Browse entries in the PDBbind-CN Database
HEADER 5CYV_COMPLEX COMPND 5CYV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 83 SER GLN ALA LEU SER ASP ASP ILE GLY PHE LEU LEU SER SEQRES 2 A 83 ARG VAL GLY GLY MET VAL LEU GLY ALA VAL ASN LYS ALA SEQRES 3 A 83 LEU VAL PRO THR GLY LEU ARG VAL ARG SER TYR SER VAL SEQRES 4 A 83 LEU VAL LEU ALA CYS GLU GLN ALA GLU GLY VAL ASN GLN SEQRES 5 A 83 ARG GLY VAL ALA ALA THR MET GLY LEU ASP PRO SER GLN SEQRES 6 A 83 ILE VAL GLY LEU VAL ASP GLU LEU GLU GLU ARG GLY LEU SEQRES 7 A 83 VAL VAL ARG THR LEU SEQRES 1 A 55 ARG ASN LYS LEU ILE ALA ALA THR GLU GLU GLY ARG ARG SEQRES 2 A 55 LEU ARG ASP ASP ALA LYS ALA ARG VAL ASP ALA ALA HIS SEQRES 3 A 55 GLY ARG TYR PHE GLU GLY ILE PRO ASP THR VAL VAL ASN SEQRES 4 A 55 GLN MET ARG ASP THR LEU GLN SER ILE ALA PHE PRO THR SEQRES 5 A 55 PHE VAL GLU SEQRES 1 B 143 SER GLN ALA LEU SER ASP ASP ILE GLY PHE LEU LEU SER SEQRES 2 B 143 ARG VAL GLY GLY MET VAL LEU GLY ALA VAL ASN LYS ALA SEQRES 3 B 143 LEU VAL PRO THR GLY LEU ARG VAL ARG SER TYR SER VAL SEQRES 4 B 143 LEU VAL LEU ALA CYS GLU GLN ALA GLU GLY VAL ASN GLN SEQRES 5 B 143 ARG GLY VAL ALA ALA THR MET GLY LEU ASP PRO SER GLN SEQRES 6 B 143 ILE VAL GLY LEU VAL ASP GLU LEU GLU GLU ARG GLY LEU SEQRES 7 B 143 VAL VAL ARG THR LEU ASP PRO SER ASP ARG ARG ASN LYS SEQRES 8 B 143 LEU ILE ALA ALA THR GLU GLU GLY ARG ARG LEU ARG ASP SEQRES 9 B 143 ASP ALA LYS ALA ARG VAL ASP ALA ALA HIS GLY ARG TYR SEQRES 10 B 143 PHE GLU GLY ILE PRO ASP THR VAL VAL ASN GLN MET ARG SEQRES 11 B 143 ASP THR LEU GLN SER ILE ALA PHE PRO THR PHE VAL GLU HET MG A 1 1 HET MG A 2 1 HET MG A 3 1 HET WCA A 737 99 ATOM 1 N SER A 4 114.692 146.231 59.741 1.00 44.81 N ATOM 2 CA SER A 4 115.327 146.933 60.876 1.00 55.19 C ATOM 3 C SER A 4 115.037 146.334 62.239 1.00 48.84 C ATOM 4 O SER A 4 113.876 146.118 62.619 1.00 41.98 O ATOM 5 CB SER A 4 114.904 148.413 60.954 1.00 58.12 C ATOM 6 OG SER A 4 115.326 148.992 62.212 1.00 34.72 O ATOM 7 HG SER A 4 115.047 149.941 62.247 1.00 0.00 H ATOM 8 HN3 SER A 4 113.659 146.244 59.861 1.00 0.00 H ATOM 9 HN2 SER A 4 115.026 145.247 59.713 1.00 0.00 H ATOM 10 HN1 SER A 4 114.946 146.710 58.853 1.00 0.00 H ATOM 11 N GLN A 5 116.094 146.158 63.022 1.00 40.94 N ATOM 12 CA GLN A 5 115.915 145.641 64.364 1.00 38.32 C ATOM 13 C GLN A 5 115.935 146.756 65.414 1.00 26.18 C ATOM 14 O GLN A 5 115.915 146.454 66.596 1.00 30.27 O ATOM 15 CB GLN A 5 116.998 144.593 64.679 1.00 43.98 C ATOM 16 CG GLN A 5 116.907 143.307 63.840 1.00 43.06 C ATOM 17 CD GLN A 5 115.657 142.479 64.128 1.00 46.52 C ATOM 18 OE1 GLN A 5 115.083 142.545 65.218 1.00 47.74 O ATOM 19 NE2 GLN A 5 115.222 141.706 63.140 1.00 51.51 N ATOM 20 HE22 GLN A 5 115.736 141.679 62.236 1.00 0.00 H ATOM 21 HE21 GLN A 5 114.368 141.127 63.270 1.00 0.00 H ATOM 22 H GLN A 5 117.046 146.390 62.674 1.00 0.00 H ATOM 23 N ALA A 6 115.951 148.035 64.975 1.00 26.00 N ATOM 24 CA ALA A 6 115.991 149.197 65.906 1.00 22.26 C ATOM 25 C ALA A 6 114.761 149.254 66.766 1.00 24.42 C ATOM 26 O ALA A 6 113.664 149.006 66.299 1.00 21.60 O ATOM 27 CB ALA A 6 116.087 150.500 65.169 1.00 27.86 C ATOM 28 H ALA A 6 115.935 148.214 63.951 1.00 0.00 H ATOM 29 N LEU A 7 114.907 149.672 68.020 1.00 20.63 N ATOM 30 CA LEU A 7 113.728 149.752 68.917 1.00 17.61 C ATOM 31 C LEU A 7 112.656 150.704 68.396 1.00 20.32 C ATOM 32 O LEU A 7 111.457 150.426 68.495 1.00 19.27 O ATOM 33 CB LEU A 7 114.186 150.166 70.336 1.00 17.62 C ATOM 34 CG LEU A 7 113.028 150.140 71.376 1.00 19.49 C ATOM 35 CD1 LEU A 7 112.550 148.734 71.560 1.00 20.85 C ATOM 36 CD2 LEU A 7 113.596 150.690 72.687 1.00 20.54 C ATOM 37 H LEU A 7 115.847 149.943 68.372 1.00 0.00 H ATOM 38 N SER A 8 113.119 151.803 67.789 1.00 19.25 N ATOM 39 CA SER A 8 112.145 152.810 67.379 1.00 21.59 C ATOM 40 C SER A 8 111.396 152.343 66.131 1.00 22.52 C ATOM 41 O SER A 8 110.406 152.976 65.767 1.00 22.99 O ATOM 42 CB SER A 8 112.849 154.150 67.125 1.00 25.39 C ATOM 43 OG SER A 8 113.766 154.089 66.069 1.00 28.51 O ATOM 44 HG SER A 8 113.294 153.832 65.238 1.00 0.00 H ATOM 45 H SER A 8 114.136 151.935 67.616 1.00 0.00 H ATOM 46 N ASP A 9 111.821 151.245 65.492 1.00 21.14 N ATOM 47 CA ASP A 9 111.066 150.650 64.361 1.00 21.80 C ATOM 48 C ASP A 9 110.228 149.458 64.807 1.00 24.97 C ATOM 49 O ASP A 9 109.546 148.841 64.002 1.00 25.39 O ATOM 50 CB ASP A 9 112.023 150.181 63.272 1.00 22.79 C ATOM 51 CG ASP A 9 112.712 151.323 62.568 1.00 32.87 C ATOM 52 OD1 ASP A 9 112.029 152.348 62.310 1.00 31.65 O ATOM 53 OD2 ASP A 9 113.946 151.202 62.273 1.00 30.53 O ATOM 54 H ASP A 9 112.708 150.795 65.798 1.00 0.00 H ATOM 55 N ASP A 10 110.261 149.146 66.116 1.00 19.25 N ATOM 56 CA ASP A 10 109.606 147.915 66.545 1.00 18.72 C ATOM 57 C ASP A 10 108.133 148.152 66.782 1.00 19.43 C ATOM 58 O ASP A 10 107.785 149.030 67.549 1.00 20.19 O ATOM 59 CB ASP A 10 110.284 147.383 67.811 1.00 20.85 C ATOM 60 CG ASP A 10 109.669 146.119 68.302 1.00 26.71 C ATOM 61 OD1 ASP A 10 110.027 145.027 67.846 1.00 28.64 O ATOM 62 OD2 ASP A 10 108.764 146.245 69.166 1.00 25.93 O ATOM 63 H ASP A 10 110.740 149.764 66.802 1.00 0.00 H ATOM 64 N ILE A 11 107.263 147.386 66.165 1.00 19.89 N ATOM 65 CA ILE A 11 105.839 147.711 66.255 1.00 18.91 C ATOM 66 C ILE A 11 105.313 147.546 67.678 1.00 17.49 C ATOM 67 O ILE A 11 104.414 148.300 68.074 1.00 19.27 O ATOM 68 CB ILE A 11 105.018 146.856 65.292 1.00 24.31 C ATOM 69 CG1 ILE A 11 103.572 147.328 65.222 1.00 25.80 C ATOM 70 CG2 ILE A 11 105.127 145.344 65.596 1.00 25.53 C ATOM 71 CD1 ILE A 11 103.440 148.590 64.463 1.00 31.50 C ATOM 72 H ILE A 11 107.582 146.560 65.620 1.00 0.00 H ATOM 73 N GLY A 12 105.854 146.574 68.421 1.00 17.12 N ATOM 74 CA GLY A 12 105.391 146.438 69.811 1.00 18.45 C ATOM 75 C GLY A 12 105.760 147.629 70.675 1.00 16.09 C ATOM 76 O GLY A 12 104.966 148.111 71.484 1.00 17.79 O ATOM 77 H GLY A 12 106.577 145.937 68.030 1.00 0.00 H ATOM 78 N PHE A 13 106.985 148.111 70.490 1.00 17.58 N ATOM 79 CA PHE A 13 107.429 149.287 71.228 1.00 18.06 C ATOM 80 C PHE A 13 106.547 150.468 70.867 1.00 16.90 C ATOM 81 O PHE A 13 106.074 151.225 71.737 1.00 17.02 O ATOM 82 CB PHE A 13 108.901 149.566 70.907 1.00 17.20 C ATOM 83 CG PHE A 13 109.394 150.866 71.448 1.00 18.05 C ATOM 84 CD1 PHE A 13 109.737 150.960 72.799 1.00 19.83 C ATOM 85 CD2 PHE A 13 109.607 151.964 70.604 1.00 19.40 C ATOM 86 CE1 PHE A 13 110.256 152.161 73.319 1.00 21.49 C ATOM 87 CE2 PHE A 13 110.150 153.165 71.129 1.00 23.05 C ATOM 88 CZ PHE A 13 110.450 153.243 72.468 1.00 22.07 C ATOM 89 H PHE A 13 107.628 147.648 69.817 1.00 0.00 H ATOM 90 N LEU A 14 106.321 150.629 69.560 1.00 16.96 N ATOM 91 CA LEU A 14 105.516 151.756 69.119 1.00 17.09 C ATOM 92 C LEU A 14 104.092 151.717 69.638 1.00 16.40 C ATOM 93 O LEU A 14 103.520 152.764 69.985 1.00 17.18 O ATOM 94 CB LEU A 14 105.549 151.809 67.592 1.00 16.47 C ATOM 95 CG LEU A 14 106.941 152.150 67.036 1.00 20.17 C ATOM 96 CD1 LEU A 14 106.985 151.858 65.496 1.00 19.75 C ATOM 97 CD2 LEU A 14 107.275 153.655 67.325 1.00 20.47 C ATOM 98 H LEU A 14 106.715 149.959 68.869 1.00 0.00 H ATOM 99 N LEU A 15 103.452 150.543 69.578 1.00 16.79 N ATOM 100 CA LEU A 15 102.107 150.447 70.114 1.00 16.68 C ATOM 101 C LEU A 15 102.041 150.737 71.597 1.00 18.09 C ATOM 102 O LEU A 15 101.147 151.486 72.050 1.00 19.30 O ATOM 103 CB LEU A 15 101.592 149.026 69.862 1.00 20.17 C ATOM 104 CG LEU A 15 101.025 148.850 68.501 1.00 24.80 C ATOM 105 CD1 LEU A 15 100.831 147.359 68.187 1.00 27.18 C ATOM 106 CD2 LEU A 15 99.642 149.605 68.379 1.00 25.75 C ATOM 107 H LEU A 15 103.912 149.712 69.154 1.00 0.00 H ATOM 108 N SER A 16 102.997 150.211 72.377 1.00 18.27 N ATOM 109 CA SER A 16 103.004 150.490 73.791 1.00 18.48 C ATOM 110 C SER A 16 103.254 151.943 74.053 1.00 16.37 C ATOM 111 O SER A 16 102.672 152.526 74.983 1.00 18.82 O ATOM 112 CB SER A 16 104.070 149.667 74.460 1.00 20.99 C ATOM 113 OG SER A 16 103.699 148.315 74.386 1.00 24.21 O ATOM 114 HG SER A 16 102.832 148.186 74.847 1.00 0.00 H ATOM 115 H SER A 16 103.732 149.603 71.962 1.00 0.00 H ATOM 116 N ARG A 17 104.161 152.542 73.275 1.00 17.02 N ATOM 117 CA ARG A 17 104.466 153.961 73.465 1.00 17.25 C ATOM 118 C ARG A 17 103.279 154.838 73.122 1.00 18.98 C ATOM 119 O ARG A 17 102.901 155.745 73.891 1.00 18.23 O ATOM 120 CB ARG A 17 105.674 154.347 72.632 1.00 20.14 C ATOM 121 CG ARG A 17 106.973 153.836 73.262 1.00 19.87 C ATOM 122 CD ARG A 17 107.563 154.872 74.212 1.00 22.24 C ATOM 123 NE ARG A 17 108.119 156.008 73.451 1.00 23.34 N ATOM 124 CZ ARG A 17 107.564 157.218 73.361 1.00 22.18 C ATOM 125 NH1 ARG A 17 108.166 158.134 72.623 1.00 25.15 N ATOM 126 NH2 ARG A 17 106.455 157.530 74.025 1.00 23.01 N ATOM 127 HE ARG A 17 109.014 155.853 72.945 1.00 0.00 H ATOM 128 HH12 ARG A 17 107.754 159.085 72.536 1.00 0.00 H ATOM 129 HH11 ARG A 17 109.052 157.904 72.129 1.00 0.00 H ATOM 130 HH22 ARG A 17 106.045 158.482 73.935 1.00 0.00 H ATOM 131 HH21 ARG A 17 105.997 156.822 74.634 1.00 0.00 H ATOM 132 H ARG A 17 104.650 152.000 72.535 1.00 0.00 H ATOM 133 N VAL A 18 102.660 154.606 71.980 1.00 17.80 N ATOM 134 CA VAL A 18 101.524 155.466 71.573 1.00 18.02 C ATOM 135 C VAL A 18 100.307 155.176 72.480 1.00 17.44 C ATOM 136 O VAL A 18 99.628 156.115 72.884 1.00 18.83 O ATOM 137 CB VAL A 18 101.180 155.287 70.116 1.00 17.50 C ATOM 138 CG1 VAL A 18 99.940 156.075 69.769 1.00 19.84 C ATOM 139 CG2 VAL A 18 102.343 155.801 69.271 1.00 18.87 C ATOM 140 H VAL A 18 102.968 153.823 71.368 1.00 0.00 H ATOM 141 N GLY A 19 100.148 153.925 72.907 1.00 17.15 N ATOM 142 CA GLY A 19 99.065 153.597 73.882 1.00 17.58 C ATOM 143 C GLY A 19 99.262 154.393 75.150 1.00 17.07 C ATOM 144 O GLY A 19 98.263 154.876 75.745 1.00 19.29 O ATOM 145 H GLY A 19 100.779 153.174 72.561 1.00 0.00 H ATOM 146 N GLY A 20 100.513 154.536 75.626 1.00 17.00 N ATOM 147 CA GLY A 20 100.712 155.250 76.863 1.00 17.14 C ATOM 148 C GLY A 20 100.572 156.751 76.685 1.00 16.79 C ATOM 149 O GLY A 20 100.111 157.444 77.596 1.00 18.87 O ATOM 150 H GLY A 20 101.323 154.138 75.110 1.00 0.00 H ATOM 151 N MET A 21 100.975 157.270 75.516 1.00 18.89 N ATOM 152 CA MET A 21 100.753 158.688 75.166 1.00 20.54 C ATOM 153 C MET A 21 99.262 159.024 75.173 1.00 19.80 C ATOM 154 O MET A 21 98.833 160.042 75.723 1.00 21.04 O ATOM 155 CB MET A 21 101.296 159.046 73.777 1.00 20.88 C ATOM 156 CG MET A 21 102.828 159.021 73.747 1.00 22.42 C ATOM 157 SD MET A 21 103.465 159.114 72.033 1.00 25.26 S ATOM 158 CE MET A 21 102.819 160.726 71.644 1.00 29.54 C ATOM 159 H MET A 21 101.460 156.654 74.833 1.00 0.00 H ATOM 160 N VAL A 22 98.473 158.159 74.533 1.00 19.72 N ATOM 161 CA VAL A 22 97.019 158.342 74.511 1.00 20.84 C ATOM 162 C VAL A 22 96.420 158.252 75.916 1.00 19.70 C ATOM 163 O VAL A 22 95.613 159.132 76.291 1.00 20.65 O ATOM 164 CB VAL A 22 96.373 157.295 73.603 1.00 20.85 C ATOM 165 CG1 VAL A 22 94.815 157.207 73.845 1.00 26.62 C ATOM 166 CG2 VAL A 22 96.736 157.642 72.176 1.00 23.52 C ATOM 167 H VAL A 22 98.895 157.344 74.043 1.00 0.00 H ATOM 168 N LEU A 23 96.848 157.262 76.691 1.00 19.74 N ATOM 169 CA LEU A 23 96.378 157.104 78.060 1.00 19.79 C ATOM 170 C LEU A 23 96.654 158.367 78.880 1.00 18.51 C ATOM 171 O LEU A 23 95.767 158.862 79.576 1.00 19.90 O ATOM 172 CB LEU A 23 97.041 155.893 78.719 1.00 21.31 C ATOM 173 CG LEU A 23 96.611 155.582 80.154 1.00 21.98 C ATOM 174 CD1 LEU A 23 96.540 154.079 80.380 1.00 25.60 C ATOM 175 CD2 LEU A 23 97.554 156.234 81.152 1.00 22.17 C ATOM 176 H LEU A 23 97.537 156.582 76.310 1.00 0.00 H ATOM 177 N GLY A 24 97.878 158.890 78.800 1.00 19.01 N ATOM 178 CA GLY A 24 98.222 160.088 79.543 1.00 21.15 C ATOM 179 C GLY A 24 97.379 161.277 79.075 1.00 20.18 C ATOM 180 O GLY A 24 96.911 162.040 79.910 1.00 20.89 O ATOM 181 H GLY A 24 98.594 158.434 78.199 1.00 0.00 H ATOM 182 N ALA A 25 97.198 161.420 77.752 1.00 19.25 N ATOM 183 CA ALA A 25 96.473 162.571 77.242 1.00 19.81 C ATOM 184 C ALA A 25 95.007 162.511 77.621 1.00 21.24 C ATOM 185 O ALA A 25 94.372 163.538 77.917 1.00 21.74 O ATOM 186 CB ALA A 25 96.630 162.626 75.719 1.00 23.35 C ATOM 187 H ALA A 25 97.576 160.709 77.094 1.00 0.00 H ATOM 188 N VAL A 26 94.460 161.282 77.587 1.00 19.80 N ATOM 189 CA VAL A 26 93.057 161.123 77.938 1.00 17.52 C ATOM 190 C VAL A 26 92.882 161.335 79.442 1.00 18.31 C ATOM 191 O VAL A 26 91.941 162.043 79.839 1.00 20.68 O ATOM 192 CB VAL A 26 92.531 159.747 77.499 1.00 20.93 C ATOM 193 CG1 VAL A 26 91.135 159.482 78.092 1.00 22.23 C ATOM 194 CG2 VAL A 26 92.412 159.788 75.956 1.00 19.21 C ATOM 195 H VAL A 26 95.032 160.458 77.314 1.00 0.00 H ATOM 196 N ASN A 27 93.802 160.819 80.278 1.00 19.49 N ATOM 197 CA ASN A 27 93.685 161.153 81.705 1.00 19.57 C ATOM 198 C ASN A 27 93.733 162.655 81.952 1.00 20.94 C ATOM 199 O ASN A 27 92.948 163.198 82.771 1.00 22.02 O ATOM 200 CB ASN A 27 94.788 160.461 82.522 1.00 20.07 C ATOM 201 CG ASN A 27 94.440 159.031 82.878 1.00 21.18 C ATOM 202 OD1 ASN A 27 93.293 158.638 82.842 1.00 21.00 O ATOM 203 ND2 ASN A 27 95.481 158.215 83.139 1.00 20.78 N ATOM 204 HD22 ASN A 27 96.448 158.596 83.160 1.00 0.00 H ATOM 205 HD21 ASN A 27 95.317 157.204 83.320 1.00 0.00 H ATOM 206 H ASN A 27 94.567 160.207 79.928 1.00 0.00 H ATOM 207 N LYS A 28 94.622 163.362 81.231 1.00 21.12 N ATOM 208 CA LYS A 28 94.707 164.809 81.394 1.00 23.08 C ATOM 209 C LYS A 28 93.386 165.487 80.997 1.00 25.30 C ATOM 210 O LYS A 28 92.846 166.320 81.721 1.00 26.12 O ATOM 211 CB LYS A 28 95.890 165.349 80.559 1.00 22.79 C ATOM 212 CG LYS A 28 96.315 166.744 80.975 1.00 33.30 C ATOM 213 CD LYS A 28 97.607 167.116 80.270 1.00 46.01 C ATOM 214 CE LYS A 28 98.333 168.269 80.968 1.00 63.96 C ATOM 215 NZ LYS A 28 97.498 169.496 81.119 1.00 67.56 N ATOM 216 HZ1 LYS A 28 97.208 169.834 80.179 1.00 0.00 H ATOM 217 HZ2 LYS A 28 96.654 169.272 81.684 1.00 0.00 H ATOM 218 HZ3 LYS A 28 98.052 170.234 81.599 1.00 0.00 H ATOM 219 H LYS A 28 95.249 162.877 80.557 1.00 0.00 H ATOM 220 N ALA A 29 92.845 165.042 79.862 1.00 22.41 N ATOM 221 CA ALA A 29 91.588 165.623 79.369 1.00 22.63 C ATOM 222 C ALA A 29 90.434 165.314 80.275 1.00 25.01 C ATOM 223 O ALA A 29 89.502 166.089 80.365 1.00 25.20 O ATOM 224 CB ALA A 29 91.301 165.117 77.960 1.00 23.66 C ATOM 225 H ALA A 29 93.313 164.284 79.326 1.00 0.00 H ATOM 226 N LEU A 30 90.517 164.170 80.943 1.00 23.46 N ATOM 227 CA LEU A 30 89.400 163.792 81.840 1.00 23.90 C ATOM 228 C LEU A 30 89.426 164.471 83.206 1.00 25.25 C ATOM 229 O LEU A 30 88.499 164.308 83.979 1.00 26.25 O ATOM 230 CB LEU A 30 89.358 162.266 82.085 1.00 22.20 C ATOM 231 CG LEU A 30 88.955 161.396 80.901 1.00 21.64 C ATOM 232 CD1 LEU A 30 89.144 159.913 81.199 1.00 23.37 C ATOM 233 CD2 LEU A 30 87.445 161.719 80.578 1.00 23.47 C ATOM 234 H LEU A 30 91.348 163.553 80.839 1.00 0.00 H ATOM 235 N VAL A 31 90.475 165.229 83.518 1.00 24.95 N ATOM 236 CA VAL A 31 90.551 165.764 84.868 1.00 25.41 C ATOM 237 C VAL A 31 89.258 166.509 85.353 1.00 26.17 C ATOM 238 O VAL A 31 88.804 166.241 86.471 1.00 27.54 O ATOM 239 CB VAL A 31 91.796 166.635 85.014 1.00 23.82 C ATOM 240 CG1 VAL A 31 91.722 167.458 86.320 1.00 30.08 C ATOM 241 CG2 VAL A 31 93.051 165.753 84.979 1.00 27.30 C ATOM 242 H VAL A 31 91.217 165.432 82.818 1.00 0.00 H ATOM 243 N PRO A 32 88.649 167.422 84.526 1.00 26.42 N ATOM 244 CA PRO A 32 87.429 168.118 84.965 1.00 28.78 C ATOM 245 C PRO A 32 86.256 167.188 85.304 1.00 30.69 C ATOM 246 O PRO A 32 85.362 167.593 86.040 1.00 34.28 O ATOM 247 CB PRO A 32 87.080 168.989 83.761 1.00 34.36 C ATOM 248 CG PRO A 32 88.426 169.199 83.043 1.00 36.81 C ATOM 249 CD PRO A 32 89.109 167.886 83.191 1.00 30.23 C ATOM 250 N THR A 33 86.290 165.957 84.782 1.00 26.66 N ATOM 251 CA THR A 33 85.201 165.010 84.980 1.00 23.88 C ATOM 252 C THR A 33 85.376 164.175 86.203 1.00 23.85 C ATOM 253 O THR A 33 84.469 163.448 86.562 1.00 25.01 O ATOM 254 CB THR A 33 85.035 164.007 83.800 1.00 25.00 C ATOM 255 OG1 THR A 33 86.106 163.076 83.798 1.00 26.54 O ATOM 256 CG2 THR A 33 85.023 164.750 82.460 1.00 26.94 C ATOM 257 HG1 THR A 33 86.963 163.561 83.695 1.00 0.00 H ATOM 258 H THR A 33 87.116 165.668 84.220 1.00 0.00 H ATOM 259 N GLY A 34 86.576 164.213 86.791 1.00 24.63 N ATOM 260 CA GLY A 34 86.899 163.332 87.911 1.00 27.11 C ATOM 261 C GLY A 34 87.198 161.876 87.560 1.00 29.35 C ATOM 262 O GLY A 34 87.496 161.097 88.456 1.00 30.30 O ATOM 263 H GLY A 34 87.293 164.882 86.445 1.00 0.00 H ATOM 264 N LEU A 35 87.089 161.499 86.295 1.00 24.02 N ATOM 265 CA LEU A 35 87.317 160.129 85.854 1.00 20.07 C ATOM 266 C LEU A 35 88.789 159.958 85.444 1.00 26.34 C ATOM 267 O LEU A 35 89.456 160.923 85.135 1.00 23.02 O ATOM 268 CB LEU A 35 86.419 159.783 84.654 1.00 22.43 C ATOM 269 CG LEU A 35 84.935 160.004 84.849 1.00 22.64 C ATOM 270 CD1 LEU A 35 84.187 159.948 83.525 1.00 25.54 C ATOM 271 CD2 LEU A 35 84.380 158.917 85.740 1.00 24.77 C ATOM 272 H LEU A 35 86.829 162.213 85.585 1.00 0.00 H ATOM 273 N ARG A 36 89.272 158.720 85.441 1.00 21.52 N ATOM 274 CA ARG A 36 90.537 158.364 84.748 1.00 19.29 C ATOM 275 C ARG A 36 90.192 157.289 83.751 1.00 17.20 C ATOM 276 O ARG A 36 89.042 156.876 83.649 1.00 20.10 O ATOM 277 CB ARG A 36 91.632 157.934 85.745 1.00 22.74 C ATOM 278 CG ARG A 36 92.296 159.154 86.422 1.00 29.87 C ATOM 279 CD ARG A 36 93.451 158.726 87.381 1.00 31.29 C ATOM 280 NE ARG A 36 94.644 158.037 86.823 1.00 36.25 N ATOM 281 CZ ARG A 36 95.805 158.616 86.427 1.00 38.64 C ATOM 282 NH1 ARG A 36 95.932 159.929 86.400 1.00 32.87 N ATOM 283 NH2 ARG A 36 96.839 157.868 86.006 1.00 36.80 N ATOM 284 HE ARG A 36 94.582 157.003 86.726 1.00 0.00 H ATOM 285 HH12 ARG A 36 96.828 160.359 86.094 1.00 0.00 H ATOM 286 HH11 ARG A 36 95.136 160.534 86.685 1.00 0.00 H ATOM 287 HH22 ARG A 36 97.723 158.325 85.705 1.00 0.00 H ATOM 288 HH21 ARG A 36 96.755 156.832 85.981 1.00 0.00 H ATOM 289 H ARG A 36 88.746 157.975 85.941 1.00 0.00 H ATOM 290 N VAL A 37 91.150 156.858 82.935 1.00 18.59 N ATOM 291 CA VAL A 37 90.747 156.016 81.827 1.00 17.71 C ATOM 292 C VAL A 37 89.964 154.754 82.193 1.00 17.99 C ATOM 293 O VAL A 37 89.019 154.417 81.443 1.00 18.23 O ATOM 294 CB VAL A 37 91.931 155.580 80.916 1.00 18.64 C ATOM 295 CG1 VAL A 37 92.435 156.803 80.105 1.00 19.76 C ATOM 296 CG2 VAL A 37 93.048 154.865 81.636 1.00 21.25 C ATOM 297 H VAL A 37 92.146 157.115 83.086 1.00 0.00 H ATOM 298 N ARG A 38 90.319 154.079 83.277 1.00 16.81 N ATOM 299 CA ARG A 38 89.609 152.812 83.592 1.00 16.86 C ATOM 300 C ARG A 38 88.206 153.093 84.092 1.00 17.95 C ATOM 301 O ARG A 38 87.293 152.373 83.714 1.00 17.43 O ATOM 302 CB ARG A 38 90.384 151.971 84.558 1.00 17.87 C ATOM 303 CG ARG A 38 91.649 151.329 83.840 1.00 16.95 C ATOM 304 CD ARG A 38 92.402 150.494 84.842 1.00 17.60 C ATOM 305 NE ARG A 38 93.629 149.982 84.129 1.00 18.20 N ATOM 306 CZ ARG A 38 94.381 149.011 84.635 1.00 20.96 C ATOM 307 NH1 ARG A 38 95.460 148.638 83.975 1.00 21.42 N ATOM 308 NH2 ARG A 38 94.061 148.403 85.747 1.00 20.40 N ATOM 309 HE ARG A 38 93.894 150.401 83.215 1.00 0.00 H ATOM 310 HH12 ARG A 38 96.064 147.880 84.352 1.00 0.00 H ATOM 311 HH11 ARG A 38 95.707 149.102 83.078 1.00 0.00 H ATOM 312 HH22 ARG A 38 94.669 147.646 86.119 1.00 0.00 H ATOM 313 HH21 ARG A 38 93.198 148.676 86.259 1.00 0.00 H ATOM 314 H ARG A 38 91.079 154.429 83.895 1.00 0.00 H ATOM 315 N SER A 39 88.022 154.126 84.907 1.00 18.85 N ATOM 316 CA SER A 39 86.647 154.371 85.352 1.00 18.88 C ATOM 317 C SER A 39 85.802 154.941 84.229 1.00 18.34 C ATOM 318 O SER A 39 84.592 154.599 84.115 1.00 18.40 O ATOM 319 CB SER A 39 86.637 155.241 86.612 1.00 19.38 C ATOM 320 OG SER A 39 87.251 156.517 86.389 1.00 21.63 O ATOM 321 HG SER A 39 87.224 157.046 87.225 1.00 0.00 H ATOM 322 H SER A 39 88.812 154.729 85.213 1.00 0.00 H ATOM 323 N TYR A 40 86.369 155.799 83.391 1.00 18.17 N ATOM 324 CA TYR A 40 85.709 156.193 82.158 1.00 19.05 C ATOM 325 C TYR A 40 85.268 155.005 81.324 1.00 20.98 C ATOM 326 O TYR A 40 84.123 154.967 80.839 1.00 19.80 O ATOM 327 CB TYR A 40 86.663 157.067 81.332 1.00 20.25 C ATOM 328 CG TYR A 40 86.119 157.397 79.929 1.00 21.16 C ATOM 329 CD1 TYR A 40 85.083 158.333 79.711 1.00 25.11 C ATOM 330 CD2 TYR A 40 86.706 156.823 78.808 1.00 20.29 C ATOM 331 CE1 TYR A 40 84.615 158.629 78.390 1.00 23.72 C ATOM 332 CE2 TYR A 40 86.231 157.098 77.525 1.00 23.72 C ATOM 333 CZ TYR A 40 85.203 158.003 77.312 1.00 29.20 C ATOM 334 OH TYR A 40 84.719 158.277 76.020 1.00 26.38 O ATOM 335 HH TYR A 40 84.373 157.443 75.615 1.00 0.00 H ATOM 336 H TYR A 40 87.302 156.197 83.621 1.00 0.00 H ATOM 337 N SER A 41 86.162 154.034 81.171 1.00 16.88 N ATOM 338 CA SER A 41 85.829 152.884 80.313 1.00 17.23 C ATOM 339 C SER A 41 84.650 152.067 80.863 1.00 17.93 C ATOM 340 O SER A 41 83.771 151.702 80.104 1.00 18.53 O ATOM 341 CB SER A 41 87.034 151.955 80.178 1.00 18.82 C ATOM 342 OG SER A 41 88.088 152.614 79.416 1.00 19.66 O ATOM 343 HG SER A 41 88.364 153.441 79.884 1.00 0.00 H ATOM 344 H SER A 41 87.084 154.085 81.650 1.00 0.00 H ATOM 345 N VAL A 42 84.675 151.749 82.159 1.00 18.06 N ATOM 346 CA VAL A 42 83.516 151.085 82.771 1.00 17.80 C ATOM 347 C VAL A 42 82.212 151.892 82.538 1.00 19.09 C ATOM 348 O VAL A 42 81.180 151.325 82.201 1.00 20.11 O ATOM 349 CB VAL A 42 83.734 150.895 84.260 1.00 16.88 C ATOM 350 CG1 VAL A 42 82.463 150.299 84.917 1.00 19.37 C ATOM 351 CG2 VAL A 42 84.937 149.954 84.464 1.00 19.04 C ATOM 352 H VAL A 42 85.513 151.971 82.734 1.00 0.00 H ATOM 353 N LEU A 43 82.281 153.215 82.765 1.00 18.47 N ATOM 354 CA LEU A 43 81.075 154.050 82.578 1.00 21.66 C ATOM 355 C LEU A 43 80.579 153.980 81.091 1.00 23.46 C ATOM 356 O LEU A 43 79.366 153.842 80.849 1.00 21.59 O ATOM 357 CB LEU A 43 81.390 155.491 83.034 1.00 17.96 C ATOM 358 CG LEU A 43 80.191 156.466 82.863 1.00 20.33 C ATOM 359 CD1 LEU A 43 78.972 156.077 83.741 1.00 21.92 C ATOM 360 CD2 LEU A 43 80.616 157.857 83.186 1.00 22.56 C ATOM 361 H LEU A 43 83.176 153.648 83.070 1.00 0.00 H ATOM 362 N VAL A 44 81.516 154.032 80.121 1.00 18.70 N ATOM 363 CA VAL A 44 81.100 153.972 78.716 1.00 20.15 C ATOM 364 C VAL A 44 80.435 152.638 78.450 1.00 20.84 C ATOM 365 O VAL A 44 79.378 152.592 77.821 1.00 23.35 O ATOM 366 CB VAL A 44 82.319 154.169 77.777 1.00 19.12 C ATOM 367 CG1 VAL A 44 81.965 153.811 76.323 1.00 22.93 C ATOM 368 CG2 VAL A 44 82.841 155.576 77.895 1.00 25.40 C ATOM 369 H VAL A 44 82.523 154.114 80.367 1.00 0.00 H ATOM 370 N LEU A 45 81.079 151.571 78.928 1.00 19.37 N ATOM 371 CA LEU A 45 80.449 150.279 78.694 1.00 21.34 C ATOM 372 C LEU A 45 79.044 150.160 79.314 1.00 21.17 C ATOM 373 O LEU A 45 78.135 149.601 78.724 1.00 24.18 O ATOM 374 CB LEU A 45 81.366 149.160 79.209 1.00 19.92 C ATOM 375 CG LEU A 45 82.664 148.991 78.383 1.00 21.45 C ATOM 376 CD1 LEU A 45 83.712 148.212 79.146 1.00 22.06 C ATOM 377 CD2 LEU A 45 82.316 148.246 77.088 1.00 21.18 C ATOM 378 H LEU A 45 81.981 151.658 79.439 1.00 0.00 H ATOM 379 N ALA A 46 78.874 150.711 80.504 1.00 20.73 N ATOM 380 CA ALA A 46 77.546 150.658 81.124 1.00 21.03 C ATOM 381 C ALA A 46 76.522 151.473 80.322 1.00 25.30 C ATOM 382 O ALA A 46 75.350 151.131 80.204 1.00 25.28 O ATOM 383 CB ALA A 46 77.636 151.198 82.548 1.00 19.86 C ATOM 384 H ALA A 46 79.668 151.174 80.991 1.00 0.00 H ATOM 385 N CYS A 47 76.990 152.586 79.774 1.00 22.45 N ATOM 386 CA CYS A 47 76.059 153.445 79.079 1.00 25.24 C ATOM 387 C CYS A 47 75.657 152.934 77.704 1.00 32.40 C ATOM 388 O CYS A 47 74.819 153.535 77.054 1.00 30.99 O ATOM 389 CB CYS A 47 76.630 154.820 78.898 1.00 26.06 C ATOM 390 SG CYS A 47 76.759 155.776 80.437 1.00 24.44 S ATOM 391 H CYS A 47 77.998 152.833 79.842 1.00 0.00 H ATOM 392 N GLU A 48 76.330 151.893 77.235 1.00 23.86 N ATOM 393 CA GLU A 48 75.991 151.337 75.913 1.00 28.44 C ATOM 394 C GLU A 48 74.648 150.605 75.847 1.00 36.32 C ATOM 395 O GLU A 48 74.167 150.316 74.770 1.00 31.75 O ATOM 396 CB GLU A 48 77.094 150.364 75.439 1.00 33.27 C ATOM 397 CG GLU A 48 78.466 150.990 75.144 1.00 37.51 C ATOM 398 CD GLU A 48 79.560 149.962 74.703 1.00 41.20 C ATOM 399 OE1 GLU A 48 79.288 148.753 74.447 1.00 43.80 O ATOM 400 OE2 GLU A 48 80.722 150.385 74.642 1.00 35.05 O ATOM 401 H GLU A 48 77.095 151.470 77.798 1.00 0.00 H ATOM 402 N GLN A 49 74.108 150.263 77.000 1.00 28.97 N ATOM 403 CA GLN A 49 72.903 149.465 77.184 1.00 40.39 C ATOM 404 C GLN A 49 71.922 150.243 78.057 1.00 32.60 C ATOM 405 O GLN A 49 72.339 151.161 78.800 1.00 30.03 O ATOM 406 CB GLN A 49 73.262 148.133 77.846 1.00 41.01 C ATOM 407 CG GLN A 49 72.482 146.926 77.337 1.00 66.28 C ATOM 408 CD GLN A 49 72.710 145.681 78.201 1.00 72.95 C ATOM 409 OE1 GLN A 49 72.684 145.751 79.433 1.00 75.69 O ATOM 410 NE2 GLN A 49 72.944 144.545 77.554 1.00 75.01 N ATOM 411 HE22 GLN A 49 72.957 144.532 76.514 1.00 0.00 H ATOM 412 HE21 GLN A 49 73.115 143.669 78.087 1.00 0.00 H ATOM 413 H GLN A 49 74.588 150.595 77.861 1.00 0.00 H ATOM 414 N ALA A 50 70.631 149.927 77.956 1.00 34.20 N ATOM 415 CA ALA A 50 69.637 150.438 78.901 1.00 29.38 C ATOM 416 C ALA A 50 69.840 149.815 80.282 1.00 26.09 C ATOM 417 O ALA A 50 70.175 150.522 81.262 1.00 31.73 O ATOM 418 CB ALA A 50 68.222 150.147 78.388 1.00 31.65 C ATOM 419 H ALA A 50 70.322 149.301 77.185 1.00 0.00 H ATOM 420 N GLU A 51 69.632 148.503 80.365 1.00 30.93 N ATOM 421 CA GLU A 51 69.791 147.801 81.621 1.00 32.35 C ATOM 422 C GLU A 51 71.258 147.618 81.863 1.00 28.59 C ATOM 423 O GLU A 51 72.068 147.865 80.998 1.00 30.75 O ATOM 424 CB GLU A 51 69.110 146.442 81.625 1.00 38.20 C ATOM 425 CG GLU A 51 69.748 145.456 80.683 1.00 40.03 C ATOM 426 CD GLU A 51 68.917 145.295 79.426 1.00 44.33 C ATOM 427 OE1 GLU A 51 68.662 144.142 79.047 1.00 40.79 O ATOM 428 OE2 GLU A 51 68.534 146.320 78.815 1.00 39.50 O ATOM 429 H GLU A 51 69.351 147.974 79.515 1.00 0.00 H ATOM 430 N GLY A 52 71.593 147.136 83.038 1.00 29.97 N ATOM 431 CA GLY A 52 73.006 147.064 83.365 1.00 31.23 C ATOM 432 C GLY A 52 73.752 146.052 82.518 1.00 34.35 C ATOM 433 O GLY A 52 73.153 145.097 81.996 1.00 35.89 O ATOM 434 H GLY A 52 70.869 146.816 83.713 1.00 0.00 H ATOM 435 N VAL A 53 75.056 146.253 82.386 1.00 27.81 N ATOM 436 CA VAL A 53 75.928 145.369 81.643 1.00 30.51 C ATOM 437 C VAL A 53 76.642 144.402 82.562 1.00 27.43 C ATOM 438 O VAL A 53 76.886 144.701 83.710 1.00 27.94 O ATOM 439 CB VAL A 53 76.953 146.139 80.825 1.00 30.61 C ATOM 440 CG1 VAL A 53 76.166 147.018 79.829 1.00 37.30 C ATOM 441 CG2 VAL A 53 77.916 146.972 81.704 1.00 26.62 C ATOM 442 H VAL A 53 75.474 147.090 82.840 1.00 0.00 H ATOM 443 N ASN A 54 76.926 143.222 82.028 1.00 29.46 N ATOM 444 CA ASN A 54 77.529 142.160 82.795 1.00 27.35 C ATOM 445 C ASN A 54 78.952 142.534 83.226 1.00 27.34 C ATOM 446 O ASN A 54 79.772 142.900 82.394 1.00 28.78 O ATOM 447 CB ASN A 54 77.519 140.898 81.958 1.00 32.70 C ATOM 448 CG ASN A 54 77.924 139.709 82.733 1.00 47.55 C ATOM 449 OD1 ASN A 54 79.096 139.558 83.068 1.00 43.85 O ATOM 450 ND2 ASN A 54 76.965 138.824 83.012 1.00 60.90 N ATOM 451 HD22 ASN A 54 75.988 139.002 82.704 1.00 0.00 H ATOM 452 HD21 ASN A 54 77.195 137.956 83.537 1.00 0.00 H ATOM 453 H ASN A 54 76.707 143.057 81.025 1.00 0.00 H ATOM 454 N GLN A 55 79.226 142.471 84.526 1.00 25.07 N ATOM 455 CA GLN A 55 80.533 142.859 85.048 1.00 27.61 C ATOM 456 C GLN A 55 81.674 141.975 84.519 1.00 29.83 C ATOM 457 O GLN A 55 82.777 142.455 84.234 1.00 26.04 O ATOM 458 CB GLN A 55 80.520 142.833 86.571 1.00 30.83 C ATOM 459 CG GLN A 55 81.875 143.118 87.217 1.00 38.92 C ATOM 460 CD GLN A 55 81.789 143.240 88.738 1.00 56.09 C ATOM 461 OE1 GLN A 55 82.040 142.270 89.470 1.00 51.80 O ATOM 462 NE2 GLN A 55 81.426 144.429 89.217 1.00 40.31 N ATOM 463 HE22 GLN A 55 81.225 145.213 88.564 1.00 0.00 H ATOM 464 HE21 GLN A 55 81.343 144.573 90.244 1.00 0.00 H ATOM 465 H GLN A 55 78.493 142.138 85.185 1.00 0.00 H ATOM 466 N ARG A 56 81.396 140.702 84.335 1.00 26.12 N ATOM 467 CA ARG A 56 82.297 139.739 83.710 1.00 35.27 C ATOM 468 C ARG A 56 82.730 140.203 82.336 1.00 26.58 C ATOM 469 O ARG A 56 83.889 140.000 81.898 1.00 26.56 O ATOM 470 CB ARG A 56 81.608 138.402 83.563 1.00 36.77 C ATOM 471 CG ARG A 56 82.345 137.230 84.104 1.00 59.88 C ATOM 472 CD ARG A 56 81.311 136.321 84.727 1.00 62.73 C ATOM 473 NE ARG A 56 80.085 136.229 83.946 1.00 86.27 N ATOM 474 CZ ARG A 56 78.917 135.793 84.406 1.00 92.76 C ATOM 475 NH1 ARG A 56 78.784 135.419 85.676 1.00 90.48 N ATOM 476 NH2 ARG A 56 77.865 135.758 83.593 1.00 81.42 N ATOM 477 HE ARG A 56 80.127 136.528 82.951 1.00 0.00 H ATOM 478 HH12 ARG A 56 77.865 135.079 86.025 1.00 0.00 H ATOM 479 HH11 ARG A 56 79.599 135.466 86.320 1.00 0.00 H ATOM 480 HH22 ARG A 56 76.947 135.418 83.945 1.00 0.00 H ATOM 481 HH21 ARG A 56 77.960 136.070 82.606 1.00 0.00 H ATOM 482 H ARG A 56 80.469 140.358 84.658 1.00 0.00 H ATOM 483 N GLY A 57 81.716 140.658 81.609 1.00 26.11 N ATOM 484 CA GLY A 57 81.953 141.093 80.245 1.00 26.77 C ATOM 485 C GLY A 57 82.757 142.384 80.178 1.00 23.82 C ATOM 486 O GLY A 57 83.614 142.580 79.307 1.00 24.23 O ATOM 487 H GLY A 57 80.759 140.702 82.014 1.00 0.00 H ATOM 488 N VAL A 58 82.474 143.296 81.109 1.00 22.94 N ATOM 489 CA VAL A 58 83.247 144.518 81.231 1.00 19.40 C ATOM 490 C VAL A 58 84.741 144.197 81.461 1.00 22.79 C ATOM 491 O VAL A 58 85.614 144.745 80.787 1.00 20.47 O ATOM 492 CB VAL A 58 82.711 145.382 82.398 1.00 20.86 C ATOM 493 CG1 VAL A 58 83.628 146.577 82.656 1.00 23.01 C ATOM 494 CG2 VAL A 58 81.346 145.906 82.002 1.00 22.63 C ATOM 495 H VAL A 58 81.682 143.128 81.762 1.00 0.00 H ATOM 496 N ALA A 59 85.009 143.267 82.375 1.00 22.51 N ATOM 497 CA ALA A 59 86.388 142.896 82.686 1.00 20.38 C ATOM 498 C ALA A 59 87.077 142.330 81.437 1.00 24.49 C ATOM 499 O ALA A 59 88.197 142.744 81.066 1.00 23.13 O ATOM 500 CB ALA A 59 86.428 141.892 83.837 1.00 24.35 C ATOM 501 H ALA A 59 84.227 142.798 82.874 1.00 0.00 H ATOM 502 N ALA A 60 86.367 141.445 80.741 1.00 22.40 N ATOM 503 CA ALA A 60 86.936 140.829 79.542 1.00 25.59 C ATOM 504 C ALA A 60 87.227 141.870 78.481 1.00 24.26 C ATOM 505 O ALA A 60 88.315 141.873 77.889 1.00 23.72 O ATOM 506 CB ALA A 60 86.024 139.738 78.980 1.00 25.92 C ATOM 507 H ALA A 60 85.407 141.191 81.050 1.00 0.00 H ATOM 508 N THR A 61 86.295 142.779 78.258 1.00 21.30 N ATOM 509 CA THR A 61 86.502 143.817 77.255 1.00 21.01 C ATOM 510 C THR A 61 87.727 144.652 77.565 1.00 21.21 C ATOM 511 O THR A 61 88.471 145.041 76.686 1.00 20.75 O ATOM 512 CB THR A 61 85.252 144.706 77.131 1.00 25.32 C ATOM 513 OG1 THR A 61 84.185 143.894 76.659 1.00 27.68 O ATOM 514 CG2 THR A 61 85.457 145.891 76.166 1.00 25.75 C ATOM 515 HG1 THR A 61 84.022 143.159 77.302 1.00 0.00 H ATOM 516 H THR A 61 85.408 142.754 78.801 1.00 0.00 H ATOM 517 N MET A 62 87.896 145.000 78.834 1.00 20.66 N ATOM 518 CA MET A 62 88.996 145.854 79.269 1.00 19.02 C ATOM 519 C MET A 62 90.292 145.082 79.496 1.00 18.94 C ATOM 520 O MET A 62 91.300 145.725 79.741 1.00 20.07 O ATOM 521 CB MET A 62 88.588 146.578 80.576 1.00 19.50 C ATOM 522 CG MET A 62 87.434 147.539 80.330 1.00 21.32 C ATOM 523 SD MET A 62 86.874 148.377 81.837 1.00 20.66 S ATOM 524 CE MET A 62 88.397 149.254 82.325 1.00 18.37 C ATOM 525 H MET A 62 87.220 144.652 79.544 1.00 0.00 H ATOM 526 N GLY A 63 90.272 143.747 79.431 1.00 21.07 N ATOM 527 CA GLY A 63 91.491 142.968 79.613 1.00 20.88 C ATOM 528 C GLY A 63 91.976 142.996 81.068 1.00 21.27 C ATOM 529 O GLY A 63 93.174 143.028 81.330 1.00 25.20 O ATOM 530 H GLY A 63 89.373 143.257 79.248 1.00 0.00 H ATOM 531 N LEU A 64 91.009 143.069 81.975 1.00 24.94 N ATOM 532 CA LEU A 64 91.232 143.032 83.429 1.00 22.18 C ATOM 533 C LEU A 64 90.545 141.868 84.079 1.00 22.28 C ATOM 534 O LEU A 64 89.626 141.275 83.517 1.00 26.49 O ATOM 535 CB LEU A 64 90.709 144.333 84.044 1.00 19.96 C ATOM 536 CG LEU A 64 91.337 145.612 83.511 1.00 23.01 C ATOM 537 CD1 LEU A 64 90.742 146.838 84.102 1.00 22.18 C ATOM 538 CD2 LEU A 64 92.929 145.606 83.691 1.00 23.20 C ATOM 539 H LEU A 64 90.030 143.158 81.636 1.00 0.00 H ATOM 540 N ASP A 65 90.978 141.535 85.302 1.00 28.32 N ATOM 541 CA ASP A 65 90.294 140.549 86.116 1.00 31.34 C ATOM 542 C ASP A 65 89.053 141.194 86.716 1.00 30.38 C ATOM 543 O ASP A 65 89.019 142.369 86.984 1.00 25.15 O ATOM 544 CB ASP A 65 91.190 140.040 87.231 1.00 30.57 C ATOM 545 CG ASP A 65 92.321 139.187 86.711 1.00 60.08 C ATOM 546 OD1 ASP A 65 92.073 138.325 85.828 1.00 54.38 O ATOM 547 OD2 ASP A 65 93.466 139.395 87.174 1.00 66.78 O ATOM 548 H ASP A 65 91.830 141.997 85.679 1.00 0.00 H ATOM 549 N PRO A 66 88.020 140.389 86.963 1.00 26.60 N ATOM 550 CA PRO A 66 86.832 140.994 87.584 1.00 26.22 C ATOM 551 C PRO A 66 87.124 141.693 88.917 1.00 25.20 C ATOM 552 O PRO A 66 86.521 142.724 89.218 1.00 24.50 O ATOM 553 CB PRO A 66 85.896 139.792 87.759 1.00 31.47 C ATOM 554 CG PRO A 66 86.255 138.917 86.635 1.00 38.33 C ATOM 555 CD PRO A 66 87.762 139.035 86.450 1.00 34.40 C ATOM 556 N SER A 67 88.094 141.186 89.656 1.00 25.13 N ATOM 557 CA SER A 67 88.434 141.843 90.906 1.00 22.76 C ATOM 558 C SER A 67 88.893 143.271 90.730 1.00 25.33 C ATOM 559 O SER A 67 88.680 144.092 91.616 1.00 29.77 O ATOM 560 CB SER A 67 89.506 141.044 91.634 1.00 26.29 C ATOM 561 OG SER A 67 90.718 140.957 90.875 1.00 30.01 O ATOM 562 HG SER A 67 91.069 141.868 90.710 1.00 0.00 H ATOM 563 H SER A 67 88.604 140.333 89.349 1.00 0.00 H ATOM 564 N GLN A 68 89.488 143.605 89.590 1.00 24.90 N ATOM 565 CA GLN A 68 89.832 144.984 89.362 1.00 24.04 C ATOM 566 C GLN A 68 88.619 145.837 89.015 1.00 25.07 C ATOM 567 O GLN A 68 88.503 147.018 89.399 1.00 28.17 O ATOM 568 CB GLN A 68 90.892 145.035 88.260 1.00 24.41 C ATOM 569 CG GLN A 68 92.146 144.334 88.671 1.00 27.19 C ATOM 570 CD GLN A 68 93.138 144.291 87.585 1.00 35.55 C ATOM 571 OE1 GLN A 68 93.103 143.382 86.752 1.00 32.19 O ATOM 572 NE2 GLN A 68 94.071 145.273 87.585 1.00 31.43 N ATOM 573 HE22 GLN A 68 94.047 146.013 88.316 1.00 0.00 H ATOM 574 HE21 GLN A 68 94.811 145.287 86.854 1.00 0.00 H ATOM 575 H GLN A 68 89.702 142.882 88.874 1.00 0.00 H ATOM 576 N ILE A 69 87.627 145.250 88.381 1.00 21.06 N ATOM 577 CA ILE A 69 86.475 146.044 87.989 1.00 22.65 C ATOM 578 C ILE A 69 85.672 146.429 89.265 1.00 23.24 C ATOM 579 O ILE A 69 85.068 147.495 89.309 1.00 20.99 O ATOM 580 CB ILE A 69 85.559 145.224 86.995 1.00 19.22 C ATOM 581 CG1 ILE A 69 86.368 144.815 85.745 1.00 22.50 C ATOM 582 CG2 ILE A 69 84.275 145.979 86.645 1.00 25.14 C ATOM 583 CD1 ILE A 69 87.030 146.062 85.110 1.00 25.78 C ATOM 584 H ILE A 69 87.667 144.234 88.164 1.00 0.00 H ATOM 585 N VAL A 70 85.716 145.584 90.288 1.00 24.14 N ATOM 586 CA VAL A 70 84.956 145.875 91.529 1.00 20.23 C ATOM 587 C VAL A 70 85.285 147.269 92.071 1.00 21.49 C ATOM 588 O VAL A 70 84.404 148.030 92.457 1.00 21.11 O ATOM 589 CB VAL A 70 85.252 144.811 92.572 1.00 26.43 C ATOM 590 CG1 VAL A 70 84.572 145.152 93.901 1.00 24.63 C ATOM 591 CG2 VAL A 70 84.760 143.454 92.107 1.00 27.59 C ATOM 592 H VAL A 70 86.285 144.716 90.220 1.00 0.00 H ATOM 593 N GLY A 71 86.565 147.605 92.201 1.00 22.65 N ATOM 594 CA GLY A 71 86.888 148.905 92.745 1.00 23.59 C ATOM 595 C GLY A 71 86.486 150.063 91.838 1.00 20.28 C ATOM 596 O GLY A 71 86.240 151.143 92.305 1.00 21.76 O ATOM 597 H GLY A 71 87.318 146.946 91.917 1.00 0.00 H ATOM 598 N LEU A 72 86.524 149.838 90.515 1.00 21.20 N ATOM 599 CA LEU A 72 86.095 150.882 89.582 1.00 18.24 C ATOM 600 C LEU A 72 84.575 151.137 89.722 1.00 17.16 C ATOM 601 O LEU A 72 84.099 152.287 89.684 1.00 19.95 O ATOM 602 CB LEU A 72 86.442 150.462 88.160 1.00 19.85 C ATOM 603 CG LEU A 72 87.948 150.272 87.949 1.00 21.08 C ATOM 604 CD1 LEU A 72 88.143 149.656 86.580 1.00 23.41 C ATOM 605 CD2 LEU A 72 88.635 151.605 88.107 1.00 21.68 C ATOM 606 H LEU A 72 86.858 148.922 90.153 1.00 0.00 H ATOM 607 N VAL A 73 83.832 150.049 89.900 1.00 17.73 N ATOM 608 CA VAL A 73 82.381 150.177 90.124 1.00 18.82 C ATOM 609 C VAL A 73 82.144 150.927 91.450 1.00 17.25 C ATOM 610 O VAL A 73 81.266 151.822 91.504 1.00 18.72 O ATOM 611 CB VAL A 73 81.683 148.819 90.108 1.00 18.88 C ATOM 612 CG1 VAL A 73 80.193 148.919 90.608 1.00 19.13 C ATOM 613 CG2 VAL A 73 81.696 148.252 88.656 1.00 21.50 C ATOM 614 H VAL A 73 84.274 149.108 89.881 1.00 0.00 H ATOM 615 N ASP A 74 82.896 150.619 92.528 1.00 18.38 N ATOM 616 CA ASP A 74 82.744 151.358 93.770 1.00 17.33 C ATOM 617 C ASP A 74 83.007 152.868 93.561 1.00 20.20 C ATOM 618 O ASP A 74 82.270 153.697 94.055 1.00 21.37 O ATOM 619 CB ASP A 74 83.732 150.853 94.829 1.00 19.69 C ATOM 620 CG ASP A 74 83.268 149.610 95.573 1.00 34.59 C ATOM 621 OD1 ASP A 74 82.213 149.036 95.265 1.00 30.04 O ATOM 622 OD2 ASP A 74 84.006 149.172 96.502 1.00 46.50 O ATOM 623 H ASP A 74 83.590 149.846 92.469 1.00 0.00 H ATOM 624 N GLU A 75 84.072 153.178 92.808 1.00 20.64 N ATOM 625 CA GLU A 75 84.432 154.556 92.466 1.00 25.05 C ATOM 626 C GLU A 75 83.285 155.297 91.785 1.00 22.30 C ATOM 627 O GLU A 75 82.894 156.379 92.197 1.00 24.27 O ATOM 628 CB GLU A 75 85.659 154.536 91.546 1.00 27.69 C ATOM 629 CG GLU A 75 86.166 155.904 91.127 1.00 39.08 C ATOM 630 CD GLU A 75 87.250 156.429 92.070 1.00 44.30 C ATOM 631 OE1 GLU A 75 87.983 155.606 92.678 1.00 37.34 O ATOM 632 OE2 GLU A 75 87.348 157.667 92.216 1.00 58.68 O ATOM 633 H GLU A 75 84.669 152.405 92.451 1.00 0.00 H ATOM 634 N LEU A 76 82.669 154.642 90.811 1.00 19.57 N ATOM 635 CA LEU A 76 81.562 155.237 90.044 1.00 19.91 C ATOM 636 C LEU A 76 80.311 155.376 90.920 1.00 22.59 C ATOM 637 O LEU A 76 79.557 156.348 90.831 1.00 22.31 O ATOM 638 CB LEU A 76 81.246 154.378 88.805 1.00 19.49 C ATOM 639 CG LEU A 76 82.334 154.428 87.733 1.00 18.71 C ATOM 640 CD1 LEU A 76 82.063 153.402 86.656 1.00 19.79 C ATOM 641 CD2 LEU A 76 82.427 155.867 87.119 1.00 22.35 C ATOM 642 H LEU A 76 82.978 153.676 90.581 1.00 0.00 H ATOM 643 N GLU A 77 80.072 154.374 91.769 1.00 19.97 N ATOM 644 CA GLU A 77 78.915 154.449 92.678 1.00 24.79 C ATOM 645 C GLU A 77 79.094 155.548 93.741 1.00 26.16 C ATOM 646 O GLU A 77 78.074 156.116 94.157 1.00 28.88 O ATOM 647 CB GLU A 77 78.682 153.074 93.339 1.00 24.01 C ATOM 648 CG GLU A 77 77.234 152.881 93.881 1.00 30.08 C ATOM 649 CD GLU A 77 76.937 151.405 94.195 1.00 40.63 C ATOM 650 OE1 GLU A 77 77.108 151.039 95.386 1.00 30.21 O ATOM 651 OE2 GLU A 77 76.486 150.656 93.256 1.00 32.43 O ATOM 652 H GLU A 77 80.699 153.545 91.789 1.00 0.00 H ATOM 653 N GLU A 78 80.339 155.908 94.118 1.00 23.45 N ATOM 654 CA GLU A 78 80.608 157.019 95.044 1.00 21.95 C ATOM 655 C GLU A 78 79.980 158.323 94.520 1.00 24.30 C ATOM 656 O GLU A 78 79.654 159.226 95.283 1.00 24.56 O ATOM 657 CB GLU A 78 82.151 157.296 95.220 1.00 32.01 C ATOM 658 CG GLU A 78 82.976 156.394 96.161 1.00 35.62 C ATOM 659 CD GLU A 78 84.467 156.785 96.236 1.00 37.47 C ATOM 660 OE1 GLU A 78 84.805 157.949 95.855 1.00 34.52 O ATOM 661 OE2 GLU A 78 85.307 155.934 96.700 1.00 29.29 O ATOM 662 H GLU A 78 81.146 155.375 93.736 1.00 0.00 H ATOM 663 N ARG A 79 79.887 158.380 93.202 1.00 20.52 N ATOM 664 CA ARG A 79 79.335 159.601 92.579 1.00 23.67 C ATOM 665 C ARG A 79 77.997 159.411 91.926 1.00 23.45 C ATOM 666 O ARG A 79 77.550 160.310 91.217 1.00 27.73 O ATOM 667 CB ARG A 79 80.297 160.140 91.531 1.00 26.84 C ATOM 668 CG ARG A 79 81.628 160.494 92.149 1.00 27.80 C ATOM 669 CD ARG A 79 82.664 160.778 91.036 1.00 32.69 C ATOM 670 NE ARG A 79 82.303 161.995 90.319 1.00 28.28 N ATOM 671 CZ ARG A 79 82.835 162.350 89.141 1.00 30.27 C ATOM 672 NH1 ARG A 79 83.727 161.567 88.521 1.00 26.86 N ATOM 673 NH2 ARG A 79 82.444 163.484 88.572 1.00 30.26 N ATOM 674 HE ARG A 79 81.592 162.623 90.746 1.00 0.00 H ATOM 675 HH12 ARG A 79 84.129 161.859 87.607 1.00 0.00 H ATOM 676 HH11 ARG A 79 84.018 160.667 88.953 1.00 0.00 H ATOM 677 HH22 ARG A 79 82.847 163.773 87.658 1.00 0.00 H ATOM 678 HH21 ARG A 79 81.734 164.083 89.040 1.00 0.00 H ATOM 679 H ARG A 79 80.197 157.580 92.614 1.00 0.00 H ATOM 680 N GLY A 80 77.343 158.298 92.225 1.00 21.30 N ATOM 681 CA GLY A 80 75.990 158.065 91.726 1.00 26.27 C ATOM 682 C GLY A 80 75.948 157.916 90.205 1.00 30.23 C ATOM 683 O GLY A 80 74.909 158.277 89.606 1.00 27.49 O ATOM 684 H GLY A 80 77.799 157.580 92.823 1.00 0.00 H ATOM 685 N LEU A 81 77.024 157.423 89.578 1.00 23.38 N ATOM 686 CA LEU A 81 77.141 157.336 88.122 1.00 21.70 C ATOM 687 C LEU A 81 76.698 155.988 87.598 1.00 20.66 C ATOM 688 O LEU A 81 76.241 155.862 86.439 1.00 21.10 O ATOM 689 CB LEU A 81 78.569 157.590 87.702 1.00 19.96 C ATOM 690 CG LEU A 81 79.096 158.953 88.132 1.00 22.84 C ATOM 691 CD1 LEU A 81 80.647 159.026 87.849 1.00 23.67 C ATOM 692 CD2 LEU A 81 78.396 160.104 87.434 1.00 27.47 C ATOM 693 H LEU A 81 77.819 157.084 90.157 1.00 0.00 H ATOM 694 N VAL A 82 76.776 154.966 88.471 1.00 20.65 N ATOM 695 CA VAL A 82 76.270 153.645 88.156 1.00 22.49 C ATOM 696 C VAL A 82 75.692 153.082 89.411 1.00 23.68 C ATOM 697 O VAL A 82 75.947 153.610 90.504 1.00 22.52 O ATOM 698 CB VAL A 82 77.284 152.638 87.610 1.00 21.51 C ATOM 699 CG1 VAL A 82 78.080 153.167 86.336 1.00 20.51 C ATOM 700 CG2 VAL A 82 78.308 152.303 88.734 1.00 22.89 C ATOM 701 H VAL A 82 77.213 155.130 89.400 1.00 0.00 H ATOM 702 N VAL A 83 74.859 152.074 89.237 1.00 22.75 N ATOM 703 CA VAL A 83 74.359 151.306 90.350 1.00 23.70 C ATOM 704 C VAL A 83 74.660 149.852 90.066 1.00 24.60 C ATOM 705 O VAL A 83 74.381 149.327 88.976 1.00 24.26 O ATOM 706 CB VAL A 83 72.860 151.513 90.596 1.00 24.68 C ATOM 707 CG1 VAL A 83 72.396 150.682 91.805 1.00 26.46 C ATOM 708 CG2 VAL A 83 72.539 152.991 90.869 1.00 31.29 C ATOM 709 H VAL A 83 74.556 151.827 88.273 1.00 0.00 H ATOM 710 N ARG A 84 75.250 149.186 91.053 1.00 25.85 N ATOM 711 CA ARG A 84 75.593 147.776 90.927 1.00 26.01 C ATOM 712 C ARG A 84 74.390 146.945 91.343 1.00 37.94 C ATOM 713 O ARG A 84 73.854 147.124 92.437 1.00 37.14 O ATOM 714 CB ARG A 84 76.801 147.435 91.801 1.00 28.57 C ATOM 715 CG ARG A 84 76.962 145.951 92.087 1.00 37.64 C ATOM 716 CD ARG A 84 77.846 145.715 93.300 1.00 29.67 C ATOM 717 NE ARG A 84 79.245 146.030 93.027 1.00 27.17 N ATOM 718 CZ ARG A 84 79.923 147.004 93.626 1.00 28.32 C ATOM 719 NH1 ARG A 84 79.329 147.765 94.536 1.00 29.09 N ATOM 720 NH2 ARG A 84 81.194 147.219 93.315 1.00 24.91 N ATOM 721 HE ARG A 84 79.744 145.455 92.318 1.00 0.00 H ATOM 722 HH12 ARG A 84 79.860 148.527 95.004 1.00 0.00 H ATOM 723 HH11 ARG A 84 78.332 147.600 94.781 1.00 0.00 H ATOM 724 HH22 ARG A 84 81.723 147.982 93.785 1.00 0.00 H ATOM 725 HH21 ARG A 84 81.662 146.625 92.601 1.00 0.00 H ATOM 726 H ARG A 84 75.473 149.684 91.938 1.00 0.00 H ATOM 727 N THR A 85 73.959 146.039 90.472 1.00 31.03 N ATOM 728 CA THR A 85 72.821 145.228 90.774 1.00 42.45 C ATOM 729 C THR A 85 73.147 143.736 90.560 1.00 46.44 C ATOM 730 O THR A 85 74.212 143.379 90.054 1.00 38.97 O ATOM 731 CB THR A 85 71.598 145.752 89.956 1.00 50.13 C ATOM 732 OG1 THR A 85 71.979 145.903 88.595 1.00 51.69 O ATOM 733 CG2 THR A 85 71.211 147.116 90.382 1.00 55.45 C ATOM 734 HG1 THR A 85 71.207 146.235 88.072 1.00 0.00 H ATOM 735 H THR A 85 74.453 145.919 89.565 1.00 0.00 H ATOM 736 N LEU A 86 72.250 142.858 90.949 1.00 59.71 N ATOM 737 CA LEU A 86 72.490 141.452 90.717 1.00 61.76 C ATOM 738 C LEU A 86 71.767 141.035 89.447 1.00 55.58 C ATOM 739 O LEU A 86 72.169 140.088 88.782 1.00 68.81 O ATOM 740 CB LEU A 86 71.955 140.644 91.857 1.00 53.68 C ATOM 741 CG LEU A 86 72.406 141.104 93.211 1.00 57.86 C ATOM 742 CD1 LEU A 86 71.980 140.100 94.253 1.00 56.78 C ATOM 743 CD2 LEU A 86 73.915 141.255 93.175 1.00 63.71 C ATOM 744 H LEU A 86 71.377 143.172 91.419 1.00 0.00 H TER 745 LEU A 86 ATOM 746 N ARG A 92 74.621 135.362 91.309 1.00 80.16 N ATOM 747 CA ARG A 92 76.068 135.338 91.484 1.00 77.88 C ATOM 748 C ARG A 92 76.544 136.342 90.454 1.00 88.68 C ATOM 749 O ARG A 92 77.586 136.983 90.590 1.00 90.88 O ATOM 750 CB ARG A 92 76.630 133.951 91.182 1.00 81.04 C ATOM 751 HN3 ARG A 92 74.386 135.082 90.335 1.00 0.00 H ATOM 752 HN2 ARG A 92 74.267 136.323 91.490 1.00 0.00 H ATOM 753 HN1 ARG A 92 74.181 134.698 91.978 1.00 0.00 H ATOM 754 N ASN A 93 75.724 136.454 89.418 1.00 89.28 N ATOM 755 CA ASN A 93 75.901 137.382 88.287 1.00 88.46 C ATOM 756 C ASN A 93 75.765 138.847 88.769 1.00 83.28 C ATOM 757 O ASN A 93 74.822 139.210 89.482 1.00 83.37 O ATOM 758 CB ASN A 93 74.892 137.044 87.161 1.00 88.51 C ATOM 759 CG ASN A 93 75.090 137.860 85.878 1.00 88.08 C ATOM 760 OD1 ASN A 93 74.676 139.006 85.766 1.00 88.76 O ATOM 761 ND2 ASN A 93 75.755 137.257 84.908 1.00 93.57 N ATOM 762 HD22 ASN A 93 76.093 136.282 85.037 1.00 0.00 H ATOM 763 HD21 ASN A 93 75.941 137.758 84.016 1.00 0.00 H ATOM 764 H ASN A 93 74.887 135.836 89.402 1.00 0.00 H ATOM 765 N LYS A 94 76.693 139.708 88.371 1.00 75.81 N ATOM 766 CA LYS A 94 76.697 141.115 88.756 1.00 51.41 C ATOM 767 C LYS A 94 76.573 142.033 87.547 1.00 40.76 C ATOM 768 O LYS A 94 77.270 141.853 86.617 1.00 34.19 O ATOM 769 CB LYS A 94 78.007 141.367 89.439 1.00 51.42 C ATOM 770 CG LYS A 94 78.090 142.631 90.250 1.00 43.22 C ATOM 771 CD LYS A 94 78.570 142.301 91.633 1.00 49.23 C ATOM 772 CE LYS A 94 77.387 141.857 92.460 1.00 60.76 C ATOM 773 NZ LYS A 94 77.623 141.847 93.913 1.00 44.42 N ATOM 774 HZ1 LYS A 94 78.405 141.197 94.132 1.00 0.00 H ATOM 775 HZ2 LYS A 94 77.869 142.807 94.230 1.00 0.00 H ATOM 776 HZ3 LYS A 94 76.761 141.530 94.401 1.00 0.00 H ATOM 777 H LYS A 94 77.455 139.362 87.754 1.00 0.00 H ATOM 778 N LEU A 95 75.668 142.996 87.564 1.00 33.43 N ATOM 779 CA LEU A 95 75.518 143.924 86.435 1.00 29.53 C ATOM 780 C LEU A 95 75.722 145.363 86.855 1.00 28.52 C ATOM 781 O LEU A 95 75.579 145.736 88.022 1.00 33.07 O ATOM 782 CB LEU A 95 74.164 143.814 85.760 1.00 40.83 C ATOM 783 CG LEU A 95 73.604 142.429 85.459 1.00 43.03 C ATOM 784 CD1 LEU A 95 72.273 142.655 84.829 1.00 51.39 C ATOM 785 CD2 LEU A 95 74.473 141.570 84.572 1.00 42.93 C ATOM 786 H LEU A 95 75.049 143.099 88.394 1.00 0.00 H ATOM 787 N ILE A 96 76.115 146.187 85.896 1.00 24.02 N ATOM 788 CA ILE A 96 76.490 147.534 86.205 1.00 23.14 C ATOM 789 C ILE A 96 75.616 148.428 85.381 1.00 22.73 C ATOM 790 O ILE A 96 75.738 148.435 84.157 1.00 23.48 O ATOM 791 CB ILE A 96 77.972 147.823 85.868 1.00 21.65 C ATOM 792 CG1 ILE A 96 78.851 146.764 86.537 1.00 23.02 C ATOM 793 CG2 ILE A 96 78.321 149.252 86.150 1.00 20.93 C ATOM 794 CD1 ILE A 96 80.282 146.713 85.932 1.00 26.67 C ATOM 795 H ILE A 96 76.152 145.854 84.912 1.00 0.00 H ATOM 796 N ALA A 97 74.726 149.154 86.043 1.00 21.50 N ATOM 797 CA ALA A 97 73.689 149.880 85.309 1.00 20.31 C ATOM 798 C ALA A 97 73.985 151.357 85.398 1.00 21.99 C ATOM 799 O ALA A 97 74.198 151.909 86.492 1.00 25.88 O ATOM 800 CB ALA A 97 72.326 149.564 85.880 1.00 25.41 C ATOM 801 H ALA A 97 74.765 149.207 87.081 1.00 0.00 H ATOM 802 N ALA A 98 74.027 152.042 84.278 1.00 21.17 N ATOM 803 CA ALA A 98 74.282 153.464 84.352 1.00 19.52 C ATOM 804 C ALA A 98 73.061 154.245 84.840 1.00 25.37 C ATOM 805 O ALA A 98 71.959 153.858 84.570 1.00 28.88 O ATOM 806 CB ALA A 98 74.694 153.983 82.990 1.00 23.70 C ATOM 807 H ALA A 98 73.881 151.574 83.361 1.00 0.00 H ATOM 808 N THR A 99 73.340 155.366 85.521 1.00 21.99 N ATOM 809 CA THR A 99 72.285 156.276 85.949 1.00 24.69 C ATOM 810 C THR A 99 72.126 157.416 84.953 1.00 26.90 C ATOM 811 O THR A 99 72.981 157.592 84.111 1.00 25.76 O ATOM 812 CB THR A 99 72.612 156.880 87.362 1.00 25.45 C ATOM 813 OG1 THR A 99 73.810 157.670 87.287 1.00 24.62 O ATOM 814 CG2 THR A 99 72.805 155.748 88.388 1.00 24.42 C ATOM 815 HG1 THR A 99 74.011 158.048 88.180 1.00 0.00 H ATOM 816 H THR A 99 74.330 155.591 85.748 1.00 0.00 H ATOM 817 N GLU A 100 71.103 158.247 85.113 1.00 27.14 N ATOM 818 CA GLU A 100 70.927 159.399 84.225 1.00 27.79 C ATOM 819 C GLU A 100 72.099 160.331 84.369 1.00 23.30 C ATOM 820 O GLU A 100 72.626 160.835 83.373 1.00 27.96 O ATOM 821 CB GLU A 100 69.609 160.155 84.515 1.00 30.89 C ATOM 822 CG GLU A 100 68.393 159.434 83.972 1.00 40.23 C ATOM 823 CD GLU A 100 67.088 160.217 84.164 1.00 69.13 C ATOM 824 OE1 GLU A 100 67.125 161.472 84.216 1.00 67.38 O ATOM 825 OE2 GLU A 100 66.035 159.564 84.289 1.00 49.89 O ATOM 826 H GLU A 100 70.419 158.078 85.878 1.00 0.00 H ATOM 827 N GLU A 101 72.558 160.540 85.595 1.00 30.48 N ATOM 828 CA GLU A 101 73.777 161.339 85.794 1.00 27.40 C ATOM 829 C GLU A 101 75.017 160.717 85.185 1.00 26.02 C ATOM 830 O GLU A 101 75.885 161.435 84.692 1.00 24.52 O ATOM 831 CB GLU A 101 74.057 161.586 87.272 1.00 29.30 C ATOM 832 CG GLU A 101 73.037 162.556 87.925 1.00 48.27 C ATOM 833 CD GLU A 101 73.053 163.983 87.326 1.00 69.03 C ATOM 834 OE1 GLU A 101 74.116 164.466 86.845 1.00 70.04 O ATOM 835 OE2 GLU A 101 71.979 164.637 87.324 1.00 76.32 O ATOM 836 H GLU A 101 72.057 160.140 86.414 1.00 0.00 H ATOM 837 N GLY A 102 75.128 159.393 85.273 1.00 25.32 N ATOM 838 CA GLY A 102 76.195 158.699 84.592 1.00 22.66 C ATOM 839 C GLY A 102 76.213 158.963 83.093 1.00 23.53 C ATOM 840 O GLY A 102 77.308 159.159 82.510 1.00 23.46 O ATOM 841 H GLY A 102 74.440 158.854 85.837 1.00 0.00 H ATOM 842 N ARG A 103 75.038 158.953 82.492 1.00 24.37 N ATOM 843 CA ARG A 103 74.915 159.090 81.048 1.00 25.49 C ATOM 844 C ARG A 103 75.283 160.511 80.644 1.00 24.86 C ATOM 845 O ARG A 103 75.972 160.718 79.642 1.00 24.89 O ATOM 846 CB ARG A 103 73.516 158.708 80.592 1.00 24.84 C ATOM 847 CG ARG A 103 73.205 157.259 80.796 1.00 21.85 C ATOM 848 CD ARG A 103 71.770 156.896 80.403 1.00 24.77 C ATOM 849 NE ARG A 103 71.391 155.584 80.927 1.00 27.43 N ATOM 850 CZ ARG A 103 71.709 154.409 80.382 1.00 24.15 C ATOM 851 NH1 ARG A 103 72.412 154.328 79.254 1.00 24.21 N ATOM 852 NH2 ARG A 103 71.292 153.292 80.971 1.00 31.61 N ATOM 853 HE ARG A 103 70.825 155.566 81.799 1.00 0.00 H ATOM 854 HH12 ARG A 103 72.645 153.397 78.852 1.00 0.00 H ATOM 855 HH11 ARG A 103 72.728 155.195 78.775 1.00 0.00 H ATOM 856 HH22 ARG A 103 71.531 152.367 80.560 1.00 0.00 H ATOM 857 HH21 ARG A 103 70.727 153.343 81.843 1.00 0.00 H ATOM 858 H ARG A 103 74.177 158.844 83.065 1.00 0.00 H ATOM 859 N ARG A 104 74.835 161.487 81.430 1.00 26.30 N ATOM 860 CA ARG A 104 75.199 162.874 81.181 1.00 30.68 C ATOM 861 C ARG A 104 76.725 163.063 81.278 1.00 24.26 C ATOM 862 O ARG A 104 77.329 163.673 80.380 1.00 27.36 O ATOM 863 CB ARG A 104 74.490 163.806 82.158 1.00 33.17 C ATOM 864 CG ARG A 104 72.977 163.810 81.938 1.00 38.87 C ATOM 865 CD ARG A 104 72.258 164.858 82.752 1.00 40.58 C ATOM 866 NE ARG A 104 72.737 166.192 82.413 1.00 52.68 N ATOM 867 CZ ARG A 104 73.556 166.909 83.180 1.00 63.52 C ATOM 868 NH1 ARG A 104 73.984 166.429 84.349 1.00 49.74 N ATOM 869 NH2 ARG A 104 73.941 168.111 82.781 1.00 52.69 N ATOM 870 HE ARG A 104 72.419 166.610 81.515 1.00 0.00 H ATOM 871 HH12 ARG A 104 74.624 166.996 84.941 1.00 0.00 H ATOM 872 HH11 ARG A 104 73.678 165.488 84.668 1.00 0.00 H ATOM 873 HH22 ARG A 104 74.581 168.676 83.375 1.00 0.00 H ATOM 874 HH21 ARG A 104 73.604 168.490 81.873 1.00 0.00 H ATOM 875 H ARG A 104 74.216 161.255 82.233 1.00 0.00 H ATOM 876 N LEU A 105 77.370 162.557 82.338 1.00 24.30 N ATOM 877 CA LEU A 105 78.825 162.725 82.479 1.00 25.54 C ATOM 878 C LEU A 105 79.583 161.993 81.375 1.00 22.97 C ATOM 879 O LEU A 105 80.543 162.527 80.823 1.00 26.00 O ATOM 880 CB LEU A 105 79.280 162.224 83.865 1.00 23.70 C ATOM 881 CG LEU A 105 80.776 162.507 84.114 1.00 26.37 C ATOM 882 CD1 LEU A 105 81.069 164.008 84.144 1.00 30.93 C ATOM 883 CD2 LEU A 105 81.274 161.855 85.373 1.00 29.14 C ATOM 884 H LEU A 105 76.838 162.041 83.067 1.00 0.00 H ATOM 885 N ARG A 106 79.082 160.824 80.965 1.00 21.64 N ATOM 886 CA ARG A 106 79.682 160.072 79.855 1.00 22.56 C ATOM 887 C ARG A 106 79.747 160.915 78.583 1.00 23.76 C ATOM 888 O ARG A 106 80.763 160.927 77.891 1.00 26.93 O ATOM 889 CB ARG A 106 78.889 158.791 79.579 1.00 22.82 C ATOM 890 CG ARG A 106 79.673 157.810 78.676 1.00 27.38 C ATOM 891 CD ARG A 106 78.823 157.192 77.704 1.00 49.40 C ATOM 892 NE ARG A 106 78.568 158.113 76.643 1.00 42.25 N ATOM 893 CZ ARG A 106 79.135 158.017 75.447 1.00 55.99 C ATOM 894 NH1 ARG A 106 79.994 157.027 75.205 1.00 65.86 N ATOM 895 NH2 ARG A 106 78.848 158.914 74.501 1.00 43.75 N ATOM 896 HE ARG A 106 77.906 158.897 76.816 1.00 0.00 H ATOM 897 HH12 ARG A 106 80.443 156.945 74.270 1.00 0.00 H ATOM 898 HH11 ARG A 106 80.216 156.337 75.951 1.00 0.00 H ATOM 899 HH22 ARG A 106 79.291 158.841 73.563 1.00 0.00 H ATOM 900 HH21 ARG A 106 78.181 159.686 74.702 1.00 0.00 H ATOM 901 H ARG A 106 78.245 160.436 81.445 1.00 0.00 H ATOM 902 N ASP A 107 78.699 161.640 78.289 1.00 27.75 N ATOM 903 CA ASP A 107 78.738 162.505 77.115 1.00 29.22 C ATOM 904 C ASP A 107 79.763 163.636 77.200 1.00 31.11 C ATOM 905 O ASP A 107 80.518 163.902 76.232 1.00 31.19 O ATOM 906 CB ASP A 107 77.360 163.065 76.908 1.00 36.12 C ATOM 907 CG ASP A 107 76.517 162.145 76.105 1.00 52.24 C ATOM 908 OD1 ASP A 107 76.864 160.937 76.026 1.00 43.15 O ATOM 909 OD2 ASP A 107 75.521 162.634 75.555 1.00 48.64 O ATOM 910 H ASP A 107 77.848 161.600 78.885 1.00 0.00 H ATOM 911 N ASP A 108 79.803 164.294 78.352 1.00 28.53 N ATOM 912 CA ASP A 108 80.805 165.329 78.541 1.00 28.19 C ATOM 913 C ASP A 108 82.245 164.778 78.474 1.00 29.73 C ATOM 914 O ASP A 108 83.146 165.361 77.813 1.00 29.13 O ATOM 915 CB ASP A 108 80.564 166.012 79.861 1.00 24.91 C ATOM 916 CG ASP A 108 81.508 167.150 80.084 1.00 39.74 C ATOM 917 OD1 ASP A 108 81.367 168.186 79.384 1.00 54.11 O ATOM 918 OD2 ASP A 108 82.385 167.033 80.952 1.00 39.13 O ATOM 919 H ASP A 108 79.126 164.072 79.109 1.00 0.00 H ATOM 920 N ALA A 109 82.479 163.648 79.131 1.00 27.16 N ATOM 921 CA ALA A 109 83.801 163.062 79.080 1.00 26.68 C ATOM 922 C ALA A 109 84.176 162.655 77.647 1.00 28.16 C ATOM 923 O ALA A 109 85.334 162.864 77.225 1.00 27.22 O ATOM 924 CB ALA A 109 83.856 161.878 80.038 1.00 24.15 C ATOM 925 H ALA A 109 81.721 163.190 79.676 1.00 0.00 H ATOM 926 N LYS A 110 83.246 162.055 76.919 1.00 26.45 N ATOM 927 CA LYS A 110 83.597 161.574 75.580 1.00 30.86 C ATOM 928 C LYS A 110 84.011 162.718 74.641 1.00 27.50 C ATOM 929 O LYS A 110 84.834 162.530 73.750 1.00 26.60 O ATOM 930 CB LYS A 110 82.449 160.778 74.937 1.00 28.16 C ATOM 931 CG LYS A 110 82.805 160.309 73.495 1.00 38.41 C ATOM 932 CD LYS A 110 82.041 159.073 73.082 1.00 50.74 C ATOM 933 CE LYS A 110 82.573 158.458 71.768 1.00 47.90 C ATOM 934 NZ LYS A 110 82.469 159.381 70.622 1.00 41.02 N ATOM 935 HZ1 LYS A 110 81.472 159.636 70.473 1.00 0.00 H ATOM 936 HZ2 LYS A 110 83.022 160.239 70.819 1.00 0.00 H ATOM 937 HZ3 LYS A 110 82.840 158.916 69.769 1.00 0.00 H ATOM 938 H LYS A 110 82.283 161.927 77.291 1.00 0.00 H ATOM 939 N ALA A 111 83.402 163.892 74.780 1.00 25.69 N ATOM 940 CA ALA A 111 83.831 164.999 73.955 1.00 32.38 C ATOM 941 C ALA A 111 85.308 165.396 74.258 1.00 28.29 C ATOM 942 O ALA A 111 86.050 165.787 73.339 1.00 30.35 O ATOM 943 CB ALA A 111 82.902 166.194 74.133 1.00 33.10 C ATOM 944 H ALA A 111 82.632 164.011 75.469 1.00 0.00 H ATOM 945 N ARG A 112 85.711 165.270 75.521 1.00 26.42 N ATOM 946 CA ARG A 112 87.105 165.570 75.925 1.00 25.07 C ATOM 947 C ARG A 112 88.033 164.499 75.433 1.00 27.15 C ATOM 948 O ARG A 112 89.129 164.814 74.977 1.00 26.43 O ATOM 949 CB ARG A 112 87.214 165.689 77.443 1.00 28.10 C ATOM 950 CG ARG A 112 86.283 166.781 77.983 1.00 29.48 C ATOM 951 CD ARG A 112 86.261 166.830 79.507 1.00 33.79 C ATOM 952 NE ARG A 112 85.199 167.759 79.911 1.00 33.08 N ATOM 953 CZ ARG A 112 85.367 169.067 80.055 1.00 38.67 C ATOM 954 NH1 ARG A 112 86.560 169.613 79.884 1.00 35.50 N ATOM 955 NH2 ARG A 112 84.318 169.839 80.370 1.00 46.22 N ATOM 956 HE ARG A 112 84.254 167.367 80.096 1.00 0.00 H ATOM 957 HH12 ARG A 112 86.683 170.639 79.999 1.00 0.00 H ATOM 958 HH11 ARG A 112 87.374 169.016 79.635 1.00 0.00 H ATOM 959 HH22 ARG A 112 84.443 170.865 80.484 1.00 0.00 H ATOM 960 HH21 ARG A 112 83.379 169.412 80.500 1.00 0.00 H ATOM 961 H ARG A 112 85.031 164.953 76.241 1.00 0.00 H ATOM 962 N VAL A 113 87.553 163.265 75.483 1.00 25.99 N ATOM 963 CA VAL A 113 88.333 162.127 75.044 1.00 24.66 C ATOM 964 C VAL A 113 88.519 162.199 73.543 1.00 29.20 C ATOM 965 O VAL A 113 89.637 162.045 73.038 1.00 30.89 O ATOM 966 CB VAL A 113 87.649 160.805 75.470 1.00 26.08 C ATOM 967 CG1 VAL A 113 88.319 159.603 74.803 1.00 30.55 C ATOM 968 CG2 VAL A 113 87.711 160.681 76.946 1.00 29.21 C ATOM 969 H VAL A 113 86.591 163.110 75.847 1.00 0.00 H ATOM 970 N ASP A 114 87.447 162.481 72.793 1.00 28.64 N ATOM 971 CA ASP A 114 87.596 162.632 71.337 1.00 30.93 C ATOM 972 C ASP A 114 88.624 163.688 70.958 1.00 40.67 C ATOM 973 O ASP A 114 89.402 163.497 70.013 1.00 36.02 O ATOM 974 CB ASP A 114 86.277 163.030 70.685 1.00 32.37 C ATOM 975 CG ASP A 114 85.265 161.905 70.661 1.00 41.21 C ATOM 976 OD1 ASP A 114 85.630 160.724 70.826 1.00 38.89 O ATOM 977 OD2 ASP A 114 84.070 162.219 70.460 1.00 44.29 O ATOM 978 H ASP A 114 86.513 162.593 73.237 1.00 0.00 H ATOM 979 N ALA A 115 88.589 164.819 71.652 1.00 29.81 N ATOM 980 CA ALA A 115 89.516 165.902 71.368 1.00 34.62 C ATOM 981 C ALA A 115 90.947 165.484 71.635 1.00 38.61 C ATOM 982 O ALA A 115 91.843 165.849 70.876 1.00 35.94 O ATOM 983 CB ALA A 115 89.186 167.098 72.210 1.00 31.89 C ATOM 984 H ALA A 115 87.887 164.932 72.411 1.00 0.00 H ATOM 985 N ALA A 116 91.164 164.785 72.749 1.00 31.69 N ATOM 986 CA ALA A 116 92.500 164.296 73.088 1.00 30.00 C ATOM 987 C ALA A 116 92.980 163.429 71.918 1.00 39.97 C ATOM 988 O ALA A 116 94.144 163.548 71.472 1.00 33.90 O ATOM 989 CB ALA A 116 92.486 163.546 74.374 1.00 28.65 C ATOM 990 H ALA A 116 90.369 164.584 73.389 1.00 0.00 H ATOM 991 N HIS A 117 92.061 162.609 71.369 1.00 37.88 N ATOM 992 CA HIS A 117 92.351 161.850 70.120 1.00 45.17 C ATOM 993 C HIS A 117 92.671 162.738 68.963 1.00 42.29 C ATOM 994 O HIS A 117 93.674 162.544 68.271 1.00 53.21 O ATOM 995 CB HIS A 117 91.172 160.970 69.674 1.00 49.16 C ATOM 996 CG HIS A 117 90.795 159.919 70.654 1.00 48.05 C ATOM 997 ND1 HIS A 117 89.617 159.207 70.553 1.00 45.53 N ATOM 998 CD2 HIS A 117 91.403 159.483 71.782 1.00 50.65 C ATOM 999 CE1 HIS A 117 89.518 158.385 71.576 1.00 34.66 C ATOM 1000 NE2 HIS A 117 90.591 158.525 72.336 1.00 38.24 N ATOM 1001 H HIS A 117 91.133 162.504 71.826 1.00 0.00 H ATOM 1002 N GLY A 118 91.767 163.679 68.709 1.00 45.03 N ATOM 1003 CA GLY A 118 91.883 164.571 67.586 1.00 49.73 C ATOM 1004 C GLY A 118 93.274 165.135 67.546 1.00 49.88 C ATOM 1005 O GLY A 118 93.845 165.305 66.484 1.00 50.53 O ATOM 1006 H GLY A 118 90.948 163.774 69.343 1.00 0.00 H ATOM 1007 N ARG A 119 93.851 165.398 68.706 1.00 32.85 N ATOM 1008 CA ARG A 119 95.156 166.043 68.721 1.00 32.49 C ATOM 1009 C ARG A 119 96.245 165.107 68.208 1.00 36.61 C ATOM 1010 O ARG A 119 97.167 165.546 67.538 1.00 33.15 O ATOM 1011 CB ARG A 119 95.477 166.540 70.107 1.00 29.76 C ATOM 1012 CG ARG A 119 94.631 167.769 70.422 1.00 40.68 C ATOM 1013 CD ARG A 119 95.151 168.493 71.612 1.00 38.69 C ATOM 1014 NE ARG A 119 94.874 167.747 72.832 1.00 41.29 N ATOM 1015 CZ ARG A 119 93.751 167.863 73.529 1.00 48.64 C ATOM 1016 NH1 ARG A 119 93.567 167.151 74.637 1.00 39.40 N ATOM 1017 NH2 ARG A 119 92.812 168.701 73.115 1.00 49.10 N ATOM 1018 HE ARG A 119 95.598 167.085 73.177 1.00 0.00 H ATOM 1019 HH12 ARG A 119 92.684 167.248 75.177 1.00 0.00 H ATOM 1020 HH11 ARG A 119 94.307 166.497 74.964 1.00 0.00 H ATOM 1021 HH22 ARG A 119 91.928 168.799 73.654 1.00 0.00 H ATOM 1022 HH21 ARG A 119 92.959 169.261 72.251 1.00 0.00 H ATOM 1023 H ARG A 119 93.378 165.147 69.598 1.00 0.00 H ATOM 1024 N TYR A 120 96.156 163.832 68.521 1.00 28.69 N ATOM 1025 CA TYR A 120 97.183 162.903 68.110 1.00 29.61 C ATOM 1026 C TYR A 120 96.975 162.398 66.704 1.00 28.79 C ATOM 1027 O TYR A 120 97.942 162.064 66.036 1.00 33.04 O ATOM 1028 CB TYR A 120 97.257 161.711 69.094 1.00 31.38 C ATOM 1029 CG TYR A 120 97.891 162.147 70.386 1.00 28.28 C ATOM 1030 CD1 TYR A 120 97.131 162.648 71.424 1.00 31.62 C ATOM 1031 CD2 TYR A 120 99.264 162.177 70.532 1.00 34.05 C ATOM 1032 CE1 TYR A 120 97.685 163.065 72.562 1.00 37.49 C ATOM 1033 CE2 TYR A 120 99.821 162.589 71.676 1.00 38.03 C ATOM 1034 CZ TYR A 120 99.042 163.053 72.708 1.00 34.38 C ATOM 1035 OH TYR A 120 99.607 163.492 73.870 1.00 42.88 O ATOM 1036 HH TYR A 120 100.124 162.756 74.283 1.00 0.00 H ATOM 1037 H TYR A 120 95.340 163.491 69.068 1.00 0.00 H ATOM 1038 N PHE A 121 95.746 162.372 66.218 1.00 29.66 N ATOM 1039 CA PHE A 121 95.549 161.820 64.879 1.00 31.48 C ATOM 1040 C PHE A 121 95.265 162.873 63.823 1.00 46.45 C ATOM 1041 O PHE A 121 94.859 162.550 62.697 1.00 38.03 O ATOM 1042 CB PHE A 121 94.429 160.781 64.870 1.00 30.25 C ATOM 1043 CG PHE A 121 94.871 159.424 65.314 1.00 33.39 C ATOM 1044 CD1 PHE A 121 94.826 159.074 66.664 1.00 29.26 C ATOM 1045 CD2 PHE A 121 95.339 158.500 64.394 1.00 28.71 C ATOM 1046 CE1 PHE A 121 95.225 157.827 67.072 1.00 31.21 C ATOM 1047 CE2 PHE A 121 95.746 157.253 64.808 1.00 26.47 C ATOM 1048 CZ PHE A 121 95.686 156.905 66.116 1.00 28.65 C ATOM 1049 H PHE A 121 94.943 162.733 66.772 1.00 0.00 H ATOM 1050 N GLU A 122 95.527 164.131 64.162 1.00 40.48 N ATOM 1051 CA GLU A 122 95.298 165.150 63.143 1.00 45.71 C ATOM 1052 C GLU A 122 96.257 164.874 61.985 1.00 44.02 C ATOM 1053 O GLU A 122 97.435 164.588 62.203 1.00 42.98 O ATOM 1054 CB GLU A 122 95.487 166.566 63.704 1.00 51.72 C ATOM 1055 CG GLU A 122 95.548 167.667 62.621 1.00 67.82 C ATOM 1056 CD GLU A 122 94.157 168.144 62.213 1.00 86.84 C ATOM 1057 OE1 GLU A 122 93.194 167.801 62.942 1.00 95.00 O ATOM 1058 OE2 GLU A 122 94.020 168.852 61.178 1.00 86.34 O ATOM 1059 H GLU A 122 95.879 164.378 65.109 1.00 0.00 H ATOM 1060 N GLY A 123 95.717 164.990 60.775 1.00 42.79 N ATOM 1061 CA GLY A 123 96.519 164.781 59.588 1.00 46.67 C ATOM 1062 C GLY A 123 96.598 163.312 59.207 1.00 46.79 C ATOM 1063 O GLY A 123 97.225 162.964 58.196 1.00 46.64 O ATOM 1064 H GLY A 123 94.710 165.233 60.681 1.00 0.00 H ATOM 1065 N ILE A 124 95.981 162.453 60.010 1.00 35.20 N ATOM 1066 CA ILE A 124 95.885 161.029 59.679 1.00 31.15 C ATOM 1067 C ILE A 124 94.471 160.754 59.177 1.00 30.72 C ATOM 1068 O ILE A 124 93.511 160.963 59.870 1.00 35.22 O ATOM 1069 CB ILE A 124 96.256 160.135 60.900 1.00 36.97 C ATOM 1070 CG1 ILE A 124 97.747 160.339 61.222 1.00 35.38 C ATOM 1071 CG2 ILE A 124 95.939 158.646 60.624 1.00 31.85 C ATOM 1072 CD1 ILE A 124 98.160 159.741 62.529 1.00 40.42 C ATOM 1073 H ILE A 124 95.556 162.799 60.894 1.00 0.00 H ATOM 1074 N PRO A 125 94.335 160.312 57.913 1.00 29.59 N ATOM 1075 CA PRO A 125 92.978 160.165 57.364 1.00 32.76 C ATOM 1076 C PRO A 125 92.167 159.012 57.969 1.00 28.23 C ATOM 1077 O PRO A 125 92.710 158.060 58.529 1.00 25.62 O ATOM 1078 CB PRO A 125 93.233 159.915 55.873 1.00 33.02 C ATOM 1079 CG PRO A 125 94.612 159.385 55.784 1.00 31.41 C ATOM 1080 CD PRO A 125 95.396 159.873 56.990 1.00 31.38 C ATOM 1081 N ASP A 126 90.855 159.106 57.824 1.00 28.37 N ATOM 1082 CA ASP A 126 89.977 158.102 58.396 1.00 29.19 C ATOM 1083 C ASP A 126 90.243 156.730 57.832 1.00 29.44 C ATOM 1084 O ASP A 126 90.109 155.781 58.557 1.00 27.92 O ATOM 1085 CB ASP A 126 88.512 158.479 58.173 1.00 37.25 C ATOM 1086 CG ASP A 126 88.124 159.735 58.930 1.00 55.00 C ATOM 1087 OD1 ASP A 126 88.801 160.050 59.941 1.00 48.52 O ATOM 1088 OD2 ASP A 126 87.154 160.401 58.496 1.00 65.11 O ATOM 1089 H ASP A 126 90.450 159.905 57.296 1.00 0.00 H ATOM 1090 N THR A 127 90.650 156.625 56.553 1.00 24.41 N ATOM 1091 CA THR A 127 90.992 155.310 56.014 1.00 22.49 C ATOM 1092 C THR A 127 92.093 154.642 56.805 1.00 20.27 C ATOM 1093 O THR A 127 92.072 153.417 57.014 1.00 22.71 O ATOM 1094 CB THR A 127 91.469 155.362 54.527 1.00 24.41 C ATOM 1095 OG1 THR A 127 92.397 156.430 54.349 1.00 27.32 O ATOM 1096 CG2 THR A 127 90.296 155.647 53.512 1.00 26.52 C ATOM 1097 HG1 THR A 127 92.693 156.454 53.405 1.00 0.00 H ATOM 1098 H THR A 127 90.720 157.472 55.954 1.00 0.00 H ATOM 1099 N VAL A 128 93.059 155.428 57.284 1.00 20.23 N ATOM 1100 CA VAL A 128 94.138 154.827 58.088 1.00 19.25 C ATOM 1101 C VAL A 128 93.659 154.471 59.483 1.00 18.72 C ATOM 1102 O VAL A 128 93.971 153.374 59.980 1.00 21.24 O ATOM 1103 CB VAL A 128 95.344 155.798 58.113 1.00 19.56 C ATOM 1104 CG1 VAL A 128 96.483 155.289 59.070 1.00 20.48 C ATOM 1105 CG2 VAL A 128 95.917 155.994 56.723 1.00 22.68 C ATOM 1106 H VAL A 128 93.051 156.450 57.093 1.00 0.00 H ATOM 1107 N VAL A 129 92.886 155.360 60.083 1.00 21.80 N ATOM 1108 CA VAL A 129 92.304 155.045 61.394 1.00 23.05 C ATOM 1109 C VAL A 129 91.442 153.788 61.307 1.00 21.53 C ATOM 1110 O VAL A 129 91.512 152.930 62.200 1.00 20.58 O ATOM 1111 CB VAL A 129 91.490 156.247 61.946 1.00 24.37 C ATOM 1112 CG1 VAL A 129 90.853 155.841 63.295 1.00 23.91 C ATOM 1113 CG2 VAL A 129 92.446 157.401 62.226 1.00 27.18 C ATOM 1114 H VAL A 129 92.692 156.276 59.630 1.00 0.00 H ATOM 1115 N ASN A 130 90.639 153.645 60.249 1.00 20.03 N ATOM 1116 CA ASN A 130 89.743 152.493 60.140 1.00 19.31 C ATOM 1117 C ASN A 130 90.536 151.185 60.047 1.00 17.78 C ATOM 1118 O ASN A 130 90.151 150.184 60.616 1.00 20.48 O ATOM 1119 CB ASN A 130 88.791 152.620 58.931 1.00 20.02 C ATOM 1120 CG ASN A 130 87.802 153.799 59.050 1.00 25.31 C ATOM 1121 OD1 ASN A 130 87.537 154.280 60.151 1.00 24.01 O ATOM 1122 ND2 ASN A 130 87.269 154.267 57.929 1.00 25.09 N ATOM 1123 HD22 ASN A 130 87.516 153.835 57.016 1.00 0.00 H ATOM 1124 HD21 ASN A 130 86.604 155.066 57.963 1.00 0.00 H ATOM 1125 H ASN A 130 90.651 154.360 59.494 1.00 0.00 H ATOM 1126 N GLN A 131 91.610 151.161 59.278 1.00 18.32 N ATOM 1127 CA GLN A 131 92.425 149.968 59.214 1.00 18.06 C ATOM 1128 C GLN A 131 93.076 149.682 60.541 1.00 18.55 C ATOM 1129 O GLN A 131 93.117 148.522 60.950 1.00 18.80 O ATOM 1130 CB GLN A 131 93.444 150.098 58.078 1.00 16.87 C ATOM 1131 CG GLN A 131 94.291 148.838 57.981 1.00 19.02 C ATOM 1132 CD GLN A 131 95.128 148.801 56.750 1.00 17.44 C ATOM 1133 OE1 GLN A 131 96.335 148.917 56.824 1.00 19.65 O ATOM 1134 NE2 GLN A 131 94.496 148.651 55.579 1.00 21.94 N ATOM 1135 HE22 GLN A 131 93.461 148.555 55.555 1.00 0.00 H ATOM 1136 HE21 GLN A 131 95.040 148.631 54.693 1.00 0.00 H ATOM 1137 H GLN A 131 91.869 151.999 58.719 1.00 0.00 H ATOM 1138 N MET A 132 93.597 150.718 61.187 1.00 20.48 N ATOM 1139 CA MET A 132 94.171 150.502 62.540 1.00 19.81 C ATOM 1140 C MET A 132 93.153 149.941 63.506 1.00 17.24 C ATOM 1141 O MET A 132 93.478 148.997 64.266 1.00 18.48 O ATOM 1142 CB MET A 132 94.736 151.809 63.069 1.00 22.75 C ATOM 1143 CG MET A 132 96.015 152.131 62.335 1.00 33.61 C ATOM 1144 SD MET A 132 96.939 153.472 63.138 1.00 50.64 S ATOM 1145 CE MET A 132 96.608 153.143 64.873 1.00 18.70 C ATOM 1146 H MET A 132 93.603 151.663 60.754 1.00 0.00 H ATOM 1147 N ARG A 133 91.925 150.465 63.431 1.00 17.48 N ATOM 1148 CA ARG A 133 90.875 149.970 64.328 1.00 17.07 C ATOM 1149 C ARG A 133 90.646 148.476 64.108 1.00 20.59 C ATOM 1150 O ARG A 133 90.596 147.679 65.086 1.00 20.96 O ATOM 1151 CB ARG A 133 89.597 150.764 64.113 1.00 22.00 C ATOM 1152 CG ARG A 133 88.397 150.280 64.983 1.00 21.32 C ATOM 1153 CD ARG A 133 87.057 151.042 64.701 1.00 23.23 C ATOM 1154 NE ARG A 133 87.229 152.457 65.014 1.00 25.93 N ATOM 1155 CZ ARG A 133 87.351 153.406 64.082 1.00 25.24 C ATOM 1156 NH1 ARG A 133 87.294 153.059 62.803 1.00 27.50 N ATOM 1157 NH2 ARG A 133 87.552 154.671 64.448 1.00 28.74 N ATOM 1158 HE ARG A 133 87.258 152.741 66.014 1.00 0.00 H ATOM 1159 HH12 ARG A 133 87.387 153.784 62.063 1.00 0.00 H ATOM 1160 HH11 ARG A 133 87.156 152.062 62.540 1.00 0.00 H ATOM 1161 HH22 ARG A 133 87.647 155.413 63.725 1.00 0.00 H ATOM 1162 HH21 ARG A 133 87.613 154.917 65.457 1.00 0.00 H ATOM 1163 H ARG A 133 91.716 151.217 62.743 1.00 0.00 H ATOM 1164 N ASP A 134 90.492 148.065 62.875 1.00 19.99 N ATOM 1165 CA ASP A 134 90.268 146.675 62.589 1.00 20.36 C ATOM 1166 C ASP A 134 91.423 145.810 63.079 1.00 20.50 C ATOM 1167 O ASP A 134 91.209 144.764 63.627 1.00 22.52 O ATOM 1168 CB ASP A 134 90.190 146.436 61.075 1.00 25.02 C ATOM 1169 CG ASP A 134 88.954 147.020 60.396 1.00 43.12 C ATOM 1170 OD1 ASP A 134 88.010 147.443 61.017 1.00 35.64 O ATOM 1171 OD2 ASP A 134 88.984 147.053 59.165 1.00 39.99 O ATOM 1172 H ASP A 134 90.532 148.751 62.095 1.00 0.00 H ATOM 1173 N THR A 135 92.651 146.253 62.833 1.00 21.36 N ATOM 1174 CA THR A 135 93.806 145.462 63.210 1.00 19.77 C ATOM 1175 C THR A 135 93.887 145.306 64.723 1.00 20.28 C ATOM 1176 O THR A 135 94.182 144.194 65.242 1.00 20.12 O ATOM 1177 CB THR A 135 95.081 146.123 62.680 1.00 23.02 C ATOM 1178 OG1 THR A 135 94.915 146.247 61.250 1.00 23.91 O ATOM 1179 CG2 THR A 135 96.307 145.262 62.986 1.00 22.89 C ATOM 1180 HG1 THR A 135 94.120 146.806 61.058 1.00 0.00 H ATOM 1181 H THR A 135 92.785 147.173 62.367 1.00 0.00 H ATOM 1182 N LEU A 136 93.695 146.426 65.414 1.00 18.79 N ATOM 1183 CA LEU A 136 93.772 146.346 66.891 1.00 18.82 C ATOM 1184 C LEU A 136 92.651 145.485 67.480 1.00 21.47 C ATOM 1185 O LEU A 136 92.847 144.737 68.431 1.00 18.25 O ATOM 1186 CB LEU A 136 93.736 147.740 67.531 1.00 18.09 C ATOM 1187 CG LEU A 136 94.960 148.585 67.101 1.00 19.21 C ATOM 1188 CD1 LEU A 136 94.721 150.037 67.547 1.00 22.01 C ATOM 1189 CD2 LEU A 136 96.232 148.030 67.696 1.00 26.27 C ATOM 1190 H LEU A 136 93.498 147.327 64.934 1.00 0.00 H ATOM 1191 N GLN A 137 91.459 145.546 66.877 1.00 18.45 N ATOM 1192 CA GLN A 137 90.362 144.706 67.341 1.00 19.43 C ATOM 1193 C GLN A 137 90.713 143.235 67.114 1.00 21.62 C ATOM 1194 O GLN A 137 90.359 142.376 67.950 1.00 22.61 O ATOM 1195 CB GLN A 137 89.119 145.071 66.589 1.00 19.86 C ATOM 1196 CG GLN A 137 88.508 146.358 67.098 1.00 19.75 C ATOM 1197 CD GLN A 137 87.333 146.839 66.245 1.00 24.27 C ATOM 1198 OE1 GLN A 137 87.142 146.410 65.075 1.00 24.29 O ATOM 1199 NE2 GLN A 137 86.522 147.711 66.808 1.00 22.54 N ATOM 1200 HE22 GLN A 137 86.708 148.045 67.775 1.00 0.00 H ATOM 1201 HE21 GLN A 137 85.696 148.066 66.285 1.00 0.00 H ATOM 1202 H GLN A 137 91.315 146.194 66.076 1.00 0.00 H ATOM 1203 N SER A 138 91.385 142.933 65.981 1.00 21.98 N ATOM 1204 CA SER A 138 91.727 141.527 65.733 1.00 22.70 C ATOM 1205 C SER A 138 92.735 140.993 66.759 1.00 23.69 C ATOM 1206 O SER A 138 92.762 139.806 67.010 1.00 25.23 O ATOM 1207 CB SER A 138 92.255 141.323 64.313 1.00 25.50 C ATOM 1208 OG SER A 138 93.592 141.769 64.158 1.00 29.97 O ATOM 1209 HG SER A 138 93.642 142.736 64.365 1.00 0.00 H ATOM 1210 H SER A 138 91.652 143.676 65.304 1.00 0.00 H ATOM 1211 N ILE A 139 93.519 141.894 67.348 1.00 21.52 N ATOM 1212 CA ILE A 139 94.504 141.483 68.373 1.00 19.91 C ATOM 1213 C ILE A 139 93.865 141.357 69.742 1.00 23.86 C ATOM 1214 O ILE A 139 94.047 140.352 70.429 1.00 25.43 O ATOM 1215 CB ILE A 139 95.655 142.493 68.441 1.00 20.05 C ATOM 1216 CG1 ILE A 139 96.401 142.468 67.105 1.00 24.33 C ATOM 1217 CG2 ILE A 139 96.642 142.129 69.595 1.00 21.13 C ATOM 1218 CD1 ILE A 139 97.346 143.638 66.900 1.00 21.52 C ATOM 1219 H ILE A 139 93.438 142.897 67.085 1.00 0.00 H ATOM 1220 N ALA A 140 93.070 142.354 70.106 1.00 21.51 N ATOM 1221 CA ALA A 140 92.476 142.357 71.433 1.00 22.43 C ATOM 1222 C ALA A 140 91.325 141.357 71.563 1.00 25.02 C ATOM 1223 O ALA A 140 91.095 140.780 72.638 1.00 26.90 O ATOM 1224 CB ALA A 140 91.982 143.724 71.757 1.00 23.37 C ATOM 1225 H ALA A 140 92.872 143.131 69.444 1.00 0.00 H ATOM 1226 N PHE A 141 90.610 141.136 70.458 1.00 22.78 N ATOM 1227 CA PHE A 141 89.408 140.311 70.462 1.00 25.62 C ATOM 1228 C PHE A 141 89.478 139.223 69.362 1.00 25.23 C ATOM 1229 O PHE A 141 88.652 139.202 68.428 1.00 29.54 O ATOM 1230 CB PHE A 141 88.162 141.224 70.293 1.00 25.23 C ATOM 1231 CG PHE A 141 88.144 142.396 71.289 1.00 25.40 C ATOM 1232 CD1 PHE A 141 88.009 142.155 72.648 1.00 31.19 C ATOM 1233 CD2 PHE A 141 88.270 143.709 70.844 1.00 24.70 C ATOM 1234 CE1 PHE A 141 88.036 143.219 73.581 1.00 27.26 C ATOM 1235 CE2 PHE A 141 88.290 144.791 71.753 1.00 27.13 C ATOM 1236 CZ PHE A 141 88.184 144.554 73.095 1.00 25.47 C ATOM 1237 H PHE A 141 90.921 141.567 69.564 1.00 0.00 H ATOM 1238 N PRO A 142 90.461 138.308 69.455 1.00 26.07 N ATOM 1239 CA PRO A 142 90.520 137.273 68.397 1.00 33.44 C ATOM 1240 C PRO A 142 89.369 136.237 68.427 1.00 41.08 C ATOM 1241 O PRO A 142 88.722 136.038 69.454 1.00 41.54 O ATOM 1242 CB PRO A 142 91.842 136.562 68.679 1.00 37.79 C ATOM 1243 CG PRO A 142 91.981 136.668 70.179 1.00 38.95 C ATOM 1244 CD PRO A 142 91.454 138.062 70.522 1.00 31.74 C ATOM 1245 N THR A 143 89.169 135.542 67.308 1.00 46.88 N ATOM 1246 CA THR A 143 88.067 134.575 67.153 1.00 55.02 C ATOM 1247 C THR A 143 88.291 133.307 67.995 1.00 66.34 C ATOM 1248 O THR A 143 87.346 132.660 68.483 1.00 53.29 O ATOM 1249 CB THR A 143 87.889 134.185 65.666 1.00 63.14 C ATOM 1250 OG1 THR A 143 87.607 135.362 64.896 1.00 68.76 O ATOM 1251 CG2 THR A 143 86.744 133.190 65.493 1.00 66.64 C ATOM 1252 HG1 THR A 143 87.493 135.113 63.945 1.00 0.00 H ATOM 1253 H THR A 143 89.819 135.688 66.509 1.00 0.00 H ATOM 1254 N PHE A 144 89.559 132.953 68.150 1.00 54.70 N ATOM 1255 CA PHE A 144 89.937 131.909 69.075 1.00 60.69 C ATOM 1256 C PHE A 144 91.377 132.157 69.514 1.00 54.38 C ATOM 1257 O PHE A 144 92.098 132.964 68.923 1.00 39.57 O ATOM 1258 CB PHE A 144 89.744 130.504 68.451 1.00 54.14 C ATOM 1259 CG PHE A 144 90.775 130.132 67.398 1.00 61.19 C ATOM 1260 CD1 PHE A 144 91.906 129.397 67.734 1.00 59.52 C ATOM 1261 CD2 PHE A 144 90.603 130.505 66.072 1.00 54.81 C ATOM 1262 CE1 PHE A 144 92.852 129.048 66.768 1.00 59.91 C ATOM 1263 CE2 PHE A 144 91.549 130.158 65.102 1.00 61.43 C ATOM 1264 CZ PHE A 144 92.671 129.426 65.456 1.00 58.78 C ATOM 1265 H PHE A 144 90.295 133.435 67.596 1.00 0.00 H ATOM 1266 N VAL A 145 91.778 131.452 70.566 1.00 57.33 N ATOM 1267 CA VAL A 145 93.116 131.598 71.103 1.00 74.12 C ATOM 1268 C VAL A 145 94.100 130.647 70.435 1.00 71.40 C ATOM 1269 O VAL A 145 93.953 129.416 70.483 1.00 70.50 O ATOM 1270 CB VAL A 145 93.115 131.398 72.614 1.00 73.59 C ATOM 1271 CG1 VAL A 145 94.497 131.037 73.102 1.00 67.78 C ATOM 1272 CG2 VAL A 145 92.637 132.678 73.254 1.00 67.37 C ATOM 1273 H VAL A 145 91.119 130.783 71.013 1.00 0.00 H ATOM 1274 N GLU A 146 95.098 131.245 69.790 1.00 69.45 N ATOM 1275 CA GLU A 146 96.050 130.481 69.011 1.00 70.07 C ATOM 1276 C GLU A 146 97.081 129.863 69.946 1.00 67.70 C ATOM 1277 O GLU A 146 97.538 130.488 70.908 1.00 51.24 O ATOM 1278 CB GLU A 146 96.708 131.362 67.945 1.00 64.48 C ATOM 1279 CG GLU A 146 96.923 130.607 66.643 1.00 82.36 C ATOM 1280 CD GLU A 146 96.873 131.478 65.399 1.00 91.25 C ATOM 1281 OE1 GLU A 146 97.910 132.075 65.031 1.00 91.18 O ATOM 1282 OE2 GLU A 146 95.786 131.556 64.783 1.00 91.55 O ATOM 1283 OXT GLU A 146 97.448 128.703 69.757 1.00 72.57 O ATOM 1284 H GLU A 146 95.196 132.279 69.846 1.00 0.00 H TER 1285 GLU A 146 ATOM 1286 N SER B 4 80.696 155.593 65.962 1.00 68.56 N ATOM 1287 CA SER B 4 80.302 154.612 66.983 1.00 57.38 C ATOM 1288 C SER B 4 80.538 155.077 68.411 1.00 50.79 C ATOM 1289 O SER B 4 81.595 155.622 68.753 1.00 52.95 O ATOM 1290 CB SER B 4 81.042 153.282 66.802 1.00 49.10 C ATOM 1291 OG SER B 4 80.765 152.414 67.889 1.00 35.66 O ATOM 1292 HG SER B 4 81.249 151.560 67.759 1.00 0.00 H ATOM 1293 HN3 SER B 4 81.711 155.799 66.055 1.00 0.00 H ATOM 1294 HN2 SER B 4 80.150 156.468 66.095 1.00 0.00 H ATOM 1295 HN1 SER B 4 80.505 155.204 65.017 1.00 0.00 H ATOM 1296 N GLN B 5 79.552 154.816 69.251 1.00 47.16 N ATOM 1297 CA GLN B 5 79.663 155.129 70.654 1.00 57.62 C ATOM 1298 C GLN B 5 80.330 153.989 71.433 1.00 46.65 C ATOM 1299 O GLN B 5 80.605 154.140 72.632 1.00 47.92 O ATOM 1300 CB GLN B 5 78.284 155.454 71.224 1.00 53.54 C ATOM 1301 CG GLN B 5 77.619 156.609 70.478 1.00 63.70 C ATOM 1302 CD GLN B 5 78.477 157.867 70.457 1.00 64.26 C ATOM 1303 OE1 GLN B 5 78.748 158.462 71.498 1.00 58.04 O ATOM 1304 NE2 GLN B 5 78.930 158.260 69.268 1.00 64.23 N ATOM 1305 HE22 GLN B 5 78.676 157.726 68.412 1.00 0.00 H ATOM 1306 HE21 GLN B 5 79.538 159.100 69.195 1.00 0.00 H ATOM 1307 H GLN B 5 78.680 154.377 68.894 1.00 0.00 H ATOM 1308 N ALA B 6 80.587 152.859 70.770 1.00 35.11 N ATOM 1309 CA ALA B 6 81.030 151.686 71.513 1.00 28.96 C ATOM 1310 C ALA B 6 82.510 151.854 71.885 1.00 23.54 C ATOM 1311 O ALA B 6 83.376 152.273 71.055 1.00 25.83 O ATOM 1312 CB ALA B 6 80.829 150.394 70.717 1.00 26.98 C ATOM 1313 H ALA B 6 80.473 152.816 69.737 1.00 0.00 H ATOM 1314 N LEU B 7 82.822 151.507 73.137 1.00 24.67 N ATOM 1315 CA LEU B 7 84.212 151.628 73.631 1.00 23.88 C ATOM 1316 C LEU B 7 85.193 150.840 72.722 1.00 22.74 C ATOM 1317 O LEU B 7 86.267 151.288 72.385 1.00 20.01 O ATOM 1318 CB LEU B 7 84.330 151.125 75.098 1.00 21.04 C ATOM 1319 CG LEU B 7 85.747 151.205 75.680 1.00 20.53 C ATOM 1320 CD1 LEU B 7 86.089 152.662 75.794 1.00 26.12 C ATOM 1321 CD2 LEU B 7 85.800 150.478 77.022 1.00 23.20 C ATOM 1322 H LEU B 7 82.080 151.148 73.771 1.00 0.00 H ATOM 1323 N SER B 8 84.698 149.674 72.287 1.00 21.37 N ATOM 1324 CA SER B 8 85.562 148.764 71.513 1.00 19.69 C ATOM 1325 C SER B 8 85.836 149.341 70.130 1.00 19.17 C ATOM 1326 O SER B 8 86.708 148.811 69.445 1.00 20.86 O ATOM 1327 CB SER B 8 84.915 147.394 71.399 1.00 24.94 C ATOM 1328 OG SER B 8 83.645 147.445 70.782 1.00 28.61 O ATOM 1329 HG SER B 8 83.738 147.816 69.869 1.00 0.00 H ATOM 1330 H SER B 8 83.713 149.413 72.493 1.00 0.00 H ATOM 1331 N ASP B 9 85.139 150.405 69.739 1.00 19.68 N ATOM 1332 CA ASP B 9 85.440 151.096 68.451 1.00 19.52 C ATOM 1333 C ASP B 9 86.294 152.360 68.656 1.00 21.69 C ATOM 1334 O ASP B 9 86.641 153.053 67.685 1.00 24.81 O ATOM 1335 CB ASP B 9 84.141 151.487 67.729 1.00 22.79 C ATOM 1336 CG ASP B 9 83.393 150.278 67.170 1.00 28.76 C ATOM 1337 OD1 ASP B 9 84.047 149.288 66.760 1.00 26.32 O ATOM 1338 OD2 ASP B 9 82.153 150.291 67.149 1.00 28.50 O ATOM 1339 H ASP B 9 84.370 150.762 70.342 1.00 0.00 H ATOM 1340 N ASP B 10 86.620 152.700 69.901 1.00 20.32 N ATOM 1341 CA ASP B 10 87.375 153.900 70.199 1.00 21.65 C ATOM 1342 C ASP B 10 88.862 153.586 69.905 1.00 20.99 C ATOM 1343 O ASP B 10 89.429 152.748 70.536 1.00 19.77 O ATOM 1344 CB ASP B 10 87.099 154.275 71.689 1.00 21.71 C ATOM 1345 CG ASP B 10 88.020 155.373 72.265 1.00 34.33 C ATOM 1346 OD1 ASP B 10 89.048 155.739 71.666 1.00 28.74 O ATOM 1347 OD2 ASP B 10 87.747 155.819 73.412 1.00 31.33 O ATOM 1348 H ASP B 10 86.323 152.084 70.685 1.00 0.00 H ATOM 1349 N ILE B 11 89.466 154.258 68.933 1.00 20.44 N ATOM 1350 CA ILE B 11 90.848 153.951 68.563 1.00 18.41 C ATOM 1351 C ILE B 11 91.813 154.225 69.721 1.00 20.25 C ATOM 1352 O ILE B 11 92.813 153.499 69.873 1.00 19.44 O ATOM 1353 CB ILE B 11 91.276 154.740 67.316 1.00 20.56 C ATOM 1354 CG1 ILE B 11 92.621 154.200 66.789 1.00 26.91 C ATOM 1355 CG2 ILE B 11 91.403 156.167 67.643 1.00 26.99 C ATOM 1356 CD1 ILE B 11 92.517 152.850 66.218 1.00 27.86 C ATOM 1357 H ILE B 11 88.953 155.009 68.430 1.00 0.00 H ATOM 1358 N GLY B 12 91.478 155.177 70.593 1.00 22.17 N ATOM 1359 CA GLY B 12 92.388 155.478 71.716 1.00 21.13 C ATOM 1360 C GLY B 12 92.321 154.324 72.687 1.00 20.73 C ATOM 1361 O GLY B 12 93.327 153.836 73.181 1.00 20.34 O ATOM 1362 H GLY B 12 90.586 155.701 70.483 1.00 0.00 H ATOM 1363 N PHE B 13 91.124 153.859 72.977 1.00 20.76 N ATOM 1364 CA PHE B 13 90.975 152.691 73.834 1.00 18.74 C ATOM 1365 C PHE B 13 91.732 151.515 73.258 1.00 17.71 C ATOM 1366 O PHE B 13 92.429 150.782 74.001 1.00 18.43 O ATOM 1367 CB PHE B 13 89.464 152.296 74.008 1.00 18.23 C ATOM 1368 CG PHE B 13 89.261 150.898 74.590 1.00 17.95 C ATOM 1369 CD1 PHE B 13 89.427 150.706 75.985 1.00 21.04 C ATOM 1370 CD2 PHE B 13 88.940 149.819 73.792 1.00 18.86 C ATOM 1371 CE1 PHE B 13 89.243 149.418 76.534 1.00 22.44 C ATOM 1372 CE2 PHE B 13 88.764 148.540 74.314 1.00 20.99 C ATOM 1373 CZ PHE B 13 88.924 148.349 75.724 1.00 23.43 C ATOM 1374 H PHE B 13 90.280 154.329 72.592 1.00 0.00 H ATOM 1375 N LEU B 14 91.571 151.245 71.968 1.00 17.50 N ATOM 1376 CA LEU B 14 92.221 150.100 71.405 1.00 16.52 C ATOM 1377 C LEU B 14 93.754 150.203 71.444 1.00 17.14 C ATOM 1378 O LEU B 14 94.423 149.176 71.628 1.00 18.33 O ATOM 1379 CB LEU B 14 91.776 149.921 69.934 1.00 15.48 C ATOM 1380 CG LEU B 14 90.296 149.521 69.807 1.00 17.70 C ATOM 1381 CD1 LEU B 14 89.829 149.742 68.364 1.00 19.08 C ATOM 1382 CD2 LEU B 14 90.003 148.114 70.315 1.00 17.51 C ATOM 1383 H LEU B 14 90.979 151.859 71.373 1.00 0.00 H ATOM 1384 N LEU B 15 94.297 151.402 71.218 1.00 17.35 N ATOM 1385 CA LEU B 15 95.746 151.595 71.345 1.00 16.88 C ATOM 1386 C LEU B 15 96.190 151.282 72.763 1.00 18.21 C ATOM 1387 O LEU B 15 97.226 150.614 72.964 1.00 19.26 O ATOM 1388 CB LEU B 15 96.112 153.014 70.959 1.00 17.13 C ATOM 1389 CG LEU B 15 96.079 153.230 69.424 1.00 18.54 C ATOM 1390 CD1 LEU B 15 95.978 154.748 69.128 1.00 22.00 C ATOM 1391 CD2 LEU B 15 97.301 152.621 68.642 1.00 17.75 C ATOM 1392 H LEU B 15 93.690 152.203 70.951 1.00 0.00 H ATOM 1393 N SER B 16 95.510 151.837 73.760 1.00 19.15 N ATOM 1394 CA SER B 16 95.927 151.590 75.141 1.00 19.08 C ATOM 1395 C SER B 16 95.704 150.108 75.478 1.00 17.56 C ATOM 1396 O SER B 16 96.503 149.535 76.253 1.00 18.14 O ATOM 1397 CB SER B 16 95.135 152.507 76.103 1.00 22.17 C ATOM 1398 OG SER B 16 95.497 153.884 75.881 1.00 24.48 O ATOM 1399 HG SER B 16 96.467 154.000 76.044 1.00 0.00 H ATOM 1400 H SER B 16 94.688 152.442 73.561 1.00 0.00 H ATOM 1401 N ARG B 17 94.611 149.517 74.993 1.00 17.45 N ATOM 1402 CA ARG B 17 94.326 148.128 75.272 1.00 20.41 C ATOM 1403 C ARG B 17 95.406 147.200 74.710 1.00 18.80 C ATOM 1404 O ARG B 17 96.025 146.429 75.449 1.00 18.21 O ATOM 1405 CB ARG B 17 92.941 147.768 74.682 1.00 22.11 C ATOM 1406 CG ARG B 17 92.554 146.333 74.901 1.00 22.39 C ATOM 1407 CD ARG B 17 92.054 146.084 76.338 1.00 26.77 C ATOM 1408 NE ARG B 17 91.236 144.876 76.326 1.00 27.72 N ATOM 1409 CZ ARG B 17 91.730 143.640 76.259 1.00 27.94 C ATOM 1410 NH1 ARG B 17 90.939 142.584 76.198 1.00 31.81 N ATOM 1411 NH2 ARG B 17 93.043 143.446 76.223 1.00 29.80 N ATOM 1412 HE ARG B 17 90.203 144.986 76.373 1.00 0.00 H ATOM 1413 HH12 ARG B 17 91.349 141.630 76.146 1.00 0.00 H ATOM 1414 HH11 ARG B 17 89.906 142.707 76.202 1.00 0.00 H ATOM 1415 HH22 ARG B 17 93.425 142.480 76.171 1.00 0.00 H ATOM 1416 HH21 ARG B 17 93.690 144.260 76.247 1.00 0.00 H ATOM 1417 H ARG B 17 93.952 150.065 74.404 1.00 0.00 H ATOM 1418 N VAL B 18 95.706 147.345 73.439 1.00 18.14 N ATOM 1419 CA VAL B 18 96.752 146.491 72.865 1.00 16.50 C ATOM 1420 C VAL B 18 98.132 146.878 73.365 1.00 19.86 C ATOM 1421 O VAL B 18 98.942 145.989 73.663 1.00 17.75 O ATOM 1422 CB VAL B 18 96.693 146.547 71.327 1.00 20.94 C ATOM 1423 CG1 VAL B 18 97.844 145.726 70.719 1.00 23.57 C ATOM 1424 CG2 VAL B 18 95.299 145.991 70.896 1.00 22.34 C ATOM 1425 H VAL B 18 95.213 148.049 72.853 1.00 0.00 H ATOM 1426 N GLY B 19 98.408 148.182 73.520 1.00 17.26 N ATOM 1427 CA GLY B 19 99.683 148.572 74.131 1.00 16.93 C ATOM 1428 C GLY B 19 99.911 147.938 75.505 1.00 19.08 C ATOM 1429 O GLY B 19 101.034 147.517 75.818 1.00 19.36 O ATOM 1430 H GLY B 19 97.728 148.906 73.211 1.00 0.00 H ATOM 1431 N GLY B 20 98.817 147.860 76.264 1.00 18.73 N ATOM 1432 CA GLY B 20 98.956 147.260 77.588 1.00 17.89 C ATOM 1433 C GLY B 20 99.165 145.773 77.534 1.00 19.23 C ATOM 1434 O GLY B 20 99.877 145.230 78.411 1.00 19.82 O ATOM 1435 H GLY B 20 97.899 148.213 75.926 1.00 0.00 H ATOM 1436 N MET B 21 98.519 145.111 76.566 1.00 18.76 N ATOM 1437 CA MET B 21 98.799 143.682 76.347 1.00 19.27 C ATOM 1438 C MET B 21 100.276 143.459 76.073 1.00 20.09 C ATOM 1439 O MET B 21 100.921 142.537 76.643 1.00 20.41 O ATOM 1440 CB MET B 21 97.992 143.125 75.162 1.00 20.91 C ATOM 1441 CG MET B 21 96.522 143.137 75.424 1.00 24.37 C ATOM 1442 SD MET B 21 95.531 142.842 73.893 1.00 24.90 S ATOM 1443 CE MET B 21 96.007 141.160 73.547 1.00 30.87 C ATOM 1444 H MET B 21 97.822 145.604 75.971 1.00 0.00 H ATOM 1445 N VAL B 22 100.822 144.310 75.228 1.00 18.59 N ATOM 1446 CA VAL B 22 102.233 144.147 74.860 1.00 18.49 C ATOM 1447 C VAL B 22 103.100 144.397 76.083 1.00 17.65 C ATOM 1448 O VAL B 22 104.003 143.581 76.355 1.00 18.68 O ATOM 1449 CB VAL B 22 102.609 145.095 73.728 1.00 18.43 C ATOM 1450 CG1 VAL B 22 104.158 145.016 73.486 1.00 23.78 C ATOM 1451 CG2 VAL B 22 101.899 144.680 72.432 1.00 21.10 C ATOM 1452 H VAL B 22 100.260 145.088 74.827 1.00 0.00 H ATOM 1453 N LEU B 23 102.826 145.477 76.836 1.00 17.15 N ATOM 1454 CA LEU B 23 103.646 145.737 78.033 1.00 15.52 C ATOM 1455 C LEU B 23 103.648 144.571 79.026 1.00 19.02 C ATOM 1456 O LEU B 23 104.689 144.182 79.531 1.00 18.82 O ATOM 1457 CB LEU B 23 103.146 147.033 78.731 1.00 15.85 C ATOM 1458 CG LEU B 23 103.440 148.325 77.960 1.00 18.41 C ATOM 1459 CD1 LEU B 23 102.640 149.459 78.452 1.00 18.20 C ATOM 1460 CD2 LEU B 23 104.920 148.749 78.030 1.00 18.27 C ATOM 1461 H LEU B 23 102.049 146.118 76.578 1.00 0.00 H ATOM 1462 N GLY B 24 102.494 144.015 79.297 1.00 19.92 N ATOM 1463 CA GLY B 24 102.422 142.945 80.281 1.00 20.97 C ATOM 1464 C GLY B 24 103.131 141.704 79.743 1.00 19.63 C ATOM 1465 O GLY B 24 103.823 141.027 80.500 1.00 20.54 O ATOM 1466 H GLY B 24 101.632 144.337 78.811 1.00 0.00 H ATOM 1467 N ALA B 25 102.972 141.417 78.447 1.00 19.15 N ATOM 1468 CA ALA B 25 103.653 140.257 77.873 1.00 21.42 C ATOM 1469 C ALA B 25 105.167 140.419 77.891 1.00 18.67 C ATOM 1470 O ALA B 25 105.907 139.445 78.104 1.00 20.09 O ATOM 1471 CB ALA B 25 103.158 140.032 76.443 1.00 20.29 C ATOM 1472 H ALA B 25 102.367 142.016 77.850 1.00 0.00 H ATOM 1473 N VAL B 26 105.642 141.619 77.627 1.00 18.28 N ATOM 1474 CA VAL B 26 107.069 141.871 77.671 1.00 18.60 C ATOM 1475 C VAL B 26 107.596 141.758 79.099 1.00 19.28 C ATOM 1476 O VAL B 26 108.617 141.089 79.293 1.00 18.37 O ATOM 1477 CB VAL B 26 107.401 143.266 77.115 1.00 23.49 C ATOM 1478 CG1 VAL B 26 108.879 143.638 77.392 1.00 24.86 C ATOM 1479 CG2 VAL B 26 106.997 143.315 75.640 1.00 26.37 C ATOM 1480 H VAL B 26 104.989 142.391 77.385 1.00 0.00 H ATOM 1481 N ASN B 27 106.912 142.342 80.111 1.00 17.63 N ATOM 1482 CA ASN B 27 107.422 142.148 81.479 1.00 16.75 C ATOM 1483 C ASN B 27 107.484 140.651 81.824 1.00 17.03 C ATOM 1484 O ASN B 27 108.443 140.202 82.474 1.00 19.24 O ATOM 1485 CB ASN B 27 106.526 142.904 82.467 1.00 17.64 C ATOM 1486 CG ASN B 27 106.825 144.396 82.525 1.00 18.08 C ATOM 1487 OD1 ASN B 27 107.970 144.815 82.309 1.00 19.94 O ATOM 1488 ND2 ASN B 27 105.803 145.204 82.818 1.00 19.45 N ATOM 1489 HD22 ASN B 27 104.858 144.805 82.992 1.00 0.00 H ATOM 1490 HD21 ASN B 27 105.952 146.232 82.872 1.00 0.00 H ATOM 1491 H ASN B 27 106.058 142.907 79.929 1.00 0.00 H ATOM 1492 N LYS B 28 106.457 139.875 81.446 1.00 17.45 N ATOM 1493 CA LYS B 28 106.478 138.457 81.770 1.00 17.88 C ATOM 1494 C LYS B 28 107.601 137.760 80.996 1.00 18.34 C ATOM 1495 O LYS B 28 108.312 136.929 81.587 1.00 19.63 O ATOM 1496 CB LYS B 28 105.125 137.816 81.446 1.00 18.10 C ATOM 1497 CG LYS B 28 104.001 138.263 82.417 1.00 29.85 C ATOM 1498 CD LYS B 28 102.668 137.620 82.048 1.00 34.64 C ATOM 1499 CE LYS B 28 101.555 138.144 82.951 1.00 45.93 C ATOM 1500 NZ LYS B 28 101.395 139.641 82.879 1.00 46.47 N ATOM 1501 HZ1 LYS B 28 102.282 140.098 83.172 1.00 0.00 H ATOM 1502 HZ2 LYS B 28 101.167 139.918 81.903 1.00 0.00 H ATOM 1503 HZ3 LYS B 28 100.625 139.937 83.513 1.00 0.00 H ATOM 1504 H LYS B 28 105.654 140.283 80.926 1.00 0.00 H ATOM 1505 N ALA B 29 107.788 138.044 79.705 1.00 17.42 N ATOM 1506 CA ALA B 29 108.858 137.374 78.977 1.00 18.56 C ATOM 1507 C ALA B 29 110.235 137.677 79.542 1.00 17.58 C ATOM 1508 O ALA B 29 111.152 136.855 79.452 1.00 18.65 O ATOM 1509 CB ALA B 29 108.767 137.806 77.486 1.00 19.48 C ATOM 1510 H ALA B 29 107.177 138.735 79.225 1.00 0.00 H ATOM 1511 N LEU B 30 110.372 138.870 80.104 1.00 17.49 N ATOM 1512 CA LEU B 30 111.643 139.331 80.623 1.00 17.41 C ATOM 1513 C LEU B 30 111.999 138.785 82.013 1.00 16.59 C ATOM 1514 O LEU B 30 113.143 138.970 82.441 1.00 19.42 O ATOM 1515 CB LEU B 30 111.674 140.868 80.700 1.00 16.80 C ATOM 1516 CG LEU B 30 111.785 141.551 79.342 1.00 17.02 C ATOM 1517 CD1 LEU B 30 111.601 143.020 79.601 1.00 18.07 C ATOM 1518 CD2 LEU B 30 113.126 141.280 78.665 1.00 18.27 C ATOM 1519 H LEU B 30 109.542 139.493 80.174 1.00 0.00 H ATOM 1520 N VAL B 31 111.062 138.126 82.724 1.00 17.52 N ATOM 1521 CA VAL B 31 111.324 137.653 84.106 1.00 19.75 C ATOM 1522 C VAL B 31 112.686 136.923 84.238 1.00 20.63 C ATOM 1523 O VAL B 31 113.491 137.268 85.129 1.00 21.64 O ATOM 1524 CB VAL B 31 110.158 136.806 84.618 1.00 19.75 C ATOM 1525 CG1 VAL B 31 110.595 136.113 85.893 1.00 23.45 C ATOM 1526 CG2 VAL B 31 108.989 137.747 84.866 1.00 22.13 C ATOM 1527 H VAL B 31 110.133 137.945 82.293 1.00 0.00 H ATOM 1528 N PRO B 32 113.059 135.993 83.330 1.00 18.78 N ATOM 1529 CA PRO B 32 114.371 135.332 83.524 1.00 19.05 C ATOM 1530 C PRO B 32 115.603 136.231 83.380 1.00 21.52 C ATOM 1531 O PRO B 32 116.676 135.827 83.838 1.00 26.74 O ATOM 1532 CB PRO B 32 114.401 134.256 82.431 1.00 21.58 C ATOM 1533 CG PRO B 32 112.967 134.076 82.028 1.00 23.73 C ATOM 1534 CD PRO B 32 112.252 135.344 82.271 1.00 20.76 C ATOM 1535 N THR B 33 115.445 137.393 82.772 1.00 19.90 N ATOM 1536 CA THR B 33 116.540 138.328 82.592 1.00 20.69 C ATOM 1537 C THR B 33 116.700 139.293 83.738 1.00 18.97 C ATOM 1538 O THR B 33 117.675 140.016 83.787 1.00 20.99 O ATOM 1539 CB THR B 33 116.334 139.163 81.316 1.00 19.00 C ATOM 1540 OG1 THR B 33 115.317 140.154 81.546 1.00 18.91 O ATOM 1541 CG2 THR B 33 115.952 138.289 80.105 1.00 20.31 C ATOM 1542 HG1 THR B 33 114.468 139.705 81.786 1.00 0.00 H ATOM 1543 H THR B 33 114.504 137.646 82.410 1.00 0.00 H ATOM 1544 N GLY B 34 115.682 139.354 84.576 1.00 18.10 N ATOM 1545 CA GLY B 34 115.661 140.344 85.648 1.00 21.14 C ATOM 1546 C GLY B 34 115.358 141.760 85.208 1.00 21.29 C ATOM 1547 O GLY B 34 115.406 142.650 86.058 1.00 23.11 O ATOM 1548 H GLY B 34 114.888 138.691 84.471 1.00 0.00 H ATOM 1549 N LEU B 35 115.089 141.979 83.938 1.00 18.33 N ATOM 1550 CA LEU B 35 114.793 143.304 83.406 1.00 17.25 C ATOM 1551 C LEU B 35 113.270 143.480 83.415 1.00 19.44 C ATOM 1552 O LEU B 35 112.527 142.500 83.523 1.00 20.04 O ATOM 1553 CB LEU B 35 115.268 143.462 81.962 1.00 17.68 C ATOM 1554 CG LEU B 35 116.796 143.229 81.824 1.00 18.18 C ATOM 1555 CD1 LEU B 35 117.071 143.119 80.354 1.00 20.49 C ATOM 1556 CD2 LEU B 35 117.532 144.384 82.431 1.00 19.79 C ATOM 1557 H LEU B 35 115.088 141.170 83.284 1.00 0.00 H ATOM 1558 N ARG B 36 112.832 144.707 83.195 1.00 17.55 N ATOM 1559 CA ARG B 36 111.444 145.078 82.996 1.00 18.17 C ATOM 1560 C ARG B 36 111.380 145.993 81.759 1.00 16.78 C ATOM 1561 O ARG B 36 112.371 146.264 81.192 1.00 19.38 O ATOM 1562 CB ARG B 36 110.788 145.690 84.218 1.00 19.10 C ATOM 1563 CG ARG B 36 110.368 144.661 85.240 1.00 20.38 C ATOM 1564 CD ARG B 36 109.954 145.264 86.552 1.00 21.71 C ATOM 1565 NE ARG B 36 108.914 146.247 86.449 1.00 22.24 N ATOM 1566 CZ ARG B 36 107.653 145.986 86.241 1.00 23.34 C ATOM 1567 NH1 ARG B 36 107.237 144.759 86.120 1.00 23.78 N ATOM 1568 NH2 ARG B 36 106.803 146.978 86.193 1.00 25.15 N ATOM 1569 HE ARG B 36 109.187 147.246 86.548 1.00 0.00 H ATOM 1570 HH12 ARG B 36 106.229 144.566 85.954 1.00 0.00 H ATOM 1571 HH11 ARG B 36 107.913 143.972 86.189 1.00 0.00 H ATOM 1572 HH22 ARG B 36 105.793 146.790 86.028 1.00 0.00 H ATOM 1573 HH21 ARG B 36 107.136 147.955 86.320 1.00 0.00 H ATOM 1574 H ARG B 36 113.540 145.468 83.162 1.00 0.00 H ATOM 1575 N VAL B 37 110.197 146.424 81.376 1.00 16.82 N ATOM 1576 CA VAL B 37 110.088 147.141 80.112 1.00 17.84 C ATOM 1577 C VAL B 37 111.076 148.324 80.002 1.00 16.61 C ATOM 1578 O VAL B 37 111.773 148.472 78.991 1.00 17.35 O ATOM 1579 CB VAL B 37 108.657 147.644 79.882 1.00 21.75 C ATOM 1580 CG1 VAL B 37 108.074 148.221 81.104 1.00 24.40 C ATOM 1581 CG2 VAL B 37 108.625 148.665 78.728 1.00 19.11 C ATOM 1582 H VAL B 37 109.356 146.256 81.964 1.00 0.00 H ATOM 1583 N ARG B 38 111.141 149.143 81.056 1.00 17.76 N ATOM 1584 CA ARG B 38 112.018 150.338 80.920 1.00 17.03 C ATOM 1585 C ARG B 38 113.518 150.025 80.977 1.00 15.88 C ATOM 1586 O ARG B 38 114.265 150.573 80.153 1.00 17.51 O ATOM 1587 CB ARG B 38 111.690 151.380 82.002 1.00 16.55 C ATOM 1588 CG ARG B 38 110.303 152.013 81.819 1.00 17.04 C ATOM 1589 CD ARG B 38 110.171 153.187 82.772 1.00 16.47 C ATOM 1590 NE ARG B 38 108.831 153.816 82.626 1.00 17.10 N ATOM 1591 CZ ARG B 38 108.492 154.976 83.144 1.00 19.81 C ATOM 1592 NH1 ARG B 38 107.230 155.434 82.995 1.00 20.61 N ATOM 1593 NH2 ARG B 38 109.399 155.739 83.835 1.00 18.84 N ATOM 1594 HE ARG B 38 108.113 153.303 82.076 1.00 0.00 H ATOM 1595 HH12 ARG B 38 106.958 156.351 83.403 1.00 0.00 H ATOM 1596 HH11 ARG B 38 106.530 154.870 82.472 1.00 0.00 H ATOM 1597 HH22 ARG B 38 109.110 156.654 84.237 1.00 0.00 H ATOM 1598 HH21 ARG B 38 110.376 155.403 83.957 1.00 0.00 H ATOM 1599 H ARG B 38 110.606 148.955 81.928 1.00 0.00 H ATOM 1600 N SER B 39 113.950 149.165 81.880 1.00 17.86 N ATOM 1601 CA SER B 39 115.388 148.836 81.915 1.00 16.60 C ATOM 1602 C SER B 39 115.797 148.092 80.667 1.00 16.78 C ATOM 1603 O SER B 39 116.909 148.313 80.142 1.00 17.14 O ATOM 1604 CB SER B 39 115.745 148.048 83.165 1.00 18.83 C ATOM 1605 OG SER B 39 114.931 146.882 83.351 1.00 20.64 O ATOM 1606 HG SER B 39 115.211 146.414 84.177 1.00 0.00 H ATOM 1607 H SER B 39 113.290 148.728 82.554 1.00 0.00 H ATOM 1608 N TYR B 40 114.934 147.195 80.161 1.00 15.76 N ATOM 1609 CA TYR B 40 115.205 146.603 78.873 1.00 16.69 C ATOM 1610 C TYR B 40 115.344 147.605 77.761 1.00 15.62 C ATOM 1611 O TYR B 40 116.286 147.507 76.944 1.00 17.21 O ATOM 1612 CB TYR B 40 114.071 145.580 78.546 1.00 17.22 C ATOM 1613 CG TYR B 40 114.068 145.055 77.151 1.00 15.19 C ATOM 1614 CD1 TYR B 40 114.964 144.095 76.744 1.00 17.99 C ATOM 1615 CD2 TYR B 40 113.110 145.540 76.212 1.00 18.20 C ATOM 1616 CE1 TYR B 40 114.965 143.607 75.438 1.00 18.53 C ATOM 1617 CE2 TYR B 40 113.081 145.032 74.924 1.00 22.18 C ATOM 1618 CZ TYR B 40 114.008 144.054 74.544 1.00 21.24 C ATOM 1619 OH TYR B 40 114.040 143.611 73.251 1.00 22.88 O ATOM 1620 HH TYR B 40 114.232 144.372 72.647 1.00 0.00 H ATOM 1621 H TYR B 40 114.080 146.930 80.692 1.00 0.00 H ATOM 1622 N SER B 41 114.447 148.581 77.703 1.00 17.76 N ATOM 1623 CA SER B 41 114.528 149.575 76.629 1.00 16.08 C ATOM 1624 C SER B 41 115.860 150.339 76.683 1.00 16.16 C ATOM 1625 O SER B 41 116.460 150.571 75.634 1.00 17.00 O ATOM 1626 CB SER B 41 113.384 150.589 76.744 1.00 19.45 C ATOM 1627 OG SER B 41 112.107 149.923 76.621 1.00 19.57 O ATOM 1628 HG SER B 41 112.016 149.250 77.342 1.00 0.00 H ATOM 1629 H SER B 41 113.691 148.640 78.415 1.00 0.00 H ATOM 1630 N VAL B 42 116.279 150.738 77.889 1.00 16.29 N ATOM 1631 CA VAL B 42 117.565 151.447 77.985 1.00 16.32 C ATOM 1632 C VAL B 42 118.741 150.606 77.522 1.00 17.21 C ATOM 1633 O VAL B 42 119.579 151.079 76.733 1.00 17.66 O ATOM 1634 CB VAL B 42 117.798 151.927 79.414 1.00 14.42 C ATOM 1635 CG1 VAL B 42 119.183 152.607 79.561 1.00 18.50 C ATOM 1636 CG2 VAL B 42 116.679 152.918 79.778 1.00 18.81 C ATOM 1637 H VAL B 42 115.709 150.552 78.739 1.00 0.00 H ATOM 1638 N LEU B 43 118.722 149.336 77.927 1.00 15.26 N ATOM 1639 CA LEU B 43 119.789 148.398 77.531 1.00 15.27 C ATOM 1640 C LEU B 43 119.814 148.239 75.998 1.00 17.35 C ATOM 1641 O LEU B 43 120.893 148.283 75.355 1.00 17.26 O ATOM 1642 CB LEU B 43 119.600 147.071 78.269 1.00 16.40 C ATOM 1643 CG LEU B 43 120.668 146.044 77.868 1.00 17.15 C ATOM 1644 CD1 LEU B 43 122.079 146.551 78.207 1.00 18.37 C ATOM 1645 CD2 LEU B 43 120.413 144.735 78.627 1.00 19.68 C ATOM 1646 H LEU B 43 117.944 149.002 78.531 1.00 0.00 H ATOM 1647 N VAL B 44 118.633 148.060 75.382 1.00 15.62 N ATOM 1648 CA VAL B 44 118.560 147.895 73.944 1.00 18.06 C ATOM 1649 C VAL B 44 119.107 149.141 73.258 1.00 16.92 C ATOM 1650 O VAL B 44 119.920 149.069 72.308 1.00 18.21 O ATOM 1651 CB VAL B 44 117.140 147.646 73.542 1.00 18.23 C ATOM 1652 CG1 VAL B 44 116.961 147.840 72.019 1.00 21.76 C ATOM 1653 CG2 VAL B 44 116.779 146.224 73.957 1.00 19.18 C ATOM 1654 H VAL B 44 117.759 148.040 75.945 1.00 0.00 H ATOM 1655 N LEU B 45 118.715 150.309 73.770 1.00 15.98 N ATOM 1656 CA LEU B 45 119.138 151.548 73.093 1.00 16.97 C ATOM 1657 C LEU B 45 120.639 151.780 73.249 1.00 18.52 C ATOM 1658 O LEU B 45 121.285 152.279 72.313 1.00 21.64 O ATOM 1659 CB LEU B 45 118.334 152.761 73.622 1.00 17.26 C ATOM 1660 CG LEU B 45 116.862 152.712 73.200 1.00 17.94 C ATOM 1661 CD1 LEU B 45 116.054 153.707 74.028 1.00 17.94 C ATOM 1662 CD2 LEU B 45 116.658 153.015 71.737 1.00 20.57 C ATOM 1663 H LEU B 45 118.125 150.344 74.626 1.00 0.00 H ATOM 1664 N ALA B 46 121.210 151.362 74.354 1.00 17.48 N ATOM 1665 CA ALA B 46 122.658 151.459 74.516 1.00 18.14 C ATOM 1666 C ALA B 46 123.368 150.514 73.553 1.00 22.28 C ATOM 1667 O ALA B 46 124.387 150.879 72.974 1.00 21.60 O ATOM 1668 CB ALA B 46 123.053 151.158 75.953 1.00 19.15 C ATOM 1669 H ALA B 46 120.629 150.960 75.117 1.00 0.00 H ATOM 1670 N CYS B 47 122.818 149.300 73.423 1.00 18.26 N ATOM 1671 CA CYS B 47 123.506 148.298 72.577 1.00 19.86 C ATOM 1672 C CYS B 47 123.503 148.701 71.097 1.00 22.10 C ATOM 1673 O CYS B 47 124.347 148.241 70.323 1.00 23.47 O ATOM 1674 CB CYS B 47 122.874 146.923 72.764 1.00 19.84 C ATOM 1675 SG CYS B 47 123.287 146.177 74.374 1.00 21.40 S ATOM 1676 H CYS B 47 121.927 149.066 73.906 1.00 0.00 H ATOM 1677 N GLU B 48 122.504 149.499 70.688 1.00 20.23 N ATOM 1678 CA GLU B 48 122.412 149.884 69.284 1.00 21.69 C ATOM 1679 C GLU B 48 123.594 150.734 68.817 1.00 25.25 C ATOM 1680 O GLU B 48 123.768 150.883 67.622 1.00 26.48 O ATOM 1681 CB GLU B 48 121.122 150.646 69.005 1.00 22.63 C ATOM 1682 CG GLU B 48 119.927 149.717 69.081 1.00 23.72 C ATOM 1683 CD GLU B 48 118.570 150.447 68.972 1.00 27.20 C ATOM 1684 OE1 GLU B 48 118.543 151.699 68.798 1.00 25.65 O ATOM 1685 OE2 GLU B 48 117.534 149.709 69.042 1.00 23.64 O ATOM 1686 H GLU B 48 121.798 149.842 71.370 1.00 0.00 H ATOM 1687 N GLN B 49 124.361 151.319 69.751 1.00 23.25 N ATOM 1688 CA GLN B 49 125.455 152.208 69.422 1.00 25.50 C ATOM 1689 C GLN B 49 126.745 151.522 69.801 1.00 24.84 C ATOM 1690 O GLN B 49 126.825 150.888 70.859 1.00 25.30 O ATOM 1691 CB GLN B 49 125.327 153.526 70.204 1.00 30.17 C ATOM 1692 CG GLN B 49 123.897 154.120 70.130 1.00 30.58 C ATOM 1693 CD GLN B 49 123.548 154.489 68.692 1.00 34.43 C ATOM 1694 OE1 GLN B 49 124.440 154.843 67.901 1.00 35.59 O ATOM 1695 NE2 GLN B 49 122.280 154.420 68.341 1.00 34.40 N ATOM 1696 HE22 GLN B 49 121.564 154.119 69.033 1.00 0.00 H ATOM 1697 HE21 GLN B 49 121.995 154.666 67.372 1.00 0.00 H ATOM 1698 H GLN B 49 124.161 151.125 70.753 1.00 0.00 H ATOM 1699 N ALA B 50 127.775 151.732 69.013 1.00 28.15 N ATOM 1700 CA ALA B 50 129.060 151.135 69.334 1.00 32.68 C ATOM 1701 C ALA B 50 129.682 151.745 70.560 1.00 26.01 C ATOM 1702 O ALA B 50 130.230 151.039 71.408 1.00 31.60 O ATOM 1703 CB ALA B 50 130.021 151.268 68.139 1.00 35.15 C ATOM 1704 H ALA B 50 127.671 152.323 68.163 1.00 0.00 H ATOM 1705 N GLU B 51 129.592 153.052 70.689 1.00 29.22 N ATOM 1706 CA GLU B 51 130.254 153.692 71.804 1.00 30.43 C ATOM 1707 C GLU B 51 129.331 154.022 72.964 1.00 26.36 C ATOM 1708 O GLU B 51 129.801 154.398 74.043 1.00 28.62 O ATOM 1709 CB GLU B 51 130.943 154.965 71.326 1.00 38.73 C ATOM 1710 CG GLU B 51 132.124 154.690 70.401 1.00 45.01 C ATOM 1711 CD GLU B 51 133.247 153.883 71.073 1.00 54.85 C ATOM 1712 OE1 GLU B 51 133.541 154.123 72.269 1.00 39.37 O ATOM 1713 OE2 GLU B 51 133.829 153.002 70.397 1.00 58.76 O ATOM 1714 H GLU B 51 129.053 153.615 70.000 1.00 0.00 H ATOM 1715 N GLY B 52 128.040 153.847 72.766 1.00 24.24 N ATOM 1716 CA GLY B 52 127.072 154.230 73.781 1.00 20.65 C ATOM 1717 C GLY B 52 126.079 155.248 73.263 1.00 23.53 C ATOM 1718 O GLY B 52 126.256 155.818 72.185 1.00 26.99 O ATOM 1719 H GLY B 52 127.709 153.430 71.873 1.00 0.00 H ATOM 1720 N VAL B 53 125.086 155.505 74.105 1.00 20.50 N ATOM 1721 CA VAL B 53 123.973 156.388 73.780 1.00 22.57 C ATOM 1722 C VAL B 53 123.839 157.456 74.867 1.00 20.80 C ATOM 1723 O VAL B 53 124.030 157.212 76.067 1.00 22.94 O ATOM 1724 CB VAL B 53 122.647 155.608 73.637 1.00 21.73 C ATOM 1725 CG1 VAL B 53 122.219 154.998 74.965 1.00 22.44 C ATOM 1726 CG2 VAL B 53 121.549 156.521 73.079 1.00 24.79 C ATOM 1727 H VAL B 53 125.103 155.054 75.042 1.00 0.00 H ATOM 1728 N ASN B 54 123.497 158.656 74.414 1.00 23.84 N ATOM 1729 CA ASN B 54 123.238 159.772 75.293 1.00 26.89 C ATOM 1730 C ASN B 54 121.939 159.684 76.094 1.00 26.30 C ATOM 1731 O ASN B 54 120.939 159.211 75.580 1.00 23.72 O ATOM 1732 CB ASN B 54 123.220 161.002 74.349 1.00 45.00 C ATOM 1733 CG ASN B 54 123.267 162.314 75.048 1.00 53.24 C ATOM 1734 OD1 ASN B 54 122.551 162.558 76.010 1.00 52.25 O ATOM 1735 ND2 ASN B 54 124.087 163.214 74.521 1.00 68.43 N ATOM 1736 HD22 ASN B 54 124.678 162.963 73.703 1.00 0.00 H ATOM 1737 HD21 ASN B 54 124.139 164.170 74.926 1.00 0.00 H ATOM 1738 H ASN B 54 123.412 158.798 73.387 1.00 0.00 H ATOM 1739 N GLN B 55 121.957 160.050 77.368 1.00 23.58 N ATOM 1740 CA GLN B 55 120.753 160.004 78.216 1.00 24.99 C ATOM 1741 C GLN B 55 119.571 160.740 77.581 1.00 27.03 C ATOM 1742 O GLN B 55 118.402 160.287 77.675 1.00 23.39 O ATOM 1743 CB GLN B 55 121.070 160.599 79.603 1.00 27.90 C ATOM 1744 CG GLN B 55 119.934 160.541 80.648 1.00 29.15 C ATOM 1745 CD GLN B 55 120.165 161.507 81.807 1.00 43.12 C ATOM 1746 OE1 GLN B 55 119.755 162.668 81.765 1.00 46.78 O ATOM 1747 NE2 GLN B 55 120.828 161.028 82.842 1.00 43.52 N ATOM 1748 HE22 GLN B 55 121.157 160.041 82.837 1.00 0.00 H ATOM 1749 HE21 GLN B 55 121.022 161.637 83.662 1.00 0.00 H ATOM 1750 H GLN B 55 122.851 160.381 77.783 1.00 0.00 H ATOM 1751 N ARG B 56 119.853 161.869 76.947 1.00 23.67 N ATOM 1752 CA ARG B 56 118.763 162.652 76.361 1.00 23.39 C ATOM 1753 C ARG B 56 118.140 161.931 75.194 1.00 22.63 C ATOM 1754 O ARG B 56 116.924 161.980 75.042 1.00 23.83 O ATOM 1755 CB ARG B 56 119.263 164.025 75.941 1.00 23.79 C ATOM 1756 CG ARG B 56 119.511 164.905 77.169 1.00 42.65 C ATOM 1757 CD ARG B 56 120.146 166.236 76.758 1.00 57.88 C ATOM 1758 NE ARG B 56 120.662 167.037 77.873 1.00 61.21 N ATOM 1759 CZ ARG B 56 119.989 168.017 78.475 1.00 72.03 C ATOM 1760 NH1 ARG B 56 118.761 168.322 78.075 1.00 73.81 N ATOM 1761 NH2 ARG B 56 120.547 168.705 79.471 1.00 74.32 N ATOM 1762 HE ARG B 56 121.620 166.825 78.218 1.00 0.00 H ATOM 1763 HH12 ARG B 56 118.236 169.087 78.545 1.00 0.00 H ATOM 1764 HH11 ARG B 56 118.324 167.796 77.292 1.00 0.00 H ATOM 1765 HH22 ARG B 56 120.016 169.469 79.937 1.00 0.00 H ATOM 1766 HH21 ARG B 56 121.513 168.478 79.782 1.00 0.00 H ATOM 1767 H ARG B 56 120.837 162.195 76.867 1.00 0.00 H ATOM 1768 N GLY B 57 118.945 161.236 74.400 1.00 23.17 N ATOM 1769 CA GLY B 57 118.459 160.404 73.307 1.00 22.35 C ATOM 1770 C GLY B 57 117.585 159.263 73.802 1.00 21.76 C ATOM 1771 O GLY B 57 116.533 158.937 73.178 1.00 22.04 O ATOM 1772 H GLY B 57 119.970 161.288 74.566 1.00 0.00 H ATOM 1773 N VAL B 58 118.034 158.614 74.863 1.00 20.06 N ATOM 1774 CA VAL B 58 117.237 157.547 75.426 1.00 18.33 C ATOM 1775 C VAL B 58 115.879 158.054 75.895 1.00 20.37 C ATOM 1776 O VAL B 58 114.813 157.445 75.585 1.00 19.29 O ATOM 1777 CB VAL B 58 117.992 156.929 76.614 1.00 19.66 C ATOM 1778 CG1 VAL B 58 117.087 155.918 77.350 1.00 24.08 C ATOM 1779 CG2 VAL B 58 119.210 156.226 76.072 1.00 23.06 C ATOM 1780 H VAL B 58 118.949 158.868 75.287 1.00 0.00 H ATOM 1781 N ALA B 59 115.919 159.178 76.614 1.00 19.94 N ATOM 1782 CA ALA B 59 114.700 159.772 77.150 1.00 20.81 C ATOM 1783 C ALA B 59 113.711 160.120 76.052 1.00 22.06 C ATOM 1784 O ALA B 59 112.526 159.819 76.161 1.00 22.73 O ATOM 1785 CB ALA B 59 115.050 161.047 77.974 1.00 24.41 C ATOM 1786 H ALA B 59 116.834 159.637 76.795 1.00 0.00 H ATOM 1787 N ALA B 60 114.202 160.705 74.966 1.00 22.61 N ATOM 1788 CA ALA B 60 113.369 161.161 73.856 1.00 22.86 C ATOM 1789 C ALA B 60 112.755 159.935 73.178 1.00 21.57 C ATOM 1790 O ALA B 60 111.556 159.944 72.829 1.00 21.51 O ATOM 1791 CB ALA B 60 114.201 161.963 72.865 1.00 24.48 C ATOM 1792 H ALA B 60 115.230 160.846 74.902 1.00 0.00 H ATOM 1793 N THR B 61 113.548 158.872 73.030 1.00 19.72 N ATOM 1794 CA THR B 61 112.981 157.671 72.382 1.00 18.91 C ATOM 1795 C THR B 61 111.887 157.045 73.230 1.00 19.26 C ATOM 1796 O THR B 61 110.859 156.617 72.710 1.00 20.12 O ATOM 1797 CB THR B 61 114.074 156.629 72.085 1.00 22.13 C ATOM 1798 OG1 THR B 61 115.019 157.186 71.169 1.00 23.73 O ATOM 1799 CG2 THR B 61 113.486 155.360 71.461 1.00 22.00 C ATOM 1800 HG1 THR B 61 115.429 157.993 71.570 1.00 0.00 H ATOM 1801 H THR B 61 114.534 158.888 73.360 1.00 0.00 H ATOM 1802 N MET B 62 112.068 157.066 74.546 1.00 20.24 N ATOM 1803 CA MET B 62 111.102 156.466 75.471 1.00 21.49 C ATOM 1804 C MET B 62 109.971 157.411 75.827 1.00 18.64 C ATOM 1805 O MET B 62 109.053 156.996 76.535 1.00 22.20 O ATOM 1806 CB MET B 62 111.833 155.995 76.745 1.00 19.07 C ATOM 1807 CG MET B 62 112.783 154.861 76.407 1.00 17.56 C ATOM 1808 SD MET B 62 113.746 154.295 77.817 1.00 19.98 S ATOM 1809 CE MET B 62 112.433 153.544 78.901 1.00 19.35 C ATOM 1810 H MET B 62 112.920 157.521 74.931 1.00 0.00 H ATOM 1811 N GLY B 63 109.999 158.666 75.381 1.00 20.46 N ATOM 1812 CA GLY B 63 108.990 159.668 75.756 1.00 24.37 C ATOM 1813 C GLY B 63 109.034 160.062 77.214 1.00 24.62 C ATOM 1814 O GLY B 63 108.007 160.480 77.745 1.00 30.34 O ATOM 1815 H GLY B 63 110.767 158.949 74.740 1.00 0.00 H ATOM 1816 N LEU B 64 110.221 160.029 77.831 1.00 21.69 N ATOM 1817 CA LEU B 64 110.360 160.312 79.278 1.00 21.42 C ATOM 1818 C LEU B 64 111.228 161.519 79.471 1.00 21.78 C ATOM 1819 O LEU B 64 112.001 161.873 78.590 1.00 25.30 O ATOM 1820 CB LEU B 64 110.960 159.128 80.036 1.00 22.51 C ATOM 1821 CG LEU B 64 110.082 157.878 79.990 1.00 21.87 C ATOM 1822 CD1 LEU B 64 110.833 156.746 80.488 1.00 21.89 C ATOM 1823 CD2 LEU B 64 108.782 158.105 80.838 1.00 26.38 C ATOM 1824 H LEU B 64 111.071 159.798 77.278 1.00 0.00 H ATOM 1825 N ASP B 65 111.094 162.196 80.606 1.00 28.80 N ATOM 1826 CA ASP B 65 112.120 163.150 80.995 1.00 27.75 C ATOM 1827 C ASP B 65 113.437 162.470 81.279 1.00 29.85 C ATOM 1828 O ASP B 65 113.494 161.346 81.784 1.00 28.26 O ATOM 1829 CB ASP B 65 111.718 163.909 82.250 1.00 35.77 C ATOM 1830 CG ASP B 65 110.591 164.853 82.012 1.00 53.06 C ATOM 1831 OD1 ASP B 65 110.420 165.288 80.851 1.00 53.93 O ATOM 1832 OD2 ASP B 65 109.882 165.154 82.994 1.00 63.06 O ATOM 1833 H ASP B 65 110.262 162.045 81.211 1.00 0.00 H ATOM 1834 N PRO B 66 114.535 163.147 80.984 1.00 26.21 N ATOM 1835 CA PRO B 66 115.835 162.551 81.260 1.00 23.39 C ATOM 1836 C PRO B 66 116.020 162.179 82.739 1.00 25.21 C ATOM 1837 O PRO B 66 116.718 161.194 82.998 1.00 24.96 O ATOM 1838 CB PRO B 66 116.812 163.643 80.832 1.00 26.14 C ATOM 1839 CG PRO B 66 116.049 164.385 79.752 1.00 29.50 C ATOM 1840 CD PRO B 66 114.621 164.401 80.208 1.00 30.73 C ATOM 1841 N SER B 67 115.377 162.915 83.677 1.00 27.52 N ATOM 1842 CA SER B 67 115.548 162.588 85.094 1.00 24.66 C ATOM 1843 C SER B 67 115.024 161.194 85.393 1.00 25.63 C ATOM 1844 O SER B 67 115.432 160.560 86.380 1.00 24.99 O ATOM 1845 CB SER B 67 114.796 163.606 85.963 1.00 24.92 C ATOM 1846 OG SER B 67 113.401 163.556 85.733 1.00 27.98 O ATOM 1847 HG SER B 67 113.064 162.650 85.949 1.00 0.00 H ATOM 1848 H SER B 67 114.766 163.707 83.393 1.00 0.00 H ATOM 1849 N GLN B 68 114.120 160.711 84.557 1.00 21.85 N ATOM 1850 CA GLN B 68 113.519 159.396 84.810 1.00 22.65 C ATOM 1851 C GLN B 68 114.385 158.266 84.307 1.00 21.90 C ATOM 1852 O GLN B 68 114.166 157.118 84.605 1.00 20.37 O ATOM 1853 CB GLN B 68 112.144 159.337 84.178 1.00 22.55 C ATOM 1854 CG GLN B 68 111.260 160.373 84.792 1.00 22.15 C ATOM 1855 CD GLN B 68 110.002 160.548 84.005 1.00 19.14 C ATOM 1856 OE1 GLN B 68 110.025 161.072 82.906 1.00 23.98 O ATOM 1857 NE2 GLN B 68 108.881 160.094 84.570 1.00 28.66 N ATOM 1858 HE22 GLN B 68 108.915 159.654 85.512 1.00 0.00 H ATOM 1859 HE21 GLN B 68 107.974 160.180 84.068 1.00 0.00 H ATOM 1860 H GLN B 68 113.836 161.262 83.722 1.00 0.00 H ATOM 1861 N ILE B 69 115.432 158.609 83.560 1.00 20.75 N ATOM 1862 CA ILE B 69 116.294 157.595 82.989 1.00 22.13 C ATOM 1863 C ILE B 69 117.466 157.296 83.933 1.00 21.58 C ATOM 1864 O ILE B 69 117.989 156.162 83.888 1.00 19.06 O ATOM 1865 CB ILE B 69 116.886 158.100 81.581 1.00 19.11 C ATOM 1866 CG1 ILE B 69 115.746 158.392 80.601 1.00 22.83 C ATOM 1867 CG2 ILE B 69 117.895 157.143 80.926 1.00 21.21 C ATOM 1868 CD1 ILE B 69 114.816 157.222 80.418 1.00 22.10 C ATOM 1869 H ILE B 69 115.633 159.614 83.385 1.00 0.00 H ATOM 1870 N VAL B 70 117.805 158.244 84.820 1.00 22.47 N ATOM 1871 CA VAL B 70 118.993 158.083 85.653 1.00 23.00 C ATOM 1872 C VAL B 70 118.945 156.787 86.470 1.00 19.47 C ATOM 1873 O VAL B 70 119.931 156.038 86.496 1.00 22.57 O ATOM 1874 CB VAL B 70 119.139 159.270 86.577 1.00 29.55 C ATOM 1875 CG1 VAL B 70 120.334 159.082 87.513 1.00 31.26 C ATOM 1876 CG2 VAL B 70 119.301 160.535 85.748 1.00 32.18 C ATOM 1877 H VAL B 70 117.219 159.098 84.915 1.00 0.00 H ATOM 1878 N GLY B 71 117.800 156.514 87.108 1.00 22.07 N ATOM 1879 CA GLY B 71 117.689 155.316 87.931 1.00 22.63 C ATOM 1880 C GLY B 71 117.699 154.004 87.183 1.00 21.97 C ATOM 1881 O GLY B 71 118.124 152.977 87.697 1.00 22.73 O ATOM 1882 H GLY B 71 116.988 157.158 87.016 1.00 0.00 H ATOM 1883 N LEU B 72 117.212 154.019 85.933 1.00 21.74 N ATOM 1884 CA LEU B 72 117.294 152.860 85.075 1.00 19.94 C ATOM 1885 C LEU B 72 118.743 152.547 84.723 1.00 19.58 C ATOM 1886 O LEU B 72 119.149 151.388 84.761 1.00 18.92 O ATOM 1887 CB LEU B 72 116.543 153.108 83.770 1.00 17.70 C ATOM 1888 CG LEU B 72 115.080 153.485 83.954 1.00 18.48 C ATOM 1889 CD1 LEU B 72 114.486 153.846 82.665 1.00 20.71 C ATOM 1890 CD2 LEU B 72 114.290 152.266 84.534 1.00 20.14 C ATOM 1891 H LEU B 72 116.765 154.886 85.573 1.00 0.00 H ATOM 1892 N VAL B 73 119.494 153.602 84.393 1.00 18.11 N ATOM 1893 CA VAL B 73 120.935 153.429 84.157 1.00 18.10 C ATOM 1894 C VAL B 73 121.617 152.962 85.430 1.00 20.24 C ATOM 1895 O VAL B 73 122.481 152.051 85.353 1.00 22.48 O ATOM 1896 CB VAL B 73 121.568 154.711 83.597 1.00 19.22 C ATOM 1897 CG1 VAL B 73 123.099 154.553 83.475 1.00 21.25 C ATOM 1898 CG2 VAL B 73 120.890 155.058 82.228 1.00 19.09 C ATOM 1899 H VAL B 73 119.060 154.543 84.303 1.00 0.00 H ATOM 1900 N ASP B 74 121.226 153.492 86.610 1.00 22.42 N ATOM 1901 CA ASP B 74 121.849 153.027 87.849 1.00 22.15 C ATOM 1902 C ASP B 74 121.621 151.525 88.023 1.00 24.87 C ATOM 1903 O ASP B 74 122.501 150.798 88.484 1.00 23.26 O ATOM 1904 CB ASP B 74 121.272 153.766 89.072 1.00 22.90 C ATOM 1905 CG ASP B 74 121.669 155.245 89.161 1.00 34.74 C ATOM 1906 OD1 ASP B 74 122.616 155.705 88.489 1.00 34.26 O ATOM 1907 OD2 ASP B 74 121.000 155.949 89.990 1.00 42.31 O ATOM 1908 H ASP B 74 120.488 154.224 86.637 1.00 0.00 H ATOM 1909 N GLU B 75 120.393 151.078 87.745 1.00 20.89 N ATOM 1910 CA GLU B 75 120.061 149.665 87.880 1.00 20.85 C ATOM 1911 C GLU B 75 120.928 148.816 86.950 1.00 21.41 C ATOM 1912 O GLU B 75 121.486 147.791 87.367 1.00 22.58 O ATOM 1913 CB GLU B 75 118.564 149.455 87.603 1.00 23.37 C ATOM 1914 CG GLU B 75 118.166 148.017 87.578 1.00 26.96 C ATOM 1915 CD GLU B 75 116.674 147.781 87.379 1.00 30.29 C ATOM 1916 OE1 GLU B 75 116.322 146.605 87.187 1.00 36.78 O ATOM 1917 OE2 GLU B 75 115.864 148.736 87.356 1.00 31.26 O ATOM 1918 H GLU B 75 119.663 151.748 87.428 1.00 0.00 H ATOM 1919 N LEU B 76 121.038 149.244 85.703 1.00 19.49 N ATOM 1920 CA LEU B 76 121.812 148.472 84.762 1.00 18.63 C ATOM 1921 C LEU B 76 123.275 148.522 85.115 1.00 20.15 C ATOM 1922 O LEU B 76 123.994 147.508 84.916 1.00 19.18 O ATOM 1923 CB LEU B 76 121.596 149.037 83.353 1.00 17.56 C ATOM 1924 CG LEU B 76 120.170 148.834 82.794 1.00 19.03 C ATOM 1925 CD1 LEU B 76 120.061 149.609 81.515 1.00 19.13 C ATOM 1926 CD2 LEU B 76 119.887 147.347 82.500 1.00 20.16 C ATOM 1927 H LEU B 76 120.573 150.125 85.405 1.00 0.00 H ATOM 1928 N GLU B 77 123.735 149.656 85.639 1.00 19.56 N ATOM 1929 CA GLU B 77 125.125 149.865 86.045 1.00 21.92 C ATOM 1930 C GLU B 77 125.503 148.891 87.172 1.00 21.77 C ATOM 1931 O GLU B 77 126.561 148.253 87.186 1.00 23.83 O ATOM 1932 CB GLU B 77 125.285 151.331 86.485 1.00 19.25 C ATOM 1933 CG GLU B 77 126.701 151.787 86.885 1.00 19.16 C ATOM 1934 CD GLU B 77 126.713 153.199 87.530 1.00 25.11 C ATOM 1935 OE1 GLU B 77 126.072 153.427 88.591 1.00 30.46 O ATOM 1936 OE2 GLU B 77 127.380 154.090 86.977 1.00 30.11 O ATOM 1937 H GLU B 77 123.065 150.441 85.768 1.00 0.00 H ATOM 1938 N GLU B 78 124.618 148.811 88.152 1.00 21.06 N ATOM 1939 CA GLU B 78 124.882 147.975 89.312 1.00 22.11 C ATOM 1940 C GLU B 78 124.986 146.510 88.928 1.00 25.22 C ATOM 1941 O GLU B 78 125.692 145.756 89.622 1.00 25.65 O ATOM 1942 CB GLU B 78 123.794 148.159 90.372 1.00 30.31 C ATOM 1943 CG GLU B 78 124.110 147.404 91.625 1.00 50.76 C ATOM 1944 CD GLU B 78 125.222 148.035 92.421 1.00 55.59 C ATOM 1945 OE1 GLU B 78 125.370 149.278 92.348 1.00 56.71 O ATOM 1946 OE2 GLU B 78 125.947 147.288 93.122 1.00 74.99 O ATOM 1947 H GLU B 78 123.730 149.348 88.092 1.00 0.00 H ATOM 1948 N ARG B 79 124.305 146.109 87.843 1.00 24.39 N ATOM 1949 CA ARG B 79 124.411 144.740 87.360 1.00 24.91 C ATOM 1950 C ARG B 79 125.542 144.534 86.389 1.00 26.06 C ATOM 1951 O ARG B 79 125.715 143.420 85.877 1.00 28.38 O ATOM 1952 CB ARG B 79 123.100 144.301 86.680 1.00 24.43 C ATOM 1953 CG ARG B 79 121.932 144.058 87.625 1.00 32.04 C ATOM 1954 CD ARG B 79 120.728 143.588 86.826 1.00 28.81 C ATOM 1955 NE ARG B 79 120.949 142.247 86.262 1.00 27.48 N ATOM 1956 CZ ARG B 79 120.046 141.627 85.476 1.00 23.82 C ATOM 1957 NH1 ARG B 79 118.897 142.191 85.204 1.00 27.27 N ATOM 1958 NH2 ARG B 79 120.315 140.423 84.975 1.00 25.95 N ATOM 1959 HE ARG B 79 121.840 141.756 86.479 1.00 0.00 H ATOM 1960 HH12 ARG B 79 118.209 141.702 84.596 1.00 0.00 H ATOM 1961 HH11 ARG B 79 118.672 143.128 85.596 1.00 0.00 H ATOM 1962 HH22 ARG B 79 119.619 139.945 84.369 1.00 0.00 H ATOM 1963 HH21 ARG B 79 121.222 139.961 85.190 1.00 0.00 H ATOM 1964 H ARG B 79 123.694 146.785 87.341 1.00 0.00 H ATOM 1965 N GLY B 80 126.306 145.588 86.097 1.00 21.34 N ATOM 1966 CA GLY B 80 127.442 145.417 85.200 1.00 20.63 C ATOM 1967 C GLY B 80 127.038 145.298 83.718 1.00 21.24 C ATOM 1968 O GLY B 80 127.797 144.797 82.887 1.00 23.96 O ATOM 1969 H GLY B 80 126.093 146.521 86.505 1.00 0.00 H ATOM 1970 N LEU B 81 125.874 145.813 83.402 1.00 20.63 N ATOM 1971 CA LEU B 81 125.342 145.677 82.047 1.00 19.70 C ATOM 1972 C LEU B 81 125.625 146.921 81.198 1.00 20.87 C ATOM 1973 O LEU B 81 125.658 146.845 79.978 1.00 19.83 O ATOM 1974 CB LEU B 81 123.824 145.436 82.077 1.00 18.05 C ATOM 1975 CG LEU B 81 123.398 144.210 82.877 1.00 21.68 C ATOM 1976 CD1 LEU B 81 121.878 144.135 83.010 1.00 22.47 C ATOM 1977 CD2 LEU B 81 123.921 142.946 82.133 1.00 20.13 C ATOM 1978 H LEU B 81 125.324 146.323 84.122 1.00 0.00 H ATOM 1979 N VAL B 82 125.741 148.086 81.849 1.00 18.85 N ATOM 1980 CA VAL B 82 126.182 149.300 81.133 1.00 18.03 C ATOM 1981 C VAL B 82 127.169 150.005 82.012 1.00 16.27 C ATOM 1982 O VAL B 82 127.249 149.730 83.227 1.00 20.38 O ATOM 1983 CB VAL B 82 125.013 150.290 80.795 1.00 17.28 C ATOM 1984 CG1 VAL B 82 123.927 149.643 79.960 1.00 19.75 C ATOM 1985 CG2 VAL B 82 124.356 150.893 82.085 1.00 19.55 C ATOM 1986 H VAL B 82 125.519 148.136 82.864 1.00 0.00 H ATOM 1987 N VAL B 83 127.929 150.919 81.412 1.00 18.92 N ATOM 1988 CA VAL B 83 128.864 151.755 82.130 1.00 20.14 C ATOM 1989 C VAL B 83 128.612 153.198 81.706 1.00 19.52 C ATOM 1990 O VAL B 83 128.347 153.454 80.539 1.00 23.25 O ATOM 1991 CB VAL B 83 130.344 151.378 81.832 1.00 23.33 C ATOM 1992 CG1 VAL B 83 131.251 152.416 82.396 1.00 23.20 C ATOM 1993 CG2 VAL B 83 130.673 150.063 82.487 1.00 22.92 C ATOM 1994 H VAL B 83 127.846 151.036 80.382 1.00 0.00 H ATOM 1995 N ARG B 84 128.685 154.122 82.640 1.00 22.71 N ATOM 1996 CA ARG B 84 128.681 155.526 82.256 1.00 23.87 C ATOM 1997 C ARG B 84 130.080 155.909 81.829 1.00 28.85 C ATOM 1998 O ARG B 84 131.041 155.846 82.649 1.00 30.08 O ATOM 1999 CB ARG B 84 128.209 156.395 83.413 1.00 24.06 C ATOM 2000 CG ARG B 84 126.746 156.207 83.780 1.00 26.16 C ATOM 2001 CD ARG B 84 126.359 157.226 84.860 1.00 29.81 C ATOM 2002 NE ARG B 84 124.900 157.389 84.981 1.00 29.26 N ATOM 2003 CZ ARG B 84 124.153 156.780 85.894 1.00 28.71 C ATOM 2004 NH1 ARG B 84 124.735 155.930 86.748 1.00 32.82 N ATOM 2005 NH2 ARG B 84 122.844 157.019 85.983 1.00 30.54 N ATOM 2006 HE ARG B 84 124.424 158.022 84.307 1.00 0.00 H ATOM 2007 HH12 ARG B 84 124.164 155.445 87.469 1.00 0.00 H ATOM 2008 HH11 ARG B 84 125.758 155.755 86.691 1.00 0.00 H ATOM 2009 HH22 ARG B 84 122.274 156.533 86.705 1.00 0.00 H ATOM 2010 HH21 ARG B 84 122.393 157.692 85.331 1.00 0.00 H ATOM 2011 H ARG B 84 128.745 153.852 83.643 1.00 0.00 H ATOM 2012 N THR B 85 130.222 156.304 80.574 1.00 24.96 N ATOM 2013 CA THR B 85 131.520 156.647 80.032 1.00 24.42 C ATOM 2014 C THR B 85 131.483 158.007 79.371 1.00 25.26 C ATOM 2015 O THR B 85 130.462 158.727 79.474 1.00 28.41 O ATOM 2016 CB THR B 85 132.014 155.529 79.058 1.00 27.27 C ATOM 2017 OG1 THR B 85 133.372 155.740 78.712 1.00 27.50 O ATOM 2018 CG2 THR B 85 131.158 155.387 77.773 1.00 25.77 C ATOM 2019 HG1 THR B 85 133.669 155.025 78.096 1.00 0.00 H ATOM 2020 H THR B 85 129.383 156.370 79.963 1.00 0.00 H ATOM 2021 N LEU B 86 132.580 158.397 78.739 1.00 27.52 N ATOM 2022 CA LEU B 86 132.625 159.705 78.077 1.00 26.72 C ATOM 2023 C LEU B 86 132.881 159.380 76.646 1.00 27.27 C ATOM 2024 O LEU B 86 133.687 158.507 76.358 1.00 33.87 O ATOM 2025 CB LEU B 86 133.711 160.641 78.660 1.00 25.82 C ATOM 2026 CG LEU B 86 133.556 160.935 80.146 1.00 31.40 C ATOM 2027 CD1 LEU B 86 134.749 161.743 80.592 1.00 39.13 C ATOM 2028 CD2 LEU B 86 132.263 161.708 80.479 1.00 33.27 C ATOM 2029 H LEU B 86 133.412 157.774 78.712 1.00 0.00 H ATOM 2030 N ASP B 87 132.124 160.020 75.754 1.00 28.18 N ATOM 2031 CA ASP B 87 132.321 159.902 74.326 1.00 28.31 C ATOM 2032 C ASP B 87 133.785 160.177 73.999 1.00 45.07 C ATOM 2033 O ASP B 87 134.280 161.258 74.265 1.00 37.64 O ATOM 2034 CB ASP B 87 131.391 160.879 73.607 1.00 30.91 C ATOM 2035 CG ASP B 87 131.410 160.734 72.068 1.00 42.73 C ATOM 2036 OD1 ASP B 87 132.344 160.099 71.506 1.00 42.11 O ATOM 2037 OD2 ASP B 87 130.494 161.308 71.412 1.00 40.40 O ATOM 2038 H ASP B 87 131.358 160.631 76.101 1.00 0.00 H ATOM 2039 N PRO B 88 134.484 159.179 73.432 1.00 36.46 N ATOM 2040 CA PRO B 88 135.864 159.440 73.001 1.00 47.03 C ATOM 2041 C PRO B 88 135.949 160.597 71.966 1.00 59.96 C ATOM 2042 O PRO B 88 137.010 161.222 71.812 1.00 40.00 O ATOM 2043 CB PRO B 88 136.293 158.101 72.379 1.00 45.88 C ATOM 2044 CG PRO B 88 135.407 157.086 72.956 1.00 54.86 C ATOM 2045 CD PRO B 88 134.071 157.786 73.174 1.00 48.44 C ATOM 2046 N SER B 89 134.847 160.897 71.271 1.00 43.63 N ATOM 2047 CA SER B 89 134.898 161.997 70.283 1.00 51.68 C ATOM 2048 C SER B 89 134.485 163.362 70.835 1.00 60.13 C ATOM 2049 O SER B 89 134.579 164.375 70.131 1.00 61.72 O ATOM 2050 CB SER B 89 134.028 161.675 69.075 1.00 43.04 C ATOM 2051 OG SER B 89 134.577 160.581 68.383 1.00 60.07 O ATOM 2052 HG SER B 89 134.012 160.371 67.598 1.00 0.00 H ATOM 2053 H SER B 89 133.967 160.365 71.423 1.00 0.00 H ATOM 2054 N ASP B 90 134.037 163.391 72.087 1.00 45.07 N ATOM 2055 CA ASP B 90 133.674 164.630 72.765 1.00 36.52 C ATOM 2056 C ASP B 90 133.538 164.320 74.243 1.00 41.28 C ATOM 2057 O ASP B 90 132.509 163.813 74.655 1.00 34.12 O ATOM 2058 CB ASP B 90 132.367 165.201 72.211 1.00 35.41 C ATOM 2059 CG ASP B 90 131.910 166.454 72.953 1.00 50.03 C ATOM 2060 OD1 ASP B 90 132.642 166.940 73.849 1.00 43.65 O ATOM 2061 OD2 ASP B 90 130.824 166.979 72.611 1.00 51.97 O ATOM 2062 H ASP B 90 133.942 162.493 72.604 1.00 0.00 H ATOM 2063 N ARG B 91 134.539 164.664 75.056 1.00 35.75 N ATOM 2064 CA ARG B 91 134.463 164.189 76.435 1.00 34.24 C ATOM 2065 C ARG B 91 133.399 164.900 77.259 1.00 32.03 C ATOM 2066 O ARG B 91 133.130 164.505 78.395 1.00 41.77 O ATOM 2067 CB ARG B 91 135.808 164.303 77.116 1.00 41.75 C ATOM 2068 CG ARG B 91 136.835 163.332 76.567 1.00 52.59 C ATOM 2069 CD ARG B 91 136.438 161.828 76.626 1.00 43.26 C ATOM 2070 NE ARG B 91 137.651 161.023 76.470 1.00 37.65 N ATOM 2071 CZ ARG B 91 137.721 159.692 76.502 1.00 47.54 C ATOM 2072 NH1 ARG B 91 136.631 158.958 76.674 1.00 38.97 N ATOM 2073 NH2 ARG B 91 138.900 159.093 76.374 1.00 36.96 N ATOM 2074 HE ARG B 91 138.542 161.538 76.320 1.00 0.00 H ATOM 2075 HH12 ARG B 91 136.701 157.921 76.697 1.00 0.00 H ATOM 2076 HH11 ARG B 91 135.706 159.419 76.786 1.00 0.00 H ATOM 2077 HH22 ARG B 91 138.961 158.055 76.398 1.00 0.00 H ATOM 2078 HH21 ARG B 91 139.762 159.662 76.250 1.00 0.00 H ATOM 2079 H ARG B 91 135.336 165.243 74.723 1.00 0.00 H ATOM 2080 N ARG B 92 132.765 165.919 76.689 1.00 34.64 N ATOM 2081 CA ARG B 92 131.651 166.566 77.365 1.00 34.89 C ATOM 2082 C ARG B 92 130.345 165.795 77.129 1.00 30.43 C ATOM 2083 O ARG B 92 129.352 166.038 77.801 1.00 31.10 O ATOM 2084 CB ARG B 92 131.530 168.026 76.893 1.00 37.84 C ATOM 2085 CG ARG B 92 132.838 168.830 77.048 1.00 40.15 C ATOM 2086 CD ARG B 92 132.706 170.266 76.524 1.00 44.38 C ATOM 2087 NE ARG B 92 133.996 170.944 76.320 1.00 41.99 N ATOM 2088 CZ ARG B 92 134.549 171.810 77.168 1.00 40.18 C ATOM 2089 NH1 ARG B 92 133.946 172.123 78.303 1.00 39.05 N ATOM 2090 NH2 ARG B 92 135.715 172.375 76.878 1.00 42.17 N ATOM 2091 HE ARG B 92 134.517 170.730 75.445 1.00 0.00 H ATOM 2092 HH12 ARG B 92 134.388 172.800 78.957 1.00 0.00 H ATOM 2093 HH11 ARG B 92 133.030 171.692 78.541 1.00 0.00 H ATOM 2094 HH22 ARG B 92 136.145 173.051 77.542 1.00 0.00 H ATOM 2095 HH21 ARG B 92 136.199 172.142 75.987 1.00 0.00 H ATOM 2096 H ARG B 92 133.067 166.257 75.753 1.00 0.00 H ATOM 2097 N ASN B 93 130.365 164.851 76.187 1.00 30.15 N ATOM 2098 CA ASN B 93 129.191 164.057 75.835 1.00 30.09 C ATOM 2099 C ASN B 93 129.220 162.765 76.652 1.00 25.06 C ATOM 2100 O ASN B 93 129.966 161.842 76.346 1.00 28.80 O ATOM 2101 CB ASN B 93 129.173 163.764 74.320 1.00 26.79 C ATOM 2102 CG ASN B 93 127.881 163.076 73.850 1.00 25.59 C ATOM 2103 OD1 ASN B 93 126.798 163.314 74.401 1.00 30.15 O ATOM 2104 ND2 ASN B 93 127.995 162.233 72.840 1.00 29.57 N ATOM 2105 HD22 ASN B 93 128.925 162.063 72.407 1.00 0.00 H ATOM 2106 HD21 ASN B 93 127.155 161.739 72.478 1.00 0.00 H ATOM 2107 H ASN B 93 131.256 164.673 75.681 1.00 0.00 H ATOM 2108 N LYS B 94 128.381 162.678 77.670 1.00 28.31 N ATOM 2109 CA LYS B 94 128.344 161.497 78.494 1.00 24.61 C ATOM 2110 C LYS B 94 127.532 160.424 77.783 1.00 30.62 C ATOM 2111 O LYS B 94 126.450 160.734 77.231 1.00 30.75 O ATOM 2112 CB LYS B 94 127.743 161.810 79.849 1.00 25.87 C ATOM 2113 CG LYS B 94 128.666 162.804 80.615 1.00 36.86 C ATOM 2114 CD LYS B 94 128.077 163.200 81.924 1.00 46.84 C ATOM 2115 CE LYS B 94 128.933 164.252 82.635 1.00 53.99 C ATOM 2116 NZ LYS B 94 128.210 164.696 83.845 1.00 62.93 N ATOM 2117 HZ1 LYS B 94 127.295 165.106 83.570 1.00 0.00 H ATOM 2118 HZ2 LYS B 94 128.052 163.881 84.471 1.00 0.00 H ATOM 2119 HZ3 LYS B 94 128.777 165.412 84.343 1.00 0.00 H ATOM 2120 H LYS B 94 127.741 163.471 77.878 1.00 0.00 H ATOM 2121 N LEU B 95 128.071 159.207 77.741 1.00 24.78 N ATOM 2122 CA LEU B 95 127.376 158.099 77.088 1.00 23.23 C ATOM 2123 C LEU B 95 127.095 156.966 78.039 1.00 27.53 C ATOM 2124 O LEU B 95 127.841 156.706 79.003 1.00 23.47 O ATOM 2125 CB LEU B 95 128.187 157.584 75.897 1.00 20.20 C ATOM 2126 CG LEU B 95 128.443 158.585 74.779 1.00 21.54 C ATOM 2127 CD1 LEU B 95 129.297 157.890 73.756 1.00 26.86 C ATOM 2128 CD2 LEU B 95 127.140 159.119 74.095 1.00 23.60 C ATOM 2129 H LEU B 95 129.000 159.042 78.179 1.00 0.00 H ATOM 2130 N ILE B 96 125.989 156.284 77.787 1.00 22.25 N ATOM 2131 CA ILE B 96 125.643 155.038 78.454 1.00 20.33 C ATOM 2132 C ILE B 96 126.060 153.909 77.523 1.00 21.40 C ATOM 2133 O ILE B 96 125.517 153.779 76.424 1.00 20.90 O ATOM 2134 CB ILE B 96 124.111 154.982 78.713 1.00 20.57 C ATOM 2135 CG1 ILE B 96 123.653 156.177 79.561 1.00 22.73 C ATOM 2136 CG2 ILE B 96 123.735 153.637 79.373 1.00 22.21 C ATOM 2137 CD1 ILE B 96 122.239 156.617 79.186 1.00 23.62 C ATOM 2138 H ILE B 96 125.332 156.659 77.074 1.00 0.00 H ATOM 2139 N ALA B 97 127.111 153.197 77.905 1.00 21.06 N ATOM 2140 CA ALA B 97 127.680 152.161 77.019 1.00 20.66 C ATOM 2141 C ALA B 97 127.436 150.768 77.532 1.00 18.00 C ATOM 2142 O ALA B 97 127.698 150.456 78.688 1.00 20.06 O ATOM 2143 CB ALA B 97 129.233 152.381 76.860 1.00 22.06 C ATOM 2144 H ALA B 97 127.539 153.369 78.837 1.00 0.00 H ATOM 2145 N ALA B 98 126.998 149.892 76.641 1.00 20.85 N ATOM 2146 CA ALA B 98 126.821 148.526 77.038 1.00 20.02 C ATOM 2147 C ALA B 98 128.115 147.798 77.237 1.00 22.63 C ATOM 2148 O ALA B 98 129.101 148.013 76.526 1.00 23.95 O ATOM 2149 CB ALA B 98 125.989 147.802 75.972 1.00 20.24 C ATOM 2150 H ALA B 98 126.786 150.190 75.668 1.00 0.00 H ATOM 2151 N THR B 99 128.138 146.906 78.230 1.00 20.83 N ATOM 2152 CA THR B 99 129.295 146.048 78.422 1.00 21.66 C ATOM 2153 C THR B 99 129.162 144.764 77.635 1.00 21.68 C ATOM 2154 O THR B 99 128.088 144.517 77.098 1.00 20.27 O ATOM 2155 CB THR B 99 129.457 145.679 79.906 1.00 21.93 C ATOM 2156 OG1 THR B 99 128.302 144.956 80.327 1.00 20.48 O ATOM 2157 CG2 THR B 99 129.564 146.951 80.812 1.00 25.21 C ATOM 2158 HG1 THR B 99 128.396 144.713 81.282 1.00 0.00 H ATOM 2159 H THR B 99 127.323 146.825 78.870 1.00 0.00 H ATOM 2160 N GLU B 100 130.209 143.948 77.589 1.00 22.11 N ATOM 2161 CA GLU B 100 130.067 142.619 76.987 1.00 27.40 C ATOM 2162 C GLU B 100 128.913 141.823 77.603 1.00 24.43 C ATOM 2163 O GLU B 100 128.097 141.192 76.898 1.00 23.89 O ATOM 2164 CB GLU B 100 131.396 141.867 77.144 1.00 28.01 C ATOM 2165 CG GLU B 100 131.271 140.399 77.420 1.00 51.80 C ATOM 2166 CD GLU B 100 132.505 139.623 76.973 1.00 74.55 C ATOM 2167 OE1 GLU B 100 133.620 140.202 76.989 1.00 76.88 O ATOM 2168 OE2 GLU B 100 132.355 138.435 76.612 1.00 90.70 O ATOM 2169 H GLU B 100 131.125 144.250 77.978 1.00 0.00 H ATOM 2170 N GLU B 101 128.789 141.870 78.926 1.00 22.68 N ATOM 2171 CA GLU B 101 127.697 141.149 79.595 1.00 23.55 C ATOM 2172 C GLU B 101 126.315 141.749 79.272 1.00 22.08 C ATOM 2173 O GLU B 101 125.321 141.036 79.031 1.00 19.88 O ATOM 2174 CB GLU B 101 127.949 141.145 81.103 1.00 25.33 C ATOM 2175 CG GLU B 101 126.856 140.509 81.936 1.00 35.39 C ATOM 2176 CD GLU B 101 126.513 139.077 81.525 1.00 54.64 C ATOM 2177 OE1 GLU B 101 127.398 138.320 81.061 1.00 49.53 O ATOM 2178 OE2 GLU B 101 125.325 138.701 81.670 1.00 63.08 O ATOM 2179 H GLU B 101 129.468 142.420 79.490 1.00 0.00 H ATOM 2180 N GLY B 102 126.269 143.072 79.187 1.00 20.77 N ATOM 2181 CA GLY B 102 125.056 143.742 78.735 1.00 17.56 C ATOM 2182 C GLY B 102 124.644 143.339 77.308 1.00 18.36 C ATOM 2183 O GLY B 102 123.461 143.151 77.049 1.00 18.87 O ATOM 2184 H GLY B 102 127.104 143.635 79.445 1.00 0.00 H ATOM 2185 N ARG B 103 125.606 143.195 76.422 1.00 19.14 N ATOM 2186 CA ARG B 103 125.257 142.805 75.046 1.00 18.73 C ATOM 2187 C ARG B 103 124.753 141.377 75.043 1.00 19.96 C ATOM 2188 O ARG B 103 123.792 141.040 74.300 1.00 20.80 O ATOM 2189 CB ARG B 103 126.432 142.975 74.082 1.00 22.62 C ATOM 2190 CG ARG B 103 126.820 144.423 73.888 1.00 22.04 C ATOM 2191 CD ARG B 103 127.953 144.604 72.845 1.00 23.37 C ATOM 2192 NE ARG B 103 128.262 146.057 72.768 1.00 28.18 N ATOM 2193 CZ ARG B 103 127.527 146.937 72.074 1.00 27.23 C ATOM 2194 NH1 ARG B 103 126.484 146.525 71.331 1.00 24.85 N ATOM 2195 NH2 ARG B 103 127.865 148.218 72.093 1.00 30.63 N ATOM 2196 HE ARG B 103 129.095 146.410 73.281 1.00 0.00 H ATOM 2197 HH12 ARG B 103 125.921 147.217 70.797 1.00 0.00 H ATOM 2198 HH11 ARG B 103 126.241 145.515 71.291 1.00 0.00 H ATOM 2199 HH22 ARG B 103 127.304 148.912 71.559 1.00 0.00 H ATOM 2200 HH21 ARG B 103 128.692 148.530 72.642 1.00 0.00 H ATOM 2201 H ARG B 103 126.598 143.354 76.690 1.00 0.00 H ATOM 2202 N ARG B 104 125.370 140.519 75.852 1.00 22.53 N ATOM 2203 CA ARG B 104 124.928 139.119 75.871 1.00 21.49 C ATOM 2204 C ARG B 104 123.491 139.023 76.436 1.00 20.97 C ATOM 2205 O ARG B 104 122.635 138.288 75.903 1.00 22.69 O ATOM 2206 CB ARG B 104 125.911 138.268 76.685 1.00 25.21 C ATOM 2207 CG ARG B 104 125.397 136.889 77.056 1.00 37.01 C ATOM 2208 CD ARG B 104 125.836 136.423 78.464 1.00 53.62 C ATOM 2209 NE ARG B 104 124.759 136.616 79.441 1.00 67.56 N ATOM 2210 CZ ARG B 104 123.602 135.945 79.468 1.00 63.02 C ATOM 2211 NH1 ARG B 104 123.327 134.994 78.574 1.00 64.11 N ATOM 2212 NH2 ARG B 104 122.710 136.232 80.410 1.00 73.26 N ATOM 2213 HE ARG B 104 124.908 137.337 80.176 1.00 0.00 H ATOM 2214 HH12 ARG B 104 122.420 134.487 78.617 1.00 0.00 H ATOM 2215 HH11 ARG B 104 124.020 134.760 77.834 1.00 0.00 H ATOM 2216 HH22 ARG B 104 121.806 135.719 80.444 1.00 0.00 H ATOM 2217 HH21 ARG B 104 122.916 136.970 81.114 1.00 0.00 H ATOM 2218 H ARG B 104 126.152 140.835 76.460 1.00 0.00 H ATOM 2219 N LEU B 105 123.190 139.790 77.481 1.00 19.91 N ATOM 2220 CA LEU B 105 121.851 139.772 78.064 1.00 19.01 C ATOM 2221 C LEU B 105 120.858 140.397 77.113 1.00 17.74 C ATOM 2222 O LEU B 105 119.715 139.940 76.997 1.00 19.66 O ATOM 2223 CB LEU B 105 121.853 140.509 79.412 1.00 20.00 C ATOM 2224 CG LEU B 105 120.514 140.404 80.131 1.00 21.03 C ATOM 2225 CD1 LEU B 105 120.230 138.965 80.533 1.00 25.31 C ATOM 2226 CD2 LEU B 105 120.469 141.360 81.360 1.00 22.76 C ATOM 2227 H LEU B 105 123.918 140.411 77.888 1.00 0.00 H ATOM 2228 N ARG B 106 121.307 141.420 76.399 1.00 18.25 N ATOM 2229 CA ARG B 106 120.400 142.082 75.479 1.00 18.06 C ATOM 2230 C ARG B 106 120.024 141.129 74.352 1.00 19.47 C ATOM 2231 O ARG B 106 118.875 141.108 73.909 1.00 20.96 O ATOM 2232 CB ARG B 106 121.041 143.348 74.908 1.00 18.93 C ATOM 2233 CG ARG B 106 120.390 143.851 73.631 1.00 22.67 C ATOM 2234 CD ARG B 106 121.427 144.139 72.558 1.00 58.79 C ATOM 2235 NE ARG B 106 120.812 144.512 71.288 1.00 63.87 N ATOM 2236 CZ ARG B 106 120.409 143.640 70.368 1.00 69.41 C ATOM 2237 NH1 ARG B 106 120.557 142.339 70.576 1.00 66.91 N ATOM 2238 NH2 ARG B 106 119.860 144.070 69.241 1.00 66.95 N ATOM 2239 HE ARG B 106 120.680 145.524 71.090 1.00 0.00 H ATOM 2240 HH12 ARG B 106 120.242 141.658 69.856 1.00 0.00 H ATOM 2241 HH11 ARG B 106 120.989 141.999 71.459 1.00 0.00 H ATOM 2242 HH22 ARG B 106 119.545 143.387 68.522 1.00 0.00 H ATOM 2243 HH21 ARG B 106 119.744 145.090 69.075 1.00 0.00 H ATOM 2244 H ARG B 106 122.291 141.742 76.496 1.00 0.00 H ATOM 2245 N ASP B 107 120.933 140.253 73.933 1.00 19.08 N ATOM 2246 CA ASP B 107 120.602 139.293 72.887 1.00 21.33 C ATOM 2247 C ASP B 107 119.570 138.276 73.422 1.00 19.55 C ATOM 2248 O ASP B 107 118.641 137.908 72.702 1.00 22.18 O ATOM 2249 CB ASP B 107 121.854 138.567 72.417 1.00 21.83 C ATOM 2250 CG ASP B 107 122.677 139.422 71.505 1.00 25.55 C ATOM 2251 OD1 ASP B 107 122.179 140.477 71.051 1.00 30.06 O ATOM 2252 OD2 ASP B 107 123.809 139.034 71.234 1.00 32.99 O ATOM 2253 H ASP B 107 121.884 140.253 74.354 1.00 0.00 H ATOM 2254 N ASP B 108 119.779 137.803 74.638 1.00 19.07 N ATOM 2255 CA ASP B 108 118.847 136.859 75.281 1.00 18.17 C ATOM 2256 C ASP B 108 117.472 137.507 75.458 1.00 19.08 C ATOM 2257 O ASP B 108 116.429 136.944 75.114 1.00 18.15 O ATOM 2258 CB ASP B 108 119.432 136.430 76.607 1.00 19.89 C ATOM 2259 CG ASP B 108 118.508 135.534 77.368 1.00 22.65 C ATOM 2260 OD1 ASP B 108 118.546 134.283 77.122 1.00 25.45 O ATOM 2261 OD2 ASP B 108 117.754 136.079 78.216 1.00 22.42 O ATOM 2262 H ASP B 108 120.627 138.106 75.158 1.00 0.00 H ATOM 2263 N ALA B 109 117.485 138.739 75.955 1.00 20.37 N ATOM 2264 CA ALA B 109 116.246 139.404 76.246 1.00 19.14 C ATOM 2265 C ALA B 109 115.440 139.754 74.991 1.00 17.98 C ATOM 2266 O ALA B 109 114.200 139.636 74.985 1.00 19.30 O ATOM 2267 CB ALA B 109 116.551 140.717 77.072 1.00 17.92 C ATOM 2268 H ALA B 109 118.390 139.220 76.133 1.00 0.00 H ATOM 2269 N LYS B 110 116.151 140.177 73.923 1.00 18.27 N ATOM 2270 CA LYS B 110 115.438 140.537 72.724 1.00 18.43 C ATOM 2271 C LYS B 110 114.842 139.280 72.058 1.00 17.20 C ATOM 2272 O LYS B 110 113.786 139.372 71.470 1.00 19.28 O ATOM 2273 CB LYS B 110 116.340 141.236 71.731 1.00 22.01 C ATOM 2274 CG LYS B 110 115.478 141.707 70.544 1.00 28.52 C ATOM 2275 CD LYS B 110 116.127 142.829 69.821 1.00 36.45 C ATOM 2276 CE LYS B 110 115.609 142.913 68.378 1.00 41.18 C ATOM 2277 NZ LYS B 110 114.139 142.914 68.215 1.00 38.02 N ATOM 2278 HZ1 LYS B 110 113.747 142.037 68.612 1.00 0.00 H ATOM 2279 HZ2 LYS B 110 113.737 143.732 68.715 1.00 0.00 H ATOM 2280 HZ3 LYS B 110 113.904 142.974 67.204 1.00 0.00 H ATOM 2281 H LYS B 110 117.188 140.241 73.965 1.00 0.00 H ATOM 2282 N ALA B 111 115.531 138.150 72.184 1.00 18.12 N ATOM 2283 CA ALA B 111 114.966 136.900 71.639 1.00 19.71 C ATOM 2284 C ALA B 111 113.624 136.604 72.369 1.00 18.76 C ATOM 2285 O ALA B 111 112.618 136.237 71.720 1.00 18.26 O ATOM 2286 CB ALA B 111 115.938 135.766 71.804 1.00 19.51 C ATOM 2287 H ALA B 111 116.456 138.147 72.660 1.00 0.00 H ATOM 2288 N ARG B 112 113.615 136.713 73.691 1.00 16.92 N ATOM 2289 CA ARG B 112 112.363 136.531 74.460 1.00 17.93 C ATOM 2290 C ARG B 112 111.278 137.495 74.100 1.00 20.27 C ATOM 2291 O ARG B 112 110.126 137.093 73.863 1.00 18.60 O ATOM 2292 CB ARG B 112 112.659 136.648 75.983 1.00 16.74 C ATOM 2293 CG ARG B 112 113.634 135.550 76.450 1.00 17.28 C ATOM 2294 CD ARG B 112 114.013 135.805 77.950 1.00 17.69 C ATOM 2295 NE ARG B 112 115.137 134.954 78.292 1.00 19.78 N ATOM 2296 CZ ARG B 112 115.067 133.659 78.562 1.00 20.48 C ATOM 2297 NH1 ARG B 112 113.884 133.022 78.624 1.00 21.44 N ATOM 2298 NH2 ARG B 112 116.199 132.956 78.744 1.00 22.12 N ATOM 2299 HE ARG B 112 116.077 135.398 78.328 1.00 0.00 H ATOM 2300 HH12 ARG B 112 113.852 132.005 78.838 1.00 0.00 H ATOM 2301 HH11 ARG B 112 113.002 133.547 78.458 1.00 0.00 H ATOM 2302 HH22 ARG B 112 116.151 131.939 78.956 1.00 0.00 H ATOM 2303 HH21 ARG B 112 117.122 133.429 78.673 1.00 0.00 H ATOM 2304 H ARG B 112 114.499 136.929 74.194 1.00 0.00 H ATOM 2305 N VAL B 113 111.642 138.767 73.990 1.00 19.03 N ATOM 2306 CA VAL B 113 110.658 139.785 73.667 1.00 20.45 C ATOM 2307 C VAL B 113 110.140 139.648 72.215 1.00 19.26 C ATOM 2308 O VAL B 113 108.925 139.681 72.018 1.00 20.38 O ATOM 2309 CB VAL B 113 111.282 141.186 73.928 1.00 21.92 C ATOM 2310 CG1 VAL B 113 110.401 142.240 73.354 1.00 26.31 C ATOM 2311 CG2 VAL B 113 111.516 141.385 75.449 1.00 24.88 C ATOM 2312 H VAL B 113 112.636 139.036 74.136 1.00 0.00 H ATOM 2313 N ASP B 114 111.029 139.329 71.274 1.00 19.32 N ATOM 2314 CA ASP B 114 110.604 139.071 69.897 1.00 20.20 C ATOM 2315 C ASP B 114 109.525 137.940 69.862 1.00 19.30 C ATOM 2316 O ASP B 114 108.490 138.015 69.189 1.00 23.05 O ATOM 2317 CB ASP B 114 111.778 138.639 68.980 1.00 22.07 C ATOM 2318 CG ASP B 114 112.719 139.805 68.559 1.00 29.47 C ATOM 2319 OD1 ASP B 114 112.405 140.954 68.852 1.00 29.51 O ATOM 2320 OD2 ASP B 114 113.768 139.482 67.938 1.00 35.48 O ATOM 2321 H ASP B 114 112.037 139.263 71.521 1.00 0.00 H ATOM 2322 N ALA B 115 109.799 136.863 70.596 1.00 18.34 N ATOM 2323 CA ALA B 115 108.887 135.724 70.538 1.00 17.90 C ATOM 2324 C ALA B 115 107.580 136.060 71.190 1.00 20.10 C ATOM 2325 O ALA B 115 106.504 135.575 70.682 1.00 24.56 O ATOM 2326 CB ALA B 115 109.523 134.515 71.249 1.00 20.70 C ATOM 2327 H ALA B 115 110.646 136.834 71.199 1.00 0.00 H ATOM 2328 N ALA B 116 107.661 136.838 72.283 1.00 19.65 N ATOM 2329 CA ALA B 116 106.484 137.267 72.989 1.00 22.57 C ATOM 2330 C ALA B 116 105.649 138.190 72.083 1.00 26.06 C ATOM 2331 O ALA B 116 104.443 138.074 72.121 1.00 29.57 O ATOM 2332 CB ALA B 116 106.869 137.957 74.264 1.00 23.04 C ATOM 2333 H ALA B 116 108.596 137.137 72.626 1.00 0.00 H ATOM 2334 N HIS B 117 106.277 139.029 71.274 1.00 26.61 N ATOM 2335 CA HIS B 117 105.510 139.903 70.344 1.00 26.62 C ATOM 2336 C HIS B 117 104.803 139.063 69.297 1.00 36.54 C ATOM 2337 O HIS B 117 103.724 139.454 68.781 1.00 25.66 O ATOM 2338 CB HIS B 117 106.420 140.932 69.605 1.00 29.71 C ATOM 2339 CG HIS B 117 106.899 142.061 70.462 1.00 29.35 C ATOM 2340 ND1 HIS B 117 107.631 143.125 69.971 1.00 31.69 N ATOM 2341 CD2 HIS B 117 106.723 142.310 71.786 1.00 28.84 C ATOM 2342 CE1 HIS B 117 107.914 143.965 70.960 1.00 31.12 C ATOM 2343 NE2 HIS B 117 107.407 143.467 72.076 1.00 29.80 N ATOM 2344 H HIS B 117 107.316 139.078 71.288 1.00 0.00 H ATOM 2345 N GLY B 118 105.328 137.886 68.956 1.00 32.50 N ATOM 2346 CA GLY B 118 104.799 137.157 67.809 1.00 35.06 C ATOM 2347 C GLY B 118 103.372 136.705 67.906 1.00 36.68 C ATOM 2348 O GLY B 118 102.632 136.717 66.934 1.00 35.39 O ATOM 2349 H GLY B 118 106.115 137.488 69.508 1.00 0.00 H ATOM 2350 N ARG B 119 102.965 136.390 69.129 1.00 36.74 N ATOM 2351 CA ARG B 119 101.601 136.025 69.461 1.00 43.54 C ATOM 2352 C ARG B 119 100.622 137.089 68.954 1.00 41.60 C ATOM 2353 O ARG B 119 99.479 136.765 68.630 1.00 46.35 O ATOM 2354 CB ARG B 119 101.446 135.845 70.972 1.00 60.91 C ATOM 2355 CG ARG B 119 100.006 135.866 71.455 1.00 81.70 C ATOM 2356 CD ARG B 119 99.559 134.490 71.920 1.00101.78 C ATOM 2357 NE ARG B 119 100.124 134.141 73.220 1.00110.16 N ATOM 2358 CZ ARG B 119 99.574 133.276 74.067 1.00 95.43 C ATOM 2359 NH1 ARG B 119 98.439 132.668 73.751 1.00 91.57 N ATOM 2360 NH2 ARG B 119 100.159 133.019 75.229 1.00 81.43 N ATOM 2361 HE ARG B 119 101.014 134.599 73.502 1.00 0.00 H ATOM 2362 HH12 ARG B 119 98.009 131.992 74.414 1.00 0.00 H ATOM 2363 HH11 ARG B 119 97.978 132.867 72.840 1.00 0.00 H ATOM 2364 HH22 ARG B 119 99.727 132.342 75.890 1.00 0.00 H ATOM 2365 HH21 ARG B 119 101.050 133.494 75.479 1.00 0.00 H ATOM 2366 H ARG B 119 103.667 136.406 69.896 1.00 0.00 H ATOM 2367 N TYR B 120 101.043 138.357 68.995 1.00 25.72 N ATOM 2368 CA TYR B 120 100.143 139.402 68.582 1.00 26.64 C ATOM 2369 C TYR B 120 100.293 139.831 67.141 1.00 25.14 C ATOM 2370 O TYR B 120 99.297 140.251 66.538 1.00 29.16 O ATOM 2371 CB TYR B 120 100.339 140.643 69.454 1.00 23.92 C ATOM 2372 CG TYR B 120 100.222 140.296 70.920 1.00 27.99 C ATOM 2373 CD1 TYR B 120 99.047 139.834 71.429 1.00 29.32 C ATOM 2374 CD2 TYR B 120 101.297 140.510 71.759 1.00 28.39 C ATOM 2375 CE1 TYR B 120 98.921 139.528 72.780 1.00 29.40 C ATOM 2376 CE2 TYR B 120 101.206 140.184 73.110 1.00 31.26 C ATOM 2377 CZ TYR B 120 100.005 139.748 73.612 1.00 31.62 C ATOM 2378 OH TYR B 120 99.910 139.430 74.949 1.00 29.89 O ATOM 2379 HH TYR B 120 100.545 138.700 75.159 1.00 0.00 H ATOM 2380 H TYR B 120 102.004 138.585 69.320 1.00 0.00 H ATOM 2381 N PHE B 121 101.514 139.774 66.614 1.00 22.45 N ATOM 2382 CA PHE B 121 101.796 140.442 65.319 1.00 23.21 C ATOM 2383 C PHE B 121 102.148 139.526 64.179 1.00 28.97 C ATOM 2384 O PHE B 121 102.074 139.956 63.026 1.00 25.37 O ATOM 2385 CB PHE B 121 102.930 141.446 65.458 1.00 23.49 C ATOM 2386 CG PHE B 121 102.740 142.426 66.572 1.00 24.37 C ATOM 2387 CD1 PHE B 121 101.600 143.231 66.599 1.00 28.44 C ATOM 2388 CD2 PHE B 121 103.677 142.554 67.555 1.00 26.32 C ATOM 2389 CE1 PHE B 121 101.423 144.123 67.628 1.00 29.61 C ATOM 2390 CE2 PHE B 121 103.480 143.451 68.603 1.00 25.18 C ATOM 2391 CZ PHE B 121 102.370 144.220 68.618 1.00 26.15 C ATOM 2392 H PHE B 121 102.271 139.261 67.110 1.00 0.00 H ATOM 2393 N GLU B 122 102.521 138.275 64.463 1.00 25.89 N ATOM 2394 CA GLU B 122 102.988 137.410 63.382 1.00 28.31 C ATOM 2395 C GLU B 122 101.927 137.234 62.300 1.00 27.97 C ATOM 2396 O GLU B 122 102.251 137.190 61.113 1.00 34.60 O ATOM 2397 CB GLU B 122 103.428 136.057 63.940 1.00 29.10 C ATOM 2398 CG GLU B 122 104.121 135.154 62.883 1.00 33.98 C ATOM 2399 CD GLU B 122 103.151 134.347 62.047 1.00 40.16 C ATOM 2400 OE1 GLU B 122 101.965 134.245 62.437 1.00 36.06 O ATOM 2401 OE2 GLU B 122 103.586 133.780 61.007 1.00 39.12 O ATOM 2402 H GLU B 122 102.480 137.922 65.440 1.00 0.00 H ATOM 2403 N GLY B 123 100.669 137.125 62.700 1.00 27.14 N ATOM 2404 CA GLY B 123 99.613 136.840 61.743 1.00 33.41 C ATOM 2405 C GLY B 123 99.087 138.025 60.963 1.00 40.71 C ATOM 2406 O GLY B 123 98.202 137.872 60.132 1.00 36.78 O ATOM 2407 H GLY B 123 100.435 137.244 63.706 1.00 0.00 H ATOM 2408 N ILE B 124 99.632 139.193 61.209 1.00 27.82 N ATOM 2409 CA ILE B 124 99.111 140.379 60.505 1.00 28.34 C ATOM 2410 C ILE B 124 99.815 140.539 59.151 1.00 23.58 C ATOM 2411 O ILE B 124 101.021 140.415 59.087 1.00 27.25 O ATOM 2412 CB ILE B 124 99.319 141.644 61.350 1.00 26.97 C ATOM 2413 CG1 ILE B 124 98.717 141.488 62.751 1.00 28.10 C ATOM 2414 CG2 ILE B 124 98.638 142.875 60.673 1.00 25.73 C ATOM 2415 CD1 ILE B 124 99.073 142.658 63.673 1.00 30.00 C ATOM 2416 H ILE B 124 100.416 139.280 61.887 1.00 0.00 H ATOM 2417 N PRO B 125 99.056 140.864 58.087 1.00 26.90 N ATOM 2418 CA PRO B 125 99.738 141.037 56.793 1.00 24.93 C ATOM 2419 C PRO B 125 100.829 142.108 56.866 1.00 25.52 C ATOM 2420 O PRO B 125 100.625 143.148 57.530 1.00 23.75 O ATOM 2421 CB PRO B 125 98.608 141.482 55.860 1.00 24.63 C ATOM 2422 CG PRO B 125 97.348 140.883 56.461 1.00 28.24 C ATOM 2423 CD PRO B 125 97.599 141.049 57.976 1.00 24.95 C ATOM 2424 N ASP B 126 101.935 141.886 56.137 1.00 26.04 N ATOM 2425 CA ASP B 126 103.093 142.774 56.225 1.00 23.65 C ATOM 2426 C ASP B 126 102.677 144.185 55.824 1.00 24.76 C ATOM 2427 O ASP B 126 103.133 145.152 56.430 1.00 23.68 O ATOM 2428 CB ASP B 126 104.244 142.345 55.295 1.00 31.50 C ATOM 2429 CG ASP B 126 104.931 141.074 55.744 1.00 52.29 C ATOM 2430 OD1 ASP B 126 104.888 140.767 56.956 1.00 38.57 O ATOM 2431 OD2 ASP B 126 105.509 140.397 54.853 1.00 54.46 O ATOM 2432 H ASP B 126 101.968 141.067 55.498 1.00 0.00 H ATOM 2433 N THR B 127 101.822 144.310 54.822 1.00 23.24 N ATOM 2434 CA THR B 127 101.473 145.652 54.380 1.00 22.29 C ATOM 2435 C THR B 127 100.659 146.436 55.421 1.00 21.22 C ATOM 2436 O THR B 127 100.714 147.676 55.539 1.00 22.64 O ATOM 2437 CB THR B 127 100.730 145.575 53.027 1.00 25.26 C ATOM 2438 OG1 THR B 127 100.764 146.865 52.425 1.00 32.36 O ATOM 2439 CG2 THR B 127 99.271 145.102 53.162 1.00 24.39 C ATOM 2440 HG1 THR B 127 100.319 147.518 53.021 1.00 0.00 H ATOM 2441 H THR B 127 101.411 143.472 54.363 1.00 0.00 H ATOM 2442 N VAL B 128 99.885 145.704 56.213 1.00 21.18 N ATOM 2443 CA VAL B 128 99.164 146.282 57.343 1.00 20.24 C ATOM 2444 C VAL B 128 100.073 146.684 58.493 1.00 23.36 C ATOM 2445 O VAL B 128 99.897 147.778 59.058 1.00 23.61 O ATOM 2446 CB VAL B 128 98.075 145.294 57.802 1.00 22.24 C ATOM 2447 CG1 VAL B 128 97.342 145.805 59.039 1.00 22.16 C ATOM 2448 CG2 VAL B 128 97.064 145.139 56.695 1.00 22.45 C ATOM 2449 H VAL B 128 99.789 144.686 56.022 1.00 0.00 H ATOM 2450 N VAL B 129 101.008 145.806 58.847 1.00 22.92 N ATOM 2451 CA VAL B 129 102.021 146.144 59.861 1.00 21.92 C ATOM 2452 C VAL B 129 102.817 147.350 59.445 1.00 23.68 C ATOM 2453 O VAL B 129 103.094 148.221 60.270 1.00 23.31 O ATOM 2454 CB VAL B 129 102.984 144.990 60.079 1.00 22.99 C ATOM 2455 CG1 VAL B 129 104.083 145.412 61.114 1.00 28.01 C ATOM 2456 CG2 VAL B 129 102.168 143.809 60.606 1.00 28.62 C ATOM 2457 H VAL B 129 101.024 144.867 58.401 1.00 0.00 H ATOM 2458 N ASN B 130 103.218 147.406 58.186 1.00 21.10 N ATOM 2459 CA ASN B 130 104.065 148.473 57.748 1.00 20.77 C ATOM 2460 C ASN B 130 103.318 149.789 57.896 1.00 22.82 C ATOM 2461 O ASN B 130 103.893 150.830 58.248 1.00 22.81 O ATOM 2462 CB ASN B 130 104.494 148.297 56.295 1.00 24.21 C ATOM 2463 CG ASN B 130 105.512 147.159 56.105 1.00 28.08 C ATOM 2464 OD1 ASN B 130 106.123 146.718 57.086 1.00 27.98 O ATOM 2465 ND2 ASN B 130 105.664 146.660 54.865 1.00 25.88 N ATOM 2466 HD22 ASN B 130 105.127 147.065 54.072 1.00 0.00 H ATOM 2467 HD21 ASN B 130 106.318 145.869 54.699 1.00 0.00 H ATOM 2468 H ASN B 130 102.917 146.673 57.513 1.00 0.00 H ATOM 2469 N GLN B 131 102.038 149.789 57.494 1.00 18.56 N ATOM 2470 CA GLN B 131 101.278 151.031 57.660 1.00 18.01 C ATOM 2471 C GLN B 131 101.079 151.413 59.114 1.00 20.91 C ATOM 2472 O GLN B 131 101.204 152.605 59.451 1.00 19.35 O ATOM 2473 CB GLN B 131 99.906 150.925 56.912 1.00 20.06 C ATOM 2474 CG GLN B 131 99.049 152.219 57.098 1.00 20.82 C ATOM 2475 CD GLN B 131 97.854 152.235 56.197 1.00 18.70 C ATOM 2476 OE1 GLN B 131 97.986 152.345 54.941 1.00 24.76 O ATOM 2477 NE2 GLN B 131 96.723 152.144 56.805 1.00 18.02 N ATOM 2478 HE22 GLN B 131 96.695 152.056 57.841 1.00 0.00 H ATOM 2479 HE21 GLN B 131 95.837 152.158 56.260 1.00 0.00 H ATOM 2480 H GLN B 131 101.602 148.940 57.080 1.00 0.00 H ATOM 2481 N MET B 132 100.810 150.445 59.971 1.00 19.21 N ATOM 2482 CA MET B 132 100.684 150.753 61.401 1.00 19.97 C ATOM 2483 C MET B 132 102.010 151.336 61.943 1.00 20.35 C ATOM 2484 O MET B 132 101.995 152.329 62.681 1.00 19.43 O ATOM 2485 CB MET B 132 100.298 149.501 62.159 1.00 21.73 C ATOM 2486 CG MET B 132 100.056 149.790 63.584 1.00 32.13 C ATOM 2487 SD MET B 132 99.067 148.457 64.321 1.00 45.78 S ATOM 2488 CE MET B 132 97.755 148.448 63.137 1.00 37.20 C ATOM 2489 H MET B 132 100.688 149.469 59.634 1.00 0.00 H ATOM 2490 N ARG B 133 103.126 150.687 61.595 1.00 19.80 N ATOM 2491 CA ARG B 133 104.442 151.152 62.082 1.00 20.53 C ATOM 2492 C ARG B 133 104.650 152.600 61.735 1.00 23.44 C ATOM 2493 O ARG B 133 104.991 153.446 62.579 1.00 21.05 O ATOM 2494 CB ARG B 133 105.583 150.330 61.466 1.00 21.58 C ATOM 2495 CG ARG B 133 106.984 150.810 61.950 1.00 22.99 C ATOM 2496 CD ARG B 133 108.123 150.059 61.264 1.00 24.30 C ATOM 2497 NE ARG B 133 108.005 148.655 61.604 1.00 28.75 N ATOM 2498 CZ ARG B 133 107.618 147.677 60.774 1.00 29.49 C ATOM 2499 NH1 ARG B 133 107.240 147.944 59.504 1.00 28.24 N ATOM 2500 NH2 ARG B 133 107.574 146.431 61.239 1.00 29.73 N ATOM 2501 HE ARG B 133 108.242 148.382 62.579 1.00 0.00 H ATOM 2502 HH12 ARG B 133 106.943 147.170 58.876 1.00 0.00 H ATOM 2503 HH11 ARG B 133 107.246 148.924 59.155 1.00 0.00 H ATOM 2504 HH22 ARG B 133 107.277 145.653 60.615 1.00 0.00 H ATOM 2505 HH21 ARG B 133 107.837 146.235 62.226 1.00 0.00 H ATOM 2506 H ARG B 133 103.068 149.851 60.979 1.00 0.00 H ATOM 2507 N ASP B 134 104.476 152.934 60.465 1.00 21.75 N ATOM 2508 CA ASP B 134 104.780 154.263 60.010 1.00 22.65 C ATOM 2509 C ASP B 134 103.815 155.261 60.635 1.00 21.20 C ATOM 2510 O ASP B 134 104.233 156.354 60.981 1.00 22.32 O ATOM 2511 CB ASP B 134 104.771 154.335 58.473 1.00 22.98 C ATOM 2512 CG ASP B 134 105.912 153.531 57.837 1.00 31.79 C ATOM 2513 OD1 ASP B 134 106.688 152.851 58.575 1.00 33.09 O ATOM 2514 OD2 ASP B 134 105.999 153.551 56.594 1.00 31.92 O ATOM 2515 H ASP B 134 104.116 152.228 59.791 1.00 0.00 H ATOM 2516 N THR B 135 102.535 154.890 60.792 1.00 20.41 N ATOM 2517 CA THR B 135 101.566 155.795 61.395 1.00 17.10 C ATOM 2518 C THR B 135 101.929 156.044 62.871 1.00 18.62 C ATOM 2519 O THR B 135 101.920 157.217 63.335 1.00 20.29 O ATOM 2520 CB THR B 135 100.124 155.219 61.267 1.00 21.45 C ATOM 2521 OG1 THR B 135 99.872 155.029 59.871 1.00 22.33 O ATOM 2522 CG2 THR B 135 99.122 156.233 61.781 1.00 21.46 C ATOM 2523 HG1 THR B 135 100.537 154.396 59.500 1.00 0.00 H ATOM 2524 H THR B 135 102.231 153.946 60.480 1.00 0.00 H ATOM 2525 N LEU B 136 102.274 154.979 63.600 1.00 19.19 N ATOM 2526 CA LEU B 136 102.618 155.132 65.028 1.00 19.47 C ATOM 2527 C LEU B 136 103.910 155.960 65.136 1.00 20.51 C ATOM 2528 O LEU B 136 104.031 156.793 66.042 1.00 21.04 O ATOM 2529 CB LEU B 136 102.797 153.784 65.692 1.00 19.53 C ATOM 2530 CG LEU B 136 101.493 152.970 65.734 1.00 20.03 C ATOM 2531 CD1 LEU B 136 101.897 151.606 66.225 1.00 21.31 C ATOM 2532 CD2 LEU B 136 100.463 153.578 66.686 1.00 23.00 C ATOM 2533 H LEU B 136 102.300 154.037 63.160 1.00 0.00 H ATOM 2534 N GLN B 137 104.862 155.762 64.228 1.00 20.08 N ATOM 2535 CA GLN B 137 106.052 156.626 64.278 1.00 21.21 C ATOM 2536 C GLN B 137 105.721 158.082 64.067 1.00 24.23 C ATOM 2537 O GLN B 137 106.342 158.962 64.708 1.00 25.56 O ATOM 2538 CB GLN B 137 107.062 156.174 63.246 1.00 22.27 C ATOM 2539 CG GLN B 137 107.732 154.906 63.649 1.00 23.18 C ATOM 2540 CD GLN B 137 108.648 154.390 62.569 1.00 29.85 C ATOM 2541 OE1 GLN B 137 108.441 154.710 61.397 1.00 29.43 O ATOM 2542 NE2 GLN B 137 109.687 153.656 62.935 1.00 26.79 N ATOM 2543 HE22 GLN B 137 109.823 153.409 63.936 1.00 0.00 H ATOM 2544 HE21 GLN B 137 110.368 153.326 62.221 1.00 0.00 H ATOM 2545 H GLN B 137 104.768 155.020 63.506 1.00 0.00 H ATOM 2546 N SER B 138 104.766 158.393 63.178 1.00 23.98 N ATOM 2547 CA SER B 138 104.453 159.791 62.932 1.00 23.70 C ATOM 2548 C SER B 138 103.787 160.443 64.144 1.00 26.66 C ATOM 2549 O SER B 138 103.863 161.656 64.310 1.00 30.30 O ATOM 2550 CB SER B 138 103.575 159.935 61.694 1.00 26.87 C ATOM 2551 OG SER B 138 102.267 159.535 61.978 1.00 23.69 O ATOM 2552 HG SER B 138 102.268 158.588 62.266 1.00 0.00 H ATOM 2553 H SER B 138 104.255 157.643 62.671 1.00 0.00 H ATOM 2554 N ILE B 139 103.161 159.647 64.997 1.00 23.01 N ATOM 2555 CA ILE B 139 102.562 160.138 66.227 1.00 24.28 C ATOM 2556 C ILE B 139 103.601 160.241 67.354 1.00 25.93 C ATOM 2557 O ILE B 139 103.711 161.297 68.012 1.00 28.20 O ATOM 2558 CB ILE B 139 101.412 159.194 66.675 1.00 24.45 C ATOM 2559 CG1 ILE B 139 100.281 159.230 65.663 1.00 23.44 C ATOM 2560 CG2 ILE B 139 100.876 159.624 68.063 1.00 23.82 C ATOM 2561 CD1 ILE B 139 99.238 158.146 65.967 1.00 24.73 C ATOM 2562 H ILE B 139 103.095 158.632 64.779 1.00 0.00 H ATOM 2563 N ALA B 140 104.394 159.193 67.566 1.00 22.64 N ATOM 2564 CA ALA B 140 105.374 159.233 68.660 1.00 23.80 C ATOM 2565 C ALA B 140 106.537 160.195 68.366 1.00 25.09 C ATOM 2566 O ALA B 140 107.092 160.813 69.307 1.00 28.86 O ATOM 2567 CB ALA B 140 105.922 157.902 68.935 1.00 22.37 C ATOM 2568 H ALA B 140 104.320 158.351 66.961 1.00 0.00 H ATOM 2569 N PHE B 141 106.951 160.241 67.096 1.00 24.75 N ATOM 2570 CA PHE B 141 108.176 160.937 66.673 1.00 25.33 C ATOM 2571 C PHE B 141 107.893 161.791 65.446 1.00 27.39 C ATOM 2572 O PHE B 141 108.346 161.472 64.345 1.00 28.73 O ATOM 2573 CB PHE B 141 109.291 159.936 66.354 1.00 24.28 C ATOM 2574 CG PHE B 141 109.544 158.930 67.434 1.00 25.01 C ATOM 2575 CD1 PHE B 141 109.951 159.363 68.690 1.00 28.82 C ATOM 2576 CD2 PHE B 141 109.429 157.580 67.200 1.00 23.39 C ATOM 2577 CE1 PHE B 141 110.190 158.441 69.678 1.00 25.11 C ATOM 2578 CE2 PHE B 141 109.645 156.679 68.189 1.00 24.46 C ATOM 2579 CZ PHE B 141 110.055 157.138 69.421 1.00 24.32 C ATOM 2580 H PHE B 141 106.379 159.761 66.372 1.00 0.00 H ATOM 2581 N PRO B 142 107.161 162.896 65.626 1.00 30.50 N ATOM 2582 CA PRO B 142 106.751 163.817 64.557 1.00 36.60 C ATOM 2583 C PRO B 142 107.975 164.323 63.784 1.00 38.70 C ATOM 2584 O PRO B 142 109.063 164.460 64.361 1.00 43.25 O ATOM 2585 CB PRO B 142 106.054 164.947 65.321 1.00 40.78 C ATOM 2586 CG PRO B 142 105.690 164.360 66.643 1.00 40.70 C ATOM 2587 CD PRO B 142 106.759 163.378 66.962 1.00 32.74 C ATOM 2588 N THR B 143 107.811 164.504 62.480 1.00 37.86 N ATOM 2589 CA THR B 143 108.908 164.985 61.662 1.00 47.13 C ATOM 2590 C THR B 143 108.664 166.431 61.358 1.00 45.67 C ATOM 2591 O THR B 143 107.580 166.958 61.618 1.00 34.78 O ATOM 2592 CB THR B 143 109.067 164.197 60.347 1.00 44.17 C ATOM 2593 OG1 THR B 143 107.797 164.059 59.707 1.00 52.08 O ATOM 2594 CG2 THR B 143 109.645 162.827 60.627 1.00 49.42 C ATOM 2595 HG1 THR B 143 107.177 163.573 60.307 1.00 0.00 H ATOM 2596 H THR B 143 106.890 164.300 62.042 1.00 0.00 H ATOM 2597 N PHE B 144 109.697 167.078 60.829 1.00 50.97 N ATOM 2598 CA PHE B 144 109.645 168.503 60.547 1.00 57.30 C ATOM 2599 C PHE B 144 109.932 168.755 59.080 1.00 59.59 C ATOM 2600 O PHE B 144 110.143 167.803 58.322 1.00 50.67 O ATOM 2601 CB PHE B 144 110.629 169.242 61.459 1.00 43.83 C ATOM 2602 CG PHE B 144 110.446 168.887 62.896 1.00 38.90 C ATOM 2603 CD1 PHE B 144 109.537 169.578 63.672 1.00 31.89 C ATOM 2604 CD2 PHE B 144 111.128 167.807 63.458 1.00 45.09 C ATOM 2605 CE1 PHE B 144 109.306 169.214 64.988 1.00 46.57 C ATOM 2606 CE2 PHE B 144 110.910 167.437 64.787 1.00 43.57 C ATOM 2607 CZ PHE B 144 110.006 168.151 65.555 1.00 47.29 C ATOM 2608 H PHE B 144 110.566 166.551 60.611 1.00 0.00 H ATOM 2609 N VAL B 145 109.905 170.030 58.687 1.00 59.17 N ATOM 2610 CA VAL B 145 110.213 170.509 57.341 1.00 66.86 C ATOM 2611 C VAL B 145 111.594 170.026 56.876 1.00 65.09 C ATOM 2612 O VAL B 145 112.525 169.906 57.671 1.00 65.01 O ATOM 2613 CB VAL B 145 110.142 172.066 57.272 1.00 62.47 C ATOM 2614 CG1 VAL B 145 109.459 172.603 58.486 1.00 55.42 C ATOM 2615 CG2 VAL B 145 111.528 172.712 57.152 1.00 64.61 C ATOM 2616 H VAL B 145 109.643 170.742 59.398 1.00 0.00 H ATOM 2617 N GLU B 146 111.735 169.657 55.608 1.00 71.35 N ATOM 2618 CA GLU B 146 113.047 169.334 55.058 1.00 91.12 C ATOM 2619 C GLU B 146 113.909 170.602 54.937 1.00 88.56 C ATOM 2620 O GLU B 146 115.139 170.541 55.023 1.00 87.82 O ATOM 2621 CB GLU B 146 112.914 168.642 53.689 1.00 97.23 C ATOM 2622 CG GLU B 146 112.236 167.264 53.716 1.00100.13 C ATOM 2623 CD GLU B 146 110.709 167.333 53.661 1.00103.27 C ATOM 2624 OE1 GLU B 146 110.155 168.456 53.658 1.00101.08 O ATOM 2625 OE2 GLU B 146 110.064 166.257 53.622 1.00 99.87 O ATOM 2626 OXT GLU B 146 113.407 171.719 54.759 1.00 82.27 O ATOM 2627 H GLU B 146 110.896 169.597 54.997 1.00 0.00 H TER 2628 GLU B 146 HETATM 2629 MG MG A 1 87.550 155.613 96.683 1.00 21.16 MG HETATM 2630 MG MG A 2 100.400 155.109 89.456 1.00 20.99 MG HETATM 2631 MG MG A 3 101.444 159.269 86.245 1.00 22.53 MG HETATM 2632 O HOH 4 81.221 144.950 91.275 1.00 32.00 O HETATM 2633 O HOH 5 93.520 165.062 60.690 1.00 63.24 O HETATM 2634 O HOH 6 92.292 128.235 71.589 1.00 43.25 O HETATM 2635 O HOH 7 99.500 128.175 68.656 1.00 32.12 O HETATM 2636 O HOH 8 88.209 148.310 57.207 1.00 26.60 O HETATM 2637 O HOH 9 84.871 169.874 86.805 1.00 47.44 O HETATM 2638 O HOH 10 86.084 158.409 71.652 1.00 56.84 O HETATM 2639 O HOH 11 85.421 158.945 57.390 1.00 53.80 O HETATM 2640 O HOH 12 85.377 156.883 74.019 1.00 30.05 O HETATM 2641 O HOH 13 81.059 170.636 79.957 1.00 51.09 O HETATM 2642 O HOH 14 86.875 144.556 63.360 1.00 48.27 O HETATM 2643 O HOH 15 94.165 140.776 89.199 1.00 52.15 O HETATM 2644 O HOH 16 85.453 166.009 70.843 1.00 55.35 O HETATM 2645 O HOH 17 99.597 162.842 64.184 1.00 51.27 O HETATM 2646 O HOH 18 76.412 164.117 85.611 1.00 39.95 O HETATM 2647 O HOH 19 102.174 163.607 74.457 1.00 49.65 O HETATM 2648 O HOH 20 92.368 161.965 62.057 1.00 62.31 O HETATM 2649 O HOH 21 86.211 147.799 62.917 1.00 29.90 O HETATM 2650 O HOH 22 107.435 160.615 72.090 1.00 31.83 O HETATM 2651 O HOH 23 83.548 164.787 70.115 1.00 59.74 O HETATM 2652 O HOH 24 82.801 158.021 68.377 1.00 54.74 O HETATM 2653 O HOH 25 92.984 157.144 51.869 1.00 26.65 O HETATM 2654 O HOH 26 112.936 154.522 63.584 1.00 36.96 O HETATM 2655 O HOH 27 68.038 146.797 76.234 1.00 48.03 O HETATM 2656 O HOH 28 85.681 159.657 89.790 1.00 40.80 O HETATM 2657 O HOH 29 87.105 157.812 88.735 1.00 38.54 O HETATM 2658 O HOH 30 94.004 161.724 86.922 1.00 39.77 O HETATM 2659 O HOH 31 69.676 155.406 82.988 1.00 31.65 O HETATM 2660 O HOH 32 122.282 143.210 66.951 1.00 58.80 O HETATM 2661 O HOH 33 76.784 139.315 94.356 1.00 59.32 O HETATM 2662 O HOH 34 95.131 142.137 82.974 1.00 34.76 O HETATM 2663 O HOH 35 93.195 168.958 82.221 1.00 49.98 O HETATM 2664 O HOH 36 89.197 168.571 79.322 1.00 31.70 O HETATM 2665 O HOH 37 72.800 159.744 90.474 1.00 44.54 O HETATM 2666 O HOH 38 74.602 155.286 92.161 1.00 40.41 O HETATM 2667 O HOH 39 64.914 159.282 81.832 1.00 41.21 O HETATM 2668 O HOH 40 73.258 150.751 81.894 1.00 26.83 O HETATM 2669 O HOH 41 90.643 167.065 75.144 1.00 34.34 O HETATM 2670 O HOH 42 91.773 162.436 85.104 1.00 29.22 O HETATM 2671 O HOH 43 112.402 144.688 66.535 1.00 39.80 O HETATM 2672 O HOH 44 81.654 163.185 71.301 1.00 48.67 O HETATM 2673 O HOH 45 90.407 148.713 90.390 1.00 29.61 O HETATM 2674 O HOH 46 79.954 163.340 73.612 1.00 39.87 O HETATM 2675 O HOH 47 93.035 133.061 66.340 1.00 60.04 O HETATM 2676 O HOH 48 112.671 146.705 65.021 1.00 31.07 O HETATM 2677 O HOH 49 78.894 139.239 85.793 1.00 49.37 O HETATM 2678 O HOH 50 70.598 142.185 79.157 1.00 55.06 O HETATM 2679 O HOH 51 78.555 147.482 77.014 1.00 32.19 O HETATM 2680 O HOH 52 71.549 146.315 93.714 1.00 30.62 O HETATM 2681 O HOH 53 84.540 145.588 64.678 1.00 63.76 O HETATM 2682 O HOH 54 66.518 157.493 86.047 1.00 52.59 O HETATM 2683 O HOH 55 87.426 151.911 94.681 1.00 27.03 O HETATM 2684 O HOH 56 86.240 137.924 68.867 1.00 71.16 O HETATM 2685 O HOH 57 94.380 147.348 89.393 1.00 48.56 O HETATM 2686 O HOH 58 87.281 156.393 61.928 1.00 39.85 O HETATM 2687 O HOH 59 85.780 138.240 82.906 1.00 41.57 O HETATM 2688 O HOH 60 90.411 151.808 55.475 1.00 25.49 O HETATM 2689 O HOH 61 84.626 160.302 94.389 1.00 41.26 O HETATM 2690 O HOH 62 92.984 137.696 65.203 1.00 50.41 O HETATM 2691 O HOH 63 89.335 153.619 91.267 1.00 37.99 O HETATM 2692 O HOH 64 87.423 157.189 95.272 1.00 26.96 O HETATM 2693 O HOH 65 79.244 143.288 79.682 1.00 36.15 O HETATM 2694 O HOH 66 69.995 151.636 83.816 1.00 41.83 O HETATM 2695 O HOH 67 84.625 158.572 92.272 1.00 48.37 O HETATM 2696 O HOH 68 111.112 146.252 63.013 1.00 26.81 O HETATM 2697 O HOH 69 66.951 142.645 80.675 1.00 27.05 O HETATM 2698 O HOH 70 88.940 143.179 63.169 1.00 36.13 O HETATM 2699 O HOH 71 100.545 162.047 76.700 1.00 32.39 O HETATM 2700 O HOH 72 84.094 153.467 97.316 1.00 25.23 O HETATM 2701 O HOH 73 95.651 138.152 69.700 1.00 50.48 O HETATM 2702 O HOH 74 75.373 165.434 75.849 1.00 54.72 O HETATM 2703 O HOH 75 95.054 166.027 76.775 1.00 27.80 O HETATM 2704 O HOH 76 88.403 162.408 67.600 1.00 45.85 O HETATM 2705 O HOH 77 78.540 154.523 75.928 1.00 30.63 O HETATM 2706 O HOH 78 88.182 144.649 57.900 1.00 40.88 O HETATM 2707 O HOH 79 81.200 153.266 96.642 1.00 22.18 O HETATM 2708 O HOH 80 90.167 165.108 88.693 1.00 45.74 O HETATM 2709 O HOH 81 69.532 148.884 75.546 1.00 36.73 O HETATM 2710 O HOH 82 104.611 156.228 76.119 1.00 24.33 O HETATM 2711 O HOH 83 112.331 141.905 64.815 1.00 55.80 O HETATM 2712 O HOH 84 97.623 149.523 59.310 1.00 32.69 O HETATM 2713 O HOH 85 72.180 153.056 76.008 1.00 35.16 O HETATM 2714 O HOH 86 88.353 137.371 71.980 1.00 49.40 O HETATM 2715 O HOH 87 91.609 138.211 90.786 1.00 63.28 O HETATM 2716 O HOH 88 90.744 156.415 92.961 1.00 34.21 O HETATM 2717 O HOH 89 116.604 154.082 65.502 1.00 39.85 O HETATM 2718 O HOH 90 82.523 167.355 83.831 1.00 49.81 O HETATM 2719 O HOH 91 86.208 131.285 70.787 1.00 67.37 O HETATM 2720 O HOH 92 88.965 138.403 89.589 1.00 38.16 O HETATM 2721 O HOH 93 85.565 147.945 59.507 1.00 42.71 O HETATM 2722 O HOH 94 76.493 162.665 92.577 1.00 47.00 O HETATM 2723 O HOH 95 85.174 156.169 57.217 1.00 38.37 O HETATM 2724 O HOH 96 68.935 157.317 86.834 1.00 35.12 O HETATM 2725 O HOH 97 99.600 161.755 56.996 1.00 60.05 O HETATM 2726 O HOH 98 73.179 142.893 80.069 1.00 58.41 O HETATM 2727 O HOH 99 76.188 142.679 79.247 1.00 53.74 O HETATM 2728 O HOH 100 91.179 135.236 65.181 1.00 52.72 O HETATM 2729 O HOH 101 95.296 138.307 67.124 1.00 34.16 O HETATM 2730 O HOH 102 95.534 155.560 84.422 1.00 34.46 O HETATM 2731 O HOH 103 75.767 155.952 75.651 1.00 49.93 O HETATM 2732 O HOH 104 105.742 160.266 74.874 1.00 43.11 O HETATM 2733 O HOH 105 87.769 156.041 67.054 1.00 29.89 O HETATM 2734 O HOH 106 113.984 153.328 60.214 1.00 65.73 O HETATM 2735 O HOH 107 89.827 161.503 56.415 1.00 43.25 O HETATM 2736 O HOH 108 83.156 140.948 76.858 1.00 44.23 O HETATM 2737 O HOH 109 96.329 146.186 85.439 1.00 25.40 O HETATM 2738 O HOH 110 89.809 138.540 74.152 1.00 44.17 O HETATM 2739 O HOH 111 115.991 153.361 62.621 1.00 53.78 O HETATM 2740 O HOH 112 92.587 154.530 85.202 1.00 23.20 O HETATM 2741 O HOH 113 92.333 143.251 91.981 1.00 38.26 O HETATM 2742 O HOH 114 74.188 167.368 87.665 1.00 65.02 O HETATM 2743 O HOH 115 83.887 140.239 90.727 1.00 52.27 O HETATM 2744 O HOH 116 71.139 159.863 88.175 1.00 34.93 O HETATM 2745 O HOH 117 69.883 144.229 92.235 1.00 37.65 O HETATM 2746 O HOH 118 79.985 150.826 96.294 1.00 31.02 O HETATM 2747 O HOH 119 95.254 134.277 69.951 1.00 58.38 O HETATM 2748 O HOH 120 90.270 154.908 86.799 1.00 36.37 O HETATM 2749 O HOH 121 87.195 150.378 61.311 1.00 29.34 O HETATM 2750 O HOH 122 95.076 141.507 61.506 1.00 29.58 O HETATM 2751 O HOH 123 94.200 143.560 59.983 1.00 35.89 O HETATM 2752 O HOH 124 88.154 138.695 82.779 1.00 39.29 O HETATM 2753 O HOH 125 82.629 166.434 86.792 1.00 44.04 O HETATM 2754 O HOH 126 78.985 161.345 72.622 1.00 50.76 O HETATM 2755 O HOH 127 89.409 156.373 88.577 1.00 49.10 O HETATM 2756 O HOH 128 69.321 147.938 84.972 1.00 32.49 O HETATM 2757 O HOH 129 95.335 142.940 79.122 1.00 38.75 O HETATM 2758 O HOH 130 84.306 132.782 69.073 1.00 70.16 O HETATM 2759 O HOH 131 118.827 147.212 61.941 1.00 52.62 O HETATM 2760 O HOH 132 76.084 165.881 78.531 1.00 52.31 O HETATM 2761 O HOH 133 88.325 143.059 94.584 1.00 35.14 O HETATM 2762 O HOH 134 99.644 163.270 88.476 1.00 54.14 O HETATM 2763 O HOH 135 90.109 170.294 73.521 1.00 42.39 O HETATM 2764 O HOH 136 114.388 146.408 69.390 1.00 39.84 O HETATM 2765 O HOH 137 70.511 152.852 87.227 1.00 61.17 O HETATM 2766 O HOH 138 97.280 134.024 62.579 1.00 68.38 O HETATM 2767 O HOH 139 89.997 159.095 54.608 1.00 38.01 O HETATM 2768 O HOH 140 87.637 140.027 75.338 1.00 46.27 O HETATM 2769 O HOH 141 101.835 160.058 78.456 1.00 34.30 O HETATM 2770 O HOH 142 92.130 163.817 64.156 1.00 54.94 O HETATM 2771 O HOH 143 92.223 168.122 66.661 1.00 49.81 O HETATM 2772 O HOH 144 117.114 140.062 65.797 1.00 50.99 O HETATM 2773 O HOH 145 119.963 146.909 66.645 1.00 58.50 O HETATM 2774 O HOH 146 87.387 172.438 81.312 1.00 59.62 O HETATM 2775 O HOH 147 96.665 128.383 64.837 1.00 60.94 O HETATM 2776 O HOH 148 81.143 146.009 74.283 1.00 54.27 O HETATM 2777 O HOH 149 85.462 159.397 67.776 1.00 54.95 O HETATM 2778 O HOH 150 69.229 163.876 83.245 1.00 60.78 O HETATM 2779 O HOH 151 81.674 170.999 82.182 1.00 59.10 O HETATM 2780 O HOH 152 85.346 135.912 69.914 1.00 69.85 O HETATM 2781 O HOH 153 81.669 140.635 92.447 1.00 47.07 O HETATM 2782 O HOH 154 95.090 153.112 84.024 1.00 29.38 O HETATM 2783 O HOH 155 89.525 137.028 83.840 1.00 55.17 O HETATM 2784 O HOH 156 91.807 142.943 60.714 1.00 54.38 O HETATM 2785 O HOH 157 93.766 168.511 77.855 1.00 41.35 O HETATM 2786 O HOH 158 85.929 139.857 92.110 1.00 43.86 O HETATM 2787 O HOH 159 87.903 141.697 65.485 1.00 48.87 O HETATM 2788 O HOH 160 85.027 140.888 74.954 1.00 44.57 O HETATM 2789 O HOH 161 81.736 137.551 79.835 1.00 54.67 O HETATM 2790 O HOH 162 74.308 167.452 79.269 1.00 57.45 O HETATM 2791 O HOH 163 86.015 151.752 98.047 1.00 31.03 O HETATM 2792 O HOH 164 77.456 150.092 71.606 1.00 35.58 O HETATM 2793 O HOH 165 93.990 170.039 80.178 1.00 51.38 O HETATM 2794 O HOH 166 83.783 153.627 64.448 1.00 30.87 O HETATM 2795 O HOH 167 79.497 138.424 79.560 1.00 35.52 O HETATM 2796 O HOH 168 111.405 152.550 58.649 1.00 49.85 O HETATM 2797 O HOH 169 117.743 142.864 60.646 1.00 62.94 O HETATM 2798 O HOH 170 88.959 162.915 91.408 1.00 35.92 O HETATM 2799 O HOH 171 96.184 143.587 84.561 1.00 45.92 O HETATM 2800 O HOH 172 81.258 142.760 94.496 1.00 35.09 O HETATM 2801 O HOH 173 85.508 144.496 68.584 1.00 29.17 O HETATM 2802 O HOH 174 86.309 169.915 88.946 1.00 64.99 O HETATM 2803 O HOH 175 103.993 158.965 77.193 1.00 35.81 O HETATM 2804 O HOH 176 97.134 146.070 89.868 1.00 62.54 O HETATM 2805 O HOH 177 94.773 135.595 67.628 1.00 62.77 O HETATM 2806 O HOH 178 72.187 168.193 79.015 1.00 58.10 O HETATM 2807 O HOH 179 91.372 162.533 88.240 1.00 60.02 O HETATM 2808 O HOH 180 88.509 158.275 66.002 1.00 33.31 O HETATM 2809 O HOH 181 86.502 150.469 56.756 1.00 30.61 O HETATM 2810 O HOH 182 63.427 159.785 87.490 1.00 34.38 O HETATM 2811 O HOH 183 84.046 147.218 62.393 1.00 55.26 O HETATM 2812 O HOH 184 80.476 142.066 76.018 1.00 62.65 O HETATM 2813 O HOH 185 85.674 150.500 59.110 1.00 27.09 O HETATM 2814 O HOH 186 85.243 132.893 62.308 1.00 48.49 O HETATM 2815 O HOH 187 90.780 170.256 80.517 1.00 44.82 O HETATM 2816 O HOH 188 89.444 168.818 76.760 1.00 42.55 O HETATM 2817 O HOH 189 99.224 168.563 65.183 1.00 54.19 O HETATM 2818 O HOH 190 92.616 145.895 92.046 1.00 53.02 O HETATM 2819 O HOH 191 89.359 142.717 59.044 1.00 45.20 O HETATM 2820 O HOH 192 73.648 161.230 93.193 1.00 53.78 O HETATM 2821 O HOH 193 114.741 155.885 61.957 1.00 61.35 O HETATM 2822 O HOH 194 112.793 158.455 65.714 1.00 61.08 O HETATM 2823 O HOH 195 86.721 140.912 94.122 1.00 37.48 O HETATM 2824 O HOH 196 82.899 138.403 77.509 1.00 50.01 O HETATM 2825 O HOH 197 92.486 151.796 88.495 1.00 43.15 O HETATM 2826 O HOH 198 86.151 138.537 72.409 1.00 66.46 O HETATM 2827 O HOH 199 68.824 150.293 85.777 1.00 36.19 O HETATM 2828 O HOH 200 69.285 154.746 88.359 1.00 46.55 O HETATM 2829 O HOH 201 107.232 142.621 64.787 1.00 47.66 O HETATM 2830 O HOH 202 92.119 153.799 87.936 1.00 43.92 O HETATM 2831 O HOH 203 83.547 137.397 89.341 1.00 51.80 O HETATM 2832 O HOH 204 78.048 143.767 75.450 1.00 62.67 O HETATM 2833 O HOH 205 86.573 160.055 65.562 1.00 69.15 O HETATM 2834 O HOH 206 113.699 138.018 66.193 1.00 35.31 O HETATM 2835 O HOH 207 123.846 134.143 76.523 1.00 51.28 O HETATM 2836 O HOH 208 122.274 163.855 77.909 1.00 40.75 O HETATM 2837 O HOH 209 120.180 146.708 70.769 1.00 24.70 O HETATM 2838 O HOH 210 103.823 163.251 83.485 1.00 42.85 O HETATM 2839 O HOH 211 124.585 152.012 89.924 1.00 45.19 O HETATM 2840 O HOH 212 108.465 156.180 59.408 1.00 71.31 O HETATM 2841 O HOH 213 108.052 162.129 81.840 1.00 34.51 O HETATM 2842 O HOH 214 119.762 133.193 75.248 1.00 29.71 O HETATM 2843 O HOH 215 108.085 152.848 55.386 1.00 39.10 O HETATM 2844 O HOH 216 83.448 154.740 70.576 1.00 36.63 O HETATM 2845 O HOH 217 130.100 137.361 76.961 1.00 60.45 O HETATM 2846 O HOH 218 107.182 150.442 57.947 1.00 33.03 O HETATM 2847 O HOH 219 100.376 134.123 64.418 1.00 54.68 O HETATM 2848 O HOH 220 104.402 137.788 59.890 1.00 45.40 O HETATM 2849 O HOH 221 105.887 155.748 55.279 1.00 44.58 O HETATM 2850 O HOH 222 99.581 137.062 65.043 1.00 48.52 O HETATM 2851 O HOH 223 127.707 150.121 93.077 1.00 58.36 O HETATM 2852 O HOH 224 114.038 146.821 85.785 1.00 29.96 O HETATM 2853 O HOH 225 110.852 170.449 52.122 1.00 65.75 O HETATM 2854 O HOH 226 101.821 161.851 80.073 1.00 45.64 O HETATM 2855 O HOH 227 96.339 151.776 59.376 1.00 35.50 O HETATM 2856 O HOH 228 108.439 159.775 62.338 1.00 38.80 O HETATM 2857 O HOH 229 117.577 147.099 68.700 1.00 33.19 O HETATM 2858 O HOH 230 83.027 147.794 64.834 1.00 45.88 O HETATM 2859 O HOH 231 109.868 161.964 72.596 1.00 34.23 O HETATM 2860 O HOH 232 124.399 145.143 92.990 1.00 44.03 O HETATM 2861 O HOH 233 117.587 144.409 86.414 1.00 35.40 O HETATM 2862 O HOH 234 83.580 146.805 68.206 1.00 34.89 O HETATM 2863 O HOH 235 125.193 154.839 90.668 1.00 56.35 O HETATM 2864 O HOH 236 130.255 150.964 86.383 1.00 34.10 O HETATM 2865 O HOH 237 104.624 152.663 54.495 1.00 26.65 O HETATM 2866 O HOH 238 105.054 154.090 85.307 1.00 25.01 O HETATM 2867 O HOH 239 103.411 141.273 83.489 1.00 28.17 O HETATM 2868 O HOH 240 106.240 133.493 60.967 1.00 39.27 O HETATM 2869 O HOH 241 112.413 144.824 71.514 1.00 32.92 O HETATM 2870 O HOH 242 102.442 163.710 65.268 1.00 41.54 O HETATM 2871 O HOH 243 115.609 158.218 87.668 1.00 25.90 O HETATM 2872 O HOH 244 105.844 159.836 79.196 1.00 41.35 O HETATM 2873 O HOH 245 112.380 163.471 76.468 1.00 33.26 O HETATM 2874 O HOH 246 127.676 146.521 95.027 1.00 54.53 O HETATM 2875 O HOH 247 123.628 158.043 89.341 1.00 51.26 O HETATM 2876 O HOH 248 125.138 138.647 68.927 1.00 55.01 O HETATM 2877 O HOH 249 128.917 154.926 68.880 1.00 36.21 O HETATM 2878 O HOH 250 109.273 153.066 59.301 1.00 36.82 O HETATM 2879 O HOH 251 97.287 154.907 86.936 1.00 38.10 O HETATM 2880 O HOH 252 98.405 149.205 86.198 1.00 28.09 O HETATM 2881 O HOH 253 106.896 150.425 83.061 1.00 24.11 O HETATM 2882 O HOH 254 101.132 161.280 86.863 1.00 31.83 O HETATM 2883 O HOH 255 110.892 142.926 69.926 1.00 39.91 O HETATM 2884 O HOH 256 119.105 152.795 66.386 1.00 32.35 O HETATM 2885 O HOH 257 104.282 144.506 86.556 1.00 26.44 O HETATM 2886 O HOH 258 94.768 151.365 81.963 1.00 20.61 O HETATM 2887 O HOH 259 133.958 153.595 77.145 1.00 35.53 O HETATM 2888 O HOH 260 110.189 164.204 66.828 1.00 50.49 O HETATM 2889 O HOH 261 102.161 138.238 57.911 1.00 44.47 O HETATM 2890 O HOH 262 107.383 134.984 83.254 1.00 29.98 O HETATM 2891 O HOH 263 112.465 161.983 87.754 1.00 27.89 O HETATM 2892 O HOH 264 107.429 144.124 67.441 1.00 36.93 O HETATM 2893 O HOH 265 123.169 135.909 74.671 1.00 26.22 O HETATM 2894 O HOH 266 116.362 138.665 68.219 1.00 27.44 O HETATM 2895 O HOH 267 131.767 154.982 85.144 1.00 40.51 O HETATM 2896 O HOH 268 135.762 152.929 73.343 1.00 50.44 O HETATM 2897 O HOH 269 110.210 141.220 84.315 1.00 23.78 O HETATM 2898 O HOH 270 128.722 148.623 85.266 1.00 27.64 O HETATM 2899 O HOH 271 127.606 157.128 70.179 1.00 45.42 O HETATM 2900 O HOH 272 105.648 150.051 86.798 1.00 30.45 O HETATM 2901 O HOH 273 99.580 156.732 83.682 1.00 24.99 O HETATM 2902 O HOH 274 100.656 143.546 84.372 1.00 28.31 O HETATM 2903 O HOH 275 101.946 153.755 89.100 1.00 31.68 O HETATM 2904 O HOH 276 103.191 159.312 87.332 1.00 35.72 O HETATM 2905 O HOH 277 103.369 140.227 60.527 1.00 46.16 O HETATM 2906 O HOH 278 112.821 138.646 87.433 1.00 32.43 O HETATM 2907 O HOH 279 132.421 153.569 74.739 1.00 33.05 O HETATM 2908 O HOH 280 118.527 138.651 70.036 1.00 27.34 O HETATM 2909 O HOH 281 124.273 160.815 78.948 1.00 29.69 O HETATM 2910 O HOH 282 129.543 149.334 74.127 1.00 31.73 O HETATM 2911 O HOH 283 100.139 158.658 87.820 1.00 34.36 O HETATM 2912 O HOH 284 126.971 150.801 73.985 1.00 26.45 O HETATM 2913 O HOH 285 136.626 172.100 73.834 1.00 60.18 O HETATM 2914 O HOH 286 106.143 138.519 58.007 1.00 56.82 O HETATM 2915 O HOH 287 123.294 140.885 86.881 1.00 51.23 O HETATM 2916 O HOH 288 126.816 144.637 91.908 1.00 52.83 O HETATM 2917 O HOH 289 118.322 135.353 80.847 1.00 33.57 O HETATM 2918 O HOH 290 120.914 154.662 65.921 1.00 47.93 O HETATM 2919 O HOH 291 120.029 153.680 70.252 1.00 25.67 O HETATM 2920 O HOH 292 125.940 140.837 71.194 1.00 26.63 O HETATM 2921 O HOH 293 136.508 156.203 77.118 1.00 43.09 O HETATM 2922 O HOH 294 94.982 145.289 77.779 1.00 28.36 O HETATM 2923 O HOH 295 103.960 134.611 71.337 1.00 41.61 O HETATM 2924 O HOH 296 130.514 146.245 74.425 1.00 40.05 O HETATM 2925 O HOH 297 102.700 150.947 91.625 1.00 31.81 O HETATM 2926 O HOH 298 112.003 155.348 84.842 1.00 19.27 O HETATM 2927 O HOH 299 100.501 144.896 86.978 1.00 28.81 O HETATM 2928 O HOH 300 113.416 144.375 87.055 1.00 30.59 O HETATM 2929 O HOH 301 105.305 148.124 83.104 1.00 22.80 O HETATM 2930 O HOH 302 111.183 134.125 78.730 1.00 20.92 O HETATM 2931 O HOH 303 129.148 167.722 80.059 1.00 37.32 O HETATM 2932 O HOH 304 106.582 158.096 84.074 1.00 26.08 O HETATM 2933 O HOH 305 115.211 164.080 75.844 1.00 32.90 O HETATM 2934 O HOH 306 101.847 149.445 53.648 1.00 23.71 O HETATM 2935 O HOH 307 119.937 132.186 78.424 1.00 47.96 O HETATM 2936 O HOH 308 104.778 136.862 77.777 1.00 26.48 O HETATM 2937 O HOH 309 105.197 154.232 88.200 1.00 30.66 O HETATM 2938 O HOH 310 106.462 133.901 68.385 1.00 28.19 O HETATM 2939 O HOH 311 105.352 163.409 61.552 1.00 48.39 O HETATM 2940 O HOH 312 108.366 142.143 86.056 1.00 30.54 O HETATM 2941 O HOH 313 131.273 148.493 70.663 1.00 30.32 O HETATM 2942 O HOH 314 104.513 156.921 85.235 1.00 26.57 O HETATM 2943 O HOH 315 106.298 157.802 59.630 1.00 35.64 O HETATM 2944 O HOH 316 100.891 147.652 90.452 1.00 46.40 O HETATM 2945 O HOH 317 126.871 150.935 90.554 1.00 50.62 O HETATM 2946 O HOH 318 117.072 161.589 88.500 1.00 39.12 O HETATM 2947 O HOH 319 103.764 153.805 77.452 1.00 22.94 O HETATM 2948 O HOH 320 98.877 156.442 89.907 1.00 38.27 O HETATM 2949 O HOH 321 129.664 138.054 79.298 1.00 41.98 O HETATM 2950 O HOH 322 101.018 136.834 75.543 1.00 33.72 O HETATM 2951 O HOH 323 100.058 151.163 75.910 1.00 19.26 O HETATM 2952 O HOH 324 123.517 159.351 71.612 1.00 33.06 O HETATM 2953 O HOH 325 130.591 144.105 83.151 1.00 22.44 O HETATM 2954 O HOH 326 101.810 158.804 58.662 1.00 34.81 O HETATM 2955 O HOH 327 103.143 146.463 90.111 1.00 31.86 O HETATM 2956 O HOH 328 128.702 139.827 74.416 1.00 43.82 O HETATM 2957 O HOH 329 115.907 152.848 68.423 1.00 23.79 O HETATM 2958 O HOH 330 123.044 139.637 84.388 1.00 52.95 O HETATM 2959 O HOH 331 137.018 165.852 74.126 1.00 50.14 O HETATM 2960 O HOH 332 99.105 153.609 88.671 1.00 37.93 O HETATM 2961 O HOH 333 108.260 145.667 63.958 1.00 25.50 O HETATM 2962 O HOH 334 133.165 165.643 81.074 1.00 43.06 O HETATM 2963 O HOH 335 103.254 136.405 74.194 1.00 43.24 O HETATM 2964 O HOH 336 102.746 163.478 86.067 1.00 47.76 O HETATM 2965 O HOH 337 116.347 155.601 69.108 1.00 30.42 O HETATM 2966 O HOH 338 124.920 136.779 72.725 1.00 38.54 O HETATM 2967 O HOH 339 101.108 142.115 53.026 1.00 30.77 O HETATM 2968 O HOH 340 129.805 169.735 72.616 1.00 48.40 O HETATM 2969 O HOH 341 134.195 141.875 74.632 1.00 58.15 O HETATM 2970 O HOH 342 98.490 151.219 89.526 1.00 39.64 O HETATM 2971 O HOH 343 106.863 144.206 53.724 1.00 48.89 O HETATM 2972 O HOH 344 99.093 143.045 80.283 1.00 28.51 O HETATM 2973 O HOH 345 125.661 161.180 71.293 1.00 38.67 O HETATM 2974 O HOH 346 122.287 132.316 77.734 1.00 60.90 O HETATM 2975 O HOH 347 82.412 147.858 73.486 1.00 26.65 O HETATM 2976 O HOH 348 117.264 132.932 84.388 1.00 56.21 O HETATM 2977 O HOH 349 109.563 149.077 83.613 1.00 22.81 O HETATM 2978 O HOH 350 101.813 139.458 54.337 1.00 36.88 O HETATM 2979 O HOH 351 123.106 140.782 68.186 1.00 57.88 O HETATM 2980 O HOH 352 126.433 148.500 68.145 1.00 43.44 O HETATM 2981 O HOH 353 99.620 133.020 60.964 1.00 63.42 O HETATM 2982 O HOH 354 127.298 153.677 66.731 1.00 47.82 O HETATM 2983 O HOH 355 106.548 157.783 78.071 1.00 46.94 O HETATM 2984 O HOH 356 124.781 144.013 70.931 1.00 29.44 O HETATM 2985 O HOH 357 133.248 150.265 71.644 1.00 51.34 O HETATM 2986 O HOH 358 105.271 160.838 85.724 1.00 43.95 O HETATM 2987 O HOH 359 116.593 159.886 70.241 1.00 46.86 O HETATM 2988 O HOH 360 105.315 141.999 59.779 1.00 53.52 O HETATM 2989 O HOH 361 112.495 148.868 84.620 1.00 31.97 O HETATM 2990 O HOH 362 126.182 164.758 78.433 1.00 32.04 O HETATM 2991 O HOH 363 83.373 155.493 73.150 1.00 36.12 O HETATM 2992 O HOH 364 122.138 163.022 84.879 1.00 48.13 O HETATM 2993 O HOH 365 133.151 153.235 67.336 1.00 61.25 O HETATM 2994 O HOH 366 100.789 162.300 62.237 1.00 53.44 O HETATM 2995 O HOH 367 103.444 143.473 83.974 1.00 25.33 O HETATM 2996 O HOH 368 109.590 162.144 88.016 1.00 43.90 O HETATM 2997 O HOH 369 118.080 144.652 88.953 1.00 37.87 O HETATM 2998 O HOH 370 77.155 152.728 69.217 1.00 38.75 O HETATM 2999 O HOH 371 123.401 166.347 76.390 1.00 50.31 O HETATM 3000 O HOH 372 114.577 165.995 83.395 1.00 35.10 O HETATM 3001 O HOH 373 131.108 167.337 69.449 1.00 34.66 O HETATM 3002 O HOH 374 106.792 144.184 58.929 1.00 48.45 O HETATM 3003 O HOH 375 125.248 151.807 64.934 1.00 43.51 O HETATM 3004 O HOH 376 102.702 133.516 66.745 1.00 60.28 O HETATM 3005 O HOH 377 110.816 172.661 53.108 1.00 43.22 O HETATM 3006 O HOH 378 111.293 161.304 63.072 1.00 53.63 O HETATM 3007 O HOH 379 127.887 159.723 70.328 1.00 49.07 O HETATM 3008 O HOH 380 99.585 164.203 78.110 1.00 44.22 O HETATM 3009 O HOH 381 112.199 140.885 86.324 1.00 42.95 O HETATM 3010 O HOH 382 120.748 162.786 72.121 1.00 45.26 O HETATM 3011 O HOH 383 117.046 169.796 57.632 1.00 48.65 O HETATM 3012 O HOH 384 122.764 155.089 92.672 1.00 50.72 O HETATM 3013 O HOH 385 109.320 147.416 56.480 1.00 51.96 O HETATM 3014 O HOH 386 100.720 138.982 79.680 1.00 36.43 O HETATM 3015 O HOH 387 121.991 146.545 68.558 1.00 49.93 O HETATM 3016 O HOH 388 97.042 134.738 60.161 1.00 64.07 O HETATM 3017 O HOH 389 111.430 155.687 60.260 1.00 57.91 O HETATM 3018 O HOH 390 119.299 137.050 85.585 1.00 60.50 O HETATM 3019 O HOH 391 118.074 132.778 81.555 1.00 41.58 O HETATM 3020 O HOH 392 106.135 160.178 82.231 1.00 39.58 O HETATM 3021 O HOH 393 132.060 150.900 74.329 1.00 39.51 O HETATM 3022 O HOH 394 123.251 160.579 85.277 1.00 41.94 O HETATM 3023 O HOH 395 110.832 156.799 63.899 1.00 50.59 O HETATM 3024 O HOH 396 121.740 137.366 83.865 1.00 55.55 O HETATM 3025 O HOH 397 108.472 168.876 50.536 1.00 61.52 O HETATM 3026 O HOH 398 124.574 159.866 87.553 1.00 53.80 O HETATM 3027 O HOH 399 117.771 163.737 72.014 1.00 54.61 O HETATM 3028 O HOH 400 106.020 138.942 65.136 1.00 35.08 O HETATM 3029 O HOH 401 118.591 164.222 84.833 1.00 42.37 O HETATM 3030 O HOH 402 109.730 136.223 66.228 1.00 37.56 O HETATM 3031 O HOH 403 105.915 140.348 85.150 1.00 35.08 O HETATM 3032 O HOH 404 106.940 133.456 81.008 1.00 37.79 O HETATM 3033 O HOH 405 128.290 153.151 91.670 1.00 61.55 O HETATM 3034 O HOH 406 126.563 166.669 80.312 1.00 41.00 O HETATM 3035 O HOH 407 119.641 156.870 67.102 1.00 50.26 O HETATM 3036 O HOH 408 116.106 130.932 82.010 1.00 42.89 O HETATM 3037 O HOH 409 102.218 164.243 88.723 1.00 59.83 O HETATM 3038 O HOH 410 119.268 158.513 70.499 1.00 44.27 O HETATM 3039 O HOH 411 124.140 142.297 90.319 1.00 43.89 O HETATM 3040 O HOH 412 131.568 143.600 73.993 1.00 41.02 O HETATM 3041 O HOH 413 111.356 138.220 65.151 1.00 52.41 O HETATM 3042 O HOH 414 98.470 146.093 87.393 1.00 43.55 O HETATM 3043 O HOH 415 85.337 156.590 69.375 1.00 45.05 O HETATM 3044 O HOH 416 117.064 166.444 83.938 1.00 51.20 O HETATM 3045 O HOH 417 110.810 149.670 59.040 1.00 51.15 O HETATM 3046 O HOH 418 107.943 149.849 55.304 1.00 37.24 O HETATM 3047 O HOH 419 121.321 134.385 73.336 1.00 25.17 O HETATM 3048 O HOH 420 126.253 144.996 96.373 1.00 33.59 O HETATM 3049 O HOH 421 118.942 156.004 69.858 1.00 26.15 O HETATM 3050 O HOH 422 131.716 139.655 80.519 1.00 49.01 O HETATM 3051 O HOH 423 126.570 143.453 68.752 1.00 64.17 O HETATM 3052 O HOH 424 125.889 140.882 68.301 1.00 56.31 O HETATM 3053 O HOH 425 130.871 146.972 84.458 1.00 42.88 O HETATM 3054 O HOH 426 106.177 138.036 61.844 1.00 50.99 O HETATM 3055 O HOH 427 105.056 158.048 56.859 1.00 49.11 O HETATM 3056 O HOH 428 100.445 154.233 91.324 1.00 32.59 O HETATM 3057 O HOH 429 123.936 163.496 79.778 1.00 42.64 O HETATM 3058 O HOH 430 101.221 142.980 88.576 1.00 40.89 O HETATM 3059 O HOH 431 130.081 169.948 69.801 1.00 40.20 O HETATM 3060 O HOH 432 124.469 159.646 81.364 1.00 38.16 O HETATM 3061 O HOH 433 119.833 150.627 64.983 1.00 33.43 O HETATM 3062 O HOH 434 84.556 143.691 72.422 1.00 41.78 O HETATM 3063 O HOH 435 110.330 163.609 74.473 1.00 47.60 O HETATM 3064 O HOH 436 114.037 159.370 67.710 1.00 32.99 O HETATM 3065 O HOH 437 122.189 137.476 87.393 1.00 61.81 O HETATM 3066 O HOH 438 110.860 162.518 68.136 1.00 30.73 O HETATM 3067 O HOH 439 121.305 160.350 70.837 1.00 43.57 O HETATM 3068 O HOH 440 103.452 162.470 88.157 1.00 52.73 O HETATM 3069 O HOH 441 109.786 133.049 83.512 1.00 43.47 O HETATM 3070 O HOH 442 128.290 142.803 91.670 1.00 52.76 O HETATM 3071 O HOH 443 126.485 135.505 70.804 1.00 58.15 O HETATM 3072 O HOH 444 108.927 141.377 88.617 1.00 54.34 O HETATM 3073 O HOH 445 127.699 137.935 69.156 1.00 42.48 O HETATM 3074 O HOH 446 102.048 131.980 68.348 1.00 32.92 O HETATM 3075 O HOH 447 123.250 150.413 63.072 1.00 63.94 O HETATM 3076 O HOH 448 94.455 139.639 58.090 1.00 49.17 O HETATM 3077 O HOH 449 130.264 141.466 72.826 1.00 55.22 O HETATM 3078 O HOH 450 116.781 162.519 70.067 1.00 52.91 O HETATM 3079 O HOH 451 107.432 131.945 58.564 1.00 41.63 O HETATM 3080 O HOH 452 98.216 142.165 52.190 1.00 36.18 O HETATM 3081 O HOH 453 125.060 159.202 92.350 1.00 60.05 O HETATM 3082 O HOH 454 109.119 138.502 88.719 1.00 51.52 O HETATM 3083 O HOH 455 121.846 152.511 60.705 1.00 72.44 O HETATM 3084 C4 WCA A 456 99.409 151.801 81.334 1.00 0.16 C HETATM 3085 C5 WCA A 456 98.324 151.058 80.867 1.00 0.10 C HETATM 3086 C6 WCA A 456 98.295 150.783 79.456 1.00 0.13 C HETATM 3087 N1 WCA A 456 99.277 151.318 78.683 1.00 -0.27 N HETATM 3088 C2 WCA A 456 100.253 152.043 79.167 1.00 0.05 C HETATM 3089 N3 WCA A 456 100.372 152.306 80.516 1.00 -0.27 N HETATM 3090 H38 WCA A 456 100.992 152.450 78.486 1.00 0.10 H HETATM 3091 N6 WCA A 456 97.211 150.018 78.969 1.00 -0.32 N HETATM 3092 H39 WCA A 456 97.147 149.796 77.965 1.00 0.18 H HETATM 3093 H40 WCA A 456 96.485 149.683 79.618 1.00 0.18 H HETATM 3094 N7 WCA A 456 97.518 150.719 81.955 1.00 -0.30 N HETATM 3095 C8 WCA A 456 98.086 151.277 83.061 1.00 0.11 C HETATM 3096 N9 WCA A 456 99.238 151.914 82.712 1.00 -0.19 N HETATM 3097 C1' WCA A 456 100.161 152.693 83.497 1.00 0.20 C HETATM 3098 O4' WCA A 456 101.167 151.912 83.909 1.00 -0.34 O HETATM 3099 C4' WCA A 456 101.770 152.840 85.071 1.00 0.12 C HETATM 3100 C5' WCA A 456 102.374 151.730 85.877 1.00 0.11 C HETATM 3101 O5' WCA A 456 101.359 150.969 86.481 1.00 -0.25 O HETATM 3102 PCF WCA A 456 101.664 150.109 87.823 1.00 0.30 P HETATM 3103 OBN WCA A 456 102.775 149.084 87.390 1.00 -0.13 O HETATM 3104 PCG WCA A 456 102.862 147.828 86.404 1.00 0.30 P HETATM 3105 OBK WCA A 456 101.581 147.882 85.457 1.00 -0.25 O HETATM 3106 CBD WCA A 456 101.539 148.583 84.189 1.00 0.09 C HETATM 3107 CCD WCA A 456 100.941 147.601 83.154 1.00 0.04 C HETATM 3108 CBX WCA A 456 99.549 147.141 83.608 1.00 0.15 C HETATM 3109 CBR WCA A 456 98.919 146.206 82.644 1.00 0.21 C HETATM 3110 NBI WCA A 456 97.912 146.658 81.804 1.00 -0.28 N HETATM 3111 CAZ WCA A 456 97.239 145.718 80.934 1.00 0.05 C HETATM 3112 CBB WCA A 456 95.689 145.844 81.224 1.00 0.06 C HETATM 3113 CBQ WCA A 456 95.177 147.180 80.732 1.00 0.18 C HETATM 3114 NBH WCA A 456 93.823 147.120 80.164 1.00 -0.29 N HETATM 3115 CAY WCA A 456 93.124 148.277 79.593 1.00 0.04 C HETATM 3116 CBA WCA A 456 92.355 148.941 80.741 1.00 0.03 C HETATM 3117 SBO WCA A 456 91.158 150.102 79.991 1.00 -0.05 S HETATM 3118 CBP WCA A 456 92.188 151.433 79.431 1.00 0.17 C HETATM 3119 CAQ WCA A 456 91.407 152.453 78.703 1.00 0.04 C HETATM 3120 CAR WCA A 456 92.207 153.531 78.096 1.00 -0.01 C HETATM 3121 CBT WCA A 456 91.458 154.421 77.207 1.00 -0.05 C HETATM 3122 CAV WCA A 456 92.292 155.207 76.434 1.00 -0.07 C HETATM 3123 CAT WCA A 456 91.774 156.087 75.559 1.00 -0.04 C HETATM 3124 CBS WCA A 456 90.391 156.144 75.434 1.00 0.08 C HETATM 3125 OAJ WCA A 456 89.937 157.022 74.425 1.00 -0.34 O HETATM 3126 H4 WCA A 456 88.987 157.008 74.399 1.00 0.25 H HETATM 3127 CAU WCA A 456 89.542 155.333 76.183 1.00 -0.04 C HETATM 3128 CAW WCA A 456 90.063 154.437 77.098 1.00 -0.07 C HETATM 3129 H6 WCA A 456 89.431 153.788 77.693 1.00 0.05 H HETATM 3130 H5 WCA A 456 88.469 155.405 76.048 1.00 0.05 H HETATM 3131 H3 WCA A 456 92.415 156.732 74.969 1.00 0.05 H HETATM 3132 H2 WCA A 456 93.367 155.114 76.534 1.00 0.05 H HETATM 3133 H7 WCA A 456 92.636 154.138 78.907 1.00 0.04 H HETATM 3134 H8 WCA A 456 93.019 153.070 77.515 1.00 0.04 H HETATM 3135 H9 WCA A 456 90.850 151.948 77.900 1.00 0.05 H HETATM 3136 H10 WCA A 456 90.699 152.910 79.410 1.00 0.05 H HETATM 3137 OAD WCA A 456 93.396 151.465 79.617 1.00 -0.38 O HETATM 3138 H11 WCA A 456 91.823 148.178 81.329 1.00 0.04 H HETATM 3139 H12 WCA A 456 93.051 149.487 81.394 1.00 0.04 H HETATM 3140 H13 WCA A 456 93.850 148.984 79.164 1.00 0.05 H HETATM 3141 H14 WCA A 456 92.425 147.948 78.809 1.00 0.05 H HETATM 3142 H15 WCA A 456 93.350 146.239 80.167 1.00 0.19 H HETATM 3143 OAE WCA A 456 95.759 148.266 80.764 1.00 -0.40 O HETATM 3144 H16 WCA A 456 95.154 145.035 80.704 1.00 0.05 H HETATM 3145 H17 WCA A 456 95.513 145.763 82.307 1.00 0.05 H HETATM 3146 H18 WCA A 456 97.447 145.962 79.882 1.00 0.05 H HETATM 3147 H19 WCA A 456 97.581 144.695 81.148 1.00 0.05 H HETATM 3148 H20 WCA A 456 97.654 147.624 81.800 1.00 0.19 H HETATM 3149 OAF WCA A 456 99.207 145.043 82.573 1.00 -0.39 O HETATM 3150 OAK WCA A 456 98.710 148.279 83.682 1.00 -0.37 O HETATM 3151 H22 WCA A 456 99.081 148.905 84.293 1.00 0.21 H HETATM 3152 H21 WCA A 456 99.629 146.657 84.593 1.00 0.08 H HETATM 3153 CAA WCA A 456 100.918 148.348 81.808 1.00 -0.05 C HETATM 3154 H23 WCA A 456 101.941 148.650 81.539 1.00 0.02 H HETATM 3155 H24 WCA A 456 100.283 149.242 81.895 1.00 0.02 H HETATM 3156 H25 WCA A 456 100.514 147.686 81.028 1.00 0.02 H HETATM 3157 CAB WCA A 456 101.925 146.421 83.006 1.00 -0.05 C HETATM 3158 H26 WCA A 456 101.970 145.860 83.951 1.00 0.02 H HETATM 3159 H27 WCA A 456 102.926 146.806 82.761 1.00 0.02 H HETATM 3160 H28 WCA A 456 101.581 145.756 82.201 1.00 0.02 H HETATM 3161 H29 WCA A 456 100.905 149.478 84.272 1.00 0.06 H HETATM 3162 H30 WCA A 456 102.554 148.880 83.887 1.00 0.06 H HETATM 3163 OAP WCA A 456 102.713 146.604 87.253 1.00 -0.61 O HETATM 3164 OAI WCA A 456 104.115 148.072 85.659 1.00 -0.61 O HETATM 3165 OAO WCA A 456 102.354 151.042 88.844 1.00 -0.61 O HETATM 3166 OAH WCA A 456 100.400 149.385 88.227 1.00 -0.61 O HETATM 3167 H31 WCA A 456 102.971 151.083 85.217 1.00 0.06 H HETATM 3168 H32 WCA A 456 103.022 152.157 86.656 1.00 0.06 H HETATM 3169 C3' WCA A 456 100.718 153.551 85.676 1.00 0.15 C HETATM 3170 O3' WCA A 456 101.045 154.951 85.358 1.00 -0.27 O HETATM 3171 PCE WCA A 456 101.585 155.942 86.537 1.00 0.20 P HETATM 3172 OAM WCA A 456 100.500 155.917 87.590 1.00 -0.55 O HETATM 3173 OAN WCA A 456 101.740 157.279 85.841 1.00 -0.55 O HETATM 3174 OAG WCA A 456 102.878 155.341 86.995 1.00 -0.55 O HETATM 3175 C2' WCA A 456 99.453 153.173 84.809 1.00 0.14 C HETATM 3176 O2' WCA A 456 98.572 154.254 84.660 1.00 -0.38 O HETATM 3177 H36 WCA A 456 99.022 154.971 84.230 1.00 0.21 H HETATM 3178 H35 WCA A 456 98.895 152.343 85.267 1.00 0.07 H HETATM 3179 H34 WCA A 456 100.593 153.354 86.751 1.00 0.07 H HETATM 3180 H33 WCA A 456 102.533 153.548 84.715 1.00 0.07 H HETATM 3181 H37 WCA A 456 100.534 153.546 82.912 1.00 0.10 H HETATM 3182 H1 WCA A 456 97.680 151.222 84.070 1.00 0.13 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 661 659 2629 CONECT 746 747 751 752 753 CONECT 751 746 CONECT 752 746 CONECT 753 746 CONECT 1286 1287 1293 1294 1295 CONECT 1293 1286 CONECT 1294 1286 CONECT 1295 1286 CONECT 2629 661 CONECT 3084 3085 3089 3096 CONECT 3085 3084 3086 3094 CONECT 3086 3085 3087 3091 CONECT 3087 3086 3088 CONECT 3088 3087 3089 3090 CONECT 3089 3084 3088 CONECT 3090 3088 CONECT 3091 3086 3092 3093 CONECT 3092 3091 CONECT 3093 3091 CONECT 3094 3085 3095 CONECT 3095 3094 3096 3182 CONECT 3096 3084 3095 3097 CONECT 3097 3096 3098 3175 3181 CONECT 3098 3097 3099 CONECT 3099 3098 3100 3169 3180 CONECT 3100 3099 3101 3167 3168 CONECT 3101 3100 3102 CONECT 3102 3101 3103 3165 3166 CONECT 3103 3102 3104 CONECT 3104 3103 3105 3163 3164 CONECT 3105 3104 3106 CONECT 3106 3105 3107 3161 3162 CONECT 3107 3106 3108 3153 3157 CONECT 3108 3107 3109 3150 3152 CONECT 3109 3108 3110 3149 CONECT 3110 3109 3111 3148 CONECT 3111 3110 3112 3146 3147 CONECT 3112 3111 3113 3144 3145 CONECT 3113 3112 3114 3143 CONECT 3114 3113 3115 3142 CONECT 3115 3114 3116 3140 3141 CONECT 3116 3115 3117 3138 3139 CONECT 3117 3116 3118 CONECT 3118 3117 3119 3137 CONECT 3119 3118 3120 3135 3136 CONECT 3120 3119 3121 3133 3134 CONECT 3121 3120 3122 3128 CONECT 3122 3121 3123 3132 CONECT 3123 3122 3124 3131 CONECT 3124 3123 3125 3127 CONECT 3125 3124 3126 CONECT 3126 3125 CONECT 3127 3124 3128 3130 CONECT 3128 3121 3127 3129 CONECT 3129 3128 CONECT 3130 3127 CONECT 3131 3123 CONECT 3132 3122 CONECT 3133 3120 CONECT 3134 3120 CONECT 3135 3119 CONECT 3136 3119 CONECT 3137 3118 CONECT 3138 3116 CONECT 3139 3116 CONECT 3140 3115 CONECT 3141 3115 CONECT 3142 3114 CONECT 3143 3113 CONECT 3144 3112 CONECT 3145 3112 CONECT 3146 3111 CONECT 3147 3111 CONECT 3148 3110 CONECT 3149 3109 CONECT 3150 3108 3151 CONECT 3151 3150 CONECT 3152 3108 CONECT 3153 3107 3154 3155 3156 CONECT 3154 3153 CONECT 3155 3153 CONECT 3156 3153 CONECT 3157 3107 3158 3159 3160 CONECT 3158 3157 CONECT 3159 3157 CONECT 3160 3157 CONECT 3161 3106 CONECT 3162 3106 CONECT 3163 3104 CONECT 3164 3104 CONECT 3165 3102 CONECT 3166 3102 CONECT 3167 3100 CONECT 3168 3100 CONECT 3169 3099 3170 3175 3179 CONECT 3170 3169 3171 CONECT 3171 3170 3172 3173 3174 CONECT 3172 3171 CONECT 3173 3171 CONECT 3174 3171 CONECT 3175 3097 3169 3176 3178 CONECT 3176 3175 3177 CONECT 3177 3176 CONECT 3178 3175 CONECT 3179 3169 CONECT 3180 3099 CONECT 3181 3097 CONECT 3182 3095 MASTER 0 0 0 0 0 0 0 0 3179 3 113 23 END
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Structure:
Ligand 2D
Ligand 3D
Protein
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Related entries of code: 5cyv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6c28
RCSB PDB
PDBbind
WCA
Entry Information
PDB ID
5cyv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CouR from Rhodococcus jostii RHA1
Ligand Name
WCA
EC.Number
E.C.-.-.-.-
Resolution
1.52(Å)
Affinity (Kd/Ki/IC50)
Kd=11uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Nucleic Acids Res. Vol. 44: pp. 595-607
Ligand Properties
Formula
C
3
0
H
4
7
N
7
O
1
8
P
3
S
Molecular Weight
918.717
Exact Mass
918.191
No. of atoms
106
No. of bonds
109
Polar Surface Area
459.41
LOGP Value
-4.43 (
Computed with XLOGP3
)
0.05 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 27
No. of Nitrogen and Oxygen Atoms: 25
No. of Rings: 4
Canonical SMILES
O=C(NCCSC(=O)CCc1ccc(cc1)O)CCNC(=O)[C@@H](C(COP(OP(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(O)(O)O)O)n1cnc2c1ncnc2N)(O)O)(O)O)(C)C)O
InChI String
InChI=1S/C30H50N7O18P3S/c1-30(2,25(42)28(43)33-10-9-20(39)32-11-12-59-21(40)8-5-17-3-6-18(38)7-4-17)14-52-58(49,50)55-57(47,48)51-13-19-24(54-56(44,45)46)23(41)29(53-19)37-16-36-22-26(31)34-15-35-27(22)37/h3-4,6-7,15-16,19,23-25,29,38,41-42,44-50,56-58H,5,8-14H2,1-2H3,(H,32,39)(H,33,43)(H2,31,34,35)/t19-,23-,24-,25+,29-/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):
Q0S6D0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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