THR A 117 69.456 75.601 -1.031 1.00 26.72 O ATOM 1121 CB THR A 117 70.814 72.853 -1.365 1.00 32.64 C ATOM 1122 OG1 THR A 117 70.072 72.401 -2.503 1.00 35.23 O ATOM 1123 CG2 THR A 117 71.656 71.716 -0.832 1.00 32.22 C ATOM 1124 HG1 THR A 117 69.461 71.672 -2.229 1.00 0.00 H ATOM 1125 H THR A 117 69.003 71.376 -0.122 1.00 0.00 H ATOM 1126 N GLU A 118 67.735 74.186 -1.221 1.00 30.99 N ATOM 1127 CA GLU A 118 66.840 75.221 -1.744 1.00 33.48 C ATOM 1128 C GLU A 118 66.521 76.282 -0.689 1.00 29.80 C ATOM 1129 O GLU A 118 66.425 77.461 -1.008 1.00 28.75 O ATOM 1130 CB GLU A 118 65.540 74.609 -2.279 1.00 36.23 C ATOM 1131 CG GLU A 118 65.763 73.720 -3.499 1.00 41.64 C ATOM 1132 CD GLU A 118 66.452 74.453 -4.644 1.00 45.61 C ATOM 1133 OE1 GLU A 118 66.034 75.584 -4.983 1.00 50.22 O ATOM 1134 OE2 GLU A 118 67.452 73.915 -5.174 1.00 50.54 O ATOM 1135 H GLU A 118 67.390 73.211 -1.113 1.00 0.00 H ATOM 1136 N PHE A 119 66.351 75.862 0.562 1.00 27.63 N ATOM 1137 CA PHE A 119 66.146 76.819 1.640 1.00 24.34 C ATOM 1138 C PHE A 119 67.451 77.522 1.991 1.00 22.06 C ATOM 1139 O PHE A 119 67.466 78.731 2.188 1.00 20.20 O ATOM 1140 CB PHE A 119 65.559 76.133 2.874 1.00 27.92 C ATOM 1141 CG PHE A 119 64.114 75.736 2.711 1.00 28.89 C ATOM 1142 CD1 PHE A 119 63.116 76.696 2.705 1.00 29.75 C ATOM 1143 CD2 PHE A 119 63.758 74.403 2.556 1.00 30.93 C ATOM 1144 CE1 PHE A 119 61.783 76.339 2.558 1.00 32.22 C ATOM 1145 CE2 PHE A 119 62.426 74.039 2.409 1.00 39.42 C ATOM 1146 CZ PHE A 119 61.439 75.012 2.410 1.00 36.86 C ATOM 1147 H PHE A 119 66.365 74.843 0.771 1.00 0.00 H ATOM 1148 N LEU A 120 68.542 76.762 2.053 1.00 22.59 N ATOM 1149 CA LEU A 120 69.851 77.324 2.372 1.00 23.70 C ATOM 1150 C LEU A 120 70.276 78.409 1.381 1.00 22.34 C ATOM 1151 O LEU A 120 70.840 79.422 1.774 1.00 18.59 O ATOM 1152 CB LEU A 120 70.919 76.220 2.410 1.00 23.03 C ATOM 1153 CG LEU A 120 72.335 76.725 2.700 1.00 22.79 C ATOM 1154 CD1 LEU A 120 72.399 77.382 4.086 1.00 23.07 C ATOM 1155 CD2 LEU A 120 73.376 75.620 2.568 1.00 24.83 C ATOM 1156 H LEU A 120 68.460 75.742 1.869 1.00 0.00 H ATOM 1157 N LYS A 121 70.020 78.184 0.093 1.00 19.99 N ATOM 1158 CA LYS A 121 70.325 79.183 -0.934 1.00 19.48 C ATOM 1159 C LYS A 121 69.675 80.543 -0.656 1.00 19.67 C ATOM 1160 O LYS A 121 70.270 81.580 -0.930 1.00 17.90 O ATOM 1161 CB LYS A 121 69.881 78.684 -2.321 1.00 23.97 C ATOM 1162 CG LYS A 121 70.839 77.709 -2.994 1.00 30.83 C ATOM 1163 CD LYS A 121 70.249 77.174 -4.319 1.00 36.06 C ATOM 1164 CE LYS A 121 70.887 75.847 -4.721 1.00 36.94 C ATOM 1165 NZ LYS A 121 70.128 75.121 -5.788 1.00 45.47 N ATOM 1166 HZ1 LYS A 121 69.166 74.916 -5.449 1.00 0.00 H ATOM 1167 HZ2 LYS A 121 70.077 75.715 -6.640 1.00 0.00 H ATOM 1168 HZ3 LYS A 121 70.615 74.230 -6.013 1.00 0.00 H ATOM 1169 H LYS A 121 69.594 77.278 -0.190 1.00 0.00 H ATOM 1170 N GLN A 122 68.451 80.532 -0.130 1.00 19.81 N ATOM 1171 CA GLN A 122 67.770 81.774 0.265 1.00 17.97 C ATOM 1172 C GLN A 122 68.501 82.504 1.390 1.00 19.39 C ATOM 1173 O GLN A 122 68.635 83.736 1.375 1.00 15.66 O ATOM 1174 CB GLN A 122 66.337 81.486 0.709 1.00 19.27 C ATOM 1175 CG GLN A 122 65.431 80.886 -0.379 1.00 21.92 C ATOM 1176 CD GLN A 122 63.970 80.982 0.000 1.00 22.52 C ATOM 1177 OE1 GLN A 122 63.484 82.060 0.316 1.00 19.79 O ATOM 1178 NE2 GLN A 122 63.263 79.852 -0.022 1.00 24.03 N ATOM 1179 HE22 GLN A 122 63.719 78.959 -0.297 1.00 0.00 H ATOM 1180 HE21 GLN A 122 62.256 79.864 0.236 1.00 0.00 H ATOM 1181 H GLN A 122 67.965 79.622 0.005 1.00 0.00 H ATOM 1182 N ILE A 123 68.945 81.748 2.390 1.00 16.47 N ATOM 1183 CA ILE A 123 69.765 82.339 3.436 1.00 16.43 C ATOM 1184 C ILE A 123 71.031 82.936 2.816 1.00 15.18 C ATOM 1185 O ILE A 123 71.407 84.067 3.131 1.00 13.69 O ATOM 1186 CB ILE A 123 70.155 81.304 4.509 1.00 18.88 C ATOM 1187 CG1 ILE A 123 68.893 80.701 5.150 1.00 18.53 C ATOM 1188 CG2 ILE A 123 71.064 81.946 5.546 1.00 16.08 C ATOM 1189 CD1 ILE A 123 69.190 79.628 6.182 1.00 21.23 C ATOM 1190 H ILE A 123 68.706 80.736 2.424 1.00 0.00 H ATOM 1191 N LEU A 124 71.694 82.166 1.948 1.00 14.77 N ATOM 1192 CA LEU A 124 72.911 82.648 1.293 1.00 16.59 C ATOM 1193 C LEU A 124 72.647 83.933 0.515 1.00 15.87 C ATOM 1194 O LEU A 124 73.431 84.868 0.585 1.00 14.05 O ATOM 1195 CB LEU A 124 73.498 81.585 0.347 1.00 14.53 C ATOM 1196 CG LEU A 124 73.988 80.288 1.003 1.00 19.34 C ATOM 1197 CD1 LEU A 124 74.671 79.379 -0.028 1.00 19.43 C ATOM 1198 CD2 LEU A 124 74.935 80.594 2.179 1.00 14.72 C ATOM 1199 H LEU A 124 71.340 81.211 1.735 1.00 0.00 H ATOM 1200 N ASN A 125 71.536 83.977 -0.216 1.00 15.68 N ATOM 1201 CA ASN A 125 71.167 85.186 -0.963 1.00 16.07 C ATOM 1202 C ASN A 125 70.961 86.407 -0.069 1.00 15.52 C ATOM 1203 O ASN A 125 71.385 87.523 -0.402 1.00 14.89 O ATOM 1204 CB ASN A 125 69.902 84.916 -1.805 1.00 18.85 C ATOM 1205 CG ASN A 125 70.180 83.992 -2.986 1.00 25.76 C ATOM 1206 OD1 ASN A 125 71.329 83.854 -3.422 1.00 25.70 O ATOM 1207 ND2 ASN A 125 69.133 83.358 -3.511 1.00 26.11 N ATOM 1208 HD22 ASN A 125 68.184 83.504 -3.112 1.00 0.00 H ATOM 1209 HD21 ASN A 125 69.265 82.717 -4.320 1.00 0.00 H ATOM 1210 H ASN A 125 70.919 83.141 -0.259 1.00 0.00 H ATOM 1211 N GLY A 126 70.340 86.201 1.082 1.00 16.82 N ATOM 1212 CA GLY A 126 70.155 87.286 2.029 1.00 14.52 C ATOM 1213 C GLY A 126 71.481 87.797 2.586 1.00 14.21 C ATOM 1214 O GLY A 126 71.705 89.001 2.702 1.00 14.03 O ATOM 1215 H GLY A 126 69.981 85.252 1.310 1.00 0.00 H ATOM 1216 N VAL A 127 72.383 86.879 2.907 1.00 14.48 N ATOM 1217 CA VAL A 127 73.660 87.277 3.495 1.00 15.43 C ATOM 1218 C VAL A 127 74.549 87.928 2.432 1.00 13.90 C ATOM 1219 O VAL A 127 75.281 88.862 2.721 1.00 14.33 O ATOM 1220 CB VAL A 127 74.370 86.073 4.164 1.00 15.66 C ATOM 1221 CG1 VAL A 127 75.791 86.453 4.597 1.00 16.02 C ATOM 1222 CG2 VAL A 127 73.547 85.615 5.392 1.00 14.33 C ATOM 1223 H VAL A 127 72.181 85.873 2.740 1.00 0.00 H ATOM 1224 N TYR A 128 74.442 87.450 1.196 1.00 14.75 N ATOM 1225 CA TYR A 128 75.171 88.042 0.076 1.00 14.59 C ATOM 1226 C TYR A 128 74.792 89.514 -0.083 1.00 15.06 C ATOM 1227 O TYR A 128 75.658 90.377 -0.253 1.00 14.10 O ATOM 1228 CB TYR A 128 74.887 87.262 -1.202 1.00 13.45 C ATOM 1229 CG TYR A 128 75.572 87.782 -2.458 1.00 18.16 C ATOM 1230 CD1 TYR A 128 76.915 87.514 -2.711 1.00 20.31 C ATOM 1231 CD2 TYR A 128 74.864 88.510 -3.401 1.00 17.16 C ATOM 1232 CE1 TYR A 128 77.539 87.974 -3.876 1.00 23.21 C ATOM 1233 CE2 TYR A 128 75.470 88.966 -4.568 1.00 18.98 C ATOM 1234 CZ TYR A 128 76.802 88.690 -4.808 1.00 22.71 C ATOM 1235 OH TYR A 128 77.386 89.147 -5.972 1.00 21.39 O ATOM 1236 HH TYR A 128 78.336 88.869 -5.994 1.00 0.00 H ATOM 1237 H TYR A 128 73.823 86.633 1.021 1.00 0.00 H ATOM 1238 N TYR A 129 73.497 89.801 -0.004 1.00 14.09 N ATOM 1239 CA TYR A 129 73.044 91.185 -0.002 1.00 14.73 C ATOM 1240 C TYR A 129 73.683 91.989 1.143 1.00 13.45 C ATOM 1241 O TYR A 129 74.286 93.050 0.915 1.00 15.05 O ATOM 1242 CB TYR A 129 71.516 91.242 0.091 1.00 15.50 C ATOM 1243 CG TYR A 129 70.973 92.652 0.225 1.00 16.38 C ATOM 1244 CD1 TYR A 129 70.911 93.512 -0.879 1.00 17.66 C ATOM 1245 CD2 TYR A 129 70.521 93.124 1.448 1.00 17.72 C ATOM 1246 CE1 TYR A 129 70.414 94.807 -0.751 1.00 17.33 C ATOM 1247 CE2 TYR A 129 70.018 94.414 1.586 1.00 17.67 C ATOM 1248 CZ TYR A 129 69.966 95.245 0.496 1.00 20.07 C ATOM 1249 OH TYR A 129 69.456 96.514 0.656 1.00 20.88 O ATOM 1250 HH TYR A 129 69.483 96.991 -0.211 1.00 0.00 H ATOM 1251 H TYR A 129 72.801 89.031 0.057 1.00 0.00 H ATOM 1252 N LEU A 130 73.568 91.485 2.368 1.00 13.25 N ATOM 1253 CA LEU A 130 74.108 92.207 3.531 1.00 14.63 C ATOM 1254 C LEU A 130 75.613 92.457 3.422 1.00 13.72 C ATOM 1255 O LEU A 130 76.081 93.565 3.677 1.00 13.67 O ATOM 1256 CB LEU A 130 73.807 91.445 4.830 1.00 14.21 C ATOM 1257 CG LEU A 130 72.314 91.293 5.178 1.00 16.17 C ATOM 1258 CD1 LEU A 130 72.146 90.398 6.395 1.00 18.66 C ATOM 1259 CD2 LEU A 130 71.680 92.664 5.423 1.00 14.98 C ATOM 1260 H LEU A 130 73.091 90.571 2.506 1.00 0.00 H ATOM 1261 N HIS A 131 76.375 91.435 3.042 1.00 14.06 N ATOM 1262 CA HIS A 131 77.826 91.598 2.970 1.00 14.39 C ATOM 1263 C HIS A 131 78.220 92.531 1.822 1.00 16.43 C ATOM 1264 O HIS A 131 79.230 93.238 1.913 1.00 16.09 O ATOM 1265 CB HIS A 131 78.518 90.233 2.844 1.00 14.54 C ATOM 1266 CG HIS A 131 78.448 89.420 4.104 1.00 15.16 C ATOM 1267 ND1 HIS A 131 79.099 88.214 4.263 1.00 17.26 N ATOM 1268 CD2 HIS A 131 77.781 89.641 5.264 1.00 16.35 C ATOM 1269 CE1 HIS A 131 78.856 87.740 5.470 1.00 14.49 C ATOM 1270 NE2 HIS A 131 78.052 88.582 6.098 1.00 16.69 N ATOM 1271 H HIS A 131 75.940 90.523 2.797 1.00 0.00 H ATOM 1272 N SER A 132 77.399 92.571 0.778 1.00 15.26 N ATOM 1273 CA SER A 132 77.615 93.510 -0.325 1.00 17.45 C ATOM 1274 C SER A 132 77.531 94.953 0.189 1.00 20.87 C ATOM 1275 O SER A 132 78.205 95.839 -0.331 1.00 20.16 O ATOM 1276 CB SER A 132 76.596 93.291 -1.460 1.00 16.80 C ATOM 1277 OG SER A 132 76.764 92.030 -2.100 1.00 17.52 O ATOM 1278 HG SER A 132 76.645 91.306 -1.436 1.00 0.00 H ATOM 1279 H SER A 132 76.587 91.922 0.743 1.00 0.00 H ATOM 1280 N LEU A 133 76.721 95.178 1.225 1.00 15.88 N ATOM 1281 CA LEU A 133 76.628 96.502 1.851 1.00 17.42 C ATOM 1282 C LEU A 133 77.549 96.655 3.076 1.00 18.08 C ATOM 1283 O LEU A 133 77.411 97.602 3.860 1.00 20.42 O ATOM 1284 CB LEU A 133 75.174 96.791 2.258 1.00 19.82 C ATOM 1285 CG LEU A 133 74.166 96.865 1.100 1.00 19.33 C ATOM 1286 CD1 LEU A 133 72.783 97.088 1.639 1.00 23.20 C ATOM 1287 CD2 LEU A 133 74.548 97.995 0.135 1.00 22.06 C ATOM 1288 H LEU A 133 76.143 94.398 1.597 1.00 0.00 H ATOM 1289 N GLN A 134 78.475 95.712 3.231 1.00 18.37 N ATOM 1290 CA GLN A 134 79.407 95.685 4.361 1.00 17.52 C ATOM 1291 C GLN A 134 78.682 95.615 5.718 1.00 17.95 C ATOM 1292 O GLN A 134 79.127 96.195 6.700 1.00 19.08 O ATOM 1293 CB GLN A 134 80.341 96.902 4.316 1.00 23.91 C ATOM 1294 CG GLN A 134 81.336 96.858 3.162 1.00 26.24 C ATOM 1295 CD GLN A 134 82.248 95.642 3.243 1.00 34.10 C ATOM 1296 OE1 GLN A 134 82.435 94.925 2.257 1.00 41.21 O ATOM 1297 NE2 GLN A 134 82.813 95.394 4.433 1.00 32.97 N ATOM 1298 HE22 GLN A 134 82.628 96.025 5.238 1.00 0.00 H ATOM 1299 HE21 GLN A 134 83.437 94.570 4.551 1.00 0.00 H ATOM 1300 H GLN A 134 78.540 94.959 2.517 1.00 0.00 H ATOM 1301 N ILE A 135 77.556 94.912 5.754 1.00 18.51 N ATOM 1302 CA ILE A 135 76.829 94.684 6.997 1.00 14.00 C ATOM 1303 C ILE A 135 77.047 93.253 7.503 1.00 13.40 C ATOM 1304 O ILE A 135 76.746 92.297 6.799 1.00 15.56 O ATOM 1305 CB ILE A 135 75.303 94.914 6.817 1.00 16.59 C ATOM 1306 CG1 ILE A 135 75.014 96.377 6.445 1.00 19.16 C ATOM 1307 CG2 ILE A 135 74.558 94.509 8.101 1.00 16.94 C ATOM 1308 CD1 ILE A 135 73.578 96.624 5.960 1.00 23.62 C ATOM 1309 H ILE A 135 77.182 94.512 4.870 1.00 0.00 H ATOM 1310 N ALA A 136 77.579 93.122 8.713 1.00 13.29 N ATOM 1311 CA ALA A 136 77.648 91.837 9.394 1.00 14.67 C ATOM 1312 C ALA A 136 76.409 91.685 10.262 1.00 13.80 C ATOM 1313 O ALA A 136 76.085 92.577 11.041 1.00 16.48 O ATOM 1314 CB ALA A 136 78.912 91.728 10.246 1.00 15.63 C ATOM 1315 H ALA A 136 77.959 93.965 9.190 1.00 0.00 H ATOM 1316 N HIS A 137 75.721 90.558 10.131 1.00 12.82 N ATOM 1317 CA HIS A 137 74.545 90.297 10.970 1.00 14.12 C ATOM 1318 C HIS A 137 74.966 90.041 12.431 1.00 15.25 C ATOM 1319 O HIS A 137 74.415 90.635 13.373 1.00 14.57 O ATOM 1320 CB HIS A 137 73.745 89.108 10.407 1.00 15.09 C ATOM 1321 CG HIS A 137 72.437 88.880 11.102 1.00 13.70 C ATOM 1322 ND1 HIS A 137 72.337 88.181 12.288 1.00 13.93 N ATOM 1323 CD2 HIS A 137 71.173 89.251 10.785 1.00 14.52 C ATOM 1324 CE1 HIS A 137 71.076 88.127 12.662 1.00 15.91 C ATOM 1325 NE2 HIS A 137 70.345 88.780 11.767 1.00 16.30 N ATOM 1326 H HIS A 137 76.018 89.853 9.427 1.00 0.00 H ATOM 1327 N PHE A 138 75.937 89.147 12.602 1.00 12.92 N ATOM 1328 CA PHE A 138 76.536 88.796 13.899 1.00 14.41 C ATOM 1329 C PHE A 138 75.619 88.007 14.846 1.00 17.68 C ATOM 1330 O PHE A 138 76.003 87.781 15.982 1.00 17.12 O ATOM 1331 CB PHE A 138 77.040 90.052 14.652 1.00 16.62 C ATOM 1332 CG PHE A 138 78.377 90.566 14.168 1.00 17.72 C ATOM 1333 CD1 PHE A 138 79.372 89.683 13.752 1.00 18.56 C ATOM 1334 CD2 PHE A 138 78.645 91.928 14.147 1.00 16.89 C ATOM 1335 CE1 PHE A 138 80.604 90.150 13.313 1.00 17.79 C ATOM 1336 CE2 PHE A 138 79.878 92.406 13.711 1.00 15.88 C ATOM 1337 CZ PHE A 138 80.862 91.513 13.297 1.00 19.49 C ATOM 1338 H PHE A 138 76.299 88.661 11.757 1.00 0.00 H ATOM 1339 N ASP A 139 74.432 87.595 14.400 1.00 16.18 N ATOM 1340 CA ASP A 139 73.544 86.778 15.243 1.00 16.21 C ATOM 1341 C ASP A 139 72.738 85.777 14.397 1.00 16.61 C ATOM 1342 O ASP A 139 71.557 85.502 14.664 1.00 17.70 O ATOM 1343 CB ASP A 139 72.607 87.686 16.051 1.00 16.82 C ATOM 1344 CG ASP A 139 72.033 87.002 17.302 1.00 23.79 C ATOM 1345 OD1 ASP A 139 72.553 85.945 17.730 1.00 18.89 O ATOM 1346 OD2 ASP A 139 71.055 87.550 17.857 1.00 24.33 O ATOM 1347 H ASP A 139 74.128 87.855 13.440 1.00 0.00 H ATOM 1348 N LEU A 140 73.378 85.235 13.369 1.00 15.42 N ATOM 1349 CA LEU A 140 72.732 84.249 12.514 1.00 15.58 C ATOM 1350 C LEU A 140 72.629 82.920 13.256 1.00 19.62 C ATOM 1351 O LEU A 140 73.636 82.355 13.698 1.00 17.05 O ATOM 1352 CB LEU A 140 73.500 84.059 11.195 1.00 14.16 C ATOM 1353 CG LEU A 140 73.520 85.265 10.244 1.00 13.99 C ATOM 1354 CD1 LEU A 140 74.470 84.991 9.073 1.00 12.91 C ATOM 1355 CD2 LEU A 140 72.100 85.614 9.738 1.00 13.95 C ATOM 1356 H LEU A 140 74.358 85.519 13.170 1.00 0.00 H ATOM 1357 N LYS A 141 71.401 82.440 13.389 1.00 19.57 N ATOM 1358 CA LYS A 141 71.120 81.164 14.040 1.00 18.80 C ATOM 1359 C LYS A 141 69.720 80.778 13.608 1.00 18.15 C ATOM 1360 O LYS A 141 68.985 81.626 13.120 1.00 19.05 O ATOM 1361 CB LYS A 141 71.245 81.271 15.569 1.00 20.19 C ATOM 1362 CG LYS A 141 70.387 82.327 16.187 1.00 20.73 C ATOM 1363 CD LYS A 141 70.667 82.462 17.676 1.00 23.06 C ATOM 1364 CE LYS A 141 69.894 83.626 18.257 1.00 28.89 C ATOM 1365 NZ LYS A 141 69.846 83.547 19.745 1.00 33.69 N ATOM 1366 HZ1 LYS A 141 69.380 82.662 20.029 1.00 0.00 H ATOM 1367 HZ2 LYS A 141 70.814 83.567 20.123 1.00 0.00 H ATOM 1368 HZ3 LYS A 141 69.310 84.357 20.117 1.00 0.00 H ATOM 1369 H LYS A 141 70.605 82.995 13.014 1.00 0.00 H ATOM 1370 N PRO A 142 69.356 79.493 13.749 1.00 20.10 N ATOM 1371 CA PRO A 142 68.053 79.014 13.265 1.00 21.91 C ATOM 1372 C PRO A 142 66.880 79.865 13.731 1.00 17.34 C ATOM 1373 O PRO A 142 65.990 80.126 12.938 1.00 21.68 O ATOM 1374 CB PRO A 142 67.965 77.596 13.857 1.00 22.61 C ATOM 1375 CG PRO A 142 69.408 77.143 13.861 1.00 24.66 C ATOM 1376 CD PRO A 142 70.216 78.382 14.195 1.00 20.34 C ATOM 1377 N GLU A 143 66.865 80.319 14.979 1.00 19.31 N ATOM 1378 CA GLU A 143 65.672 81.061 15.412 1.00 21.45 C ATOM 1379 C GLU A 143 65.523 82.438 14.732 1.00 21.90 C ATOM 1380 O GLU A 143 64.450 83.026 14.790 1.00 20.68 O ATOM 1381 CB GLU A 143 65.639 81.217 16.946 1.00 28.67 C ATOM 1382 CG GLU A 143 66.874 81.855 17.544 1.00 32.33 C ATOM 1383 CD GLU A 143 66.968 81.607 19.057 1.00 44.86 C ATOM 1384 OE1 GLU A 143 65.911 81.574 19.731 1.00 43.61 O ATOM 1385 OE2 GLU A 143 68.094 81.426 19.585 1.00 46.28 O ATOM 1386 H GLU A 143 67.665 80.156 15.624 1.00 0.00 H ATOM 1387 N ASN A 144 66.571 82.933 14.078 1.00 17.41 N ATOM 1388 CA ASN A 144 66.447 84.198 13.354 1.00 18.67 C ATOM 1389 C ASN A 144 66.224 84.009 11.852 1.00 17.37 C ATOM 1390 O ASN A 144 66.288 84.970 11.068 1.00 16.95 O ATOM 1391 CB ASN A 144 67.684 85.063 13.603 1.00 15.26 C ATOM 1392 CG ASN A 144 67.725 85.609 15.016 1.00 20.39 C ATOM 1393 OD1 ASN A 144 66.684 85.763 15.650 1.00 20.47 O ATOM 1394 ND2 ASN A 144 68.925 85.889 15.522 1.00 16.32 N ATOM 1395 HD22 ASN A 144 69.779 85.742 14.947 1.00 0.00 H ATOM 1396 HD21 ASN A 144 69.008 86.254 16.492 1.00 0.00 H ATOM 1397 H ASN A 144 67.476 82.421 14.082 1.00 0.00 H ATOM 1398 N ILE A 145 65.966 82.763 11.455 1.00 17.39 N ATOM 1399 CA ILE A 145 65.607 82.418 10.069 1.00 18.50 C ATOM 1400 C ILE A 145 64.105 82.085 10.027 1.00 19.93 C ATOM 1401 O ILE A 145 63.690 81.005 10.451 1.00 20.22 O ATOM 1402 CB ILE A 145 66.420 81.208 9.537 1.00 17.13 C ATOM 1403 CG1 ILE A 145 67.927 81.391 9.789 1.00 21.70 C ATOM 1404 CG2 ILE A 145 66.114 80.940 8.052 1.00 21.04 C ATOM 1405 CD1 ILE A 145 68.553 82.611 9.076 1.00 18.36 C ATOM 1406 H ILE A 145 66.021 81.998 12.157 1.00 0.00 H ATOM 1407 N MET A 146 63.294 83.021 9.545 1.00 19.72 N ATOM 1408 CA MET A 146 61.831 82.883 9.597 1.00 19.24 C ATOM 1409 C MET A 146 61.235 82.605 8.215 1.00 21.93 C ATOM 1410 O MET A 146 61.913 82.750 7.198 1.00 21.62 O ATOM 1411 CB MET A 146 61.192 84.149 10.170 1.00 19.37 C ATOM 1412 CG MET A 146 61.556 84.449 11.625 1.00 22.99 C ATOM 1413 SD MET A 146 60.822 83.268 12.766 1.00 30.48 S ATOM 1414 CE MET A 146 59.244 84.017 13.038 1.00 32.92 C ATOM 1415 H MET A 146 63.706 83.876 9.119 1.00 0.00 H ATOM 1416 N LEU A 147 59.960 82.224 8.181 1.00 21.76 N ATOM 1417 CA LEU A 147 59.245 82.072 6.915 1.00 22.00 C ATOM 1418 C LEU A 147 58.193 83.162 6.802 1.00 22.07 C ATOM 1419 O LEU A 147 57.490 83.443 7.766 1.00 22.04 O ATOM 1420 CB LEU A 147 58.592 80.690 6.811 1.00 22.66 C ATOM 1421 CG LEU A 147 59.563 79.521 6.634 1.00 25.32 C ATOM 1422 CD1 LEU A 147 58.837 78.187 6.775 1.00 27.31 C ATOM 1423 CD2 LEU A 147 60.258 79.611 5.278 1.00 22.19 C ATOM 1424 H LEU A 147 59.462 82.030 9.073 1.00 0.00 H ATOM 1425 N LEU A 148 58.107 83.798 5.637 1.00 19.01 N ATOM 1426 CA LEU A 148 57.086 84.816 5.411 1.00 25.35 C ATOM 1427 C LEU A 148 55.685 84.188 5.516 1.00 30.65 C ATOM 1428 O LEU A 148 54.830 84.673 6.255 1.00 31.00 O ATOM 1429 CB LEU A 148 57.301 85.486 4.049 1.00 27.74 C ATOM 1430 CG LEU A 148 56.329 86.583 3.609 1.00 32.30 C ATOM 1431 CD1 LEU A 148 56.359 87.748 4.585 1.00 26.56 C ATOM 1432 CD2 LEU A 148 56.643 87.043 2.187 1.00 35.96 C ATOM 1433 H LEU A 148 58.777 83.566 4.876 1.00 0.00 H ATOM 1434 N ASP A 149 55.483 83.087 4.798 1.00 26.92 N ATOM 1435 CA ASP A 149 54.195 82.389 4.745 1.00 34.81 C ATOM 1436 C ASP A 149 54.449 80.891 4.568 1.00 33.31 C ATOM 1437 O ASP A 149 54.974 80.465 3.540 1.00 35.22 O ATOM 1438 CB ASP A 149 53.337 82.932 3.592 1.00 32.76 C ATOM 1439 CG ASP A 149 51.898 82.389 3.596 1.00 41.22 C ATOM 1440 OD1 ASP A 149 51.608 81.392 4.297 1.00 37.44 O ATOM 1441 OD2 ASP A 149 51.052 82.964 2.868 1.00 40.70 O ATOM 1442 H ASP A 149 56.277 82.703 4.247 1.00 0.00 H ATOM 1443 N ARG A 150 54.093 80.098 5.572 1.00 35.49 N ATOM 1444 CA ARG A 150 54.346 78.658 5.530 1.00 37.20 C ATOM 1445 C ARG A 150 53.321 77.906 4.673 1.00 43.94 C ATOM 1446 O ARG A 150 53.468 76.708 4.431 1.00 44.82 O ATOM 1447 CB ARG A 150 54.360 78.081 6.946 1.00 35.87 C ATOM 1448 CG ARG A 150 53.151 78.481 7.767 1.00 43.99 C ATOM 1449 CD ARG A 150 52.924 77.543 8.934 1.00 46.04 C ATOM 1450 NE ARG A 150 54.151 77.253 9.670 1.00 44.03 N ATOM 1451 CZ ARG A 150 54.586 76.024 9.930 1.00 44.87 C ATOM 1452 NH1 ARG A 150 53.893 74.972 9.509 1.00 49.40 N ATOM 1453 NH2 ARG A 150 55.708 75.841 10.611 1.00 41.88 N ATOM 1454 HE ARG A 150 54.718 78.055 10.011 1.00 0.00 H ATOM 1455 HH12 ARG A 150 54.233 74.010 9.712 1.00 0.00 H ATOM 1456 HH11 ARG A 150 53.011 75.110 8.976 1.00 0.00 H ATOM 1457 HH22 ARG A 150 56.043 74.877 10.811 1.00 0.00 H ATOM 1458 HH21 ARG A 150 56.253 76.661 10.945 1.00 0.00 H ATOM 1459 H ARG A 150 53.625 80.509 6.405 1.00 0.00 H ATOM 1460 N ASN A 151 52.294 78.610 4.207 1.00 42.84 N ATOM 1461 CA ASN A 151 51.227 77.974 3.433 1.00 46.28 C ATOM 1462 C ASN A 151 51.275 78.320 1.952 1.00 45.83 C ATOM 1463 O ASN A 151 50.258 78.687 1.362 1.00 49.94 O ATOM 1464 CB ASN A 151 49.855 78.361 3.995 1.00 43.74 C ATOM 1465 CG ASN A 151 49.725 78.062 5.474 1.00 46.11 C ATOM 1466 OD1 ASN A 151 50.023 76.954 5.925 1.00 50.16 O ATOM 1467 ND2 ASN A 151 49.290 79.057 6.243 1.00 48.01 N ATOM 1468 HD22 ASN A 151 49.050 79.976 5.819 1.00 0.00 H ATOM 1469 HD21 ASN A 151 49.190 78.916 7.269 1.00 0.00 H ATOM 1470 H ASN A 151 52.248 79.632 4.396 1.00 0.00 H ATOM 1471 N VAL A 152 52.458 78.219 1.354 1.00 40.56 N ATOM 1472 CA VAL A 152 52.607 78.404 -0.083 1.00 41.32 C ATOM 1473 C VAL A 152 53.510 77.288 -0.608 1.00 39.36 C ATOM 1474 O VAL A 152 54.228 76.665 0.173 1.00 40.37 O ATOM 1475 CB VAL A 152 53.187 79.797 -0.431 1.00 41.92 C ATOM 1476 CG1 VAL A 152 52.211 80.895 -0.028 1.00 41.99 C ATOM 1477 CG2 VAL A 152 54.561 79.998 0.228 1.00 38.90 C ATOM 1478 H VAL A 152 53.299 78.002 1.927 1.00 0.00 H ATOM 1479 N PRO A 153 53.461 77.009 -1.924 1.00 45.80 N ATOM 1480 CA PRO A 153 54.281 75.926 -2.489 1.00 43.87 C ATOM 1481 C PRO A 153 55.796 76.113 -2.308 1.00 42.30 C ATOM 1482 O PRO A 153 56.495 75.128 -2.045 1.00 44.61 O ATOM 1483 CB PRO A 153 53.908 75.945 -3.980 1.00 44.50 C ATOM 1484 CG PRO A 153 53.295 77.278 -4.217 1.00 48.39 C ATOM 1485 CD PRO A 153 52.587 77.614 -2.945 1.00 45.78 C ATOM 1486 N LYS A 154 56.289 77.344 -2.444 1.00 38.50 N ATOM 1487 CA LYS A 154 57.718 77.628 -2.277 1.00 38.16 C ATOM 1488 C LYS A 154 57.952 78.747 -1.253 1.00 34.05 C ATOM 1489 O LYS A 154 58.139 79.904 -1.629 1.00 31.05 O ATOM 1490 CB LYS A 154 58.346 78.007 -3.623 1.00 39.88 C ATOM 1491 H LYS A 154 55.642 78.125 -2.675 1.00 0.00 H ATOM 1492 N PRO A 155 57.936 78.394 0.042 1.00 32.36 N ATOM 1493 CA PRO A 155 58.001 79.352 1.157 1.00 31.32 C ATOM 1494 C PRO A 155 59.257 80.230 1.115 1.00 26.98 C ATOM 1495 O PRO A 155 60.335 79.755 0.755 1.00 26.92 O ATOM 1496 CB PRO A 155 57.998 78.446 2.393 1.00 30.41 C ATOM 1497 CG PRO A 155 57.335 77.181 1.928 1.00 34.48 C ATOM 1498 CD PRO A 155 57.797 77.007 0.518 1.00 32.39 C ATOM 1499 N ARG A 156 59.111 81.504 1.456 1.00 24.25 N ATOM 1500 CA ARG A 156 60.242 82.403 1.390 1.00 23.35 C ATOM 1501 C ARG A 156 60.847 82.691 2.756 1.00 25.60 C ATOM 1502 O ARG A 156 60.149 82.992 3.723 1.00 20.93 O ATOM 1503 CB ARG A 156 59.877 83.725 0.722 1.00 27.61 C ATOM 1504 CG ARG A 156 61.070 84.242 -0.093 1.00 35.64 C ATOM 1505 CD ARG A 156 61.012 85.715 -0.357 1.00 35.65 C ATOM 1506 NE ARG A 156 59.793 86.088 -1.060 1.00 44.31 N ATOM 1507 CZ ARG A 156 59.182 87.252 -0.890 1.00 48.53 C ATOM 1508 NH1 ARG A 156 59.687 88.143 -0.038 1.00 39.63 N ATOM 1509 NH2 ARG A 156 58.071 87.526 -1.559 1.00 47.98 N ATOM 1510 HE ARG A 156 59.381 85.407 -1.729 1.00 0.00 H ATOM 1511 HH12 ARG A 156 59.212 89.058 0.100 1.00 0.00 H ATOM 1512 HH11 ARG A 156 60.556 87.924 0.489 1.00 0.00 H ATOM 1513 HH22 ARG A 156 57.594 88.440 -1.423 1.00 0.00 H ATOM 1514 HH21 ARG A 156 57.676 86.827 -2.220 1.00 0.00 H ATOM 1515 H ARG A 156 58.184 81.856 1.770 1.00 0.00 H ATOM 1516 N ILE A 157 62.168 82.612 2.784 1.00 20.40 N ATOM 1517 CA ILE A 157 62.977 82.888 3.962 1.00 23.44 C ATOM 1518 C ILE A 157 63.151 84.386 4.182 1.00 17.49 C ATOM 1519 O ILE A 157 63.380 85.139 3.230 1.00 19.08 O ATOM 1520 CB ILE A 157 64.372 82.218 3.807 1.00 23.00 C ATOM 1521 CG1 ILE A 157 64.238 80.697 3.920 1.00 25.72 C ATOM 1522 CG2 ILE A 157 65.379 82.762 4.815 1.00 24.78 C ATOM 1523 CD1 ILE A 157 63.791 80.248 5.272 1.00 28.25 C ATOM 1524 H ILE A 157 62.658 82.335 1.910 1.00 0.00 H ATOM 1525 N LYS A 158 63.043 84.795 5.441 1.00 17.87 N ATOM 1526 CA LYS A 158 63.385 86.133 5.884 1.00 17.27 C ATOM 1527 C LYS A 158 64.304 86.072 7.104 1.00 17.37 C ATOM 1528 O LYS A 158 63.967 85.466 8.122 1.00 16.16 O ATOM 1529 CB LYS A 158 62.124 86.927 6.232 1.00 22.86 C ATOM 1530 CG LYS A 158 61.189 87.165 5.058 1.00 23.28 C ATOM 1531 CD LYS A 158 61.454 88.513 4.435 1.00 22.92 C ATOM 1532 CE LYS A 158 60.435 88.818 3.333 1.00 30.91 C ATOM 1533 NZ LYS A 158 60.909 89.969 2.517 1.00 30.79 N ATOM 1534 HZ1 LYS A 158 61.018 90.804 3.128 1.00 0.00 H ATOM 1535 HZ2 LYS A 158 61.825 89.732 2.085 1.00 0.00 H ATOM 1536 HZ3 LYS A 158 60.214 90.172 1.770 1.00 0.00 H ATOM 1537 H LYS A 158 62.694 84.118 6.149 1.00 0.00 H ATOM 1538 N ILE A 159 65.458 86.715 6.991 1.00 15.24 N ATOM 1539 CA ILE A 159 66.391 86.887 8.111 1.00 14.69 C ATOM 1540 C ILE A 159 65.920 88.027 9.002 1.00 17.53 C ATOM 1541 O ILE A 159 65.656 89.134 8.514 1.00 15.32 O ATOM 1542 CB ILE A 159 67.821 87.190 7.612 1.00 16.93 C ATOM 1543 CG1 ILE A 159 68.340 86.037 6.745 1.00 15.89 C ATOM 1544 CG2 ILE A 159 68.761 87.485 8.804 1.00 16.14 C ATOM 1545 CD1 ILE A 159 69.642 86.370 5.948 1.00 14.77 C ATOM 1546 H ILE A 159 65.714 87.116 6.066 1.00 0.00 H ATOM 1547 N ILE A 160 65.813 87.765 10.306 1.00 13.75 N ATOM 1548 CA ILE A 160 65.406 88.797 11.249 1.00 15.09 C ATOM 1549 C ILE A 160 66.453 89.060 12.344 1.00 15.03 C ATOM 1550 O ILE A 160 67.528 88.460 12.346 1.00 15.96 O ATOM 1551 CB ILE A 160 64.089 88.422 11.944 1.00 18.03 C ATOM 1552 CG1 ILE A 160 64.297 87.162 12.796 1.00 18.00 C ATOM 1553 CG2 ILE A 160 62.962 88.226 10.922 1.00 17.39 C ATOM 1554 CD1 ILE A 160 63.197 86.940 13.826 1.00 19.62 C ATOM 1555 H ILE A 160 66.024 86.808 10.654 1.00 0.00 H ATOM 1556 N ASP A 161 66.084 89.949 13.264 1.00 16.62 N ATOM 1557 CA ASP A 161 66.844 90.333 14.463 1.00 19.58 C ATOM 1558 C ASP A 161 68.227 90.915 14.167 1.00 16.95 C ATOM 1559 O ASP A 161 69.239 90.201 14.156 1.00 17.53 O ATOM 1560 CB ASP A 161 66.986 89.157 15.429 1.00 18.21 C ATOM 1561 CG ASP A 161 67.439 89.607 16.812 1.00 23.96 C ATOM 1562 OD1 ASP A 161 67.936 90.748 16.941 1.00 23.45 O ATOM 1563 OD2 ASP A 161 67.294 88.832 17.772 1.00 22.65 O ATOM 1564 H ASP A 161 65.167 90.418 13.120 1.00 0.00 H ATOM 1565 N PHE A 162 68.250 92.228 13.973 1.00 14.54 N ATOM 1566 CA PHE A 162 69.468 92.956 13.644 1.00 16.27 C ATOM 1567 C PHE A 162 70.024 93.697 14.872 1.00 16.75 C ATOM 1568 O PHE A 162 70.708 94.707 14.744 1.00 17.03 O ATOM 1569 CB PHE A 162 69.201 93.910 12.479 1.00 14.92 C ATOM 1570 CG PHE A 162 69.188 93.211 11.150 1.00 16.69 C ATOM 1571 CD1 PHE A 162 68.123 92.394 10.800 1.00 15.95 C ATOM 1572 CD2 PHE A 162 70.270 93.312 10.288 1.00 12.99 C ATOM 1573 CE1 PHE A 162 68.121 91.708 9.586 1.00 17.70 C ATOM 1574 CE2 PHE A 162 70.281 92.635 9.076 1.00 16.59 C ATOM 1575 CZ PHE A 162 69.212 91.838 8.723 1.00 15.50 C ATOM 1576 H PHE A 162 67.360 92.760 14.060 1.00 0.00 H ATOM 1577 N GLY A 163 69.727 93.163 16.057 1.00 17.14 N ATOM 1578 CA GLY A 163 70.198 93.732 17.311 1.00 19.37 C ATOM 1579 C GLY A 163 71.711 93.742 17.502 1.00 19.63 C ATOM 1580 O GLY A 163 72.240 94.582 18.232 1.00 21.69 O ATOM 1581 H GLY A 163 69.136 92.307 16.086 1.00 0.00 H ATOM 1582 N LEU A 164 72.414 92.803 16.879 1.00 15.00 N ATOM 1583 CA LEU A 164 73.879 92.753 16.994 1.00 16.39 C ATOM 1584 C LEU A 164 74.592 93.224 15.717 1.00 17.13 C ATOM 1585 O LEU A 164 75.823 93.280 15.672 1.00 17.16 O ATOM 1586 CB LEU A 164 74.333 91.324 17.339 1.00 17.22 C ATOM 1587 CG LEU A 164 73.843 90.836 18.708 1.00 20.83 C ATOM 1588 CD1 LEU A 164 74.346 89.433 19.017 1.00 22.71 C ATOM 1589 CD2 LEU A 164 74.295 91.815 19.784 1.00 23.68 C ATOM 1590 H LEU A 164 71.921 92.093 16.301 1.00 0.00 H ATOM 1591 N ALA A 165 73.825 93.554 14.681 1.00 16.22 N ATOM 1592 CA ALA A 165 74.415 93.853 13.376 1.00 16.91 C ATOM 1593 C ALA A 165 75.269 95.127 13.398 1.00 15.89 C ATOM 1594 O ALA A 165 74.955 96.077 14.107 1.00 16.02 O ATOM 1595 CB ALA A 165 73.317 93.964 12.314 1.00 14.45 C ATOM 1596 H ALA A 165 72.793 93.600 14.800 1.00 0.00 H ATOM 1597 N HIS A 166 76.340 95.136 12.607 1.00 14.77 N ATOM 1598 CA HIS A 166 77.271 96.267 12.538 1.00 17.38 C ATOM 1599 C HIS A 166 77.694 96.539 11.100 1.00 17.99 C ATOM 1600 O HIS A 166 77.869 95.596 10.319 1.00 17.81 O ATOM 1601 CB HIS A 166 78.542 95.996 13.353 1.00 19.88 C ATOM 1602 CG HIS A 166 78.406 96.246 14.823 1.00 20.37 C ATOM 1603 ND1 HIS A 166 77.729 95.385 15.662 1.00 22.68 N ATOM 1604 CD2 HIS A 166 78.896 97.235 15.608 1.00 25.62 C ATOM 1605 CE1 HIS A 166 77.796 95.842 16.903 1.00 22.84 C ATOM 1606 NE2 HIS A 166 78.494 96.964 16.898 1.00 24.83 N ATOM 1607 H HIS A 166 76.525 94.304 12.011 1.00 0.00 H ATOM 1608 N LYS A 167 77.883 97.809 10.761 1.00 17.63 N ATOM 1609 CA LYS A 167 78.581 98.168 9.524 1.00 23.24 C ATOM 1610 C LYS A 167 80.078 97.993 9.753 1.00 22.59 C ATOM 1611 O LYS A 167 80.620 98.548 10.699 1.00 24.92 O ATOM 1612 CB LYS A 167 78.292 99.610 9.110 1.00 24.90 C ATOM 1613 CG LYS A 167 77.102 99.793 8.194 1.00 34.97 C ATOM 1614 CD LYS A 167 77.514 99.832 6.719 1.00 34.69 C ATOM 1615 CE LYS A 167 76.274 100.004 5.850 1.00 34.31 C ATOM 1616 NZ LYS A 167 76.489 100.064 4.363 1.00 29.81 N ATOM 1617 HZ1 LYS A 167 77.106 100.870 4.135 1.00 0.00 H ATOM 1618 HZ2 LYS A 167 76.937 99.182 4.043 1.00 0.00 H ATOM 1619 HZ3 LYS A 167 75.572 100.182 3.886 1.00 0.00 H ATOM 1620 H LYS A 167 77.529 98.562 11.385 1.00 0.00 H ATOM 1621 N ILE A 168 80.747 97.232 8.899 1.00 23.79 N ATOM 1622 CA ILE A 168 82.169 96.974 9.103 1.00 27.05 C ATOM 1623 C ILE A 168 82.982 98.210 8.675 1.00 35.94 C ATOM 1624 O ILE A 168 82.983 98.590 7.511 1.00 39.56 O ATOM 1625 CB ILE A 168 82.615 95.703 8.345 1.00 30.96 C ATOM 1626 CG1 ILE A 168 81.911 94.472 8.930 1.00 25.55 C ATOM 1627 CG2 ILE A 168 84.126 95.523 8.414 1.00 37.86 C ATOM 1628 CD1 ILE A 168 81.851 94.450 10.469 1.00 24.76 C ATOM 1629 H ILE A 168 80.257 96.817 8.081 1.00 0.00 H ATOM 1630 N ASP A 169 83.640 98.839 9.647 1.00 34.40 N ATOM 1631 CA ASP A 169 84.380 100.090 9.452 1.00 44.00 C ATOM 1632 C ASP A 169 85.834 99.825 9.063 1.00 37.54 C ATOM 1633 O ASP A 169 86.568 99.182 9.807 1.00 40.60 O ATOM 1634 CB ASP A 169 84.301 100.936 10.737 1.00 47.07 C ATOM 1635 CG ASP A 169 85.388 102.018 10.827 1.00 50.74 C ATOM 1636 OD1 ASP A 169 85.797 102.577 9.782 1.00 51.90 O ATOM 1637 OD2 ASP A 169 85.811 102.327 11.966 1.00 42.95 O ATOM 1638 H ASP A 169 83.628 98.419 10.598 1.00 0.00 H ATOM 1639 N PHE A 170 86.247 100.341 7.908 1.00 41.03 N ATOM 1640 CA PHE A 170 87.598 100.093 7.405 1.00 37.70 C ATOM 1641 C PHE A 170 88.737 100.447 8.383 1.00 39.10 C ATOM 1642 O PHE A 170 89.710 99.695 8.514 1.00 42.14 O ATOM 1643 CB PHE A 170 87.836 100.852 6.094 1.00 38.83 C ATOM 1644 CG PHE A 170 89.157 100.514 5.448 1.00 32.71 C ATOM 1645 CD1 PHE A 170 89.290 99.359 4.680 1.00 35.57 C ATOM 1646 CD2 PHE A 170 90.268 101.321 5.641 1.00 32.68 C ATOM 1647 CE1 PHE A 170 90.509 99.021 4.095 1.00 32.58 C ATOM 1648 CE2 PHE A 170 91.492 100.994 5.064 1.00 28.29 C ATOM 1649 CZ PHE A 170 91.613 99.840 4.287 1.00 26.85 C ATOM 1650 H PHE A 170 85.597 100.932 7.352 1.00 0.00 H ATOM 1651 N GLY A 171 88.626 101.584 9.057 1.00 36.20 N ATOM 1652 CA GLY A 171 89.755 102.120 9.806 1.00 36.41 C ATOM 1653 C GLY A 171 89.958 101.664 11.246 1.00 40.46 C ATOM 1654 O GLY A 171 90.993 101.957 11.842 1.00 35.70 O ATOM 1655 H GLY A 171 87.722 102.099 9.051 1.00 0.00 H ATOM 1656 N ASN A 172 88.984 100.967 11.823 1.00 40.78 N ATOM 1657 CA ASN A 172 89.106 100.558 13.222 1.00 45.29 C ATOM 1658 C ASN A 172 88.613 99.141 13.475 1.00 39.50 C ATOM 1659 O ASN A 172 87.496 98.781 13.093 1.00 39.10 O ATOM 1660 CB ASN A 172 88.344 101.523 14.140 1.00 42.60 C ATOM 1661 CG ASN A 172 88.949 102.915 14.168 1.00 44.50 C ATOM 1662 OD1 ASN A 172 89.953 103.157 14.846 1.00 43.07 O ATOM 1663 ND2 ASN A 172 88.328 103.844 13.443 1.00 42.71 N ATOM 1664 HD22 ASN A 172 87.485 103.593 12.888 1.00 0.00 H ATOM 1665 HD21 ASN A 172 88.686 104.820 13.432 1.00 0.00 H ATOM 1666 H ASN A 172 88.135 100.712 11.279 1.00 0.00 H ATOM 1667 N GLU A 173 89.448 98.344 14.130 1.00 39.21 N ATOM 1668 CA GLU A 173 89.051 97.000 14.506 1.00 38.60 C ATOM 1669 C GLU A 173 87.854 97.048 15.453 1.00 40.13 C ATOM 1670 O GLU A 173 87.680 97.997 16.219 1.00 35.61 O ATOM 1671 CB GLU A 173 90.230 96.241 15.131 1.00 39.54 C ATOM 1672 CG GLU A 173 91.278 95.829 14.086 1.00 40.51 C ATOM 1673 CD GLU A 173 92.376 94.926 14.628 1.00 39.83 C ATOM 1674 OE1 GLU A 173 92.607 94.916 15.861 1.00 42.14 O ATOM 1675 OE2 GLU A 173 93.009 94.224 13.812 1.00 38.11 O ATOM 1676 H GLU A 173 90.398 98.687 14.377 1.00 0.00 H ATOM 1677 N PHE A 174 86.996 96.041 15.344 1.00 33.65 N ATOM 1678 CA PHE A 174 85.876 95.880 16.252 1.00 32.21 C ATOM 1679 C PHE A 174 86.064 94.556 16.986 1.00 30.15 C ATOM 1680 O PHE A 174 86.311 93.523 16.359 1.00 24.63 O ATOM 1681 CB PHE A 174 84.540 95.922 15.488 1.00 31.58 C ATOM 1682 CG PHE A 174 83.325 95.649 16.348 1.00 33.99 C ATOM 1683 CD1 PHE A 174 82.985 96.503 17.391 1.00 34.73 C ATOM 1684 CD2 PHE A 174 82.510 94.553 16.091 1.00 28.90 C ATOM 1685 CE1 PHE A 174 81.868 96.257 18.180 1.00 32.57 C ATOM 1686 CE2 PHE A 174 81.388 94.299 16.871 1.00 30.46 C ATOM 1687 CZ PHE A 174 81.069 95.152 17.921 1.00 32.98 C ATOM 1688 H PHE A 174 87.131 95.345 14.583 1.00 0.00 H ATOM 1689 N LYS A 175 85.996 94.603 18.314 1.00 26.69 N ATOM 1690 CA LYS A 175 86.061 93.397 19.132 1.00 30.48 C ATOM 1691 C LYS A 175 84.885 93.407 20.084 1.00 32.44 C ATOM 1692 O LYS A 175 84.503 94.472 20.582 1.00 34.10 O ATOM 1693 CB LYS A 175 87.364 93.317 19.935 1.00 33.32 C ATOM 1694 CG LYS A 175 88.626 93.033 19.144 1.00 33.23 C ATOM 1695 CD LYS A 175 89.831 93.083 20.087 1.00 35.79 C ATOM 1696 CE LYS A 175 91.037 92.428 19.461 1.00 42.74 C ATOM 1697 NZ LYS A 175 92.258 92.526 20.330 1.00 48.19 N ATOM 1698 HZ1 LYS A 175 92.485 93.527 20.495 1.00 0.00 H ATOM 1699 HZ2 LYS A 175 92.073 92.057 21.240 1.00 0.00 H ATOM 1700 HZ3 LYS A 175 93.058 92.061 19.855 1.00 0.00 H ATOM 1701 H LYS A 175 85.894 95.526 18.782 1.00 0.00 H ATOM 1702 N ASN A 176 84.322 92.231 20.342 1.00 29.00 N ATOM 1703 CA ASN A 176 83.274 92.090 21.345 1.00 31.69 C ATOM 1704 C ASN A 176 82.946 90.626 21.607 1.00 32.03 C ATOM 1705 O ASN A 176 83.194 89.758 20.767 1.00 29.56 O ATOM 1706 CB ASN A 176 82.007 92.843 20.921 1.00 33.07 C ATOM 1707 CG ASN A 176 81.168 93.289 22.108 1.00 40.83 C ATOM 1708 OD1 ASN A 176 81.562 93.123 23.268 1.00 40.04 O ATOM 1709 ND2 ASN A 176 80.009 93.866 21.822 1.00 42.69 N ATOM 1710 HD22 ASN A 176 79.718 93.985 20.831 1.00 0.00 H ATOM 1711 HD21 ASN A 176 79.391 94.200 22.589 1.00 0.00 H ATOM 1712 H ASN A 176 84.637 91.391 19.815 1.00 0.00 H ATOM 1713 N ILE A 177 82.409 90.359 22.791 1.00 34.17 N ATOM 1714 CA ILE A 177 81.926 89.032 23.140 1.00 35.88 C ATOM 1715 C ILE A 177 80.415 89.135 23.318 1.00 38.64 C ATOM 1716 O ILE A 177 79.929 89.904 24.154 1.00 37.62 O ATOM 1717 CB ILE A 177 82.601 88.484 24.422 1.00 37.56 C ATOM 1718 CG1 ILE A 177 84.126 88.454 24.253 1.00 33.73 C ATOM 1719 CG2 ILE A 177 82.069 87.094 24.755 1.00 42.77 C ATOM 1720 CD1 ILE A 177 84.869 87.789 25.398 1.00 34.93 C ATOM 1721 H ILE A 177 82.331 91.123 23.492 1.00 0.00 H ATOM 1722 N PHE A 178 79.680 88.367 22.518 1.00 33.11 N ATOM 1723 CA PHE A 178 78.225 88.481 22.433 1.00 33.66 C ATOM 1724 C PHE A 178 77.678 87.263 21.700 1.00 30.86 C ATOM 1725 O PHE A 178 78.452 86.419 21.252 1.00 32.58 O ATOM 1726 CB PHE A 178 77.834 89.749 21.683 1.00 33.06 C ATOM 1727 CG PHE A 178 78.447 89.825 20.313 1.00 32.88 C ATOM 1728 CD1 PHE A 178 77.841 89.209 19.229 1.00 31.56 C ATOM 1729 CD2 PHE A 178 79.656 90.465 20.120 1.00 36.93 C ATOM 1730 CE1 PHE A 178 78.419 89.253 17.977 1.00 31.62 C ATOM 1731 CE2 PHE A 178 80.234 90.517 18.869 1.00 34.27 C ATOM 1732 CZ PHE A 178 79.617 89.913 17.801 1.00 28.45 C ATOM 1733 H PHE A 178 80.160 87.657 21.929 1.00 0.00 H ATOM 1734 N GLY A 179 76.359 87.181 21.550 1.00 27.93 N ATOM 1735 CA GLY A 179 75.771 86.117 20.746 1.00 25.58 C ATOM 1736 C GLY A 179 75.656 84.803 21.504 1.00 26.89 C ATOM 1737 O GLY A 179 76.055 84.714 22.662 1.00 26.23 O ATOM 1738 H GLY A 179 75.743 87.881 22.010 1.00 0.00 H ATOM 1739 N THR A 180 75.129 83.781 20.835 1.00 22.27 N ATOM 1740 CA THR A 180 74.846 82.482 21.457 1.00 22.93 C ATOM 1741 C THR A 180 76.010 81.505 21.224 1.00 23.08 C ATOM 1742 O THR A 180 76.402 81.279 20.092 1.00 21.02 O ATOM 1743 CB THR A 180 73.526 81.905 20.893 1.00 24.94 C ATOM 1744 OG1 THR A 180 72.481 82.865 21.089 1.00 24.95 O ATOM 1745 CG2 THR A 180 73.145 80.583 21.557 1.00 26.68 C ATOM 1746 HG1 THR A 180 72.711 83.703 20.615 1.00 0.00 H ATOM 1747 H THR A 180 74.908 83.908 19.827 1.00 0.00 H ATOM 1748 N PRO A 181 76.574 80.939 22.308 1.00 24.14 N ATOM 1749 CA PRO A 181 77.786 80.101 22.249 1.00 20.95 C ATOM 1750 C PRO A 181 77.804 79.057 21.124 1.00 20.08 C ATOM 1751 O PRO A 181 78.792 78.938 20.401 1.00 22.56 O ATOM 1752 CB PRO A 181 77.793 79.418 23.624 1.00 27.22 C ATOM 1753 CG PRO A 181 77.171 80.447 24.534 1.00 30.20 C ATOM 1754 CD PRO A 181 76.116 81.159 23.694 1.00 24.29 C ATOM 1755 N GLU A 182 76.709 78.328 20.974 1.00 20.96 N ATOM 1756 CA GLU A 182 76.553 77.312 19.935 1.00 24.38 C ATOM 1757 C GLU A 182 76.852 77.801 18.498 1.00 22.01 C ATOM 1758 O GLU A 182 77.311 77.023 17.642 1.00 20.25 O ATOM 1759 CB GLU A 182 75.118 76.792 20.014 1.00 25.51 C ATOM 1760 CG GLU A 182 74.810 75.508 19.330 1.00 31.85 C ATOM 1761 CD GLU A 182 73.487 74.919 19.815 1.00 31.45 C ATOM 1762 OE1 GLU A 182 72.973 75.354 20.868 1.00 33.38 O ATOM 1763 OE2 GLU A 182 72.954 74.032 19.135 1.00 38.04 O ATOM 1764 H GLU A 182 75.918 78.487 21.630 1.00 0.00 H ATOM 1765 N PHE A 183 76.589 79.083 18.243 1.00 21.61 N ATOM 1766 CA PHE A 183 76.558 79.601 16.871 1.00 20.80 C ATOM 1767 C PHE A 183 77.619 80.661 16.537 1.00 20.75 C ATOM 1768 O PHE A 183 77.732 81.063 15.385 1.00 19.75 O ATOM 1769 CB PHE A 183 75.159 80.169 16.579 1.00 21.83 C ATOM 1770 CG PHE A 183 74.064 79.160 16.767 1.00 19.05 C ATOM 1771 CD1 PHE A 183 73.845 78.182 15.814 1.00 25.30 C ATOM 1772 CD2 PHE A 183 73.283 79.168 17.908 1.00 22.85 C ATOM 1773 CE1 PHE A 183 72.847 77.232 15.992 1.00 26.05 C ATOM 1774 CE2 PHE A 183 72.284 78.228 18.085 1.00 21.89 C ATOM 1775 CZ PHE A 183 72.076 77.262 17.137 1.00 21.69 C ATOM 1776 H PHE A 183 76.402 79.731 19.035 1.00 0.00 H ATOM 1777 N VAL A 184 78.404 81.097 17.518 1.00 20.13 N ATOM 1778 CA VAL A 184 79.374 82.170 17.267 1.00 18.14 C ATOM 1779 C VAL A 184 80.748 81.649 16.848 1.00 22.38 C ATOM 1780 O VAL A 184 81.163 80.553 17.240 1.00 20.32 O ATOM 1781 CB VAL A 184 79.558 83.082 18.505 1.00 21.05 C ATOM 1782 CG1 VAL A 184 78.267 83.833 18.812 1.00 20.84 C ATOM 1783 CG2 VAL A 184 80.033 82.278 19.718 1.00 21.40 C ATOM 1784 H VAL A 184 78.330 80.676 18.466 1.00 0.00 H ATOM 1785 N ALA A 185 81.445 82.454 16.051 1.00 18.44 N ATOM 1786 CA ALA A 185 82.744 82.087 15.491 1.00 21.25 C ATOM 1787 C ALA A 185 83.836 82.155 16.568 1.00 21.43 C ATOM 1788 O ALA A 185 83.653 82.820 17.592 1.00 19.90 O ATOM 1789 CB ALA A 185 83.089 83.007 14.304 1.00 18.78 C ATOM 1790 H ALA A 185 81.048 83.386 15.816 1.00 0.00 H ATOM 1791 N PRO A 186 84.959 81.450 16.349 1.00 20.02 N ATOM 1792 CA PRO A 186 86.040 81.458 17.354 1.00 22.30 C ATOM 1793 C PRO A 186 86.587 82.865 17.637 1.00 22.83 C ATOM 1794 O PRO A 186 86.988 83.124 18.763 1.00 24.36 O ATOM 1795 CB PRO A 186 87.120 80.567 16.726 1.00 22.04 C ATOM 1796 CG PRO A 186 86.382 79.677 15.762 1.00 25.53 C ATOM 1797 CD PRO A 186 85.225 80.507 15.247 1.00 20.34 C ATOM 1798 N GLU A 187 86.583 83.766 16.652 1.00 21.45 N ATOM 1799 CA GLU A 187 87.053 85.129 16.900 1.00 21.04 C ATOM 1800 C GLU A 187 86.160 85.878 17.904 1.00 23.00 C ATOM 1801 O GLU A 187 86.642 86.719 18.662 1.00 21.98 O ATOM 1802 CB GLU A 187 87.172 85.922 15.586 1.00 20.16 C ATOM 1803 CG GLU A 187 85.910 85.968 14.724 1.00 20.75 C ATOM 1804 CD GLU A 187 85.873 84.880 13.660 1.00 21.60 C ATOM 1805 OE1 GLU A 187 86.421 83.785 13.906 1.00 22.54 O ATOM 1806 OE2 GLU A 187 85.275 85.114 12.581 1.00 22.88 O ATOM 1807 H GLU A 187 86.245 83.498 15.706 1.00 0.00 H ATOM 1808 N ILE A 188 84.871 85.558 17.939 1.00 19.33 N ATOM 1809 CA ILE A 188 83.999 86.150 18.946 1.00 18.85 C ATOM 1810 C ILE A 188 84.326 85.564 20.323 1.00 23.69 C ATOM 1811 O ILE A 188 84.438 86.301 21.303 1.00 24.32 O ATOM 1812 CB ILE A 188 82.506 85.925 18.616 1.00 21.11 C ATOM 1813 CG1 ILE A 188 82.130 86.709 17.353 1.00 19.69 C ATOM 1814 CG2 ILE A 188 81.622 86.329 19.792 1.00 21.08 C ATOM 1815 CD1 ILE A 188 80.741 86.379 16.793 1.00 22.08 C ATOM 1816 H ILE A 188 84.484 84.885 17.247 1.00 0.00 H ATOM 1817 N VAL A 189 84.491 84.243 20.380 1.00 21.35 N ATOM 1818 CA VAL A 189 84.790 83.553 21.639 1.00 26.07 C ATOM 1819 C VAL A 189 86.087 84.061 22.263 1.00 26.71 C ATOM 1820 O VAL A 189 86.181 84.242 23.475 1.00 28.94 O ATOM 1821 CB VAL A 189 84.903 82.023 21.434 1.00 26.98 C ATOM 1822 CG1 VAL A 189 85.240 81.334 22.754 1.00 25.87 C ATOM 1823 CG2 VAL A 189 83.593 81.451 20.843 1.00 22.75 C ATOM 1824 H VAL A 189 84.405 83.685 19.506 1.00 0.00 H ATOM 1825 N ASN A 190 87.069 84.312 21.406 1.00 23.99 N ATOM 1826 CA ASN A 190 88.425 84.657 21.815 1.00 28.35 C ATOM 1827 C ASN A 190 88.727 86.158 21.825 1.00 29.95 C ATOM 1828 O ASN A 190 89.877 86.564 22.002 1.00 30.50 O ATOM 1829 CB ASN A 190 89.417 83.939 20.895 1.00 26.31 C ATOM 1830 CG ASN A 190 89.544 82.473 21.232 1.00 30.96 C ATOM 1831 OD1 ASN A 190 89.541 82.104 22.402 1.00 29.38 O ATOM 1832 ND2 ASN A 190 89.659 81.633 20.218 1.00 29.20 N ATOM 1833 HD22 ASN A 190 89.656 81.992 19.242 1.00 0.00 H ATOM 1834 HD21 ASN A 190 89.752 80.613 20.396 1.00 0.00 H ATOM 1835 H ASN A 190 86.860 84.260 20.389 1.00 0.00 H ATOM 1836 N TYR A 191 87.690 86.964 21.624 1.00 27.48 N ATOM 1837 CA TYR A 191 87.791 88.419 21.663 1.00 26.45 C ATOM 1838 C TYR A 191 88.846 88.914 20.670 1.00 30.35 C ATOM 1839 O TYR A 191 89.704 89.734 20.992 1.00 30.49 O ATOM 1840 CB TYR A 191 88.092 88.885 23.101 1.00 29.93 C ATOM 1841 CG TYR A 191 87.942 90.374 23.325 1.00 34.45 C ATOM 1842 CD1 TYR A 191 86.719 91.004 23.132 1.00 33.18 C ATOM 1843 CD2 TYR A 191 89.023 91.152 23.733 1.00 37.94 C ATOM 1844 CE1 TYR A 191 86.572 92.362 23.326 1.00 34.36 C ATOM 1845 CE2 TYR A 191 88.886 92.517 23.932 1.00 38.16 C ATOM 1846 CZ TYR A 191 87.656 93.113 23.734 1.00 40.30 C ATOM 1847 OH TYR A 191 87.506 94.469 23.931 1.00 48.26 O ATOM 1848 HH TYR A 191 86.568 94.726 23.746 1.00 0.00 H ATOM 1849 H TYR A 191 86.762 86.537 21.430 1.00 0.00 H ATOM 1850 N GLU A 192 88.778 88.391 19.453 1.00 24.97 N ATOM 1851 CA GLU A 192 89.681 88.791 18.382 1.00 23.32 C ATOM 1852 C GLU A 192 88.945 89.684 17.357 1.00 25.58 C ATOM 1853 O GLU A 192 87.731 89.872 17.476 1.00 23.62 O ATOM 1854 CB GLU A 192 90.287 87.527 17.763 1.00 23.91 C ATOM 1855 CG GLU A 192 91.116 86.783 18.806 1.00 28.49 C ATOM 1856 CD GLU A 192 91.692 85.469 18.327 1.00 34.33 C ATOM 1857 OE1 GLU A 192 91.146 84.873 17.374 1.00 36.10 O ATOM 1858 OE2 GLU A 192 92.692 85.023 18.931 1.00 39.37 O ATOM 1859 H GLU A 192 88.055 87.670 19.256 1.00 0.00 H ATOM 1860 N PRO A 193 89.678 90.280 16.393 1.00 22.19 N ATOM 1861 CA PRO A 193 89.005 91.187 15.452 1.00 26.22 C ATOM 1862 C PRO A 193 87.867 90.523 14.670 1.00 20.51 C ATOM 1863 O PRO A 193 88.010 89.390 14.191 1.00 20.03 O ATOM 1864 CB PRO A 193 90.139 91.618 14.514 1.00 28.78 C ATOM 1865 CG PRO A 193 91.361 91.582 15.394 1.00 30.69 C ATOM 1866 CD PRO A 193 91.150 90.382 16.292 1.00 27.29 C ATOM 1867 N LEU A 194 86.748 91.236 14.568 1.00 21.93 N ATOM 1868 CA LEU A 194 85.522 90.715 13.959 1.00 17.66 C ATOM 1869 C LEU A 194 85.251 91.370 12.602 1.00 25.91 C ATOM 1870 O LEU A 194 85.651 92.518 12.363 1.00 21.29 O ATOM 1871 CB LEU A 194 84.330 90.947 14.892 1.00 19.82 C ATOM 1872 CG LEU A 194 84.486 90.395 16.318 1.00 20.71 C ATOM 1873 CD1 LEU A 194 83.233 90.633 17.144 1.00 22.42 C ATOM 1874 CD2 LEU A 194 84.830 88.923 16.271 1.00 18.62 C ATOM 1875 H LEU A 194 86.744 92.208 14.938 1.00 0.00 H ATOM 1876 N GLY A 195 84.559 90.647 11.725 1.00 20.42 N ATOM 1877 CA GLY A 195 84.189 91.177 10.418 1.00 22.33 C ATOM 1878 C GLY A 195 83.078 90.344 9.801 1.00 20.97 C ATOM 1879 O GLY A 195 82.399 89.597 10.506 1.00 17.15 O ATOM 1880 H GLY A 195 84.275 89.679 11.978 1.00 0.00 H ATOM 1881 N LEU A 196 82.898 90.459 8.488 1.00 18.33 N ATOM 1882 CA LEU A 196 81.869 89.702 7.777 1.00 18.07 C ATOM 1883 C LEU A 196 82.048 88.180 7.897 1.00 20.02 C ATOM 1884 O LEU A 196 81.074 87.416 7.824 1.00 18.27 O ATOM 1885 CB LEU A 196 81.862 90.104 6.297 1.00 17.52 C ATOM 1886 CG LEU A 196 81.649 91.599 6.011 1.00 19.50 C ATOM 1887 CD1 LEU A 196 81.719 91.834 4.508 1.00 22.90 C ATOM 1888 CD2 LEU A 196 80.307 92.085 6.564 1.00 17.02 C ATOM 1889 H LEU A 196 83.508 91.107 7.951 1.00 0.00 H ATOM 1890 N GLU A 197 83.294 87.748 8.083 1.00 19.83 N ATOM 1891 CA GLU A 197 83.619 86.325 8.094 1.00 19.40 C ATOM 1892 C GLU A 197 82.924 85.557 9.219 1.00 16.46 C ATOM 1893 O GLU A 197 82.676 84.359 9.082 1.00 16.61 O ATOM 1894 CB GLU A 197 85.147 86.123 8.190 1.00 18.65 C ATOM 1895 CG GLU A 197 85.903 86.656 6.981 1.00 19.81 C ATOM 1896 CD GLU A 197 86.226 88.147 7.074 1.00 29.79 C ATOM 1897 OE1 GLU A 197 85.991 88.752 8.143 1.00 30.09 O ATOM 1898 OE2 GLU A 197 86.716 88.712 6.069 1.00 36.21 O ATOM 1899 H GLU A 197 84.055 88.443 8.224 1.00 0.00 H ATOM 1900 N ALA A 198 82.621 86.233 10.326 1.00 14.91 N ATOM 1901 CA ALA A 198 81.952 85.574 11.445 1.00 18.02 C ATOM 1902 C ALA A 198 80.598 85.004 11.000 1.00 15.13 C ATOM 1903 O ALA A 198 80.196 83.929 11.440 1.00 17.89 O ATOM 1904 CB ALA A 198 81.763 86.546 12.620 1.00 15.74 C ATOM 1905 H ALA A 198 82.864 87.242 10.394 1.00 0.00 H ATOM 1906 N ASP A 199 79.897 85.733 10.142 1.00 15.05 N ATOM 1907 CA ASP A 199 78.619 85.258 9.604 1.00 15.45 C ATOM 1908 C ASP A 199 78.779 83.947 8.825 1.00 15.92 C ATOM 1909 O ASP A 199 77.887 83.095 8.863 1.00 12.96 O ATOM 1910 CB ASP A 199 77.976 86.302 8.678 1.00 14.21 C ATOM 1911 CG ASP A 199 77.330 87.475 9.428 1.00 13.39 C ATOM 1912 OD1 ASP A 199 77.059 87.399 10.645 1.00 14.89 O ATOM 1913 OD2 ASP A 199 77.053 88.494 8.761 1.00 14.89 O ATOM 1914 H ASP A 199 80.262 86.661 9.845 1.00 0.00 H ATOM 1915 N MET A 200 79.881 83.792 8.083 1.00 12.92 N ATOM 1916 CA MET A 200 80.055 82.579 7.270 1.00 14.62 C ATOM 1917 C MET A 200 80.258 81.337 8.154 1.00 16.90 C ATOM 1918 O MET A 200 79.765 80.251 7.831 1.00 14.52 O ATOM 1919 CB MET A 200 81.220 82.732 6.284 1.00 15.02 C ATOM 1920 CG MET A 200 81.034 83.903 5.306 1.00 16.30 C ATOM 1921 SD MET A 200 79.398 83.871 4.521 1.00 15.27 S ATOM 1922 CE MET A 200 79.442 82.266 3.709 1.00 17.47 C ATOM 1923 H MET A 200 80.615 84.529 8.081 1.00 0.00 H ATOM 1924 N TRP A 201 80.981 81.501 9.260 1.00 14.34 N ATOM 1925 CA TRP A 201 81.076 80.432 10.266 1.00 18.00 C ATOM 1926 C TRP A 201 79.687 79.994 10.754 1.00 16.60 C ATOM 1927 O TRP A 201 79.373 78.799 10.769 1.00 16.24 O ATOM 1928 CB TRP A 201 81.927 80.884 11.454 1.00 15.24 C ATOM 1929 CG TRP A 201 81.936 79.900 12.612 1.00 18.84 C ATOM 1930 CD1 TRP A 201 80.954 79.720 13.555 1.00 18.51 C ATOM 1931 CD2 TRP A 201 82.974 78.966 12.935 1.00 19.24 C ATOM 1932 NE1 TRP A 201 81.316 78.722 14.436 1.00 19.22 N ATOM 1933 CE2 TRP A 201 82.558 78.253 14.084 1.00 19.19 C ATOM 1934 CE3 TRP A 201 84.216 78.661 12.364 1.00 18.42 C ATOM 1935 CZ2 TRP A 201 83.344 77.271 14.677 1.00 20.85 C ATOM 1936 CZ3 TRP A 201 84.998 77.675 12.958 1.00 21.36 C ATOM 1937 CH2 TRP A 201 84.552 76.989 14.097 1.00 20.73 C ATOM 1938 HE1 TRP A 201 80.743 78.381 15.234 1.00 0.00 H ATOM 1939 H TRP A 201 81.485 82.397 9.415 1.00 0.00 H ATOM 1940 N SER A 202 78.864 80.959 11.163 1.00 14.64 N ATOM 1941 CA SER A 202 77.515 80.664 11.649 1.00 17.17 C ATOM 1942 C SER A 202 76.667 79.960 10.591 1.00 16.32 C ATOM 1943 O SER A 202 75.859 79.087 10.912 1.00 16.37 O ATOM 1944 CB SER A 202 76.816 81.947 12.106 1.00 17.81 C ATOM 1945 OG SER A 202 77.562 82.590 13.127 1.00 20.45 O ATOM 1946 HG SER A 202 77.651 81.981 13.902 1.00 0.00 H ATOM 1947 H SER A 202 79.188 81.947 11.136 1.00 0.00 H ATOM 1948 N ILE A 203 76.849 80.346 9.331 1.00 17.18 N ATOM 1949 CA ILE A 203 76.176 79.671 8.222 1.00 14.94 C ATOM 1950 C ILE A 203 76.625 78.200 8.166 1.00 17.81 C ATOM 1951 O ILE A 203 75.826 77.302 7.897 1.00 15.67 O ATOM 1952 CB ILE A 203 76.455 80.397 6.871 1.00 14.74 C ATOM 1953 CG1 ILE A 203 75.651 81.704 6.795 1.00 15.75 C ATOM 1954 CG2 ILE A 203 76.096 79.519 5.661 1.00 14.24 C ATOM 1955 CD1 ILE A 203 76.078 82.602 5.633 1.00 18.45 C ATOM 1956 H ILE A 203 77.484 81.145 9.130 1.00 0.00 H ATOM 1957 N GLY A 204 77.896 77.948 8.462 1.00 16.09 N ATOM 1958 CA GLY A 204 78.387 76.580 8.500 1.00 18.37 C ATOM 1959 C GLY A 204 77.709 75.766 9.597 1.00 17.84 C ATOM 1960 O GLY A 204 77.344 74.607 9.401 1.00 19.02 O ATOM 1961 H GLY A 204 78.544 78.735 8.668 1.00 0.00 H ATOM 1962 N VAL A 205 77.534 76.382 10.760 1.00 19.06 N ATOM 1963 CA VAL A 205 76.834 75.738 11.862 1.00 16.80 C ATOM 1964 C VAL A 205 75.372 75.476 11.477 1.00 20.20 C ATOM 1965 O VAL A 205 74.839 74.387 11.698 1.00 18.57 O ATOM 1966 CB VAL A 205 76.887 76.589 13.140 1.00 17.53 C ATOM 1967 CG1 VAL A 205 76.091 75.918 14.259 1.00 19.34 C ATOM 1968 CG2 VAL A 205 78.334 76.818 13.576 1.00 16.63 C ATOM 1969 H VAL A 205 77.905 77.345 10.886 1.00 0.00 H ATOM 1970 N ILE A 206 74.729 76.478 10.882 1.00 17.96 N ATOM 1971 CA ILE A 206 73.336 76.335 10.473 1.00 17.15 C ATOM 1972 C ILE A 206 73.195 75.194 9.475 1.00 19.17 C ATOM 1973 O ILE A 206 72.243 74.408 9.551 1.00 20.10 O ATOM 1974 CB ILE A 206 72.789 77.660 9.872 1.00 16.87 C ATOM 1975 CG1 ILE A 206 72.581 78.684 10.987 1.00 15.80 C ATOM 1976 CG2 ILE A 206 71.474 77.421 9.130 1.00 18.28 C ATOM 1977 CD1 ILE A 206 72.435 80.101 10.506 1.00 17.69 C ATOM 1978 H ILE A 206 75.226 77.374 10.706 1.00 0.00 H ATOM 1979 N THR A 207 74.175 75.066 8.583 1.00 15.39 N ATOM 1980 CA THR A 207 74.091 74.073 7.512 1.00 19.19 C ATOM 1981 C THR A 207 74.227 72.669 8.108 1.00 22.17 C ATOM 1982 O THR A 207 73.473 71.759 7.775 1.00 21.28 O ATOM 1983 CB THR A 207 75.174 74.306 6.433 1.00 18.63 C ATOM 1984 OG1 THR A 207 74.962 75.586 5.812 1.00 19.49 O ATOM 1985 CG2 THR A 207 75.124 73.207 5.344 1.00 20.36 C ATOM 1986 HG1 THR A 207 75.019 76.298 6.498 1.00 0.00 H ATOM 1987 H THR A 207 75.012 75.680 8.648 1.00 0.00 H ATOM 1988 N TYR A 208 75.188 72.519 9.010 1.00 20.52 N ATOM 1989 CA TYR A 208 75.384 71.275 9.733 1.00 21.55 C ATOM 1990 C TYR A 208 74.096 70.793 10.417 1.00 22.20 C ATOM 1991 O TYR A 208 73.735 69.619 10.315 1.00 23.51 O ATOM 1992 CB TYR A 208 76.497 71.471 10.752 1.00 23.21 C ATOM 1993 CG TYR A 208 76.920 70.254 11.557 1.00 23.33 C ATOM 1994 CD1 TYR A 208 76.126 69.765 12.586 1.00 25.12 C ATOM 1995 CD2 TYR A 208 78.147 69.644 11.330 1.00 25.82 C ATOM 1996 CE1 TYR A 208 76.524 68.679 13.349 1.00 27.84 C ATOM 1997 CE2 TYR A 208 78.557 68.548 12.092 1.00 29.19 C ATOM 1998 CZ TYR A 208 77.737 68.078 13.096 1.00 27.15 C ATOM 1999 OH TYR A 208 78.134 67.007 13.863 1.00 31.87 O ATOM 2000 HH TYR A 208 78.979 67.231 14.328 1.00 0.00 H ATOM 2001 H TYR A 208 75.823 73.319 9.206 1.00 0.00 H ATOM 2002 N ILE A 209 73.412 71.692 11.120 1.00 21.00 N ATOM 2003 CA ILE A 209 72.180 71.326 11.809 1.00 22.21 C ATOM 2004 C ILE A 209 71.066 71.026 10.808 1.00 25.47 C ATOM 2005 O ILE A 209 70.313 70.059 10.973 1.00 22.39 O ATOM 2006 CB ILE A 209 71.719 72.427 12.782 1.00 23.14 C ATOM 2007 CG1 ILE A 209 72.852 72.781 13.759 1.00 21.61 C ATOM 2008 CG2 ILE A 209 70.469 71.977 13.550 1.00 27.18 C ATOM 2009 CD1 ILE A 209 72.526 73.932 14.671 1.00 22.86 C ATOM 2010 H ILE A 209 73.761 72.670 11.179 1.00 0.00 H ATOM 2011 N LEU A 210 70.967 71.863 9.779 1.00 22.49 N ATOM 2012 CA LEU A 210 69.985 71.683 8.710 1.00 24.72 C ATOM 2013 C LEU A 210 70.002 70.257 8.142 1.00 23.15 C ATOM 2014 O LEU A 210 68.956 69.663 7.896 1.00 23.40 O ATOM 2015 CB LEU A 210 70.241 72.696 7.585 1.00 22.49 C ATOM 2016 CG LEU A 210 69.411 72.596 6.300 1.00 22.74 C ATOM 2017 CD1 LEU A 210 67.935 72.736 6.601 1.00 23.34 C ATOM 2018 CD2 LEU A 210 69.862 73.643 5.277 1.00 23.66 C ATOM 2019 H LEU A 210 71.613 72.677 9.733 1.00 0.00 H ATOM 2020 N LEU A 211 71.192 69.709 7.938 1.00 24.90 N ATOM 2021 CA LEU A 211 71.300 68.394 7.314 1.00 22.47 C ATOM 2022 C LEU A 211 71.147 67.243 8.312 1.00 27.57 C ATOM 2023 O LEU A 211 70.766 66.138 7.929 1.00 29.89 O ATOM 2024 CB LEU A 211 72.639 68.266 6.587 1.00 23.47 C ATOM 2025 CG LEU A 211 72.937 69.256 5.460 1.00 21.98 C ATOM 2026 CD1 LEU A 211 74.300 68.963 4.879 1.00 23.40 C ATOM 2027 CD2 LEU A 211 71.856 69.223 4.370 1.00 24.13 C ATOM 2028 H LEU A 211 72.052 70.218 8.224 1.00 0.00 H ATOM 2029 N SER A 212 71.447 67.485 9.587 1.00 28.20 N ATOM 2030 CA SER A 212 71.546 66.368 10.537 1.00 29.25 C ATOM 2031 C SER A 212 70.607 66.455 11.729 1.00 33.76 C ATOM 2032 O SER A 212 70.301 65.440 12.355 1.00 34.71 O ATOM 2033 CB SER A 212 72.979 66.246 11.049 1.00 28.64 C ATOM 2034 OG SER A 212 73.289 67.291 11.961 1.00 27.58 O ATOM 2035 HG SER A 212 73.189 68.165 11.506 1.00 0.00 H ATOM 2036 H SER A 212 71.610 68.460 9.909 1.00 0.00 H ATOM 2037 N GLY A 213 70.157 67.662 12.056 1.00 30.07 N ATOM 2038 CA GLY A 213 69.366 67.870 13.253 1.00 26.17 C ATOM 2039 C GLY A 213 70.214 67.865 14.518 1.00 30.07 C ATOM 2040 O GLY A 213 69.688 67.988 15.622 1.00 32.06 O ATOM 2041 H GLY A 213 70.376 68.472 11.442 1.00 0.00 H ATOM 2042 N ALA A 214 71.527 67.712 14.359 1.00 28.77 N ATOM 2043 CA ALA A 214 72.458 67.810 15.483 1.00 30.47 C ATOM 2044 C ALA A 214 73.323 69.078 15.395 1.00 29.06 C ATOM 2045 O ALA A 214 73.531 69.635 14.316 1.00 25.82 O ATOM 2046 CB ALA A 214 73.341 66.579 15.553 1.00 31.41 C ATOM 2047 H ALA A 214 71.901 67.517 13.408 1.00 0.00 H ATOM 2048 N SER A 215 73.826 69.511 16.547 1.00 29.49 N ATOM 2049 CA SER A 215 74.598 70.743 16.667 1.00 26.78 C ATOM 2050 C SER A 215 76.084 70.418 16.800 1.00 28.98 C ATOM 2051 O SER A 215 76.461 69.583 17.623 1.00 29.92 O ATOM 2052 CB SER A 215 74.103 71.547 17.869 1.00 29.59 C ATOM 2053 OG SER A 215 74.848 72.743 18.036 1.00 30.75 O ATOM 2054 HG SER A 215 74.503 73.239 18.821 1.00 0.00 H ATOM 2055 H SER A 215 73.661 68.944 17.403 1.00 0.00 H ATOM 2056 N PRO A 216 76.935 71.062 15.981 1.00 26.12 N ATOM 2057 CA PRO A 216 78.328 70.612 15.888 1.00 26.25 C ATOM 2058 C PRO A 216 79.175 70.851 17.145 1.00 26.04 C ATOM 2059 O PRO A 216 79.995 69.991 17.470 1.00 25.02 O ATOM 2060 CB PRO A 216 78.881 71.416 14.704 1.00 24.25 C ATOM 2061 CG PRO A 216 77.988 72.620 14.606 1.00 21.51 C ATOM 2062 CD PRO A 216 76.631 72.151 15.030 1.00 24.48 C ATOM 2063 N PHE A 217 78.984 71.966 17.841 1.00 21.55 N ATOM 2064 CA PHE A 217 79.874 72.293 18.951 1.00 23.90 C ATOM 2065 C PHE A 217 79.212 72.262 20.333 1.00 23.46 C ATOM 2066 O PHE A 217 79.876 72.492 21.347 1.00 23.87 O ATOM 2067 CB PHE A 217 80.507 73.665 18.705 1.00 23.10 C ATOM 2068 CG PHE A 217 81.263 73.744 17.412 1.00 22.32 C ATOM 2069 CD1 PHE A 217 82.492 73.114 17.271 1.00 21.37 C ATOM 2070 CD2 PHE A 217 80.726 74.426 16.320 1.00 23.50 C ATOM 2071 CE1 PHE A 217 83.180 73.176 16.074 1.00 24.37 C ATOM 2072 CE2 PHE A 217 81.408 74.494 15.116 1.00 21.04 C ATOM 2073 CZ PHE A 217 82.634 73.868 14.986 1.00 24.38 C ATOM 2074 H PHE A 217 78.201 72.605 17.595 1.00 0.00 H ATOM 2075 N LEU A 218 77.921 71.961 20.378 1.00 24.42 N ATOM 2076 CA LEU A 218 77.165 72.000 21.631 1.00 22.92 C ATOM 2077 C LEU A 218 77.675 70.979 22.658 1.00 25.37 C ATOM 2078 O LEU A 218 77.567 69.778 22.440 1.00 25.05 O ATOM 2079 CB LEU A 218 75.679 71.746 21.361 1.00 24.44 C ATOM 2080 CG LEU A 218 74.750 71.818 22.574 1.00 29.04 C ATOM 2081 CD1 LEU A 218 74.806 73.211 23.218 1.00 27.58 C ATOM 2082 CD2 LEU A 218 73.326 71.463 22.191 1.00 33.64 C ATOM 2083 H LEU A 218 77.433 71.690 19.500 1.00 0.00 H ATOM 2084 N GLY A 219 78.233 71.471 23.760 1.00 25.09 N ATOM 2085 CA GLY A 219 78.728 70.620 24.829 1.00 27.32 C ATOM 2086 C GLY A 219 77.812 70.608 26.035 1.00 30.06 C ATOM 2087 O GLY A 219 76.676 71.096 25.958 1.00 25.32 O ATOM 2088 H GLY A 219 78.318 72.503 23.861 1.00 0.00 H ATOM 2089 N ASP A 220 78.303 70.064 27.153 1.00 28.16 N ATOM 2090 CA ASP A 220 77.471 69.864 28.340 1.00 32.36 C ATOM 2091 C ASP A 220 77.454 71.065 29.287 1.00 33.10 C ATOM 2092 O ASP A 220 76.646 71.117 30.218 1.00 35.07 O ATOM 2093 CB ASP A 220 77.923 68.611 29.101 1.00 30.72 C ATOM 2094 CG ASP A 220 77.608 67.337 28.353 1.00 32.65 C ATOM 2095 OD1 ASP A 220 76.553 67.288 27.676 1.00 30.30 O ATOM 2096 OD2 ASP A 220 78.421 66.387 28.428 1.00 29.31 O ATOM 2097 H ASP A 220 79.302 69.776 27.180 1.00 0.00 H ATOM 2098 N THR A 221 78.345 72.025 29.054 1.00 31.93 N ATOM 2099 CA THR A 221 78.285 73.321 29.731 1.00 32.45 C ATOM 2100 C THR A 221 78.554 74.416 28.704 1.00 32.33 C ATOM 2101 O THR A 221 79.075 74.130 27.631 1.00 26.61 O ATOM 2102 CB THR A 221 79.325 73.455 30.872 1.00 34.12 C ATOM 2103 OG1 THR A 221 80.650 73.432 30.321 1.00 30.96 O ATOM 2104 CG2 THR A 221 79.176 72.337 31.920 1.00 32.97 C ATOM 2105 HG1 THR A 221 81.312 73.518 31.052 1.00 0.00 H ATOM 2106 H THR A 221 79.108 71.849 28.369 1.00 0.00 H ATOM 2107 N LYS A 222 78.223 75.661 29.043 1.00 33.80 N ATOM 2108 CA LYS A 222 78.550 76.798 28.182 1.00 36.17 C ATOM 2109 C LYS A 222 80.053 76.853 27.893 1.00 32.92 C ATOM 2110 O LYS A 222 80.476 77.004 26.750 1.00 27.44 O ATOM 2111 CB LYS A 222 78.083 78.106 28.824 1.00 32.37 C ATOM 2112 CG LYS A 222 78.577 79.367 28.109 1.00 37.40 C ATOM 2113 CD LYS A 222 78.094 80.633 28.820 1.00 40.00 C ATOM 2114 CE LYS A 222 78.662 81.890 28.183 1.00 42.73 C ATOM 2115 NZ LYS A 222 78.278 83.106 28.948 1.00 47.53 N ATOM 2116 HZ1 LYS A 222 77.241 83.186 28.971 1.00 0.00 H ATOM 2117 HZ2 LYS A 222 78.643 83.033 29.919 1.00 0.00 H ATOM 2118 HZ3 LYS A 222 78.682 83.946 28.487 1.00 0.00 H ATOM 2119 H LYS A 222 77.722 75.828 29.939 1.00 0.00 H ATOM 2120 N GLN A 223 80.864 76.701 28.932 1.00 32.59 N ATOM 2121 CA GLN A 223 82.311 76.779 28.767 1.00 31.08 C ATOM 2122 C GLN A 223 82.846 75.660 27.874 1.00 29.04 C ATOM 2123 O GLN A 223 83.821 75.849 27.149 1.00 29.33 O ATOM 2124 CB GLN A 223 83.016 76.754 30.127 1.00 38.50 C ATOM 2125 CG GLN A 223 82.259 77.488 31.250 1.00 45.03 C ATOM 2126 CD GLN A 223 81.071 76.705 31.809 1.00 41.24 C ATOM 2127 OE1 GLN A 223 81.216 75.550 32.215 1.00 62.04 O ATOM 2128 NE2 GLN A 223 79.897 77.327 31.827 1.00 42.62 N ATOM 2129 HE22 GLN A 223 79.820 78.302 31.474 1.00 0.00 H ATOM 2130 HE21 GLN A 223 79.055 76.839 32.194 1.00 0.00 H ATOM 2131 H GLN A 223 80.463 76.524 29.875 1.00 0.00 H ATOM 2132 N GLU A 224 82.200 74.502 27.908 1.00 30.50 N ATOM 2133 CA GLU A 224 82.640 73.391 27.070 1.00 29.80 C ATOM 2134 C GLU A 224 82.298 73.663 25.598 1.00 27.64 C ATOM 2135 O GLU A 224 83.102 73.405 24.705 1.00 25.60 O ATOM 2136 CB GLU A 224 82.006 72.078 27.539 1.00 28.44 C ATOM 2137 CG GLU A 224 82.549 70.849 26.819 1.00 33.05 C ATOM 2138 CD GLU A 224 82.203 69.553 27.536 1.00 34.77 C ATOM 2139 OE1 GLU A 224 83.136 68.918 28.082 1.00 35.98 O ATOM 2140 OE2 GLU A 224 81.005 69.176 27.555 1.00 31.10 O ATOM 2141 H GLU A 224 81.377 74.385 28.534 1.00 0.00 H ATOM 2142 N THR A 225 81.101 74.189 25.363 1.00 26.44 N ATOM 2143 CA THR A 225 80.698 74.606 24.017 1.00 28.45 C ATOM 2144 C THR A 225 81.714 75.590 23.438 1.00 21.53 C ATOM 2145 O THR A 225 82.223 75.396 22.335 1.00 23.68 O ATOM 2146 CB THR A 225 79.301 75.239 24.034 1.00 25.08 C ATOM 2147 OG1 THR A 225 78.359 74.270 24.506 1.00 25.65 O ATOM 2148 CG2 THR A 225 78.885 75.718 22.630 1.00 23.10 C ATOM 2149 HG1 THR A 225 77.454 74.671 24.520 1.00 0.00 H ATOM 2150 H THR A 225 80.434 74.308 26.152 1.00 0.00 H ATOM 2151 N LEU A 226 82.035 76.618 24.215 1.00 26.17 N ATOM 2152 CA LEU A 226 82.995 77.633 23.794 1.00 23.87 C ATOM 2153 C LEU A 226 84.358 77.035 23.478 1.00 27.20 C ATOM 2154 O LEU A 226 84.988 77.419 22.499 1.00 23.81 O ATOM 2155 CB LEU A 226 83.131 78.713 24.866 1.00 26.48 C ATOM 2156 CG LEU A 226 81.885 79.563 25.119 1.00 25.93 C ATOM 2157 CD1 LEU A 226 82.165 80.622 26.177 1.00 31.47 C ATOM 2158 CD2 LEU A 226 81.419 80.213 23.817 1.00 26.34 C ATOM 2159 H LEU A 226 81.589 76.702 25.151 1.00 0.00 H ATOM 2160 N ALA A 227 84.809 76.083 24.296 1.00 27.09 N ATOM 2161 CA ALA A 227 86.076 75.406 24.042 1.00 23.29 C ATOM 2162 C ALA A 227 86.036 74.595 22.739 1.00 23.01 C ATOM 2163 O ALA A 227 87.008 74.575 21.991 1.00 26.53 O ATOM 2164 CB ALA A 227 86.444 74.494 25.228 1.00 29.28 C ATOM 2165 H ALA A 227 84.247 75.818 25.130 1.00 0.00 H ATOM 2166 N ASN A 228 84.916 73.924 22.482 1.00 25.01 N ATOM 2167 CA ASN A 228 84.721 73.193 21.228 1.00 24.60 C ATOM 2168 C ASN A 228 84.836 74.111 20.019 1.00 21.90 C ATOM 2169 O ASN A 228 85.472 73.777 19.027 1.00 22.95 O ATOM 2170 CB ASN A 228 83.353 72.509 21.204 1.00 23.87 C ATOM 2171 CG ASN A 228 83.285 71.299 22.119 1.00 27.50 C ATOM 2172 OD1 ASN A 228 84.300 70.663 22.407 1.00 27.92 O ATOM 2173 ND2 ASN A 228 82.086 70.971 22.567 1.00 22.59 N ATOM 2174 HD22 ASN A 228 81.257 71.538 22.297 1.00 0.00 H ATOM 2175 HD21 ASN A 228 81.971 70.146 23.190 1.00 0.00 H ATOM 2176 H ASN A 228 84.157 73.919 23.193 1.00 0.00 H ATOM 2177 N VAL A 229 84.187 75.264 20.116 1.00 25.34 N ATOM 2178 CA VAL A 229 84.191 76.240 19.038 1.00 23.75 C ATOM 2179 C VAL A 229 85.618 76.709 18.771 1.00 24.12 C ATOM 2180 O VAL A 229 86.099 76.644 17.639 1.00 25.73 O ATOM 2181 CB VAL A 229 83.282 77.453 19.369 1.00 25.83 C ATOM 2182 CG1 VAL A 229 83.531 78.607 18.383 1.00 22.36 C ATOM 2183 CG2 VAL A 229 81.805 77.037 19.384 1.00 22.34 C ATOM 2184 H VAL A 229 83.661 75.476 20.988 1.00 0.00 H ATOM 2185 N SER A 230 86.297 77.148 19.830 1.00 24.99 N ATOM 2186 CA SER A 230 87.656 77.672 19.712 1.00 26.91 C ATOM 2187 C SER A 230 88.625 76.661 19.091 1.00 28.80 C ATOM 2188 O SER A 230 89.500 77.021 18.305 1.00 32.42 O ATOM 2189 CB SER A 230 88.178 78.105 21.086 1.00 26.71 C ATOM 2190 OG SER A 230 89.437 78.741 20.949 1.00 31.18 O ATOM 2191 HG SER A 230 90.081 78.110 20.540 1.00 0.00 H ATOM 2192 H SER A 230 85.847 77.117 20.767 1.00 0.00 H ATOM 2193 N ALA A 231 88.468 75.393 19.442 1.00 26.69 N ATOM 2194 CA ALA A 231 89.353 74.363 18.909 1.00 30.76 C ATOM 2195 C ALA A 231 88.823 73.738 17.613 1.00 31.28 C ATOM 2196 O ALA A 231 89.450 72.832 17.064 1.00 31.88 O ATOM 2197 CB ALA A 231 89.580 73.283 19.956 1.00 34.29 C ATOM 2198 H ALA A 231 87.709 75.130 20.102 1.00 0.00 H ATOM 2199 N VAL A 232 87.688 74.240 17.123 1.00 27.24 N ATOM 2200 CA VAL A 232 86.996 73.647 15.972 1.00 29.06 C ATOM 2201 C VAL A 232 86.878 72.136 16.173 1.00 29.74 C ATOM 2202 O VAL A 232 87.278 71.344 15.323 1.00 28.61 O ATOM 2203 CB VAL A 232 87.712 73.954 14.630 1.00 30.18 C ATOM 2204 CG1 VAL A 232 86.769 73.701 13.448 1.00 28.39 C ATOM 2205 CG2 VAL A 232 88.199 75.406 14.604 1.00 28.63 C ATOM 2206 H VAL A 232 87.278 75.083 17.573 1.00 0.00 H ATOM 2207 N ASN A 233 86.356 71.753 17.332 1.00 28.85 N ATOM 2208 CA ASN A 233 86.192 70.348 17.680 1.00 29.59 C ATOM 2209 C ASN A 233 84.805 69.857 17.318 1.00 27.83 C ATOM 2210 O ASN A 233 83.853 70.067 18.068 1.00 28.09 O ATOM 2211 CB ASN A 233 86.431 70.122 19.177 1.00 29.44 C ATOM 2212 CG ASN A 233 86.257 68.665 19.573 1.00 36.94 C ATOM 2213 OD1 ASN A 233 86.787 67.769 18.906 1.00 35.32 O ATOM 2214 ND2 ASN A 233 85.489 68.417 20.638 1.00 33.64 N ATOM 2215 HD22 ASN A 233 85.064 69.205 21.168 1.00 0.00 H ATOM 2216 HD21 ASN A 233 85.316 67.436 20.937 1.00 0.00 H ATOM 2217 H ASN A 233 86.055 72.479 18.013 1.00 0.00 H ATOM 2218 N TYR A 234 84.693 69.213 16.165 1.00 30.11 N ATOM 2219 CA TYR A 234 83.416 68.682 15.712 1.00 32.63 C ATOM 2220 C TYR A 234 83.645 67.478 14.818 1.00 28.69 C ATOM 2221 O TYR A 234 84.744 67.267 14.326 1.00 30.68 O ATOM 2222 CB TYR A 234 82.605 69.754 14.968 1.00 29.11 C ATOM 2223 CG TYR A 234 83.017 70.003 13.523 1.00 28.82 C ATOM 2224 CD1 TYR A 234 84.109 70.806 13.214 1.00 28.28 C ATOM 2225 CD2 TYR A 234 82.285 69.457 12.466 1.00 28.93 C ATOM 2226 CE1 TYR A 234 84.477 71.047 11.895 1.00 26.74 C ATOM 2227 CE2 TYR A 234 82.647 69.689 11.140 1.00 28.20 C ATOM 2228 CZ TYR A 234 83.741 70.487 10.865 1.00 27.33 C ATOM 2229 OH TYR A 234 84.103 70.735 9.563 1.00 27.89 O ATOM 2230 HH TYR A 234 84.902 71.320 9.549 1.00 0.00 H ATOM 2231 H TYR A 234 85.537 69.084 15.571 1.00 0.00 H ATOM 2232 N GLU A 235 82.599 66.692 14.615 1.00 31.61 N ATOM 2233 CA GLU A 235 82.698 65.494 13.799 1.00 35.93 C ATOM 2234 C GLU A 235 81.423 65.306 12.998 1.00 31.96 C ATOM 2235 O GLU A 235 80.340 65.675 13.454 1.00 34.20 O ATOM 2236 CB GLU A 235 82.949 64.257 14.678 1.00 37.61 C ATOM 2237 CG GLU A 235 84.353 64.162 15.246 1.00 45.48 C ATOM 2238 CD GLU A 235 85.375 63.757 14.199 1.00 51.63 C ATOM 2239 OE1 GLU A 235 84.971 63.161 13.172 1.00 50.53 O ATOM 2240 OE2 GLU A 235 86.580 64.041 14.400 1.00 58.28 O ATOM 2241 H GLU A 235 81.686 66.938 15.049 1.00 0.00 H ATOM 2242 N PHE A 236 81.547 64.739 11.806 1.00 31.62 N ATOM 2243 CA PHE A 236 80.367 64.275 11.098 1.00 35.38 C ATOM 2244 C PHE A 236 80.041 62.878 11.629 1.00 39.47 C ATOM 2245 O PHE A 236 80.447 61.878 11.040 1.00 39.87 O ATOM 2246 CB PHE A 236 80.594 64.259 9.580 1.00 32.98 C ATOM 2247 CG PHE A 236 80.836 65.629 8.982 1.00 32.03 C ATOM 2248 CD1 PHE A 236 79.824 66.586 8.963 1.00 30.50 C ATOM 2249 CD2 PHE A 236 82.066 65.954 8.439 1.00 30.80 C ATOM 2250 CE1 PHE A 236 80.043 67.849 8.409 1.00 28.37 C ATOM 2251 CE2 PHE A 236 82.295 67.211 7.887 1.00 32.85 C ATOM 2252 CZ PHE A 236 81.278 68.158 7.873 1.00 29.13 C ATOM 2253 H PHE A 236 82.488 64.627 11.378 1.00 0.00 H ATOM 2254 N GLU A 237 79.335 62.814 12.755 1.00 38.42 N ATOM 2255 CA GLU A 237 78.993 61.532 13.373 1.00 43.70 C ATOM 2256 C GLU A 237 78.201 60.615 12.423 1.00 42.75 C ATOM 2257 O GLU A 237 77.138 60.993 11.929 1.00 38.19 O ATOM 2258 CB GLU A 237 78.198 61.758 14.672 1.00 44.06 C ATOM 2259 CG GLU A 237 78.909 62.590 15.751 1.00 42.93 C ATOM 2260 CD GLU A 237 80.009 61.829 16.492 1.00 47.52 C ATOM 2261 OE1 GLU A 237 80.327 60.682 16.101 1.00 46.56 O ATOM 2262 OE2 GLU A 237 80.558 62.384 17.479 1.00 46.91 O ATOM 2263 H GLU A 237 79.019 63.696 13.207 1.00 0.00 H ATOM 2264 N ASP A 238 78.719 59.414 12.168 1.00 43.50 N ATOM 2265 CA ASP A 238 78.048 58.465 11.268 1.00 43.28 C ATOM 2266 C ASP A 238 76.556 58.290 11.580 1.00 42.61 C ATOM 2267 O ASP A 238 75.743 58.041 10.681 1.00 42.48 O ATOM 2268 CB ASP A 238 78.722 57.102 11.332 1.00 51.69 C ATOM 2269 CG ASP A 238 79.798 56.936 10.292 1.00 59.67 C ATOM 2270 OD1 ASP A 238 79.570 57.337 9.126 1.00 61.77 O ATOM 2271 OD2 ASP A 238 80.876 56.427 10.662 1.00 62.10 O ATOM 2272 H ASP A 238 79.618 59.142 12.615 1.00 0.00 H ATOM 2273 N GLU A 239 76.196 58.411 12.854 1.00 38.87 N ATOM 2274 CA GLU A 239 74.800 58.267 13.252 1.00 42.37 C ATOM 2275 C GLU A 239 73.926 59.299 12.546 1.00 42.33 C ATOM 2276 O GLU A 239 72.778 59.015 12.202 1.00 39.59 O ATOM 2277 CB GLU A 239 74.654 58.400 14.768 1.00 45.32 C ATOM 2278 CG GLU A 239 73.215 58.281 15.296 1.00 45.94 C ATOM 2279 CD GLU A 239 73.165 58.223 16.818 1.00 52.85 C ATOM 2280 OE1 GLU A 239 74.247 58.224 17.438 1.00 54.51 O ATOM 2281 OE2 GLU A 239 72.058 58.187 17.402 1.00 54.69 O ATOM 2282 H GLU A 239 76.918 58.611 13.575 1.00 0.00 H ATOM 2283 N TYR A 240 74.483 60.485 12.308 1.00 39.38 N ATOM 2284 CA TYR A 240 73.698 61.607 11.798 1.00 39.40 C ATOM 2285 C TYR A 240 74.010 61.965 10.344 1.00 38.71 C ATOM 2286 O TYR A 240 73.194 62.584 9.664 1.00 39.96 O ATOM 2287 CB TYR A 240 73.913 62.839 12.685 1.00 41.29 C ATOM 2288 CG TYR A 240 73.400 62.681 14.097 1.00 39.37 C ATOM 2289 CD1 TYR A 240 72.065 62.919 14.400 1.00 41.08 C ATOM 2290 CD2 TYR A 240 74.250 62.296 15.129 1.00 43.04 C ATOM 2291 CE1 TYR A 240 71.586 62.777 15.695 1.00 43.97 C ATOM 2292 CE2 TYR A 240 73.780 62.151 16.429 1.00 45.11 C ATOM 2293 CZ TYR A 240 72.447 62.393 16.703 1.00 47.93 C ATOM 2294 OH TYR A 240 71.969 62.248 17.986 1.00 51.36 O ATOM 2295 HH TYR A 240 71.002 62.459 18.002 1.00 0.00 H ATOM 2296 H TYR A 240 75.499 60.615 12.489 1.00 0.00 H ATOM 2297 N PHE A 241 75.182 61.568 9.865 1.00 36.50 N ATOM 2298 CA PHE A 241 75.625 61.990 8.544 1.00 36.71 C ATOM 2299 C PHE A 241 75.831 60.844 7.557 1.00 40.30 C ATOM 2300 O PHE A 241 76.510 61.017 6.543 1.00 37.25 O ATOM 2301 CB PHE A 241 76.915 62.809 8.676 1.00 36.80 C ATOM 2302 CG PHE A 241 76.689 64.173 9.269 1.00 35.90 C ATOM 2303 CD1 PHE A 241 76.349 65.248 8.457 1.00 34.42 C ATOM 2304 CD2 PHE A 241 76.775 64.372 10.638 1.00 33.26 C ATOM 2305 CE1 PHE A 241 76.109 66.511 9.008 1.00 28.46 C ATOM 2306 CE2 PHE A 241 76.539 65.627 11.193 1.00 32.26 C ATOM 2307 CZ PHE A 241 76.217 66.698 10.374 1.00 30.40 C ATOM 2308 H PHE A 241 75.790 60.949 10.439 1.00 0.00 H ATOM 2309 N SER A 242 75.223 59.692 7.834 1.00 40.20 N ATOM 2310 CA SER A 242 75.446 58.505 7.006 1.00 46.47 C ATOM 2311 C SER A 242 74.961 58.693 5.566 1.00 42.85 C ATOM 2312 O SER A 242 75.548 58.142 4.635 1.00 44.68 O ATOM 2313 CB SER A 242 74.774 57.275 7.631 1.00 41.77 C ATOM 2314 OG SER A 242 73.374 57.452 7.775 1.00 48.69 O ATOM 2315 HG SER A 242 73.200 58.232 8.360 1.00 0.00 H ATOM 2316 H SER A 242 74.581 59.635 8.650 1.00 0.00 H ATOM 2317 N ASN A 243 73.904 59.484 5.390 1.00 41.82 N ATOM 2318 CA ASN A 243 73.326 59.732 4.071 1.00 42.38 C ATOM 2319 C ASN A 243 73.728 61.074 3.453 1.00 41.29 C ATOM 2320 O ASN A 243 73.100 61.532 2.497 1.00 42.93 O ATOM 2321 CB ASN A 243 71.798 59.670 4.150 1.00 42.50 C ATOM 2322 CG ASN A 243 71.294 58.368 4.740 1.00 50.36 C ATOM 2323 OD1 ASN A 243 71.755 57.289 4.368 1.00 52.13 O ATOM 2324 ND2 ASN A 243 70.343 58.462 5.669 1.00 46.56 N ATOM 2325 HD22 ASN A 243 69.983 59.396 5.952 1.00 0.00 H ATOM 2326 HD21 ASN A 243 69.961 57.602 6.111 1.00 0.00 H ATOM 2327 H ASN A 243 73.475 59.941 6.220 1.00 0.00 H ATOM 2328 N THR A 244 74.760 61.708 3.998 1.00 37.82 N ATOM 2329 CA THR A 244 75.150 63.041 3.548 1.00 35.34 C ATOM 2330 C THR A 244 76.277 62.983 2.518 1.00 33.97 C ATOM 2331 O THR A 244 77.254 62.257 2.697 1.00 35.60 O ATOM 2332 CB THR A 244 75.577 63.923 4.748 1.00 36.13 C ATOM 2333 OG1 THR A 244 74.541 63.905 5.737 1.00 34.70 O ATOM 2334 CG2 THR A 244 75.803 65.359 4.308 1.00 28.54 C ATOM 2335 HG1 THR A 244 73.705 64.260 5.344 1.00 0.00 H ATOM 2336 H THR A 244 75.299 61.247 4.758 1.00 0.00 H ATOM 2337 N SER A 245 76.144 63.756 1.441 1.00 32.99 N ATOM 2338 CA SER A 245 77.116 63.720 0.341 1.00 32.14 C ATOM 2339 C SER A 245 78.474 64.282 0.727 1.00 32.95 C ATOM 2340 O SER A 245 78.586 65.080 1.660 1.00 29.12 O ATOM 2341 CB SER A 245 76.591 64.495 -0.872 1.00 32.87 C ATOM 2342 OG SER A 245 76.598 65.894 -0.620 1.00 29.91 O ATOM 2343 HG SER A 245 76.020 66.091 0.159 1.00 0.00 H ATOM 2344 H SER A 245 75.331 64.401 1.378 1.00 0.00 H ATOM 2345 N ALA A 246 79.499 63.879 -0.020 1.00 28.94 N ATOM 2346 CA ALA A 246 80.848 64.396 0.164 1.00 30.99 C ATOM 2347 C ALA A 246 80.921 65.901 -0.092 1.00 29.42 C ATOM 2348 O ALA A 246 81.686 66.604 0.560 1.00 29.19 O ATOM 2349 CB ALA A 246 81.816 63.672 -0.752 1.00 31.06 C ATOM 2350 H ALA A 246 79.331 63.170 -0.762 1.00 0.00 H ATOM 2351 N LEU A 247 80.141 66.385 -1.058 1.00 30.21 N ATOM 2352 CA LEU A 247 80.123 67.812 -1.381 1.00 28.48 C ATOM 2353 C LEU A 247 79.482 68.636 -0.260 1.00 25.48 C ATOM 2354 O LEU A 247 79.929 69.748 0.031 1.00 27.22 O ATOM 2355 CB LEU A 247 79.390 68.061 -2.702 1.00 29.37 C ATOM 2356 CG LEU A 247 80.189 67.862 -3.995 1.00 31.98 C ATOM 2357 CD1 LEU A 247 79.299 67.972 -5.231 1.00 30.23 C ATOM 2358 CD2 LEU A 247 81.324 68.864 -4.065 1.00 32.81 C ATOM 2359 H LEU A 247 79.532 65.734 -1.594 1.00 0.00 H ATOM 2360 N ALA A 248 78.440 68.097 0.365 1.00 24.86 N ATOM 2361 CA ALA A 248 77.807 68.789 1.486 1.00 26.57 C ATOM 2362 C ALA A 248 78.802 68.921 2.640 1.00 28.26 C ATOM 2363 O ALA A 248 78.906 69.978 3.261 1.00 22.11 O ATOM 2364 CB ALA A 248 76.551 68.063 1.936 1.00 26.13 C ATOM 2365 H ALA A 248 78.072 67.175 0.054 1.00 0.00 H ATOM 2366 N LYS A 249 79.554 67.854 2.912 1.00 27.27 N ATOM 2367 CA LYS A 249 80.562 67.904 3.974 1.00 26.81 C ATOM 2368 C LYS A 249 81.692 68.872 3.638 1.00 26.10 C ATOM 2369 O LYS A 249 82.219 69.555 4.519 1.00 26.21 O ATOM 2370 CB LYS A 249 81.148 66.512 4.241 1.00 31.56 C ATOM 2371 CG LYS A 249 80.185 65.528 4.867 1.00 30.44 C ATOM 2372 CD LYS A 249 80.909 64.222 5.169 1.00 36.74 C ATOM 2373 CE LYS A 249 79.935 63.099 5.441 1.00 40.62 C ATOM 2374 NZ LYS A 249 80.653 61.804 5.613 1.00 46.03 N ATOM 2375 HZ1 LYS A 249 81.183 61.585 4.746 1.00 0.00 H ATOM 2376 HZ2 LYS A 249 81.312 61.878 6.414 1.00 0.00 H ATOM 2377 HZ3 LYS A 249 79.963 61.048 5.799 1.00 0.00 H ATOM 2378 H LYS A 249 79.424 66.979 2.366 1.00 0.00 H ATOM 2379 N ASP A 250 82.073 68.919 2.363 1.00 26.46 N ATOM 2380 CA ASP A 250 83.133 69.823 1.927 1.00 27.84 C ATOM 2381 C ASP A 250 82.721 71.294 2.106 1.00 26.11 C ATOM 2382 O ASP A 250 83.529 72.126 2.521 1.00 22.85 O ATOM 2383 CB ASP A 250 83.509 69.555 0.465 1.00 24.47 C ATOM 2384 CG ASP A 250 84.657 70.423 -0.001 1.00 31.89 C ATOM 2385 OD1 ASP A 250 85.804 70.125 0.373 1.00 34.55 O ATOM 2386 OD2 ASP A 250 84.420 71.415 -0.718 1.00 29.83 O ATOM 2387 H ASP A 250 81.608 68.302 1.667 1.00 0.00 H ATOM 2388 N PHE A 251 81.465 71.594 1.776 1.00 23.99 N ATOM 2389 CA PHE A 251 80.883 72.930 1.972 1.00 24.92 C ATOM 2390 C PHE A 251 81.001 73.355 3.439 1.00 20.86 C ATOM 2391 O PHE A 251 81.515 74.438 3.762 1.00 19.57 O ATOM 2392 CB PHE A 251 79.415 72.922 1.510 1.00 21.18 C ATOM 2393 CG PHE A 251 78.726 74.269 1.587 1.00 24.11 C ATOM 2394 CD1 PHE A 251 78.844 75.187 0.551 1.00 21.34 C ATOM 2395 CD2 PHE A 251 77.930 74.595 2.677 1.00 21.84 C ATOM 2396 CE1 PHE A 251 78.202 76.423 0.608 1.00 22.06 C ATOM 2397 CE2 PHE A 251 77.281 75.833 2.742 1.00 21.84 C ATOM 2398 CZ PHE A 251 77.424 76.746 1.706 1.00 19.94 C ATOM 2399 H PHE A 251 80.869 70.849 1.361 1.00 0.00 H ATOM 2400 N ILE A 252 80.535 72.489 4.326 1.00 19.35 N ATOM 2401 CA ILE A 252 80.620 72.759 5.755 1.00 20.83 C ATOM 2402 C ILE A 252 82.064 72.928 6.222 1.00 23.77 C ATOM 2403 O ILE A 252 82.369 73.895 6.930 1.00 21.11 O ATOM 2404 CB ILE A 252 79.926 71.658 6.572 1.00 19.94 C ATOM 2405 CG1 ILE A 252 78.414 71.706 6.298 1.00 21.95 C ATOM 2406 CG2 ILE A 252 80.212 71.843 8.068 1.00 19.26 C ATOM 2407 CD1 ILE A 252 77.614 70.519 6.859 1.00 21.66 C ATOM 2408 H ILE A 252 80.102 71.603 3.997 1.00 0.00 H ATOM 2409 N ARG A 253 82.953 72.018 5.809 1.00 22.94 N ATOM 2410 CA ARG A 253 84.373 72.091 6.202 1.00 23.97 C ATOM 2411 C ARG A 253 85.042 73.395 5.787 1.00 23.88 C ATOM 2412 O ARG A 253 85.908 73.905 6.494 1.00 23.97 O ATOM 2413 CB ARG A 253 85.169 70.912 5.612 1.00 28.17 C ATOM 2414 CG ARG A 253 85.096 69.633 6.444 1.00 31.74 C ATOM 2415 CD ARG A 253 86.128 68.590 5.991 1.00 39.03 C ATOM 2416 NE ARG A 253 85.573 67.684 4.993 1.00 44.98 N ATOM 2417 CZ ARG A 253 85.125 66.464 5.266 1.00 43.28 C ATOM 2418 NH1 ARG A 253 85.183 66.000 6.506 1.00 47.94 N ATOM 2419 NH2 ARG A 253 84.628 65.704 4.301 1.00 47.44 N ATOM 2420 HE ARG A 253 85.525 68.013 4.008 1.00 0.00 H ATOM 2421 HH12 ARG A 253 84.832 65.045 6.721 1.00 0.00 H ATOM 2422 HH11 ARG A 253 85.579 66.591 7.264 1.00 0.00 H ATOM 2423 HH22 ARG A 253 84.278 64.749 4.519 1.00 0.00 H ATOM 2424 HH21 ARG A 253 84.588 66.062 3.326 1.00 0.00 H ATOM 2425 H ARG A 253 82.635 71.240 5.196 1.00 0.00 H ATOM 2426 N ARG A 254 84.646 73.934 4.639 1.00 22.68 N ATOM 2427 CA ARG A 254 85.233 75.181 4.152 1.00 23.47 C ATOM 2428 C ARG A 254 84.712 76.412 4.918 1.00 21.58 C ATOM 2429 O ARG A 254 85.286 77.502 4.814 1.00 22.28 O ATOM 2430 CB ARG A 254 84.976 75.333 2.646 1.00 23.29 C ATOM 2431 CG ARG A 254 85.835 74.378 1.793 1.00 27.65 C ATOM 2432 CD ARG A 254 85.592 74.557 0.303 1.00 34.17 C ATOM 2433 NE ARG A 254 86.375 73.620 -0.505 1.00 34.07 N ATOM 2434 CZ ARG A 254 87.618 73.845 -0.931 1.00 41.46 C ATOM 2435 NH1 ARG A 254 88.241 74.978 -0.621 1.00 38.58 N ATOM 2436 NH2 ARG A 254 88.246 72.928 -1.661 1.00 41.51 N ATOM 2437 HE ARG A 254 85.931 72.716 -0.765 1.00 0.00 H ATOM 2438 HH12 ARG A 254 89.211 75.147 -0.957 1.00 0.00 H ATOM 2439 HH11 ARG A 254 87.759 75.695 -0.043 1.00 0.00 H ATOM 2440 HH22 ARG A 254 89.216 73.103 -1.994 1.00 0.00 H ATOM 2441 HH21 ARG A 254 87.767 72.036 -1.899 1.00 0.00 H ATOM 2442 H ARG A 254 83.908 73.462 4.079 1.00 0.00 H ATOM 2443 N LEU A 255 83.648 76.228 5.698 1.00 21.76 N ATOM 2444 CA LEU A 255 83.091 77.310 6.525 1.00 21.53 C ATOM 2445 C LEU A 255 83.548 77.234 7.980 1.00 20.35 C ATOM 2446 O LEU A 255 83.786 78.261 8.614 1.00 18.27 O ATOM 2447 CB LEU A 255 81.554 77.288 6.474 1.00 19.25 C ATOM 2448 CG LEU A 255 80.981 77.611 5.099 1.00 16.29 C ATOM 2449 CD1 LEU A 255 79.495 77.303 5.028 1.00 21.25 C ATOM 2450 CD2 LEU A 255 81.253 79.076 4.753 1.00 18.40 C ATOM 2451 H LEU A 255 83.197 75.291 5.723 1.00 0.00 H ATOM 2452 N LEU A 256 83.662 76.021 8.517 1.00 21.68 N ATOM 2453 CA LEU A 256 84.072 75.859 9.907 1.00 19.17 C ATOM 2454 C LEU A 256 85.603 75.816 9.958 1.00 25.15 C ATOM 2455 O LEU A 256 86.218 74.776 10.210 1.00 24.13 O ATOM 2456 CB LEU A 256 83.435 74.609 10.534 1.00 21.20 C ATOM 2457 CG LEU A 256 81.889 74.633 10.565 1.00 21.42 C ATOM 2458 CD1 LEU A 256 81.300 73.392 11.231 1.00 21.32 C ATOM 2459 CD2 LEU A 256 81.343 75.903 11.234 1.00 16.96 C ATOM 2460 H LEU A 256 83.457 75.181 7.939 1.00 0.00 H ATOM 2461 N VAL A 257 86.180 76.987 9.714 1.00 22.37 N ATOM 2462 CA VAL A 257 87.611 77.217 9.591 1.00 23.44 C ATOM 2463 C VAL A 257 87.994 78.303 10.581 1.00 24.15 C ATOM 2464 O VAL A 257 87.430 79.387 10.541 1.00 21.86 O ATOM 2465 CB VAL A 257 87.978 77.654 8.151 1.00 23.88 C ATOM 2466 CG1 VAL A 257 89.448 78.104 8.057 1.00 25.67 C ATOM 2467 CG2 VAL A 257 87.682 76.537 7.178 1.00 23.94 C ATOM 2468 H VAL A 257 85.555 77.810 9.601 1.00 0.00 H ATOM 2469 N LYS A 258 88.941 78.016 11.471 1.00 23.13 N ATOM 2470 CA LYS A 258 89.246 78.929 12.574 1.00 25.37 C ATOM 2471 C LYS A 258 89.776 80.282 12.101 1.00 25.50 C ATOM 2472 O LYS A 258 89.340 81.326 12.588 1.00 26.55 O ATOM 2473 CB LYS A 258 90.249 78.289 13.536 1.00 28.12 C ATOM 2474 CG LYS A 258 90.491 79.125 14.780 1.00 27.61 C ATOM 2475 CD LYS A 258 91.345 78.401 15.790 1.00 31.29 C ATOM 2476 CE LYS A 258 91.558 79.270 17.037 1.00 33.22 C ATOM 2477 NZ LYS A 258 91.893 78.438 18.218 1.00 36.75 N ATOM 2478 HZ1 LYS A 258 91.115 77.773 18.404 1.00 0.00 H ATOM 2479 HZ2 LYS A 258 92.767 77.907 18.029 1.00 0.00 H ATOM 2480 HZ3 LYS A 258 92.031 79.053 19.046 1.00 0.00 H ATOM 2481 H LYS A 258 89.474 77.127 11.381 1.00 0.00 H ATOM 2482 N ASP A 259 90.706 80.258 11.151 1.00 25.52 N ATOM 2483 CA ASP A 259 91.282 81.478 10.586 1.00 28.93 C ATOM 2484 C ASP A 259 90.266 82.142 9.657 1.00 22.87 C ATOM 2485 O ASP A 259 89.934 81.589 8.611 1.00 24.23 O ATOM 2486 CB ASP A 259 92.576 81.151 9.831 1.00 29.81 C ATOM 2487 CG ASP A 259 93.304 82.393 9.315 1.00 36.53 C ATOM 2488 OD1 ASP A 259 92.771 83.522 9.419 1.00 32.15 O ATOM 2489 OD2 ASP A 259 94.428 82.230 8.791 1.00 33.97 O ATOM 2490 H ASP A 259 91.036 79.338 10.797 1.00 0.00 H ATOM 2491 N PRO A 260 89.777 83.331 10.036 1.00 24.41 N ATOM 2492 CA PRO A 260 88.730 83.994 9.246 1.00 25.57 C ATOM 2493 C PRO A 260 89.178 84.292 7.824 1.00 27.59 C ATOM 2494 O PRO A 260 88.338 84.349 6.927 1.00 26.97 O ATOM 2495 CB PRO A 260 88.473 85.304 10.010 1.00 27.16 C ATOM 2496 CG PRO A 260 89.079 85.097 11.366 1.00 28.76 C ATOM 2497 CD PRO A 260 90.216 84.155 11.179 1.00 26.50 C ATOM 2498 N LYS A 261 90.479 84.482 7.625 1.00 28.63 N ATOM 2499 CA LYS A 261 91.005 84.832 6.308 1.00 28.11 C ATOM 2500 C LYS A 261 91.090 83.624 5.379 1.00 26.72 C ATOM 2501 O LYS A 261 91.261 83.779 4.173 1.00 28.29 O ATOM 2502 CB LYS A 261 92.388 85.487 6.434 1.00 36.13 C ATOM 2503 CG LYS A 261 92.393 86.826 7.174 1.00 37.46 C ATOM 2504 CD LYS A 261 93.801 87.413 7.209 1.00 52.45 C ATOM 2505 CE LYS A 261 93.805 88.873 7.648 1.00 53.57 C ATOM 2506 NZ LYS A 261 95.138 89.509 7.422 1.00 55.76 N ATOM 2507 HZ1 LYS A 261 95.861 88.999 7.968 1.00 0.00 H ATOM 2508 HZ2 LYS A 261 95.373 89.468 6.410 1.00 0.00 H ATOM 2509 HZ3 LYS A 261 95.104 90.501 7.732 1.00 0.00 H ATOM 2510 H LYS A 261 91.136 84.379 8.424 1.00 0.00 H ATOM 2511 N LYS A 262 90.974 82.422 5.932 1.00 24.88 N ATOM 2512 CA LYS A 262 90.981 81.223 5.102 1.00 25.73 C ATOM 2513 C LYS A 262 89.576 80.631 4.940 1.00 25.56 C ATOM 2514 O LYS A 262 89.373 79.675 4.190 1.00 25.46 O ATOM 2515 CB LYS A 262 91.938 80.186 5.695 1.00 28.99 C ATOM 2516 CG LYS A 262 93.401 80.624 5.650 1.00 31.72 C ATOM 2517 CD LYS A 262 94.300 79.610 6.339 1.00 40.44 C ATOM 2518 H LYS A 262 90.878 82.335 6.964 1.00 0.00 H ATOM 2519 N ARG A 263 88.619 81.210 5.662 1.00 22.02 N ATOM 2520 CA ARG A 263 87.220 80.787 5.622 1.00 22.43 C ATOM 2521 C ARG A 263 86.588 81.155 4.269 1.00 21.09 C ATOM 2522 O ARG A 263 86.902 82.197 3.697 1.00 20.92 O ATOM 2523 CB ARG A 263 86.458 81.445 6.791 1.00 22.42 C ATOM 2524 CG ARG A 263 85.131 80.822 7.165 1.00 18.75 C ATOM 2525 CD ARG A 263 84.570 81.481 8.432 1.00 18.65 C ATOM 2526 NE ARG A 263 85.484 81.305 9.563 1.00 20.22 N ATOM 2527 CZ ARG A 263 85.568 82.120 10.612 1.00 20.80 C ATOM 2528 NH1 ARG A 263 84.785 83.195 10.698 1.00 20.89 N ATOM 2529 NH2 ARG A 263 86.444 81.864 11.581 1.00 21.35 N ATOM 2530 HE ARG A 263 86.116 80.479 9.545 1.00 0.00 H ATOM 2531 HH12 ARG A 263 84.857 83.826 11.521 1.00 0.00 H ATOM 2532 HH11 ARG A 263 84.102 83.402 9.942 1.00 0.00 H ATOM 2533 HH22 ARG A 263 86.512 82.499 12.402 1.00 0.00 H ATOM 2534 HH21 ARG A 263 87.061 81.029 11.517 1.00 0.00 H ATOM 2535 H ARG A 263 88.879 82.001 6.285 1.00 0.00 H ATOM 2536 N MET A 264 85.732 80.286 3.742 1.00 20.11 N ATOM 2537 CA MET A 264 85.014 80.588 2.507 1.00 19.15 C ATOM 2538 C MET A 264 84.155 81.851 2.682 1.00 21.29 C ATOM 2539 O MET A 264 83.489 82.009 3.700 1.00 20.74 O ATOM 2540 CB MET A 264 84.150 79.394 2.092 1.00 21.99 C ATOM 2541 CG MET A 264 83.443 79.529 0.753 1.00 23.07 C ATOM 2542 SD MET A 264 83.023 77.900 0.075 1.00 24.27 S ATOM 2543 CE MET A 264 81.839 77.300 1.283 1.00 22.55 C ATOM 2544 H MET A 264 85.571 79.375 4.217 1.00 0.00 H ATOM 2545 N THR A 265 84.198 82.751 1.698 1.00 23.06 N ATOM 2546 CA THR A 265 83.388 83.977 1.715 1.00 19.51 C ATOM 2547 C THR A 265 81.957 83.708 1.198 1.00 18.43 C ATOM 2548 O THR A 265 81.691 82.654 0.636 1.00 15.60 O ATOM 2549 CB THR A 265 84.019 85.072 0.856 1.00 21.48 C ATOM 2550 OG1 THR A 265 83.965 84.679 -0.523 1.00 21.39 O ATOM 2551 CG2 THR A 265 85.482 85.326 1.276 1.00 19.09 C ATOM 2552 HG1 THR A 265 84.373 85.386 -1.083 1.00 0.00 H ATOM 2553 H THR A 265 84.828 82.578 0.889 1.00 0.00 H ATOM 2554 N ILE A 266 81.041 84.656 1.385 1.00 16.09 N ATOM 2555 CA ILE A 266 79.684 84.451 0.885 1.00 15.55 C ATOM 2556 C ILE A 266 79.702 84.343 -0.646 1.00 20.43 C ATOM 2557 O ILE A 266 78.992 83.516 -1.222 1.00 16.34 O ATOM 2558 CB ILE A 266 78.709 85.573 1.345 1.00 16.61 C ATOM 2559 CG1 ILE A 266 77.263 85.224 0.970 1.00 15.99 C ATOM 2560 CG2 ILE A 266 79.128 86.947 0.799 1.00 15.52 C ATOM 2561 CD1 ILE A 266 76.670 84.015 1.727 1.00 15.91 C ATOM 2562 H ILE A 266 81.290 85.535 1.883 1.00 0.00 H ATOM 2563 N GLN A 267 80.553 85.132 -1.300 1.00 19.80 N ATOM 2564 CA GLN A 267 80.596 85.127 -2.761 1.00 20.95 C ATOM 2565 C GLN A 267 81.058 83.760 -3.262 1.00 22.77 C ATOM 2566 O GLN A 267 80.517 83.218 -4.215 1.00 23.62 O ATOM 2567 CB GLN A 267 81.524 86.238 -3.275 1.00 24.86 C ATOM 2568 CG GLN A 267 81.403 86.525 -4.748 1.00 30.58 C ATOM 2569 CD GLN A 267 82.250 87.714 -5.187 1.00 33.39 C ATOM 2570 OE1 GLN A 267 83.197 88.116 -4.504 1.00 38.69 O ATOM 2571 NE2 GLN A 267 81.903 88.286 -6.322 1.00 27.83 N ATOM 2572 HE22 GLN A 267 81.098 87.915 -6.866 1.00 0.00 H ATOM 2573 HE21 GLN A 267 82.434 89.108 -6.673 1.00 0.00 H ATOM 2574 H GLN A 267 81.192 85.756 -0.767 1.00 0.00 H ATOM 2575 N ASP A 268 82.046 83.188 -2.590 1.00 21.27 N ATOM 2576 CA ASP A 268 82.535 81.884 -2.982 1.00 23.07 C ATOM 2577 C ASP A 268 81.578 80.758 -2.615 1.00 25.33 C ATOM 2578 O ASP A 268 81.536 79.743 -3.305 1.00 24.19 O ATOM 2579 CB ASP A 268 83.903 81.628 -2.362 1.00 24.15 C ATOM 2580 CG ASP A 268 85.001 82.381 -3.076 1.00 26.11 C ATOM 2581 OD1 ASP A 268 84.760 82.863 -4.205 1.00 31.22 O ATOM 2582 OD2 ASP A 268 86.096 82.501 -2.506 1.00 30.74 O ATOM 2583 H ASP A 268 82.472 83.678 -1.778 1.00 0.00 H ATOM 2584 N SER A 269 80.815 80.925 -1.538 1.00 19.08 N ATOM 2585 CA SER A 269 79.903 79.865 -1.125 1.00 18.93 C ATOM 2586 C SER A 269 78.843 79.656 -2.203 1.00 21.73 C ATOM 2587 O SER A 269 78.408 78.532 -2.439 1.00 22.33 O ATOM 2588 CB SER A 269 79.243 80.187 0.229 1.00 20.56 C ATOM 2589 OG SER A 269 78.254 81.200 0.101 1.00 19.77 O ATOM 2590 HG SER A 269 78.673 82.026 -0.248 1.00 0.00 H ATOM 2591 H SER A 269 80.869 81.809 -0.992 1.00 0.00 H ATOM 2592 N LEU A 270 78.442 80.739 -2.869 1.00 21.72 N ATOM 2593 CA LEU A 270 77.427 80.651 -3.920 1.00 22.17 C ATOM 2594 C LEU A 270 77.955 79.995 -5.214 1.00 24.73 C ATOM 2595 O LEU A 270 77.173 79.597 -6.080 1.00 28.58 O ATOM 2596 CB LEU A 270 76.867 82.046 -4.224 1.00 23.58 C ATOM 2597 CG LEU A 270 75.933 82.623 -3.158 1.00 23.70 C ATOM 2598 CD1 LEU A 270 75.654 84.102 -3.425 1.00 25.99 C ATOM 2599 CD2 LEU A 270 74.643 81.820 -3.153 1.00 24.01 C ATOM 2600 H LEU A 270 78.858 81.664 -2.638 1.00 0.00 H ATOM 2601 N GLN A 271 79.277 79.883 -5.335 1.00 25.98 N ATOM 2602 CA GLN A 271 79.905 79.229 -6.488 1.00 27.77 C ATOM 2603 C GLN A 271 80.358 77.797 -6.173 1.00 29.11 C ATOM 2604 O GLN A 271 80.808 77.070 -7.063 1.00 30.36 O ATOM 2605 CB GLN A 271 81.106 80.047 -6.979 1.00 25.32 C ATOM 2606 CG GLN A 271 80.776 81.480 -7.341 1.00 29.68 C ATOM 2607 CD GLN A 271 79.776 81.575 -8.478 1.00 40.16 C ATOM 2608 OE1 GLN A 271 79.842 80.807 -9.438 1.00 42.24 O ATOM 2609 NE2 GLN A 271 78.833 82.509 -8.369 1.00 40.76 N ATOM 2610 HE22 GLN A 271 78.816 83.136 -7.540 1.00 0.00 H ATOM 2611 HE21 GLN A 271 78.114 82.611 -9.113 1.00 0.00 H ATOM 2612 H GLN A 271 79.885 80.273 -4.586 1.00 0.00 H ATOM 2613 N HIS A 272 80.255 77.397 -4.908 1.00 24.34 N ATOM 2614 CA HIS A 272 80.621 76.036 -4.499 1.00 25.90 C ATOM 2615 C HIS A 272 79.744 75.009 -5.223 1.00 27.74 C ATOM 2616 O HIS A 272 78.537 75.193 -5.334 1.00 26.74 O ATOM 2617 CB HIS A 272 80.493 75.890 -2.981 1.00 25.72 C ATOM 2618 CG HIS A 272 81.054 74.617 -2.436 1.00 24.61 C ATOM 2619 ND1 HIS A 272 80.377 73.414 -2.500 1.00 25.24 N ATOM 2620 CD2 HIS A 272 82.214 74.355 -1.787 1.00 24.52 C ATOM 2621 CE1 HIS A 272 81.100 72.474 -1.926 1.00 25.71 C ATOM 2622 NE2 HIS A 272 82.223 73.018 -1.483 1.00 25.53 N ATOM 2623 H HIS A 272 79.907 78.065 -4.192 1.00 0.00 H ATOM 2624 N PRO A 273 80.358 73.926 -5.731 1.00 30.29 N ATOM 2625 CA PRO A 273 79.639 72.915 -6.524 1.00 29.62 C ATOM 2626 C PRO A 273 78.401 72.309 -5.837 1.00 32.11 C ATOM 2627 O PRO A 273 77.493 71.869 -6.538 1.00 32.63 O ATOM 2628 CB PRO A 273 80.709 71.837 -6.783 1.00 27.26 C ATOM 2629 CG PRO A 273 81.881 72.191 -5.915 1.00 32.18 C ATOM 2630 CD PRO A 273 81.805 73.670 -5.692 1.00 27.36 C ATOM 2631 N TRP A 274 78.345 72.306 -4.507 1.00 27.63 N ATOM 2632 CA TRP A 274 77.163 71.800 -3.805 1.00 26.61 C ATOM 2633 C TRP A 274 75.958 72.709 -4.038 1.00 28.25 C ATOM 2634 O TRP A 274 74.808 72.255 -4.067 1.00 26.31 O ATOM 2635 CB TRP A 274 77.446 71.673 -2.302 1.00 25.74 C ATOM 2636 CG TRP A 274 76.390 70.927 -1.537 1.00 26.75 C ATOM 2637 CD1 TRP A 274 75.917 69.676 -1.809 1.00 28.36 C ATOM 2638 CD2 TRP A 274 75.701 71.368 -0.360 1.00 26.11 C ATOM 2639 NE1 TRP A 274 74.965 69.318 -0.887 1.00 28.73 N ATOM 2640 CE2 TRP A 274 74.817 70.337 0.017 1.00 28.00 C ATOM 2641 CE3 TRP A 274 75.736 72.536 0.403 1.00 23.58 C ATOM 2642 CZ2 TRP A 274 73.985 70.435 1.130 1.00 24.86 C ATOM 2643 CZ3 TRP A 274 74.907 72.633 1.506 1.00 26.43 C ATOM 2644 CH2 TRP A 274 74.037 71.592 1.855 1.00 26.53 C ATOM 2645 HE1 TRP A 274 74.441 68.420 -0.876 1.00 0.00 H ATOM 2646 H TRP A 274 79.151 72.668 -3.959 1.00 0.00 H ATOM 2647 N ILE A 275 76.239 73.997 -4.213 1.00 26.49 N ATOM 2648 CA ILE A 275 75.211 75.028 -4.328 1.00 26.26 C ATOM 2649 C ILE A 275 74.945 75.357 -5.798 1.00 30.53 C ATOM 2650 O ILE A 275 73.812 75.625 -6.200 1.00 30.64 O ATOM 2651 CB ILE A 275 75.629 76.323 -3.584 1.00 25.91 C ATOM 2652 CG1 ILE A 275 75.829 76.054 -2.082 1.00 23.18 C ATOM 2653 CG2 ILE A 275 74.609 77.429 -3.799 1.00 24.65 C ATOM 2654 CD1 ILE A 275 74.591 75.556 -1.375 1.00 25.00 C ATOM 2655 H ILE A 275 77.237 74.283 -4.271 1.00 0.00 H ATOM 2656 N LYS A 276 76.011 75.322 -6.587 1.00 32.75 N ATOM 2657 CA LYS A 276 75.951 75.613 -8.012 1.00 36.60 C ATOM 2658 C LYS A 276 76.577 74.457 -8.790 1.00 37.87 C ATOM 2659 O LYS A 276 77.756 74.515 -9.149 1.00 40.75 O ATOM 2660 CB LYS A 276 76.677 76.920 -8.316 1.00 33.53 C ATOM 2661 CG LYS A 276 76.543 77.397 -9.749 1.00 39.24 C ATOM 2662 CD LYS A 276 77.266 78.715 -9.941 1.00 44.14 C ATOM 2663 CE LYS A 276 77.012 79.288 -11.326 1.00 49.17 C ATOM 2664 NZ LYS A 276 77.770 80.549 -11.528 1.00 45.10 N ATOM 2665 HZ1 LYS A 276 77.473 81.248 -10.818 1.00 0.00 H ATOM 2666 HZ2 LYS A 276 78.788 80.360 -11.426 1.00 0.00 H ATOM 2667 HZ3 LYS A 276 77.578 80.918 -12.481 1.00 0.00 H ATOM 2668 H LYS A 276 76.931 75.076 -6.169 1.00 0.00 H ATOM 2669 N PRO A 277 75.797 73.387 -9.020 1.00 43.71 N ATOM 2670 CA PRO A 277 76.274 72.153 -9.668 1.00 44.37 C ATOM 2671 C PRO A 277 76.744 72.352 -11.114 1.00 48.82 C ATOM 2672 O PRO A 277 76.772 73.478 -11.615 1.00 48.83 O ATOM 2673 CB PRO A 277 75.041 71.236 -9.631 1.00 44.10 C ATOM 2674 CG PRO A 277 74.184 71.779 -8.533 1.00 44.17 C ATOM 2675 CD PRO A 277 74.401 73.266 -8.559 1.00 38.55 C TER 2676 PRO A 277 HETATM 2677 O HOH 1 91.900 95.353 17.761 1.00 43.52 O HETATM 2678 O HOH 2 62.214 103.783 33.989 1.00 48.38 O HETATM 2679 O HOH 3 80.847 66.526 28.087 1.00 29.85 O HETATM 2680 O HOH 4 91.353 92.610 11.092 1.00 51.46 O HETATM 2681 O HOH 5 76.546 103.798 24.471 1.00 40.45 O HETATM 2682 O HOH 6 51.794 100.713 4.755 1.00 19.46 O HETATM 2683 O HOH 7 70.044 103.677 36.920 1.00 39.79 O HETATM 2684 O HOH 8 46.970 89.302 16.769 1.00 45.56 O HETATM 2685 O HOH 9 69.566 98.204 -1.348 1.00 27.54 O HETATM 2686 O HOH 10 85.469 70.061 28.452 1.00 40.25 O HETATM 2687 O HOH 11 72.806 105.611 38.843 1.00 35.95 O HETATM 2688 O HOH 12 66.002 101.129 32.736 1.00 38.83 O HETATM 2689 O HOH 13 56.960 107.690 9.999 1.00 43.22 O HETATM 2690 O HOH 14 95.957 80.014 9.048 1.00 41.76 O HETATM 2691 O HOH 15 43.882 98.412 12.278 1.00 32.06 O HETATM 2692 O HOH 16 93.593 93.552 18.187 1.00 42.00 O HETATM 2693 O HOH 17 71.257 88.328 -3.027 1.00 17.79 O HETATM 2694 O HOH 18 76.385 68.310 20.065 1.00 29.15 O HETATM 2695 O HOH 19 80.942 95.586 -0.615 1.00 49.25 O HETATM 2696 O HOH 20 84.620 93.232 2.017 1.00 45.80 O HETATM 2697 O HOH 21 67.715 103.727 24.925 1.00 28.99 O HETATM 2698 O HOH 22 79.273 87.323 -6.900 1.00 32.94 O HETATM 2699 O HOH 23 66.413 104.158 34.952 1.00 41.94 O HETATM 2700 O HOH 24 43.200 106.905 15.408 1.00 43.75 O HETATM 2701 O HOH 25 78.970 84.442 -6.243 1.00 33.87 O HETATM 2702 O HOH 26 53.389 96.427 3.386 1.00 44.76 O HETATM 2703 O HOH 27 80.257 67.351 16.422 1.00 30.78 O HETATM 2704 O HOH 28 48.999 106.649 6.829 1.00 39.67 O HETATM 2705 O HOH 29 72.638 86.170 -4.475 1.00 30.69 O HETATM 2706 O HOH 30 75.472 73.070 27.652 1.00 47.59 O HETATM 2707 O HOH 31 62.533 109.053 28.759 1.00 43.01 O HETATM 2708 O HOH 32 48.241 92.672 5.414 1.00 29.59 O HETATM 2709 O HOH 33 49.886 105.129 9.195 1.00 31.28 O HETATM 2710 O HOH 34 84.945 93.522 5.199 1.00 36.51 O HETATM 2711 O HOH 35 40.345 99.934 16.899 1.00 42.34 O HETATM 2712 O HOH 36 57.720 101.841 4.112 1.00 33.07 O HETATM 2713 O HOH 37 49.182 89.713 6.369 1.00 42.29 O HETATM 2714 O HOH 38 83.090 73.166 31.973 1.00 43.39 O HETATM 2715 O HOH 39 90.920 104.908 11.571 1.00 39.78 O HETATM 2716 O HOH 40 43.245 96.550 3.224 1.00 33.14 O HETATM 2717 O HOH 41 66.968 106.259 24.263 1.00 35.48 O HETATM 2718 O HOH 42 59.589 106.532 10.833 1.00 23.43 O HETATM 2719 O HOH 43 73.904 105.147 24.217 1.00 28.74 O HETATM 2720 O HOH 44 73.359 68.147 19.163 1.00 39.68 O HETATM 2721 O HOH 45 77.413 105.129 26.918 1.00 54.96 O HETATM 2722 O HOH 46 75.904 99.595 33.076 1.00 54.45 O HETATM 2723 O HOH 47 51.789 106.876 9.876 1.00 41.82 O HETATM 2724 O HOH 48 77.905 58.147 15.335 1.00 47.62 O HETATM 2725 O HOH 49 55.970 98.932 3.771 1.00 40.76 O HETATM 2726 O HOH 50 41.338 104.216 7.502 1.00 33.34 O HETATM 2727 O HOH 51 93.793 90.545 18.556 1.00 40.58 O HETATM 2728 O HOH 52 49.101 87.035 10.122 1.00 46.31 O HETATM 2729 O HOH 53 75.827 99.559 34.920 1.00 56.38 O HETATM 2730 O HOH 54 42.620 105.821 4.812 1.00 37.84 O HETATM 2731 O HOH 55 88.505 96.747 9.916 1.00 56.30 O HETATM 2732 O HOH 56 81.425 58.456 13.465 1.00 54.27 O HETATM 2733 O HOH 57 93.544 86.052 11.152 1.00 48.16 O HETATM 2734 O HOH 58 64.716 111.042 23.065 1.00 51.32 O HETATM 2735 O HOH 59 86.812 93.849 9.656 1.00 42.17 O HETATM 2736 O HOH 60 77.523 102.749 28.970 1.00 47.65 O HETATM 2737 O HOH 61 41.901 101.803 18.707 1.00 46.56 O HETATM 2738 O HOH 62 57.926 99.595 4.370 1.00 48.41 O HETATM 2739 O HOH 63 79.869 90.710 -2.662 1.00 33.65 O HETATM 2740 O HOH 64 91.424 106.290 14.195 1.00 45.84 O HETATM 2741 O HOH 65 62.062 93.058 -2.134 1.00 41.44 O HETATM 2742 O HOH 66 46.477 80.683 4.318 1.00 46.27 O HETATM 2743 O HOH 67 89.174 95.163 11.012 1.00 51.79 O HETATM 2744 O HOH 68 54.701 94.875 4.191 1.00 31.34 O HETATM 2745 O HOH 69 85.871 72.981 29.455 1.00 49.21 O HETATM 2746 O HOH 70 77.167 98.727 -3.230 1.00 35.86 O HETATM 2747 O HOH 71 81.983 100.308 3.390 1.00 52.55 O HETATM 2748 O HOH 72 47.444 108.676 8.345 1.00 52.64 O HETATM 2749 O HOH 73 76.305 85.500 12.469 1.00 14.51 O HETATM 2750 O HOH 74 71.888 91.080 14.679 1.00 16.98 O HETATM 2751 O HOH 75 81.435 86.936 3.185 1.00 17.16 O HETATM 2752 O HOH 76 72.599 96.664 15.531 1.00 17.79 O HETATM 2753 O HOH 77 54.049 93.442 6.607 1.00 17.90 O HETATM 2754 O HOH 78 79.844 78.045 16.702 1.00 18.16 O HETATM 2755 O HOH 79 77.294 74.187 17.505 1.00 18.24 O HETATM 2756 O HOH 80 75.525 83.396 15.518 1.00 18.53 O HETATM 2757 O HOH 81 79.862 84.110 14.251 1.00 18.54 O HETATM 2758 O HOH 82 64.232 98.640 5.309 1.00 18.61 O HETATM 2759 O HOH 83 85.019 87.927 11.720 1.00 18.75 O HETATM 2760 O HOH 84 84.462 84.177 5.275 1.00 19.24 O HETATM 2761 O HOH 85 54.292 90.819 5.561 1.00 19.53 O HETATM 2762 O HOH 86 89.081 82.946 14.741 1.00 19.67 O HETATM 2763 O HOH 87 47.360 104.433 10.306 1.00 20.12 O HETATM 2764 O HOH 88 86.312 82.131 -0.341 1.00 20.27 O HETATM 2765 O HOH 89 90.316 87.819 13.794 1.00 21.26 O HETATM 2766 O HOH 90 85.863 89.928 19.324 1.00 21.64 O HETATM 2767 O HOH 91 90.764 85.224 14.711 1.00 23.50 O HETATM 2768 O HOH 92 82.130 87.659 -0.717 1.00 23.55 O HETATM 2769 O HOH 93 87.238 84.605 4.504 1.00 23.61 O HETATM 2770 O HOH 94 77.594 85.440 15.194 1.00 23.82 O HETATM 2771 O HOH 95 72.504 98.073 25.132 1.00 24.01 O HETATM 2772 O HOH 96 74.503 84.062 18.108 1.00 24.04 O HETATM 2773 O HOH 97 90.018 82.373 17.246 1.00 24.17 O HETATM 2774 O HOH 98 77.254 99.987 12.599 1.00 25.05 O HETATM 2775 O HOH 99 85.060 91.833 7.072 1.00 25.51 O HETATM 2776 O HOH 100 55.757 91.214 3.054 1.00 25.62 O HETATM 2777 O HOH 101 68.515 79.254 17.127 1.00 25.77 O HETATM 2778 O HOH 102 64.676 77.956 12.071 1.00 26.96 O HETATM 2779 O HOH 103 92.190 77.883 10.393 1.00 27.01 O HETATM 2780 O HOH 104 70.492 90.351 17.855 1.00 27.07 O HETATM 2781 O HOH 105 83.361 86.986 4.670 1.00 27.21 O HETATM 2782 O HOH 106 74.622 77.777 22.957 1.00 27.28 O HETATM 2783 O HOH 107 87.799 77.406 3.438 1.00 27.36 O HETATM 2784 O HOH 108 72.017 85.524 20.471 1.00 27.54 O HETATM 2785 O HOH 109 66.327 84.001 -2.599 1.00 28.24 O HETATM 2786 O HOH 110 68.577 97.387 19.160 1.00 28.57 O HETATM 2787 O HOH 111 64.580 77.344 14.784 1.00 29.23 O HETATM 2788 O HOH 112 69.245 105.801 13.799 1.00 29.58 O HETATM 2789 O HOH 113 87.492 94.282 13.275 1.00 29.66 O HETATM 2790 O HOH 114 89.524 75.007 22.914 1.00 30.09 O HETATM 2791 O HOH 115 45.538 106.445 10.349 1.00 30.19 O HETATM 2792 O HOH 116 74.659 104.077 17.061 1.00 30.33 O HETATM 2793 O HOH 117 70.759 96.811 19.259 1.00 30.46 O HETATM 2794 O HOH 118 80.510 90.077 -0.632 1.00 31.85 O HETATM 2795 O HOH 119 86.182 72.198 9.331 1.00 31.89 O HETATM 2796 O HOH 120 87.621 87.255 3.730 1.00 32.16 O HETATM 2797 O HOH 121 85.538 86.076 -2.118 1.00 32.22 O HETATM 2798 O HOH 122 57.962 78.663 14.661 1.00 32.33 O HETATM 2799 O HOH 123 56.524 82.333 1.986 1.00 32.34 O HETATM 2800 O HOH 124 62.538 102.367 29.600 1.00 32.36 O HETATM 2801 O HOH 125 72.452 65.170 4.007 1.00 33.53 O HETATM 2802 O HOH 126 75.954 100.686 24.493 1.00 33.61 O HETATM 2803 O HOH 127 57.605 77.352 10.916 1.00 34.08 O HETATM 2804 O HOH 128 70.831 104.432 7.328 1.00 34.27 O HETATM 2805 O HOH 129 79.151 64.542 -3.242 1.00 34.31 O HETATM 2806 O HOH 130 84.353 83.698 25.410 1.00 34.45 O HETATM 2807 O HOH 131 76.225 75.880 25.375 1.00 34.47 O HETATM 2808 O HOH 132 92.683 79.961 20.259 1.00 34.62 O HETATM 2809 O HOH 133 70.364 91.214 20.673 1.00 34.76 O HETATM 2810 O HOH 134 83.607 78.054 -4.266 1.00 35.00 O HETATM 2811 O HOH 135 88.071 72.673 7.782 1.00 35.08 O HETATM 2812 O HOH 136 77.566 100.846 18.281 1.00 35.10 O HETATM 2813 O HOH 137 63.426 84.133 -2.369 1.00 35.24 O HETATM 2814 O HOH 138 74.558 80.204 -6.733 1.00 35.54 O HETATM 2815 O HOH 139 61.034 77.306 -0.914 1.00 35.74 O HETATM 2816 O HOH 140 74.420 88.952 22.912 1.00 35.81 O HETATM 2817 O HOH 141 87.670 77.420 0.680 1.00 35.94 O HETATM 2818 O HOH 142 56.302 84.153 12.280 1.00 35.96 O HETATM 2819 O HOH 143 61.644 92.015 2.371 1.00 36.00 O HETATM 2820 O HOH 144 61.054 108.067 12.464 1.00 36.04 O HETATM 2821 O HOH 145 75.428 102.055 11.452 1.00 36.12 O HETATM 2822 O HOH 146 64.647 66.150 -3.832 1.00 36.15 O HETATM 2823 O HOH 147 55.419 101.538 24.770 1.00 36.29 O HETATM 2824 O HOH 148 74.312 95.911 20.178 1.00 36.35 O HETATM 2825 O HOH 149 93.087 84.432 13.423 1.00 36.74 O HETATM 2826 O HOH 150 84.294 88.181 -1.811 1.00 36.76 O HETATM 2827 O HOH 151 68.458 76.447 17.606 1.00 36.84 O HETATM 2828 O HOH 152 68.728 106.460 11.625 1.00 37.06 O HETATM 2829 O HOH 153 83.879 65.662 1.690 1.00 37.54 O HETATM 2830 O HOH 154 77.294 95.180 19.961 1.00 37.55 O HETATM 2831 O HOH 155 71.564 87.372 21.322 1.00 37.65 O HETATM 2832 O HOH 156 55.239 83.847 -0.084 1.00 37.82 O HETATM 2833 O HOH 157 78.830 61.791 -1.958 1.00 37.96 O HETATM 2834 O HOH 158 67.483 100.121 -0.286 1.00 38.11 O HETATM 2835 O HOH 159 49.469 87.806 23.226 1.00 38.13 O HETATM 2836 O HOH 160 49.115 110.714 18.340 1.00 38.25 O HETATM 2837 O HOH 161 54.976 83.407 17.434 1.00 38.54 O HETATM 2838 O HOH 162 58.780 83.070 19.501 1.00 38.68 O HETATM 2839 O HOH 163 44.580 101.515 18.688 1.00 38.99 O HETATM 2840 O HOH 164 85.833 77.658 27.445 1.00 39.30 O HETATM 2841 O HOH 165 57.877 97.104 5.322 1.00 39.55 O HETATM 2842 O HOH 166 86.477 68.412 2.357 1.00 39.64 O HETATM 2843 O HOH 167 60.021 82.071 17.072 1.00 39.71 O HETATM 2844 O HOH 168 57.769 81.533 15.679 1.00 39.77 O HETATM 2845 O HOH 169 86.573 97.126 19.813 1.00 39.84 O HETATM 2846 O HOH 170 93.545 81.879 13.750 1.00 39.91 O HETATM 2847 O HOH 171 91.343 76.821 21.298 1.00 40.02 O HETATM 2848 O HOH 172 67.022 92.074 19.284 1.00 40.02 O HETATM 2849 O HOH 173 75.829 67.518 -4.419 1.00 40.06 O HETATM 2850 O HOH 174 72.023 95.267 22.871 1.00 40.06 O HETATM 2851 O HOH 175 55.541 104.611 28.060 1.00 40.27 O HETATM 2852 O HOH 176 74.806 102.358 9.036 1.00 40.69 O HETATM 2853 O HOH 177 68.885 74.444 16.432 1.00 40.78 O HETATM 2854 O HOH 178 92.261 88.400 22.552 1.00 40.98 O HETATM 2855 O HOH 179 51.254 93.501 4.873 1.00 41.15 O HETATM 2856 O HOH 180 69.192 63.239 0.467 1.00 41.20 O HETATM 2857 O HOH 181 73.434 101.305 2.285 1.00 41.30 O HETATM 2858 O HOH 182 61.960 93.678 0.200 1.00 41.34 O HETATM 2859 O HOH 183 67.400 89.848 20.314 1.00 41.45 O HETATM 2860 O HOH 184 79.234 98.114 19.257 1.00 41.69 O HETATM 2861 O HOH 185 88.734 70.489 12.802 1.00 41.79 O HETATM 2862 O HOH 186 54.807 107.318 27.006 1.00 41.92 O HETATM 2863 O HOH 187 47.236 99.522 19.483 1.00 42.00 O HETATM 2864 O HOH 188 84.086 63.796 11.061 1.00 42.13 O HETATM 2865 O HOH 189 84.549 97.519 11.937 1.00 42.19 O HETATM 2866 O HOH 190 53.146 108.261 23.127 1.00 42.30 O HETATM 2867 O HOH 191 70.534 62.710 10.732 1.00 42.33 O HETATM 2868 O HOH 192 64.971 90.401 21.007 1.00 42.36 O HETATM 2869 O HOH 193 77.122 76.119 31.620 1.00 42.47 O HETATM 2870 O HOH 194 91.367 86.371 2.777 1.00 42.53 O HETATM 2871 O HOH 195 72.151 61.920 6.934 1.00 42.71 O HETATM 2872 O HOH 196 81.701 64.581 -4.721 1.00 42.75 O HETATM 2873 O HOH 197 49.035 81.411 5.205 1.00 42.80 O HETATM 2874 O HOH 198 60.280 84.473 22.007 1.00 42.80 O HETATM 2875 O HOH 199 72.288 59.063 9.506 1.00 43.09 O HETATM 2876 O HOH 200 63.065 101.249 4.797 1.00 43.41 O HETATM 2877 O HOH 201 66.235 79.229 -3.587 1.00 43.43 O HETATM 2878 O HOH 202 76.699 65.134 -4.599 1.00 43.45 O HETATM 2879 O HOH 203 92.394 86.318 23.095 1.00 43.66 O HETATM 2880 O HOH 204 93.302 85.478 21.557 1.00 43.66 O HETATM 2881 O HOH 205 89.652 75.273 3.616 1.00 44.12 O HETATM 2882 O HOH 206 47.356 104.666 24.035 1.00 44.15 O HETATM 2883 O HOH 207 58.791 91.694 0.967 1.00 44.24 O HETATM 2884 O HOH 208 70.678 73.439 20.154 1.00 44.51 O HETATM 2885 O HOH 209 61.086 101.004 31.344 1.00 44.54 O HETATM 2886 O HOH 210 84.801 95.476 23.471 1.00 44.66 O HETATM 2887 O HOH 211 58.364 89.649 0.364 1.00 44.71 O HETATM 2888 O HOH 212 62.747 72.488 -1.294 1.00 44.83 O HETATM 2889 O HOH 213 82.377 89.078 1.226 1.00 44.91 O HETATM 2890 O HOH 214 52.577 106.023 23.536 1.00 45.28 O HETATM 2891 O HOH 215 95.957 84.082 7.311 1.00 45.43 O HETATM 2892 O HOH 216 63.163 76.700 -1.025 1.00 45.63 O HETATM 2893 O HOH 217 77.087 102.945 16.224 1.00 45.64 O HETATM 2894 O HOH 218 80.460 75.849 -9.625 1.00 46.08 O HETATM 2895 O HOH 219 55.861 71.208 6.961 1.00 46.31 O HETATM 2896 O HOH 220 80.091 60.338 8.498 1.00 46.48 O HETATM 2897 O HOH 221 61.041 74.756 -1.018 1.00 46.50 O HETATM 2898 O HOH 222 55.743 70.736 4.365 1.00 46.52 O HETATM 2899 O HOH 223 92.915 75.651 19.791 1.00 46.71 O HETATM 2900 O HOH 224 70.085 104.303 4.407 1.00 46.77 O HETATM 2901 O HOH 225 84.671 101.917 6.223 1.00 46.94 O HETATM 2902 O HOH 226 84.075 63.080 3.414 1.00 46.94 O HETATM 2903 O HOH 227 62.342 89.791 20.422 1.00 47.03 O HETATM 2904 O HOH 228 45.661 98.277 20.295 1.00 47.07 O HETATM 2905 O HOH 229 53.199 93.532 26.581 1.00 47.38 O HETATM 2906 O HOH 230 55.077 110.043 22.320 1.00 47.39 O HETATM 2907 O HOH 231 62.696 110.554 19.484 1.00 47.84 O HETATM 2908 O HOH 232 71.916 97.311 28.983 1.00 48.14 O HETATM 2909 O HOH 233 53.478 80.388 12.449 1.00 48.30 O HETATM 2910 O HOH 234 91.250 78.921 2.265 1.00 48.40 O HETATM 2911 O HOH 235 82.996 61.794 6.995 1.00 48.49 O HETATM 2912 O HOH 236 51.206 84.087 13.183 1.00 48.60 O HETATM 2913 O HOH 237 73.244 99.243 30.138 1.00 49.18 O HETATM 2914 O HOH 238 94.051 78.310 12.746 1.00 49.22 O HETATM 2915 O HOH 239 86.883 105.136 9.678 1.00 49.46 O HETATM 2916 O HOH 240 66.641 88.404 25.017 1.00 49.58 O HETATM 2917 O HOH 241 70.427 73.278 18.046 1.00 49.92 O HETATM 2918 O HOH 242 60.983 76.667 18.587 1.00 50.19 O HETATM 2919 O HOH 243 53.715 72.515 8.887 1.00 50.47 O HETATM 2920 O HOH 244 76.323 60.837 -2.207 1.00 50.92 O HETATM 2921 O HOH 245 53.958 65.252 7.942 1.00 51.07 O HETATM 2922 O HOH 246 57.892 71.338 14.620 1.00 51.29 O HETATM 2923 O HOH 247 88.080 85.057 25.591 1.00 51.36 O HETATM 2924 O HOH 248 50.413 91.197 25.081 1.00 51.39 O HETATM 2925 O HOH 249 48.541 82.077 1.919 1.00 51.69 O HETATM 2926 O HOH 250 50.841 99.826 22.031 1.00 51.78 O HETATM 2927 O HOH 251 59.737 83.860 24.550 1.00 52.11 O HETATM 2928 O HOH 252 92.018 75.815 5.589 1.00 52.31 O HETATM 2929 O HOH 253 87.866 70.499 -1.626 1.00 52.49 O HETATM 2930 O HOH 254 56.275 89.953 -0.167 1.00 52.67 O HETATM 2931 O HOH 255 71.996 93.904 21.606 1.00 52.94 O HETATM 2932 O HOH 256 61.439 64.203 0.547 1.00 53.11 O HETATM 2933 O HOH 257 84.457 75.758 -4.225 1.00 53.20 O HETATM 2934 O HOH 258 70.021 106.682 9.697 1.00 53.71 O HETATM 2935 O HOH 259 89.264 73.529 5.196 1.00 53.74 O HETATM 2936 O HOH 260 53.052 83.311 13.273 1.00 53.75 O HETATM 2937 O HOH 261 84.962 102.032 14.012 1.00 54.30 O HETATM 2938 O HOH 262 64.275 85.136 23.736 1.00 54.68 O HETATM 2939 O HOH 263 52.151 85.052 1.175 1.00 55.27 O HETATM 2940 O HOH 264 71.260 95.332 25.690 1.00 55.31 O HETATM 2941 O HOH 265 68.526 109.068 14.995 1.00 55.60 O HETATM 2942 O HOH 266 62.323 76.663 20.541 1.00 56.24 O HETATM 2943 O HOH 267 52.411 101.993 23.473 1.00 56.47 O HETATM 2944 O HOH 268 66.057 81.605 22.430 1.00 56.58 O HETATM 2945 O HOH 269 85.464 65.773 -0.515 1.00 56.60 O HETATM 2946 O HOH 270 53.732 89.825 1.559 1.00 56.81 O HETATM 2947 O HOH 271 85.083 66.518 -2.416 1.00 57.34 O HETATM 2948 O HOH 272 52.208 73.635 6.337 1.00 57.61 O HETATM 2949 O HOH 273 64.161 85.300 26.515 1.00 59.40 O HETATM 2950 O HOH 274 81.246 100.552 5.754 1.00 61.06 O HETATM 2951 O HOH 275 59.851 71.692 15.812 1.00 64.76 O HETATM 2952 CBF UNN A 276 63.686 90.367 17.566 1.00 0.06 C HETATM 2953 OBE UNN A 276 64.403 91.385 16.866 1.00 -0.32 O HETATM 2954 CAZ UNN A 276 63.889 91.698 15.635 1.00 0.13 C HETATM 2955 CAY UNN A 276 62.758 91.077 15.110 1.00 -0.02 C HETATM 2956 CAX UNN A 276 62.318 91.480 13.854 1.00 -0.01 C HETATM 2957 CBC UNN A 276 63.019 92.454 13.128 1.00 -0.06 C HETATM 2958 CBB UNN A 276 64.149 93.083 13.640 1.00 -0.03 C HETATM 2959 CBA UNN A 276 64.563 92.689 14.910 1.00 0.13 C HETATM 2960 OBD UNN A 276 65.664 93.223 15.493 1.00 -0.33 O HETATM 2961 H UNN A 276 66.039 93.880 14.918 1.00 0.25 H HETATM 2962 H UNN A 276 64.681 93.842 13.078 1.00 0.05 H HETATM 2963 H UNN A 276 62.670 92.725 12.138 1.00 0.06 H HETATM 2964 CAV UNN A 276 61.170 90.904 13.310 1.00 0.06 C HETATM 2965 CAU UNN A 276 60.533 91.562 12.258 1.00 -0.00 C HETATM 2966 CAT UNN A 276 59.333 91.063 11.755 1.00 0.03 C HETATM 2967 CAR UNN A 276 58.796 90.002 12.344 1.00 0.20 C HETATM 2968 NAS UNN A 276 59.430 89.451 13.398 1.00 -0.23 N HETATM 2969 NAW UNN A 276 60.528 89.891 13.898 1.00 -0.26 N HETATM 2970 CAG UNN A 276 58.693 88.406 13.792 1.00 0.15 C HETATM 2971 CAP UNN A 276 57.610 88.326 13.000 1.00 0.16 C HETATM 2972 NAQ UNN A 276 57.670 89.324 12.098 1.00 -0.18 N HETATM 2973 H1 UNN A 276 56.981 89.526 11.360 1.00 0.28 H HETATM 2974 H UNN A 276 56.819 87.581 13.075 1.00 0.18 H HETATM 2975 CAB UNN A 276 58.948 87.565 14.823 1.00 0.05 C HETATM 2976 CAA UNN A 276 60.049 87.728 15.677 1.00 -0.01 C HETATM 2977 CAF UNN A 276 60.298 86.867 16.742 1.00 0.06 C HETATM 2978 CAE UNN A 276 59.445 85.791 16.966 1.00 -0.02 C HETATM 2979 CAD UNN A 276 58.337 85.617 16.138 1.00 -0.04 C HETATM 2980 CAC UNN A 276 58.088 86.497 15.076 1.00 -0.02 C HETATM 2981 H UNN A 276 57.219 86.346 14.446 1.00 0.08 H HETATM 2982 H UNN A 276 57.659 84.790 16.318 1.00 0.07 H HETATM 2983 H UNN A 276 59.640 85.096 17.775 1.00 0.08 H HETATM 2984 CAH UNN A 276 61.448 87.047 17.527 1.00 0.12 C HETATM 2985 OAI UNN A 276 61.397 88.278 18.261 1.00 -0.34 O HETATM 2986 H UNN A 276 62.209 88.394 18.740 1.00 0.22 H HETATM 2987 NAJ UNN A 276 61.631 85.912 18.447 1.00 0.27 N HETATM 2988 CAK UNN A 276 62.938 85.959 19.121 1.00 0.01 C HETATM 2989 CAL UNN A 276 64.057 85.886 18.063 1.00 0.01 C HETATM 2990 NAM UNN A 276 65.388 85.882 18.692 1.00 0.23 N HETATM 2991 CAO UNN A 276 65.504 84.700 19.563 1.00 -0.04 C HETATM 2992 H UNN A 276 66.497 84.690 20.037 1.00 0.08 H HETATM 2993 H UNN A 276 65.375 83.788 18.962 1.00 0.08 H HETATM 2994 H UNN A 276 64.727 84.740 20.340 1.00 0.08 H HETATM 2995 CAN UNN A 276 65.534 87.090 19.519 1.00 -0.04 C HETATM 2996 H UNN A 276 65.450 87.983 18.882 1.00 0.08 H HETATM 2997 H UNN A 276 66.518 87.082 20.010 1.00 0.08 H HETATM 2998 H UNN A 276 64.743 87.109 20.283 1.00 0.08 H HETATM 2999 H UNN A 276 66.104 85.860 17.983 1.00 0.20 H HETATM 3000 H UNN A 276 63.978 86.758 17.397 1.00 0.09 H HETATM 3001 H UNN A 276 63.935 84.964 17.476 1.00 0.09 H HETATM 3002 H UNN A 276 63.027 85.106 19.810 1.00 0.09 H HETATM 3003 H UNN A 276 63.027 86.898 19.686 1.00 0.09 H HETATM 3004 H UNN A 276 61.565 85.053 17.923 1.00 0.21 H HETATM 3005 H UNN A 276 60.904 85.937 19.144 1.00 0.21 H HETATM 3006 H UNN A 276 62.316 87.087 16.853 1.00 0.14 H HETATM 3007 H UNN A 276 60.730 88.553 15.501 1.00 0.07 H HETATM 3008 H UNN A 276 58.850 91.530 10.904 1.00 0.09 H HETATM 3009 H UNN A 276 60.970 92.459 11.833 1.00 0.09 H HETATM 3010 H UNN A 276 62.237 90.304 15.663 1.00 0.06 H HETATM 3011 H UNN A 276 64.167 90.182 18.538 1.00 0.06 H HETATM 3012 H UNN A 276 63.691 89.441 16.973 1.00 0.06 H HETATM 3013 H UNN A 276 62.648 90.694 17.727 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2952 2953 3011 3012 3013 CONECT 2953 2952 2954 CONECT 2954 2953 2955 2959 CONECT 2955 2954 2956 3010 CONECT 2956 2955 2957 2964 CONECT 2957 2956 2958 2963 CONECT 2958 2957 2959 2962 CONECT 2959 2954 2958 2960 CONECT 2960 2959 2961 CONECT 2961 2960 CONECT 2962 2958 CONECT 2963 2957 CONECT 2964 2956 2965 2969 CONECT 2965 2964 2966 3009 CONECT 2966 2965 2967 3008 CONECT 2967 2966 2968 2972 CONECT 2968 2967 2969 2970 CONECT 2969 2964 2968 CONECT 2970 2968 2971 2975 CONECT 2971 2970 2972 2974 CONECT 2972 2967 2971 2973 CONECT 2973 2972 CONECT 2974 2971 CONECT 2975 2970 2976 2980 CONECT 2976 2975 2977 3007 CONECT 2977 2976 2978 2984 CONECT 2978 2977 2979 2983 CONECT 2979 2978 2980 2982 CONECT 2980 2975 2979 2981 CONECT 2981 2980 CONECT 2982 2979 CONECT 2983 2978 CONECT 2984 2977 2985 2987 3006 CONECT 2985 2984 2986 CONECT 2986 2985 CONECT 2987 2984 2988 3004 3005 CONECT 2988 2987 2989 3002 3003 CONECT 2989 2988 2990 3000 3001 CONECT 2990 2989 2991 2995 2999 CONECT 2991 2990 2992 2993 2994 CONECT 2992 2991 CONECT 2993 2991 CONECT 2994 2991 CONECT 2995 2990 2996 2997 2998 CONECT 2996 2995 CONECT 2997 2995 CONECT 2998 2995 CONECT 2999 2990 CONECT 3000 2989 CONECT 3001 2989 CONECT 3002 2988 CONECT 3003 2988 CONECT 3004 2987 CONECT 3005 2987 CONECT 3006 2984 CONECT 3007 2976 CONECT 3008 2966 CONECT 3009 2965 CONECT 3010 2955 CONECT 3011 2952 CONECT 3012 2952 CONECT 3013 2952 MASTER 0 0 0 0 0 0 0 0 3012 1 66 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4txc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2yak
RCSB PDB
PDBbind
285aa, >2YAK_1|Chain... at 100%
5aut
RCSB PDB
PDBbind
293aa, >5AUT_1|Chain... at 97%
5auu
RCSB PDB
PDBbind
293aa, >5AUU_1|Chain... at 97%
5auv
RCSB PDB
PDBbind
293aa, >5AUV_1|Chain... at 97%
5auw
RCSB PDB
PDBbind
293aa, >5AUW_1|Chain... at 97%
5aux
RCSB PDB
PDBbind
293aa, >5AUX_1|Chain... at 97%
5auy
RCSB PDB
PDBbind
293aa, >5AUY_1|Chain... at 97%
5auz
RCSB PDB
PDBbind
293aa, >5AUZ_1|Chain... at 97%
5av0
RCSB PDB
PDBbind
293aa, >5AV0_1|Chain... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4txc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Death-associated protein kinase 1 DAPK1
Ligand Name
38G
EC.Number
E.C.2.7.11.1
Resolution
1.95(Å)
Affinity (Kd/Ki/IC50)
Kd=0.24uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Chembiochem Vol. 16: pp. 59-63
Ligand Properties
Formula
C
2
4
H
3
0
N
5
O
3
Molecular Weight
436.527
Exact Mass
436.235
No. of atoms
62
No. of bonds
65
Polar Surface Area
103.52
LOGP Value
2.30 (
Computed with XLOGP3
)
-0.10 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
COc1cc(ccc1O)c1ccc2[n+](n1)c(c[nH]2)c1cccc(c1)[C@H]([NH2+]CC[NH+](C)C)O
InChI String
InChI=1S/C24H27N5O3/c1-28(2)12-11-25-24(31)18-6-4-5-17(13-18)20-15-26-23-10-8-19(27-29(20)23)16-7-9-21(30)22(14-16)32-3/h4-10,13-15,24-25,31H,11-12H2,1-3H3,(H,27,30)/p+3/t24-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P53355
Entrez Gene ID
NCBI Entrez Gene ID:
1612
ASD
Information of known allosteric effects of PDB entries
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