Browse entries in the PDBbind-CN Database
HEADER 6B7F_COMPLEX COMPND 6B7F_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 157 LYS ARG ALA ILE TYR PRO GLY THR PHE ASP PRO ILE THR SEQRES 2 A 157 ASN GLY HIS ILE ASP ILE VAL THR ARG ALA THR GLN MET SEQRES 3 A 157 PHE ASP HIS VAL ILE LEU ALA ILE ALA ALA SER PRO SER SEQRES 4 A 157 LYS LYS PRO MET PHE THR LEU GLU GLU ARG VAL ALA LEU SEQRES 5 A 157 ALA GLN GLN ALA THR ALA HIS LEU GLY ASN VAL GLU VAL SEQRES 6 A 157 VAL GLY PHE SER ASP LEU MET ALA ASN PHE ALA ARG ASN SEQRES 7 A 157 GLN HIS ALA THR VAL LEU ILE ARG GLY LEU ARG ALA VAL SEQRES 8 A 157 ALA ASP PHE GLU TYR GLU MET GLN LEU ALA HIS MET ASN SEQRES 9 A 157 ARG HIS LEU MET PRO GLU LEU GLU SER VAL PHE LEU MET SEQRES 10 A 157 PRO SER LYS GLU TRP SER PHE ILE SER SER SER LEU VAL SEQRES 11 A 157 LYS GLU VAL ALA ARG HIS GLN GLY ASP VAL THR HIS PHE SEQRES 12 A 157 LEU PRO GLU ASN VAL HIS GLN ALA LEU MET ALA LYS LEU SEQRES 13 A 157 ALA SEQRES 1 B 157 LYS ARG ALA ILE TYR PRO GLY THR PHE ASP PRO ILE THR SEQRES 2 B 157 ASN GLY HIS ILE ASP ILE VAL THR ARG ALA THR GLN MET SEQRES 3 B 157 PHE ASP HIS VAL ILE LEU ALA ILE ALA ALA SER PRO SER SEQRES 4 B 157 LYS LYS PRO MET PHE THR LEU GLU GLU ARG VAL ALA LEU SEQRES 5 B 157 ALA GLN GLN ALA THR ALA HIS LEU GLY ASN VAL GLU VAL SEQRES 6 B 157 VAL GLY PHE SER ASP LEU MET ALA ASN PHE ALA ARG ASN SEQRES 7 B 157 GLN HIS ALA THR VAL LEU ILE ARG GLY LEU ARG ALA VAL SEQRES 8 B 157 ALA ASP PHE GLU TYR GLU MET GLN LEU ALA HIS MET ASN SEQRES 9 B 157 ARG HIS LEU MET PRO GLU LEU GLU SER VAL PHE LEU MET SEQRES 10 B 157 PRO SER LYS GLU TRP SER PHE ILE SER SER SER LEU VAL SEQRES 11 B 157 LYS GLU VAL ALA ARG HIS GLN GLY ASP VAL THR HIS PHE SEQRES 12 B 157 LEU PRO GLU ASN VAL HIS GLN ALA LEU MET ALA LYS LEU SEQRES 13 B 157 ALA HET K A 1 1 HET K A 2 1 HET K A 3 1 HET CW A 4 36 ATOM 1 N LYS A 3 54.929 105.988 140.852 1.00 67.69 N ATOM 2 CA LYS A 3 53.926 105.725 141.874 1.00 61.44 C ATOM 3 C LYS A 3 53.009 106.932 142.070 1.00 56.89 C ATOM 4 O LYS A 3 53.427 107.997 142.534 1.00 55.20 O ATOM 5 CB LYS A 3 54.564 105.349 143.191 1.00 60.34 C ATOM 6 CG LYS A 3 53.702 104.456 144.065 1.00 62.44 C ATOM 7 CD LYS A 3 53.514 103.061 143.514 1.00 64.19 C ATOM 8 CE LYS A 3 52.432 102.351 144.314 1.00 60.70 C ATOM 9 NZ LYS A 3 52.031 101.039 143.741 1.00 61.14 N ATOM 10 HZ1 LYS A 3 51.664 101.180 142.778 1.00 0.00 H ATOM 11 HZ2 LYS A 3 52.858 100.409 143.709 1.00 0.00 H ATOM 12 HZ3 LYS A 3 51.292 100.613 144.336 1.00 0.00 H ATOM 13 HN3 LYS A 3 55.508 106.803 141.138 1.00 0.00 H ATOM 14 HN2 LYS A 3 54.456 106.197 139.950 1.00 0.00 H ATOM 15 HN1 LYS A 3 55.537 105.151 140.741 1.00 0.00 H ATOM 16 N ARG A 4 51.742 106.706 141.734 1.00 49.40 N ATOM 17 CA ARG A 4 50.740 107.742 141.621 1.00 46.91 C ATOM 18 C ARG A 4 49.614 107.471 142.602 1.00 41.95 C ATOM 19 O ARG A 4 49.011 106.405 142.565 1.00 42.21 O ATOM 20 CB ARG A 4 50.210 107.784 140.190 1.00 47.85 C ATOM 21 CG ARG A 4 51.158 108.454 139.225 1.00 43.38 C ATOM 22 CD ARG A 4 50.663 108.240 137.821 1.00 41.15 C ATOM 23 NE ARG A 4 49.508 109.075 137.532 1.00 46.77 N ATOM 24 CZ ARG A 4 49.567 110.379 137.299 1.00 42.24 C ATOM 25 NH1 ARG A 4 50.742 111.002 137.287 1.00 37.78 N ATOM 26 NH2 ARG A 4 48.452 111.045 137.038 1.00 44.92 N ATOM 27 HE ARG A 4 48.574 108.619 137.506 1.00 0.00 H ATOM 28 HH12 ARG A 4 50.786 112.025 137.104 1.00 0.00 H ATOM 29 HH11 ARG A 4 51.616 110.466 137.461 1.00 0.00 H ATOM 30 HH22 ARG A 4 48.488 112.068 136.854 1.00 0.00 H ATOM 31 HH21 ARG A 4 47.540 110.545 137.017 1.00 0.00 H ATOM 32 H ARG A 4 51.455 105.725 141.541 1.00 0.00 H ATOM 33 N ALA A 5 49.304 108.441 143.469 1.00 35.40 N ATOM 34 CA ALA A 5 48.249 108.285 144.463 1.00 30.82 C ATOM 35 C ALA A 5 47.221 109.403 144.301 1.00 28.23 C ATOM 36 O ALA A 5 47.545 110.525 143.862 1.00 32.07 O ATOM 37 CB ALA A 5 48.827 108.365 145.886 1.00 30.84 C ATOM 38 H ALA A 5 49.833 109.336 143.433 1.00 0.00 H ATOM 39 N ILE A 6 45.971 109.094 144.645 1.00 25.41 N ATOM 40 CA ILE A 6 44.872 110.058 144.621 1.00 29.40 C ATOM 41 C ILE A 6 44.375 110.280 146.041 1.00 35.30 C ATOM 42 O ILE A 6 44.110 109.324 146.785 1.00 43.11 O ATOM 43 CB ILE A 6 43.700 109.607 143.738 1.00 30.48 C ATOM 44 CG1 ILE A 6 44.172 109.455 142.300 1.00 39.83 C ATOM 45 CG2 ILE A 6 42.578 110.634 143.788 1.00 27.92 C ATOM 46 CD1 ILE A 6 43.146 108.824 141.406 1.00 50.57 C ATOM 47 H ILE A 6 45.767 108.119 144.945 1.00 0.00 H ATOM 48 N TYR A 7 44.209 111.550 146.398 1.00 27.96 N ATOM 49 CA TYR A 7 43.593 111.941 147.656 1.00 27.85 C ATOM 50 C TYR A 7 42.258 112.560 147.291 1.00 31.61 C ATOM 51 O TYR A 7 42.197 113.752 146.937 1.00 30.12 O ATOM 52 CB TYR A 7 44.483 112.939 148.392 1.00 28.80 C ATOM 53 CG TYR A 7 43.965 113.450 149.721 1.00 27.83 C ATOM 54 CD1 TYR A 7 43.017 112.745 150.445 1.00 26.71 C ATOM 55 CD2 TYR A 7 44.463 114.625 150.268 1.00 29.98 C ATOM 56 CE1 TYR A 7 42.566 113.209 151.678 1.00 32.05 C ATOM 57 CE2 TYR A 7 44.025 115.097 151.489 1.00 34.67 C ATOM 58 CZ TYR A 7 43.080 114.390 152.192 1.00 35.65 C ATOM 59 OH TYR A 7 42.664 114.882 153.407 1.00 34.92 O ATOM 60 HH TYR A 7 41.987 114.272 153.794 1.00 0.00 H ATOM 61 H TYR A 7 44.534 112.296 145.750 1.00 0.00 H ATOM 62 N PRO A 8 41.163 111.809 147.339 1.00 30.45 N ATOM 63 CA PRO A 8 39.877 112.369 146.914 1.00 28.52 C ATOM 64 C PRO A 8 39.097 112.900 148.095 1.00 26.42 C ATOM 65 O PRO A 8 39.348 112.497 149.236 1.00 27.37 O ATOM 66 CB PRO A 8 39.176 111.173 146.280 1.00 30.20 C ATOM 67 CG PRO A 8 39.657 110.021 147.124 1.00 31.24 C ATOM 68 CD PRO A 8 41.086 110.357 147.541 1.00 25.50 C ATOM 69 N GLY A 9 38.163 113.800 147.834 1.00 23.80 N ATOM 70 CA GLY A 9 37.352 114.349 148.894 1.00 23.71 C ATOM 71 C GLY A 9 36.483 115.459 148.350 1.00 26.33 C ATOM 72 O GLY A 9 36.579 115.846 147.181 1.00 30.82 O ATOM 73 H GLY A 9 38.012 114.115 146.855 1.00 0.00 H ATOM 74 N THR A 10 35.616 115.959 149.230 1.00 24.15 N ATOM 75 CA THR A 10 34.728 117.067 148.878 1.00 26.01 C ATOM 76 C THR A 10 35.451 118.399 149.010 1.00 26.89 C ATOM 77 O THR A 10 35.217 119.308 148.211 1.00 29.03 O ATOM 78 CB THR A 10 33.451 117.007 149.731 1.00 31.71 C ATOM 79 OG1 THR A 10 32.772 115.767 149.464 1.00 29.47 O ATOM 80 CG2 THR A 10 32.491 118.158 149.417 1.00 39.05 C ATOM 81 HG1 THR A 10 32.537 115.721 148.503 1.00 0.00 H ATOM 82 H THR A 10 35.570 115.553 150.186 1.00 0.00 H ATOM 83 N PHE A 11 36.357 118.509 149.978 1.00 26.97 N ATOM 84 CA PHE A 11 37.168 119.708 150.236 1.00 27.68 C ATOM 85 C PHE A 11 36.315 120.974 150.136 1.00 34.55 C ATOM 86 O PHE A 11 36.529 121.848 149.297 1.00 36.75 O ATOM 87 CB PHE A 11 38.378 119.766 149.290 1.00 25.89 C ATOM 88 CG PHE A 11 39.208 118.501 149.281 1.00 29.42 C ATOM 89 CD1 PHE A 11 39.997 118.162 150.365 1.00 27.86 C ATOM 90 CD2 PHE A 11 39.209 117.655 148.175 1.00 31.72 C ATOM 91 CE1 PHE A 11 40.752 116.989 150.353 1.00 28.80 C ATOM 92 CE2 PHE A 11 39.975 116.489 148.165 1.00 21.98 C ATOM 93 CZ PHE A 11 40.738 116.164 149.249 1.00 23.13 C ATOM 94 H PHE A 11 36.502 117.687 150.598 1.00 0.00 H ATOM 95 N ASP A 12 35.333 121.068 151.028 1.00 29.07 N ATOM 96 CA ASP A 12 34.343 122.143 151.000 1.00 28.39 C ATOM 97 C ASP A 12 34.338 122.969 152.280 1.00 28.47 C ATOM 98 O ASP A 12 33.400 122.854 153.083 1.00 28.70 O ATOM 99 CB ASP A 12 32.960 121.535 150.770 1.00 27.30 C ATOM 100 CG ASP A 12 31.889 122.579 150.609 1.00 29.98 C ATOM 101 OD1 ASP A 12 32.128 123.522 149.847 1.00 32.76 O ATOM 102 OD2 ASP A 12 30.819 122.467 151.248 1.00 29.66 O ATOM 103 H ASP A 12 35.267 120.348 151.775 1.00 0.00 H ATOM 104 N PRO A 13 35.354 123.824 152.507 1.00 26.80 N ATOM 105 CA PRO A 13 36.580 123.983 151.717 1.00 26.38 C ATOM 106 C PRO A 13 37.711 123.133 152.258 1.00 25.49 C ATOM 107 O PRO A 13 37.545 122.524 153.321 1.00 24.21 O ATOM 108 CB PRO A 13 36.928 125.445 151.909 1.00 31.78 C ATOM 109 CG PRO A 13 36.525 125.701 153.329 1.00 27.39 C ATOM 110 CD PRO A 13 35.328 124.810 153.611 1.00 27.07 C ATOM 111 N ILE A 14 38.849 123.119 151.571 1.00 23.59 N ATOM 112 CA ILE A 14 40.023 122.403 152.051 1.00 26.90 C ATOM 113 C ILE A 14 40.502 123.058 153.344 1.00 27.31 C ATOM 114 O ILE A 14 40.500 124.289 153.476 1.00 23.50 O ATOM 115 CB ILE A 14 41.103 122.411 150.948 1.00 27.70 C ATOM 116 CG1 ILE A 14 42.342 121.608 151.332 1.00 31.00 C ATOM 117 CG2 ILE A 14 41.475 123.844 150.558 1.00 29.86 C ATOM 118 CD1 ILE A 14 43.222 121.298 150.116 1.00 30.89 C ATOM 119 H ILE A 14 38.902 123.632 150.668 1.00 0.00 H ATOM 120 N THR A 15 40.906 122.242 154.314 1.00 22.74 N ATOM 121 CA THR A 15 41.350 122.720 155.626 1.00 22.85 C ATOM 122 C THR A 15 42.820 122.376 155.847 1.00 28.27 C ATOM 123 O THR A 15 43.472 121.740 155.011 1.00 32.44 O ATOM 124 CB THR A 15 40.517 122.121 156.758 1.00 22.24 C ATOM 125 OG1 THR A 15 40.960 120.774 156.994 1.00 18.71 O ATOM 126 CG2 THR A 15 39.039 122.121 156.399 1.00 23.05 C ATOM 127 HG1 THR A 15 40.841 120.239 156.169 1.00 0.00 H ATOM 128 H THR A 15 40.907 121.218 154.133 1.00 0.00 H ATOM 129 N ASN A 16 43.350 122.828 156.990 1.00 27.34 N ATOM 130 CA ASN A 16 44.728 122.505 157.347 1.00 26.59 C ATOM 131 C ASN A 16 44.888 121.026 157.662 1.00 26.41 C ATOM 132 O ASN A 16 45.999 120.500 157.553 1.00 32.16 O ATOM 133 CB ASN A 16 45.182 123.355 158.537 1.00 28.19 C ATOM 134 CG ASN A 16 45.427 124.809 158.159 1.00 28.26 C ATOM 135 OD1 ASN A 16 45.511 125.153 156.978 1.00 29.84 O ATOM 136 ND2 ASN A 16 45.531 125.671 159.164 1.00 26.85 N ATOM 137 HD22 ASN A 16 45.454 125.337 160.146 1.00 0.00 H ATOM 138 HD21 ASN A 16 45.690 126.680 158.969 1.00 0.00 H ATOM 139 H ASN A 16 42.775 123.414 157.629 1.00 0.00 H ATOM 140 N GLY A 17 43.803 120.348 158.057 1.00 25.79 N ATOM 141 CA GLY A 17 43.841 118.896 158.147 1.00 29.22 C ATOM 142 C GLY A 17 44.055 118.244 156.794 1.00 33.22 C ATOM 143 O GLY A 17 44.838 117.299 156.664 1.00 31.12 O ATOM 144 H GLY A 17 42.931 120.860 158.300 1.00 0.00 H ATOM 145 N HIS A 18 43.369 118.748 155.764 1.00 33.29 N ATOM 146 CA HIS A 18 43.586 118.246 154.412 1.00 24.94 C ATOM 147 C HIS A 18 44.993 118.560 153.934 1.00 25.27 C ATOM 148 O HIS A 18 45.616 117.755 153.234 1.00 27.18 O ATOM 149 CB HIS A 18 42.569 118.852 153.455 1.00 25.55 C ATOM 150 CG HIS A 18 41.150 118.533 153.795 1.00 28.20 C ATOM 151 ND1 HIS A 18 40.197 119.511 153.981 1.00 28.52 N ATOM 152 CD2 HIS A 18 40.515 117.351 153.969 1.00 26.22 C ATOM 153 CE1 HIS A 18 39.039 118.948 154.265 1.00 25.77 C ATOM 154 NE2 HIS A 18 39.204 117.637 154.264 1.00 30.02 N ATOM 155 H HIS A 18 42.675 119.505 155.928 1.00 0.00 H ATOM 156 N ILE A 19 45.501 119.742 154.277 1.00 26.71 N ATOM 157 CA ILE A 19 46.863 120.071 153.886 1.00 32.20 C ATOM 158 C ILE A 19 47.830 119.128 154.579 1.00 35.09 C ATOM 159 O ILE A 19 48.782 118.623 153.969 1.00 30.29 O ATOM 160 CB ILE A 19 47.176 121.543 154.218 1.00 33.12 C ATOM 161 CG1 ILE A 19 46.282 122.493 153.419 1.00 31.26 C ATOM 162 CG2 ILE A 19 48.652 121.847 153.975 1.00 28.95 C ATOM 163 CD1 ILE A 19 46.226 122.197 151.932 1.00 34.75 C ATOM 164 H ILE A 19 44.930 120.422 154.818 1.00 0.00 H ATOM 165 N ASP A 20 47.577 118.851 155.860 1.00 28.92 N ATOM 166 CA ASP A 20 48.391 117.900 156.605 1.00 30.34 C ATOM 167 C ASP A 20 48.473 116.557 155.888 1.00 27.81 C ATOM 168 O ASP A 20 49.567 116.049 155.627 1.00 28.44 O ATOM 169 CB ASP A 20 47.810 117.740 158.014 1.00 33.02 C ATOM 170 CG ASP A 20 48.651 116.849 158.892 1.00 41.10 C ATOM 171 OD1 ASP A 20 49.591 117.358 159.538 1.00 48.03 O ATOM 172 OD2 ASP A 20 48.378 115.632 158.919 1.00 41.05 O ATOM 173 H ASP A 20 46.782 119.324 156.336 1.00 0.00 H ATOM 174 N ILE A 21 47.321 115.991 155.520 1.00 22.77 N ATOM 175 CA ILE A 21 47.297 114.671 154.900 1.00 23.16 C ATOM 176 C ILE A 21 47.978 114.689 153.538 1.00 26.08 C ATOM 177 O ILE A 21 48.832 113.843 153.250 1.00 27.17 O ATOM 178 CB ILE A 21 45.852 114.152 154.799 1.00 21.86 C ATOM 179 CG1 ILE A 21 45.217 114.067 156.193 1.00 25.04 C ATOM 180 CG2 ILE A 21 45.825 112.806 154.122 1.00 16.42 C ATOM 181 CD1 ILE A 21 45.785 112.945 157.063 1.00 17.84 C ATOM 182 H ILE A 21 46.427 116.499 155.678 1.00 0.00 H ATOM 183 N VAL A 22 47.647 115.670 152.693 1.00 24.92 N ATOM 184 CA VAL A 22 48.237 115.680 151.359 1.00 23.83 C ATOM 185 C VAL A 22 49.749 115.866 151.435 1.00 25.44 C ATOM 186 O VAL A 22 50.481 115.297 150.617 1.00 29.78 O ATOM 187 CB VAL A 22 47.563 116.747 150.465 1.00 22.87 C ATOM 188 CG1 VAL A 22 48.306 118.080 150.516 1.00 22.59 C ATOM 189 CG2 VAL A 22 47.440 116.261 149.013 1.00 21.97 C ATOM 190 H VAL A 22 46.980 116.414 152.982 1.00 0.00 H ATOM 191 N THR A 23 50.253 116.607 152.432 1.00 27.67 N ATOM 192 CA THR A 23 51.700 116.807 152.549 1.00 28.85 C ATOM 193 C THR A 23 52.396 115.516 152.930 1.00 32.62 C ATOM 194 O THR A 23 53.476 115.214 152.421 1.00 35.99 O ATOM 195 CB THR A 23 52.019 117.900 153.571 1.00 31.50 C ATOM 196 OG1 THR A 23 51.325 119.107 153.219 1.00 37.59 O ATOM 197 CG2 THR A 23 53.533 118.206 153.601 1.00 30.65 C ATOM 198 HG1 THR A 23 50.350 118.936 153.213 1.00 0.00 H ATOM 199 H THR A 23 49.613 117.043 153.127 1.00 0.00 H ATOM 200 N ARG A 24 51.772 114.725 153.795 1.00 36.54 N ATOM 201 CA ARG A 24 52.341 113.437 154.157 1.00 33.01 C ATOM 202 C ARG A 24 52.330 112.497 152.967 1.00 35.46 C ATOM 203 O ARG A 24 53.241 111.684 152.810 1.00 40.98 O ATOM 204 CB ARG A 24 51.557 112.825 155.318 1.00 31.99 C ATOM 205 CG ARG A 24 51.645 113.610 156.607 1.00 32.80 C ATOM 206 CD ARG A 24 50.757 113.010 157.684 1.00 33.00 C ATOM 207 NE ARG A 24 50.651 113.914 158.821 1.00 37.77 N ATOM 208 CZ ARG A 24 51.609 114.074 159.730 1.00 42.76 C ATOM 209 NH1 ARG A 24 52.734 113.372 159.636 1.00 42.42 N ATOM 210 NH2 ARG A 24 51.448 114.928 160.736 1.00 36.39 N ATOM 211 HE ARG A 24 49.776 114.466 158.928 1.00 0.00 H ATOM 212 HH12 ARG A 24 53.485 113.495 160.345 1.00 0.00 H ATOM 213 HH11 ARG A 24 52.864 112.700 158.853 1.00 0.00 H ATOM 214 HH22 ARG A 24 52.202 115.047 161.443 1.00 0.00 H ATOM 215 HH21 ARG A 24 50.568 115.477 160.816 1.00 0.00 H ATOM 216 H ARG A 24 50.871 115.029 154.216 1.00 0.00 H ATOM 217 N ALA A 25 51.327 112.616 152.105 1.00 36.99 N ATOM 218 CA ALA A 25 51.257 111.763 150.930 1.00 34.83 C ATOM 219 C ALA A 25 52.353 112.093 149.927 1.00 34.36 C ATOM 220 O ALA A 25 52.849 111.193 149.239 1.00 31.75 O ATOM 221 CB ALA A 25 49.884 111.904 150.278 1.00 30.78 C ATOM 222 H ALA A 25 50.585 113.326 152.272 1.00 0.00 H ATOM 223 N THR A 26 52.780 113.352 149.856 1.00 40.15 N ATOM 224 CA THR A 26 53.846 113.734 148.931 1.00 43.84 C ATOM 225 C THR A 26 55.217 113.285 149.418 1.00 44.09 C ATOM 226 O THR A 26 56.119 113.114 148.592 1.00 43.89 O ATOM 227 CB THR A 26 53.855 115.255 148.680 1.00 38.51 C ATOM 228 OG1 THR A 26 54.034 115.957 149.920 1.00 39.42 O ATOM 229 CG2 THR A 26 52.558 115.705 148.042 1.00 37.04 C ATOM 230 HG1 THR A 26 53.292 115.732 150.535 1.00 0.00 H ATOM 231 H THR A 26 52.349 114.074 150.467 1.00 0.00 H ATOM 232 N GLN A 27 55.401 113.076 150.718 1.00 46.67 N ATOM 233 CA GLN A 27 56.647 112.524 151.239 1.00 46.37 C ATOM 234 C GLN A 27 56.736 111.019 151.051 1.00 40.73 C ATOM 235 O GLN A 27 57.807 110.436 151.269 1.00 41.38 O ATOM 236 CB GLN A 27 56.793 112.878 152.724 1.00 50.09 C ATOM 237 CG GLN A 27 56.862 114.375 152.935 1.00 56.28 C ATOM 238 CD GLN A 27 56.442 114.815 154.332 1.00 67.45 C ATOM 239 OE1 GLN A 27 55.812 114.064 155.091 1.00 69.63 O ATOM 240 NE2 GLN A 27 56.785 116.050 154.675 1.00 66.28 N ATOM 241 HE22 GLN A 27 57.314 116.647 154.008 1.00 0.00 H ATOM 242 HE21 GLN A 27 56.525 116.421 155.611 1.00 0.00 H ATOM 243 H GLN A 27 54.636 113.312 151.382 1.00 0.00 H ATOM 244 N MET A 28 55.650 110.393 150.622 1.00 31.77 N ATOM 245 CA MET A 28 55.518 108.952 150.551 1.00 33.18 C ATOM 246 C MET A 28 55.299 108.445 149.130 1.00 38.46 C ATOM 247 O MET A 28 55.698 107.314 148.819 1.00 34.37 O ATOM 248 CB MET A 28 54.359 108.527 151.464 1.00 42.12 C ATOM 249 CG MET A 28 53.959 107.087 151.467 1.00 51.62 C ATOM 250 SD MET A 28 52.652 106.888 152.706 1.00 52.42 S ATOM 251 CE MET A 28 53.512 107.477 154.126 1.00 47.80 C ATOM 252 H MET A 28 54.842 110.972 150.317 1.00 0.00 H ATOM 253 N PHE A 29 54.700 109.261 148.258 1.00 38.68 N ATOM 254 CA PHE A 29 54.440 108.902 146.872 1.00 39.45 C ATOM 255 C PHE A 29 54.971 109.990 145.936 1.00 43.96 C ATOM 256 O PHE A 29 55.093 111.157 146.306 1.00 47.55 O ATOM 257 CB PHE A 29 52.942 108.635 146.654 1.00 34.82 C ATOM 258 CG PHE A 29 52.397 107.506 147.508 1.00 36.43 C ATOM 259 CD1 PHE A 29 52.705 106.182 147.202 1.00 33.22 C ATOM 260 CD2 PHE A 29 51.625 107.758 148.635 1.00 31.32 C ATOM 261 CE1 PHE A 29 52.229 105.145 147.993 1.00 34.17 C ATOM 262 CE2 PHE A 29 51.150 106.726 149.424 1.00 30.95 C ATOM 263 CZ PHE A 29 51.449 105.422 149.101 1.00 30.06 C ATOM 264 H PHE A 29 54.404 110.202 148.587 1.00 0.00 H ATOM 265 N ASP A 30 55.265 109.588 144.695 1.00 48.84 N ATOM 266 CA ASP A 30 55.909 110.476 143.726 1.00 53.83 C ATOM 267 C ASP A 30 54.984 111.592 143.259 1.00 50.69 C ATOM 268 O ASP A 30 55.384 112.762 143.215 1.00 56.31 O ATOM 269 CB ASP A 30 56.375 109.662 142.515 1.00 62.51 C ATOM 270 CG ASP A 30 57.501 108.709 142.839 1.00 65.54 C ATOM 271 OD1 ASP A 30 58.543 109.173 143.337 1.00 68.58 O ATOM 272 OD2 ASP A 30 57.341 107.501 142.612 1.00 67.43 O ATOM 273 H ASP A 30 55.029 108.616 144.410 1.00 0.00 H ATOM 274 N HIS A 31 53.743 111.255 142.920 1.00 46.80 N ATOM 275 CA HIS A 31 52.777 112.214 142.406 1.00 42.23 C ATOM 276 C HIS A 31 51.465 111.975 143.139 1.00 36.47 C ATOM 277 O HIS A 31 50.993 110.832 143.226 1.00 34.43 O ATOM 278 CB HIS A 31 52.583 112.039 140.899 1.00 47.52 C ATOM 279 CG HIS A 31 51.866 113.177 140.234 1.00 48.05 C ATOM 280 ND1 HIS A 31 52.413 114.437 140.130 1.00 47.90 N ATOM 281 CD2 HIS A 31 50.652 113.245 139.637 1.00 47.67 C ATOM 282 CE1 HIS A 31 51.570 115.230 139.494 1.00 48.21 C ATOM 283 NE2 HIS A 31 50.493 114.532 139.186 1.00 45.97 N ATOM 284 H HIS A 31 53.450 110.263 143.027 1.00 0.00 H ATOM 285 N VAL A 32 50.883 113.042 143.680 1.00 33.75 N ATOM 286 CA VAL A 32 49.618 112.967 144.394 1.00 34.12 C ATOM 287 C VAL A 32 48.619 113.829 143.651 1.00 36.21 C ATOM 288 O VAL A 32 48.905 114.988 143.332 1.00 36.55 O ATOM 289 CB VAL A 32 49.757 113.420 145.859 1.00 32.17 C ATOM 290 CG1 VAL A 32 48.443 113.263 146.585 1.00 28.48 C ATOM 291 CG2 VAL A 32 50.831 112.618 146.551 1.00 29.51 C ATOM 292 H VAL A 32 51.351 113.966 143.589 1.00 0.00 H ATOM 293 N ILE A 33 47.454 113.270 143.383 1.00 33.97 N ATOM 294 CA ILE A 33 46.380 114.002 142.742 1.00 32.51 C ATOM 295 C ILE A 33 45.358 114.315 143.820 1.00 33.22 C ATOM 296 O ILE A 33 44.654 113.422 144.303 1.00 35.83 O ATOM 297 CB ILE A 33 45.754 113.202 141.595 1.00 32.89 C ATOM 298 CG1 ILE A 33 46.744 113.077 140.440 1.00 38.41 C ATOM 299 CG2 ILE A 33 44.456 113.856 141.126 1.00 28.27 C ATOM 300 CD1 ILE A 33 46.488 111.882 139.582 1.00 42.59 C ATOM 301 H ILE A 33 47.302 112.274 143.640 1.00 0.00 H ATOM 302 N LEU A 34 45.259 115.584 144.195 1.00 35.97 N ATOM 303 CA LEU A 34 44.185 115.996 145.083 1.00 33.66 C ATOM 304 C LEU A 34 42.947 116.113 144.208 1.00 28.97 C ATOM 305 O LEU A 34 42.836 117.039 143.395 1.00 29.02 O ATOM 306 CB LEU A 34 44.530 117.310 145.779 1.00 40.57 C ATOM 307 CG LEU A 34 43.703 117.626 147.029 1.00 40.95 C ATOM 308 CD1 LEU A 34 44.485 118.424 148.046 1.00 37.11 C ATOM 309 CD2 LEU A 34 42.467 118.412 146.610 1.00 42.83 C ATOM 310 H LEU A 34 45.949 116.283 143.854 1.00 0.00 H ATOM 311 N ALA A 35 42.039 115.150 144.348 1.00 30.55 N ATOM 312 CA ALA A 35 40.887 115.025 143.469 1.00 28.54 C ATOM 313 C ALA A 35 39.663 115.541 144.213 1.00 27.30 C ATOM 314 O ALA A 35 39.331 115.033 145.288 1.00 36.66 O ATOM 315 CB ALA A 35 40.682 113.580 143.048 1.00 28.78 C ATOM 316 H ALA A 35 42.158 114.459 145.117 1.00 0.00 H ATOM 317 N ILE A 36 39.003 116.555 143.679 1.00 27.13 N ATOM 318 CA ILE A 36 37.877 117.170 144.360 1.00 25.39 C ATOM 319 C ILE A 36 36.607 116.620 143.729 1.00 26.41 C ATOM 320 O ILE A 36 36.377 116.766 142.518 1.00 29.72 O ATOM 321 CB ILE A 36 37.970 118.697 144.280 1.00 30.86 C ATOM 322 CG1 ILE A 36 39.346 119.138 144.795 1.00 27.39 C ATOM 323 CG2 ILE A 36 36.930 119.360 145.190 1.00 30.75 C ATOM 324 CD1 ILE A 36 39.478 120.647 145.039 1.00 27.63 C ATOM 325 H ILE A 36 39.297 116.920 142.751 1.00 0.00 H ATOM 326 N ALA A 37 35.814 115.926 144.537 1.00 25.65 N ATOM 327 CA ALA A 37 34.579 115.334 144.044 1.00 28.73 C ATOM 328 C ALA A 37 33.514 116.422 143.988 1.00 29.17 C ATOM 329 O ALA A 37 33.426 117.277 144.877 1.00 31.61 O ATOM 330 CB ALA A 37 34.138 114.179 144.931 1.00 25.48 C ATOM 331 H ALA A 37 36.079 115.804 145.535 1.00 0.00 H ATOM 332 N ALA A 38 32.721 116.414 142.914 1.00 29.63 N ATOM 333 CA ALA A 38 31.692 117.438 142.768 1.00 34.10 C ATOM 334 C ALA A 38 30.689 117.343 143.904 1.00 37.01 C ATOM 335 O ALA A 38 30.247 118.371 144.436 1.00 41.41 O ATOM 336 CB ALA A 38 30.995 117.295 141.420 1.00 29.74 C ATOM 337 H ALA A 38 32.836 115.681 142.185 1.00 0.00 H ATOM 338 N SER A 39 30.346 116.115 144.304 1.00 37.89 N ATOM 339 CA SER A 39 29.487 115.796 145.441 1.00 44.67 C ATOM 340 C SER A 39 28.239 116.719 145.535 1.00 48.27 C ATOM 341 O SER A 39 28.051 117.368 146.543 1.00 43.90 O ATOM 342 CB SER A 39 30.282 115.845 146.739 1.00 50.13 C ATOM 343 OG SER A 39 31.194 114.761 146.839 1.00 53.61 O ATOM 344 HG SER A 39 31.691 114.827 147.693 1.00 0.00 H ATOM 345 H SER A 39 30.724 115.315 143.757 1.00 0.00 H ATOM 346 N PRO A 40 27.416 116.744 144.483 1.00 54.91 N ATOM 347 CA PRO A 40 26.262 117.672 144.524 1.00 57.41 C ATOM 348 C PRO A 40 25.175 117.231 145.494 1.00 62.32 C ATOM 349 O PRO A 40 24.336 118.055 145.876 1.00 66.73 O ATOM 350 CB PRO A 40 25.759 117.656 143.071 1.00 53.44 C ATOM 351 CG PRO A 40 26.189 116.325 142.575 1.00 50.18 C ATOM 352 CD PRO A 40 27.523 116.081 143.175 1.00 48.96 C ATOM 353 N SER A 41 25.192 115.961 145.916 1.00 62.32 N ATOM 354 CA SER A 41 24.281 115.444 146.928 1.00 60.43 C ATOM 355 C SER A 41 24.527 116.095 148.280 1.00 63.51 C ATOM 356 O SER A 41 23.647 116.056 149.145 1.00 69.83 O ATOM 357 CB SER A 41 24.416 113.916 147.035 1.00 61.76 C ATOM 358 OG SER A 41 25.715 113.549 147.469 1.00 67.99 O ATOM 359 HG SER A 41 25.775 112.563 147.529 1.00 0.00 H ATOM 360 H SER A 41 25.890 115.311 145.501 1.00 0.00 H ATOM 361 N LYS A 42 25.725 116.630 148.502 1.00 58.71 N ATOM 362 CA LYS A 42 26.117 117.277 149.751 1.00 53.90 C ATOM 363 C LYS A 42 25.775 118.758 149.799 1.00 56.88 C ATOM 364 O LYS A 42 25.991 119.386 150.842 1.00 62.75 O ATOM 365 CB LYS A 42 27.625 117.129 149.985 1.00 51.92 C ATOM 366 CG LYS A 42 27.953 115.910 150.781 1.00 51.73 C ATOM 367 CD LYS A 42 29.406 115.570 150.698 1.00 52.35 C ATOM 368 CE LYS A 42 29.601 114.172 151.209 1.00 57.17 C ATOM 369 NZ LYS A 42 31.041 113.875 151.353 1.00 61.98 N ATOM 370 HZ1 LYS A 42 31.507 113.967 150.428 1.00 0.00 H ATOM 371 HZ2 LYS A 42 31.466 114.545 152.025 1.00 0.00 H ATOM 372 HZ3 LYS A 42 31.160 112.904 151.707 1.00 0.00 H ATOM 373 H LYS A 42 26.428 116.584 147.736 1.00 0.00 H ATOM 374 N LYS A 43 25.267 119.326 148.704 1.00 56.17 N ATOM 375 CA LYS A 43 24.980 120.750 148.580 1.00 55.96 C ATOM 376 C LYS A 43 26.201 121.523 149.064 1.00 52.44 C ATOM 377 O LYS A 43 26.093 122.228 150.078 1.00 55.03 O ATOM 378 CB LYS A 43 23.749 121.144 149.396 1.00 57.55 C ATOM 379 H LYS A 43 25.063 118.715 147.888 1.00 0.00 H ATOM 380 N PRO A 44 27.373 121.403 148.417 1.00 52.94 N ATOM 381 CA PRO A 44 28.565 122.067 148.967 1.00 49.69 C ATOM 382 C PRO A 44 28.407 123.580 148.950 1.00 43.09 C ATOM 383 O PRO A 44 27.704 124.141 148.109 1.00 43.90 O ATOM 384 CB PRO A 44 29.705 121.604 148.052 1.00 54.73 C ATOM 385 CG PRO A 44 29.069 121.022 146.846 1.00 56.62 C ATOM 386 CD PRO A 44 27.685 120.586 147.225 1.00 57.27 C ATOM 387 N MET A 45 29.048 124.241 149.916 1.00 40.74 N ATOM 388 CA MET A 45 28.981 125.702 149.983 1.00 39.51 C ATOM 389 C MET A 45 29.698 126.338 148.798 1.00 39.17 C ATOM 390 O MET A 45 29.220 127.328 148.235 1.00 46.63 O ATOM 391 CB MET A 45 29.569 126.200 151.306 1.00 38.82 C ATOM 392 CG MET A 45 29.940 127.678 151.342 1.00 42.18 C ATOM 393 SD MET A 45 30.560 128.132 152.977 1.00 44.74 S ATOM 394 CE MET A 45 29.078 127.909 153.969 1.00 38.06 C ATOM 395 H MET A 45 29.598 123.715 150.625 1.00 0.00 H ATOM 396 N PHE A 46 30.851 125.794 148.412 1.00 37.44 N ATOM 397 CA PHE A 46 31.631 126.306 147.299 1.00 37.07 C ATOM 398 C PHE A 46 31.392 125.445 146.061 1.00 40.38 C ATOM 399 O PHE A 46 31.207 124.228 146.151 1.00 41.57 O ATOM 400 CB PHE A 46 33.115 126.318 147.647 1.00 36.27 C ATOM 401 CG PHE A 46 33.467 127.233 148.781 1.00 36.26 C ATOM 402 CD1 PHE A 46 33.425 126.778 150.086 1.00 37.18 C ATOM 403 CD2 PHE A 46 33.826 128.555 148.555 1.00 38.89 C ATOM 404 CE1 PHE A 46 33.734 127.619 151.151 1.00 39.73 C ATOM 405 CE2 PHE A 46 34.135 129.402 149.621 1.00 39.17 C ATOM 406 CZ PHE A 46 34.090 128.931 150.913 1.00 38.51 C ATOM 407 H PHE A 46 31.208 124.966 148.930 1.00 0.00 H ATOM 408 N THR A 47 31.425 126.087 144.895 1.00 40.83 N ATOM 409 CA THR A 47 31.319 125.352 143.645 1.00 42.49 C ATOM 410 C THR A 47 32.586 124.533 143.430 1.00 46.60 C ATOM 411 O THR A 47 33.627 124.776 144.049 1.00 46.24 O ATOM 412 CB THR A 47 31.091 126.303 142.466 1.00 43.77 C ATOM 413 OG1 THR A 47 32.273 127.091 142.244 1.00 43.28 O ATOM 414 CG2 THR A 47 29.909 127.216 142.722 1.00 44.21 C ATOM 415 HG1 THR A 47 32.474 127.618 143.057 1.00 0.00 H ATOM 416 H THR A 47 31.527 127.122 144.878 1.00 0.00 H ATOM 417 N LEU A 48 32.482 123.530 142.559 1.00 41.70 N ATOM 418 CA LEU A 48 33.652 122.714 142.266 1.00 34.53 C ATOM 419 C LEU A 48 34.792 123.563 141.732 1.00 36.45 C ATOM 420 O LEU A 48 35.959 123.349 142.088 1.00 38.13 O ATOM 421 CB LEU A 48 33.296 121.624 141.267 1.00 29.69 C ATOM 422 CG LEU A 48 34.455 120.677 140.967 1.00 31.05 C ATOM 423 CD1 LEU A 48 34.965 119.951 142.208 1.00 26.19 C ATOM 424 CD2 LEU A 48 34.003 119.703 139.922 1.00 30.72 C ATOM 425 H LEU A 48 31.574 123.332 142.093 1.00 0.00 H ATOM 426 N GLU A 49 34.475 124.554 140.904 1.00 38.88 N ATOM 427 CA GLU A 49 35.528 125.422 140.395 1.00 43.44 C ATOM 428 C GLU A 49 36.112 126.263 141.515 1.00 40.58 C ATOM 429 O GLU A 49 37.320 126.519 141.542 1.00 40.51 O ATOM 430 CB GLU A 49 34.989 126.300 139.267 1.00 50.76 C ATOM 431 CG GLU A 49 34.425 125.513 138.100 1.00 61.70 C ATOM 432 CD GLU A 49 32.913 125.507 138.087 1.00 70.27 C ATOM 433 OE1 GLU A 49 32.330 125.945 137.071 1.00 77.53 O ATOM 434 OE2 GLU A 49 32.310 125.082 139.097 1.00 64.89 O ATOM 435 H GLU A 49 33.486 124.708 140.623 1.00 0.00 H ATOM 436 N GLU A 50 35.274 126.672 142.462 1.00 38.86 N ATOM 437 CA GLU A 50 35.780 127.411 143.613 1.00 45.43 C ATOM 438 C GLU A 50 36.697 126.543 144.465 1.00 38.14 C ATOM 439 O GLU A 50 37.815 126.942 144.810 1.00 36.85 O ATOM 440 CB GLU A 50 34.593 127.936 144.435 1.00 49.03 C ATOM 441 CG GLU A 50 33.997 129.261 143.983 1.00 51.78 C ATOM 442 CD GLU A 50 32.673 129.557 144.669 1.00 58.20 C ATOM 443 OE1 GLU A 50 31.988 128.602 145.080 1.00 55.64 O ATOM 444 OE2 GLU A 50 32.320 130.743 144.817 1.00 65.98 O ATOM 445 H GLU A 50 34.258 126.465 142.382 1.00 0.00 H ATOM 446 N ARG A 51 36.251 125.327 144.767 1.00 33.16 N ATOM 447 CA ARG A 51 37.031 124.399 145.580 1.00 30.52 C ATOM 448 C ARG A 51 38.349 124.017 144.901 1.00 32.88 C ATOM 449 O ARG A 51 39.397 123.941 145.571 1.00 37.94 O ATOM 450 CB ARG A 51 36.163 123.192 145.917 1.00 26.58 C ATOM 451 CG ARG A 51 35.024 123.519 146.872 1.00 28.94 C ATOM 452 CD ARG A 51 34.114 122.337 147.170 1.00 30.76 C ATOM 453 NE ARG A 51 33.056 122.139 146.173 1.00 30.52 N ATOM 454 CZ ARG A 51 32.746 120.960 145.640 1.00 28.23 C ATOM 455 NH1 ARG A 51 31.764 120.849 144.751 1.00 22.89 N ATOM 456 NH2 ARG A 51 33.412 119.879 146.018 1.00 33.20 N ATOM 457 HE ARG A 51 32.515 122.972 145.864 1.00 0.00 H ATOM 458 HH12 ARG A 51 31.534 119.920 144.344 1.00 0.00 H ATOM 459 HH11 ARG A 51 31.226 121.691 144.463 1.00 0.00 H ATOM 460 HH22 ARG A 51 33.177 118.953 145.607 1.00 0.00 H ATOM 461 HH21 ARG A 51 34.170 119.956 146.726 1.00 0.00 H ATOM 462 H ARG A 51 35.319 125.029 144.414 1.00 0.00 H ATOM 463 N VAL A 52 38.309 123.760 143.567 1.00 30.54 N ATOM 464 CA VAL A 52 39.569 123.466 142.866 1.00 31.46 C ATOM 465 C VAL A 52 40.532 124.658 142.933 1.00 36.46 C ATOM 466 O VAL A 52 41.718 124.493 143.220 1.00 34.45 O ATOM 467 CB VAL A 52 39.267 123.043 141.426 1.00 31.73 C ATOM 468 CG1 VAL A 52 40.540 122.947 140.548 1.00 24.01 C ATOM 469 CG2 VAL A 52 38.545 121.666 141.369 1.00 25.45 C ATOM 470 H VAL A 52 37.406 123.771 143.052 1.00 0.00 H ATOM 471 N ALA A 53 40.021 125.895 142.717 1.00 37.19 N ATOM 472 CA ALA A 53 40.884 127.082 142.804 1.00 34.54 C ATOM 473 C ALA A 53 41.464 127.244 144.205 1.00 34.80 C ATOM 474 O ALA A 53 42.667 127.487 144.364 1.00 35.85 O ATOM 475 CB ALA A 53 40.099 128.321 142.411 1.00 35.36 C ATOM 476 H ALA A 53 39.012 126.005 142.488 1.00 0.00 H ATOM 477 N LEU A 54 40.626 127.123 145.234 1.00 33.29 N ATOM 478 CA LEU A 54 41.113 127.265 146.603 1.00 32.57 C ATOM 479 C LEU A 54 42.198 126.247 146.914 1.00 33.32 C ATOM 480 O LEU A 54 43.231 126.593 147.499 1.00 35.77 O ATOM 481 CB LEU A 54 39.952 127.108 147.577 1.00 34.89 C ATOM 482 CG LEU A 54 38.930 128.251 147.564 1.00 39.49 C ATOM 483 CD1 LEU A 54 37.708 127.937 148.408 1.00 38.13 C ATOM 484 CD2 LEU A 54 39.582 129.554 148.031 1.00 38.87 C ATOM 485 H LEU A 54 39.620 126.926 145.061 1.00 0.00 H ATOM 486 N ALA A 55 41.999 124.995 146.496 1.00 30.19 N ATOM 487 CA ALA A 55 42.969 123.949 146.804 1.00 29.22 C ATOM 488 C ALA A 55 44.260 124.128 146.011 1.00 31.66 C ATOM 489 O ALA A 55 45.353 123.882 146.539 1.00 29.55 O ATOM 490 CB ALA A 55 42.351 122.573 146.537 1.00 27.75 C ATOM 491 H ALA A 55 41.147 124.763 145.947 1.00 0.00 H ATOM 492 N GLN A 56 44.156 124.565 144.748 1.00 35.18 N ATOM 493 CA GLN A 56 45.352 124.808 143.941 1.00 41.57 C ATOM 494 C GLN A 56 46.237 125.845 144.611 1.00 43.23 C ATOM 495 O GLN A 56 47.442 125.637 144.793 1.00 42.83 O ATOM 496 CB GLN A 56 44.965 125.283 142.543 1.00 46.45 C ATOM 497 CG GLN A 56 44.732 124.196 141.521 1.00 54.91 C ATOM 498 CD GLN A 56 44.075 124.744 140.269 1.00 60.28 C ATOM 499 OE1 GLN A 56 43.597 125.881 140.258 1.00 59.77 O ATOM 500 NE2 GLN A 56 44.037 123.937 139.213 1.00 60.48 N ATOM 501 HE22 GLN A 56 44.454 122.986 139.270 1.00 0.00 H ATOM 502 HE21 GLN A 56 43.590 124.257 138.330 1.00 0.00 H ATOM 503 H GLN A 56 43.215 124.733 144.337 1.00 0.00 H ATOM 504 N GLN A 57 45.634 126.959 145.021 1.00 49.05 N ATOM 505 CA GLN A 57 46.385 128.019 145.677 1.00 56.18 C ATOM 506 C GLN A 57 46.923 127.557 147.018 1.00 51.64 C ATOM 507 O GLN A 57 48.085 127.817 147.350 1.00 52.04 O ATOM 508 CB GLN A 57 45.477 129.233 145.877 1.00 68.78 C ATOM 509 CG GLN A 57 46.133 130.416 146.562 1.00 83.06 C ATOM 510 CD GLN A 57 46.653 131.453 145.599 1.00100.14 C ATOM 511 OE1 GLN A 57 47.479 131.156 144.737 1.00109.06 O ATOM 512 NE2 GLN A 57 46.168 132.684 145.737 1.00101.15 N ATOM 513 HE22 GLN A 57 45.471 132.888 146.481 1.00 0.00 H ATOM 514 HE21 GLN A 57 46.486 133.443 145.101 1.00 0.00 H ATOM 515 H GLN A 57 44.611 127.073 144.870 1.00 0.00 H ATOM 516 N ALA A 58 46.123 126.793 147.761 1.00 43.59 N ATOM 517 CA ALA A 58 46.546 126.347 149.078 1.00 35.64 C ATOM 518 C ALA A 58 47.628 125.282 149.012 1.00 39.43 C ATOM 519 O ALA A 58 48.287 125.033 150.026 1.00 37.74 O ATOM 520 CB ALA A 58 45.347 125.822 149.865 1.00 30.19 C ATOM 521 H ALA A 58 45.190 126.514 147.396 1.00 0.00 H ATOM 522 N THR A 59 47.839 124.658 147.851 1.00 41.83 N ATOM 523 CA THR A 59 48.816 123.585 147.713 1.00 42.09 C ATOM 524 C THR A 59 49.952 123.929 146.756 1.00 43.16 C ATOM 525 O THR A 59 50.759 123.053 146.430 1.00 42.86 O ATOM 526 CB THR A 59 48.133 122.294 147.247 1.00 37.87 C ATOM 527 OG1 THR A 59 47.417 122.539 146.033 1.00 36.25 O ATOM 528 CG2 THR A 59 47.173 121.775 148.313 1.00 37.11 C ATOM 529 HG1 THR A 59 46.731 123.236 146.190 1.00 0.00 H ATOM 530 H THR A 59 47.288 124.947 147.017 1.00 0.00 H ATOM 531 N ALA A 60 50.043 125.182 146.310 1.00 44.70 N ATOM 532 CA ALA A 60 50.980 125.517 145.243 1.00 50.65 C ATOM 533 C ALA A 60 52.429 125.268 145.647 1.00 53.80 C ATOM 534 O ALA A 60 53.252 124.898 144.801 1.00 52.75 O ATOM 535 CB ALA A 60 50.786 126.974 144.823 1.00 45.96 C ATOM 536 H ALA A 60 49.443 125.924 146.724 1.00 0.00 H ATOM 537 N HIS A 61 52.748 125.410 146.934 1.00 54.14 N ATOM 538 CA HIS A 61 54.106 125.216 147.429 1.00 59.67 C ATOM 539 C HIS A 61 54.520 123.756 147.471 1.00 63.36 C ATOM 540 O HIS A 61 55.655 123.461 147.859 1.00 69.11 O ATOM 541 CB HIS A 61 54.216 125.791 148.835 1.00 64.05 C ATOM 542 CG HIS A 61 53.373 125.065 149.837 1.00 70.47 C ATOM 543 ND1 HIS A 61 52.006 125.221 149.914 1.00 71.99 N ATOM 544 CD2 HIS A 61 53.704 124.165 150.794 1.00 69.89 C ATOM 545 CE1 HIS A 61 51.530 124.451 150.877 1.00 70.68 C ATOM 546 NE2 HIS A 61 52.540 123.803 151.428 1.00 70.28 N ATOM 547 H HIS A 61 52.001 125.669 147.610 1.00 0.00 H ATOM 548 N LEU A 62 53.636 122.846 147.098 1.00 63.31 N ATOM 549 CA LEU A 62 53.913 121.418 147.095 1.00 60.35 C ATOM 550 C LEU A 62 54.062 121.009 145.636 1.00 62.96 C ATOM 551 O LEU A 62 53.098 121.067 144.865 1.00 66.09 O ATOM 552 CB LEU A 62 52.794 120.664 147.805 1.00 58.44 C ATOM 553 CG LEU A 62 52.572 120.808 149.308 1.00 56.38 C ATOM 554 CD1 LEU A 62 51.284 120.122 149.718 1.00 50.71 C ATOM 555 CD2 LEU A 62 53.740 120.174 150.041 1.00 54.86 C ATOM 556 H LEU A 62 52.696 123.167 146.791 1.00 0.00 H ATOM 557 N GLY A 63 55.276 120.611 145.257 1.00 66.18 N ATOM 558 CA GLY A 63 55.592 120.476 143.847 1.00 64.17 C ATOM 559 C GLY A 63 54.882 119.337 143.151 1.00 59.24 C ATOM 560 O GLY A 63 54.549 119.446 141.968 1.00 59.20 O ATOM 561 H GLY A 63 55.999 120.397 145.973 1.00 0.00 H ATOM 562 N ASN A 64 54.625 118.241 143.862 1.00 58.98 N ATOM 563 CA ASN A 64 54.115 117.035 143.225 1.00 62.34 C ATOM 564 C ASN A 64 52.647 116.770 143.554 1.00 53.21 C ATOM 565 O ASN A 64 52.216 115.614 143.605 1.00 50.27 O ATOM 566 CB ASN A 64 54.986 115.826 143.574 1.00 71.28 C ATOM 567 CG ASN A 64 55.160 115.623 145.070 1.00 71.29 C ATOM 568 OD1 ASN A 64 55.112 116.573 145.854 1.00 72.62 O ATOM 569 ND2 ASN A 64 55.369 114.370 145.470 1.00 69.10 N ATOM 570 HD22 ASN A 64 55.402 113.600 144.772 1.00 0.00 H ATOM 571 HD21 ASN A 64 55.500 114.162 146.481 1.00 0.00 H ATOM 572 H ASN A 64 54.791 118.246 144.889 1.00 0.00 H ATOM 573 N VAL A 65 51.862 117.830 143.751 1.00 47.77 N ATOM 574 CA VAL A 65 50.412 117.769 143.925 1.00 45.57 C ATOM 575 C VAL A 65 49.758 118.379 142.693 1.00 43.08 C ATOM 576 O VAL A 65 50.090 119.515 142.331 1.00 37.80 O ATOM 577 CB VAL A 65 49.972 118.536 145.185 1.00 41.43 C ATOM 578 CG1 VAL A 65 48.466 118.702 145.215 1.00 39.32 C ATOM 579 CG2 VAL A 65 50.463 117.852 146.428 1.00 40.97 C ATOM 580 H VAL A 65 52.314 118.766 143.783 1.00 0.00 H ATOM 581 N GLU A 66 48.839 117.655 142.076 1.00 39.70 N ATOM 582 CA GLU A 66 48.029 118.126 140.968 1.00 40.14 C ATOM 583 C GLU A 66 46.592 118.141 141.467 1.00 41.10 C ATOM 584 O GLU A 66 46.083 117.108 141.913 1.00 44.76 O ATOM 585 CB GLU A 66 48.209 117.204 139.762 1.00 39.40 C ATOM 586 CG GLU A 66 47.316 117.468 138.590 1.00 42.34 C ATOM 587 CD GLU A 66 47.354 116.333 137.590 1.00 47.26 C ATOM 588 OE1 GLU A 66 46.568 116.370 136.620 1.00 50.82 O ATOM 589 OE2 GLU A 66 48.153 115.391 137.786 1.00 47.09 O ATOM 590 H GLU A 66 48.686 116.681 142.408 1.00 0.00 H ATOM 591 N VAL A 67 45.962 119.307 141.458 1.00 36.27 N ATOM 592 CA VAL A 67 44.580 119.427 141.903 1.00 33.21 C ATOM 593 C VAL A 67 43.661 119.291 140.700 1.00 30.91 C ATOM 594 O VAL A 67 43.874 119.928 139.664 1.00 34.04 O ATOM 595 CB VAL A 67 44.344 120.753 142.644 1.00 31.03 C ATOM 596 CG1 VAL A 67 42.909 120.832 143.149 1.00 28.11 C ATOM 597 CG2 VAL A 67 45.311 120.873 143.808 1.00 31.88 C ATOM 598 H VAL A 67 46.465 120.155 141.126 1.00 0.00 H ATOM 599 N VAL A 68 42.652 118.440 140.830 1.00 32.80 N ATOM 600 CA VAL A 68 41.726 118.125 139.753 1.00 32.96 C ATOM 601 C VAL A 68 40.339 117.985 140.359 1.00 33.42 C ATOM 602 O VAL A 68 40.192 117.462 141.466 1.00 36.33 O ATOM 603 CB VAL A 68 42.133 116.828 139.021 1.00 40.67 C ATOM 604 CG1 VAL A 68 41.172 116.529 137.886 1.00 52.86 C ATOM 605 CG2 VAL A 68 43.565 116.914 138.499 1.00 39.27 C ATOM 606 H VAL A 68 42.516 117.974 141.750 1.00 0.00 H ATOM 607 N GLY A 69 39.318 118.471 139.643 1.00 28.97 N ATOM 608 CA GLY A 69 37.953 118.164 139.999 1.00 26.28 C ATOM 609 C GLY A 69 37.423 117.000 139.190 1.00 31.18 C ATOM 610 O GLY A 69 37.939 116.693 138.119 1.00 31.63 O ATOM 611 H GLY A 69 39.510 119.077 138.820 1.00 0.00 H ATOM 612 N PHE A 70 36.392 116.342 139.719 1.00 26.88 N ATOM 613 CA PHE A 70 35.819 115.205 139.015 1.00 26.67 C ATOM 614 C PHE A 70 34.423 114.919 139.544 1.00 33.50 C ATOM 615 O PHE A 70 34.125 115.153 140.718 1.00 31.05 O ATOM 616 CB PHE A 70 36.715 113.966 139.142 1.00 22.14 C ATOM 617 CG PHE A 70 36.664 113.292 140.491 1.00 21.58 C ATOM 618 CD1 PHE A 70 37.314 113.849 141.588 1.00 24.09 C ATOM 619 CD2 PHE A 70 36.025 112.069 140.646 1.00 26.10 C ATOM 620 CE1 PHE A 70 37.292 113.227 142.833 1.00 23.92 C ATOM 621 CE2 PHE A 70 36.000 111.428 141.887 1.00 31.81 C ATOM 622 CZ PHE A 70 36.638 112.015 142.988 1.00 30.03 C ATOM 623 H PHE A 70 35.998 116.641 140.634 1.00 0.00 H ATOM 624 N SER A 71 33.574 114.407 138.656 1.00 29.88 N ATOM 625 CA SER A 71 32.231 113.971 139.012 1.00 30.01 C ATOM 626 C SER A 71 32.033 112.498 138.699 1.00 31.02 C ATOM 627 O SER A 71 30.917 111.984 138.830 1.00 36.49 O ATOM 628 CB SER A 71 31.175 114.819 138.297 1.00 26.72 C ATOM 629 OG SER A 71 31.404 114.835 136.901 1.00 37.06 O ATOM 630 HG SER A 71 31.362 113.910 136.550 1.00 0.00 H ATOM 631 H SER A 71 33.882 114.314 137.667 1.00 0.00 H ATOM 632 N ASP A 72 33.090 111.810 138.291 1.00 32.30 N ATOM 633 CA ASP A 72 33.021 110.404 137.926 1.00 37.24 C ATOM 634 C ASP A 72 32.866 109.490 139.137 1.00 38.08 C ATOM 635 O ASP A 72 32.879 109.902 140.302 1.00 35.46 O ATOM 636 CB ASP A 72 34.290 109.977 137.198 1.00 42.13 C ATOM 637 CG ASP A 72 34.434 110.620 135.857 1.00 50.47 C ATOM 638 OD1 ASP A 72 33.479 111.291 135.416 1.00 57.36 O ATOM 639 OD2 ASP A 72 35.498 110.440 135.234 1.00 55.41 O ATOM 640 H ASP A 72 34.007 112.296 138.229 1.00 0.00 H ATOM 641 N LEU A 73 32.746 108.210 138.820 1.00 33.83 N ATOM 642 CA LEU A 73 32.904 107.169 139.811 1.00 28.53 C ATOM 643 C LEU A 73 34.364 107.164 140.233 1.00 26.84 C ATOM 644 O LEU A 73 35.255 107.268 139.391 1.00 29.18 O ATOM 645 CB LEU A 73 32.527 105.818 139.203 1.00 25.90 C ATOM 646 CG LEU A 73 32.570 104.576 140.091 1.00 25.04 C ATOM 647 CD1 LEU A 73 31.308 104.508 140.935 1.00 17.84 C ATOM 648 CD2 LEU A 73 32.797 103.294 139.284 1.00 32.03 C ATOM 649 H LEU A 73 32.533 107.948 137.836 1.00 0.00 H ATOM 650 N MET A 74 34.610 107.077 141.541 1.00 29.50 N ATOM 651 CA MET A 74 35.980 107.136 142.047 1.00 29.60 C ATOM 652 C MET A 74 36.877 106.118 141.354 1.00 32.95 C ATOM 653 O MET A 74 38.001 106.439 140.950 1.00 32.70 O ATOM 654 CB MET A 74 35.991 106.893 143.557 1.00 36.05 C ATOM 655 CG MET A 74 37.386 106.821 144.154 1.00 32.61 C ATOM 656 SD MET A 74 37.965 108.500 144.443 1.00 36.30 S ATOM 657 CE MET A 74 39.260 108.690 143.227 1.00 35.51 C ATOM 658 H MET A 74 33.819 106.966 142.207 1.00 0.00 H ATOM 659 N ALA A 75 36.402 104.876 141.227 1.00 39.07 N ATOM 660 CA ALA A 75 37.247 103.824 140.672 1.00 36.09 C ATOM 661 C ALA A 75 37.625 104.130 139.226 1.00 35.45 C ATOM 662 O ALA A 75 38.776 103.919 138.821 1.00 43.57 O ATOM 663 CB ALA A 75 36.547 102.469 140.784 1.00 36.42 C ATOM 664 H ALA A 75 35.429 104.659 141.524 1.00 0.00 H ATOM 665 N ASN A 76 36.677 104.652 138.441 1.00 32.14 N ATOM 666 CA ASN A 76 36.959 105.020 137.058 1.00 29.70 C ATOM 667 C ASN A 76 37.953 106.161 137.000 1.00 29.02 C ATOM 668 O ASN A 76 38.907 106.123 136.220 1.00 30.79 O ATOM 669 CB ASN A 76 35.669 105.426 136.348 1.00 28.64 C ATOM 670 CG ASN A 76 34.760 104.262 136.088 1.00 27.46 C ATOM 671 OD1 ASN A 76 35.192 103.119 136.094 1.00 30.09 O ATOM 672 ND2 ASN A 76 33.487 104.542 135.882 1.00 25.94 N ATOM 673 HD22 ASN A 76 33.165 105.531 135.886 1.00 0.00 H ATOM 674 HD21 ASN A 76 32.806 103.774 135.716 1.00 0.00 H ATOM 675 H ASN A 76 35.721 104.798 138.823 1.00 0.00 H ATOM 676 N PHE A 77 37.801 107.139 137.885 1.00 34.78 N ATOM 677 CA PHE A 77 38.698 108.284 137.861 1.00 35.20 C ATOM 678 C PHE A 77 40.102 107.869 138.282 1.00 38.55 C ATOM 679 O PHE A 77 41.093 108.385 137.756 1.00 35.13 O ATOM 680 CB PHE A 77 38.145 109.388 138.760 1.00 38.60 C ATOM 681 CG PHE A 77 38.992 110.622 138.799 1.00 40.14 C ATOM 682 CD1 PHE A 77 38.850 111.590 137.823 1.00 37.63 C ATOM 683 CD2 PHE A 77 39.942 110.809 139.795 1.00 33.72 C ATOM 684 CE1 PHE A 77 39.626 112.729 137.848 1.00 34.12 C ATOM 685 CE2 PHE A 77 40.725 111.944 139.818 1.00 30.41 C ATOM 686 CZ PHE A 77 40.565 112.905 138.846 1.00 30.32 C ATOM 687 H PHE A 77 37.042 107.087 138.594 1.00 0.00 H ATOM 688 N ALA A 78 40.207 106.940 139.238 1.00 44.58 N ATOM 689 CA ALA A 78 41.521 106.457 139.657 1.00 42.61 C ATOM 690 C ALA A 78 42.219 105.694 138.539 1.00 41.51 C ATOM 691 O ALA A 78 43.434 105.830 138.349 1.00 42.88 O ATOM 692 CB ALA A 78 41.390 105.576 140.896 1.00 41.34 C ATOM 693 H ALA A 78 39.349 106.559 139.686 1.00 0.00 H ATOM 694 N ARG A 79 41.467 104.885 137.794 1.00 39.46 N ATOM 695 CA ARG A 79 42.036 104.201 136.640 1.00 37.87 C ATOM 696 C ARG A 79 42.499 105.202 135.590 1.00 41.06 C ATOM 697 O ARG A 79 43.629 105.124 135.095 1.00 37.97 O ATOM 698 CB ARG A 79 41.017 103.217 136.067 1.00 38.42 C ATOM 699 CG ARG A 79 41.612 102.157 135.164 1.00 39.19 C ATOM 700 CD ARG A 79 40.585 101.147 134.667 1.00 41.59 C ATOM 701 NE ARG A 79 40.083 100.260 135.717 1.00 44.57 N ATOM 702 CZ ARG A 79 38.984 100.454 136.447 1.00 49.83 C ATOM 703 NH1 ARG A 79 38.640 99.553 137.358 1.00 47.08 N ATOM 704 NH2 ARG A 79 38.227 101.530 136.276 1.00 47.89 N ATOM 705 HE ARG A 79 40.634 99.400 135.912 1.00 0.00 H ATOM 706 HH12 ARG A 79 37.785 99.695 137.933 1.00 0.00 H ATOM 707 HH11 ARG A 79 39.226 98.705 137.498 1.00 0.00 H ATOM 708 HH22 ARG A 79 37.374 101.663 136.855 1.00 0.00 H ATOM 709 HH21 ARG A 79 38.487 102.241 135.562 1.00 0.00 H ATOM 710 H ARG A 79 40.466 104.741 138.038 1.00 0.00 H ATOM 711 N ASN A 80 41.656 106.190 135.283 1.00 40.54 N ATOM 712 CA ASN A 80 41.967 107.146 134.234 1.00 37.14 C ATOM 713 C ASN A 80 43.170 108.005 134.590 1.00 37.42 C ATOM 714 O ASN A 80 43.807 108.563 133.690 1.00 49.41 O ATOM 715 CB ASN A 80 40.732 108.012 133.970 1.00 36.93 C ATOM 716 CG ASN A 80 39.539 107.194 133.493 1.00 35.47 C ATOM 717 OD1 ASN A 80 39.663 106.014 133.174 1.00 37.37 O ATOM 718 ND2 ASN A 80 38.370 107.817 133.467 1.00 35.70 N ATOM 719 HD22 ASN A 80 38.308 108.817 133.745 1.00 0.00 H ATOM 720 HD21 ASN A 80 37.515 107.306 133.169 1.00 0.00 H ATOM 721 H ASN A 80 40.760 106.277 135.804 1.00 0.00 H ATOM 722 N GLN A 81 43.496 108.125 135.878 1.00 37.12 N ATOM 723 CA GLN A 81 44.661 108.865 136.339 1.00 39.31 C ATOM 724 C GLN A 81 45.847 107.949 136.570 1.00 36.85 C ATOM 725 O GLN A 81 46.903 108.413 137.015 1.00 39.16 O ATOM 726 CB GLN A 81 44.337 109.640 137.627 1.00 49.97 C ATOM 727 CG GLN A 81 43.281 110.724 137.478 1.00 57.30 C ATOM 728 CD GLN A 81 43.706 111.803 136.507 1.00 65.53 C ATOM 729 OE1 GLN A 81 44.731 112.453 136.692 1.00 67.06 O ATOM 730 NE2 GLN A 81 42.901 112.010 135.466 1.00 68.00 N ATOM 731 HE22 GLN A 81 42.043 111.434 135.350 1.00 0.00 H ATOM 732 HE21 GLN A 81 43.131 112.747 134.769 1.00 0.00 H ATOM 733 H GLN A 81 42.888 107.667 136.587 1.00 0.00 H ATOM 734 N HIS A 82 45.709 106.669 136.259 1.00 36.45 N ATOM 735 CA HIS A 82 46.804 105.722 136.406 1.00 39.92 C ATOM 736 C HIS A 82 47.287 105.653 137.851 1.00 41.24 C ATOM 737 O HIS A 82 48.475 105.510 138.130 1.00 41.46 O ATOM 738 CB HIS A 82 47.937 106.079 135.445 1.00 40.75 C ATOM 739 CG HIS A 82 47.478 106.245 134.026 1.00 48.30 C ATOM 740 ND1 HIS A 82 48.171 106.977 133.086 1.00 52.67 N ATOM 741 CD2 HIS A 82 46.388 105.757 133.386 1.00 51.04 C ATOM 742 CE1 HIS A 82 47.523 106.937 131.934 1.00 52.21 C ATOM 743 NE2 HIS A 82 46.436 106.206 132.091 1.00 48.24 N ATOM 744 H HIS A 82 44.793 106.332 135.900 1.00 0.00 H ATOM 745 N ALA A 83 46.355 105.781 138.787 1.00 40.39 N ATOM 746 CA ALA A 83 46.662 105.650 140.201 1.00 34.64 C ATOM 747 C ALA A 83 46.345 104.235 140.666 1.00 33.83 C ATOM 748 O ALA A 83 45.381 103.610 140.216 1.00 34.00 O ATOM 749 CB ALA A 83 45.884 106.662 141.038 1.00 32.97 C ATOM 750 H ALA A 83 45.376 105.981 138.500 1.00 0.00 H ATOM 751 N THR A 84 47.186 103.735 141.558 1.00 36.15 N ATOM 752 CA THR A 84 46.989 102.462 142.215 1.00 37.39 C ATOM 753 C THR A 84 46.806 102.628 143.718 1.00 40.92 C ATOM 754 O THR A 84 46.579 101.634 144.422 1.00 43.25 O ATOM 755 CB THR A 84 48.184 101.538 141.942 1.00 44.17 C ATOM 756 OG1 THR A 84 49.385 102.206 142.342 1.00 49.31 O ATOM 757 CG2 THR A 84 48.286 101.228 140.463 1.00 45.12 C ATOM 758 HG1 THR A 84 49.483 103.044 141.824 1.00 0.00 H ATOM 759 H THR A 84 48.034 104.287 141.799 1.00 0.00 H ATOM 760 N VAL A 85 46.900 103.853 144.231 1.00 38.67 N ATOM 761 CA VAL A 85 46.799 104.142 145.656 1.00 31.24 C ATOM 762 C VAL A 85 45.714 105.192 145.859 1.00 32.05 C ATOM 763 O VAL A 85 45.708 106.229 145.178 1.00 29.38 O ATOM 764 CB VAL A 85 48.145 104.633 146.228 1.00 28.80 C ATOM 765 CG1 VAL A 85 48.042 104.929 147.724 1.00 33.62 C ATOM 766 CG2 VAL A 85 49.260 103.613 145.965 1.00 26.58 C ATOM 767 H VAL A 85 47.054 104.648 143.579 1.00 0.00 H ATOM 768 N LEU A 86 44.806 104.930 146.795 1.00 29.26 N ATOM 769 CA LEU A 86 43.792 105.893 147.207 1.00 31.63 C ATOM 770 C LEU A 86 44.091 106.314 148.642 1.00 28.33 C ATOM 771 O LEU A 86 44.140 105.464 149.544 1.00 29.52 O ATOM 772 CB LEU A 86 42.404 105.287 147.111 1.00 36.40 C ATOM 773 CG LEU A 86 41.304 106.184 146.543 1.00 43.86 C ATOM 774 CD1 LEU A 86 41.685 106.664 145.150 1.00 47.52 C ATOM 775 CD2 LEU A 86 40.000 105.414 146.519 1.00 52.93 C ATOM 776 H LEU A 86 44.820 103.997 147.253 1.00 0.00 H ATOM 777 N ILE A 87 44.280 107.615 148.863 1.00 28.75 N ATOM 778 CA ILE A 87 44.615 108.141 150.182 1.00 29.58 C ATOM 779 C ILE A 87 43.389 108.764 150.813 1.00 29.35 C ATOM 780 O ILE A 87 42.635 109.497 150.154 1.00 34.15 O ATOM 781 CB ILE A 87 45.760 109.153 150.107 1.00 32.49 C ATOM 782 CG1 ILE A 87 47.037 108.425 149.696 1.00 39.79 C ATOM 783 CG2 ILE A 87 45.894 109.932 151.427 1.00 28.76 C ATOM 784 CD1 ILE A 87 48.049 109.324 149.041 1.00 44.60 C ATOM 785 H ILE A 87 44.185 108.278 148.067 1.00 0.00 H ATOM 786 N ARG A 88 43.160 108.412 152.073 1.00 29.79 N ATOM 787 CA ARG A 88 42.091 108.958 152.893 1.00 31.17 C ATOM 788 C ARG A 88 42.675 109.240 154.267 1.00 29.12 C ATOM 789 O ARG A 88 43.535 108.487 154.760 1.00 25.73 O ATOM 790 CB ARG A 88 40.913 107.980 153.006 1.00 37.05 C ATOM 791 CG ARG A 88 40.175 107.775 151.688 1.00 35.75 C ATOM 792 CD ARG A 88 39.425 109.034 151.248 1.00 35.49 C ATOM 793 NE ARG A 88 38.063 109.015 151.768 1.00 40.09 N ATOM 794 CZ ARG A 88 37.215 110.038 151.732 1.00 50.55 C ATOM 795 NH1 ARG A 88 37.581 111.199 151.212 1.00 56.76 N ATOM 796 NH2 ARG A 88 35.994 109.901 152.232 1.00 55.42 N ATOM 797 HE ARG A 88 37.728 108.131 152.202 1.00 0.00 H ATOM 798 HH12 ARG A 88 36.910 111.993 151.189 1.00 0.00 H ATOM 799 HH11 ARG A 88 38.540 111.317 150.827 1.00 0.00 H ATOM 800 HH22 ARG A 88 35.328 110.700 152.205 1.00 0.00 H ATOM 801 HH21 ARG A 88 35.702 108.995 152.651 1.00 0.00 H ATOM 802 H ARG A 88 43.786 107.700 152.501 1.00 0.00 H ATOM 803 N GLY A 89 42.210 110.323 154.884 1.00 29.37 N ATOM 804 CA GLY A 89 42.668 110.677 156.203 1.00 27.74 C ATOM 805 C GLY A 89 41.707 110.080 157.216 1.00 29.78 C ATOM 806 O GLY A 89 40.491 110.055 157.009 1.00 41.05 O ATOM 807 H GLY A 89 41.506 110.922 154.407 1.00 0.00 H ATOM 808 N LEU A 90 42.269 109.579 158.301 1.00 35.94 N ATOM 809 CA LEU A 90 41.505 108.927 159.350 1.00 43.75 C ATOM 810 C LEU A 90 41.447 109.842 160.555 1.00 55.75 C ATOM 811 O LEU A 90 42.487 110.159 161.152 1.00 72.16 O ATOM 812 CB LEU A 90 42.147 107.598 159.726 1.00 47.75 C ATOM 813 CG LEU A 90 41.557 106.435 158.930 1.00 54.99 C ATOM 814 CD1 LEU A 90 41.975 105.106 159.520 1.00 53.63 C ATOM 815 CD2 LEU A 90 40.038 106.561 158.914 1.00 59.48 C ATOM 816 H LEU A 90 43.301 109.654 158.409 1.00 0.00 H ATOM 817 N ARG A 91 40.235 110.246 160.929 1.00 54.61 N ATOM 818 CA ARG A 91 40.034 111.129 162.072 1.00 60.75 C ATOM 819 C ARG A 91 39.447 110.368 163.256 1.00 62.12 C ATOM 820 O ARG A 91 40.146 110.118 164.239 1.00 60.81 O ATOM 821 CB ARG A 91 39.136 112.299 161.683 1.00 66.07 C ATOM 822 CG ARG A 91 39.752 113.651 161.964 1.00 73.23 C ATOM 823 CD ARG A 91 38.677 114.704 162.032 1.00 78.71 C ATOM 824 NE ARG A 91 37.515 114.302 161.252 1.00 80.26 N ATOM 825 CZ ARG A 91 37.219 114.784 160.052 1.00 80.41 C ATOM 826 NH1 ARG A 91 36.144 114.349 159.414 1.00 80.59 N ATOM 827 NH2 ARG A 91 37.989 115.708 159.497 1.00 83.02 N ATOM 828 HE ARG A 91 36.876 113.591 161.662 1.00 0.00 H ATOM 829 HH12 ARG A 91 35.910 114.725 158.473 1.00 0.00 H ATOM 830 HH11 ARG A 91 35.533 113.631 159.854 1.00 0.00 H ATOM 831 HH22 ARG A 91 37.754 116.084 158.556 1.00 0.00 H ATOM 832 HH21 ARG A 91 38.828 116.058 160.002 1.00 0.00 H ATOM 833 H ARG A 91 39.407 109.922 160.390 1.00 0.00 H ATOM 834 N ALA A 92 38.195 109.922 163.163 1.00 65.60 N ATOM 835 CA ALA A 92 37.527 109.317 164.308 1.00 64.34 C ATOM 836 C ALA A 92 36.851 107.996 163.931 1.00 67.48 C ATOM 837 O ALA A 92 36.799 107.590 162.762 1.00 74.13 O ATOM 838 CB ALA A 92 36.497 110.282 164.908 1.00 62.25 C ATOM 839 H ALA A 92 37.687 110.007 162.260 1.00 0.00 H ATOM 840 N VAL A 93 36.295 107.348 164.963 1.00 64.32 N ATOM 841 CA VAL A 93 35.678 106.025 164.827 1.00 64.03 C ATOM 842 C VAL A 93 34.500 106.049 163.854 1.00 69.90 C ATOM 843 O VAL A 93 34.289 105.100 163.088 1.00 74.04 O ATOM 844 CB VAL A 93 35.265 105.516 166.225 1.00 62.22 C ATOM 845 CG1 VAL A 93 33.964 104.707 166.176 1.00 64.78 C ATOM 846 CG2 VAL A 93 36.395 104.711 166.878 1.00 56.69 C ATOM 847 H VAL A 93 36.301 107.802 165.899 1.00 0.00 H ATOM 848 N ALA A 94 33.772 107.166 163.794 1.00 67.71 N ATOM 849 CA ALA A 94 32.609 107.228 162.911 1.00 63.00 C ATOM 850 C ALA A 94 33.013 107.425 161.452 1.00 63.19 C ATOM 851 O ALA A 94 32.332 106.921 160.550 1.00 62.03 O ATOM 852 CB ALA A 94 31.668 108.336 163.382 1.00 64.71 C ATOM 853 H ALA A 94 34.031 107.990 164.374 1.00 0.00 H ATOM 854 N ASP A 95 34.131 108.107 161.200 1.00 61.97 N ATOM 855 CA ASP A 95 34.647 108.217 159.840 1.00 62.91 C ATOM 856 C ASP A 95 35.181 106.869 159.397 1.00 53.12 C ATOM 857 O ASP A 95 34.925 106.416 158.276 1.00 55.02 O ATOM 858 CB ASP A 95 35.766 109.266 159.769 1.00 73.60 C ATOM 859 CG ASP A 95 35.398 110.572 160.453 1.00 81.78 C ATOM 860 OD1 ASP A 95 34.250 111.025 160.299 1.00 83.83 O ATOM 861 OD2 ASP A 95 36.246 111.122 161.187 1.00 83.72 O ATOM 862 H ASP A 95 34.641 108.566 161.982 1.00 0.00 H ATOM 863 N PHE A 96 35.893 106.205 160.306 1.00 47.20 N ATOM 864 CA PHE A 96 36.508 104.910 160.049 1.00 45.82 C ATOM 865 C PHE A 96 35.541 103.883 159.465 1.00 40.98 C ATOM 866 O PHE A 96 35.823 103.286 158.425 1.00 36.77 O ATOM 867 CB PHE A 96 37.114 104.415 161.358 1.00 49.39 C ATOM 868 CG PHE A 96 37.626 103.024 161.295 1.00 52.97 C ATOM 869 CD1 PHE A 96 38.783 102.725 160.605 1.00 59.36 C ATOM 870 CD2 PHE A 96 36.940 102.003 161.931 1.00 48.25 C ATOM 871 CE1 PHE A 96 39.246 101.428 160.541 1.00 58.59 C ATOM 872 CE2 PHE A 96 37.401 100.706 161.875 1.00 52.24 C ATOM 873 CZ PHE A 96 38.558 100.420 161.178 1.00 54.37 C ATOM 874 H PHE A 96 36.016 106.633 161.246 1.00 0.00 H ATOM 875 N GLU A 97 34.386 103.678 160.096 1.00 39.24 N ATOM 876 CA GLU A 97 33.482 102.641 159.606 1.00 40.84 C ATOM 877 C GLU A 97 32.958 102.966 158.214 1.00 39.29 C ATOM 878 O GLU A 97 32.806 102.068 157.376 1.00 36.96 O ATOM 879 CB GLU A 97 32.346 102.435 160.591 1.00 49.58 C ATOM 880 CG GLU A 97 32.686 101.326 161.558 1.00 65.17 C ATOM 881 CD GLU A 97 31.631 101.076 162.601 1.00 72.52 C ATOM 882 OE1 GLU A 97 30.865 102.007 162.925 1.00 75.94 O ATOM 883 OE2 GLU A 97 31.572 99.928 163.088 1.00 69.05 O ATOM 884 H GLU A 97 34.131 104.249 160.927 1.00 0.00 H ATOM 885 N TYR A 98 32.741 104.242 157.921 1.00 34.58 N ATOM 886 CA TYR A 98 32.296 104.609 156.589 1.00 30.86 C ATOM 887 C TYR A 98 33.422 104.446 155.585 1.00 34.55 C ATOM 888 O TYR A 98 33.188 103.968 154.473 1.00 39.10 O ATOM 889 CB TYR A 98 31.795 106.059 156.584 1.00 33.37 C ATOM 890 CG TYR A 98 31.396 106.570 155.215 1.00 39.30 C ATOM 891 CD1 TYR A 98 30.374 105.971 154.500 1.00 41.03 C ATOM 892 CD2 TYR A 98 32.052 107.646 154.634 1.00 42.68 C ATOM 893 CE1 TYR A 98 30.003 106.435 153.251 1.00 41.35 C ATOM 894 CE2 TYR A 98 31.689 108.121 153.384 1.00 36.55 C ATOM 895 CZ TYR A 98 30.667 107.513 152.698 1.00 42.00 C ATOM 896 OH TYR A 98 30.298 107.970 151.453 1.00 46.93 O ATOM 897 HH TYR A 98 29.551 107.419 151.109 1.00 0.00 H ATOM 898 H TYR A 98 32.889 104.976 158.643 1.00 0.00 H ATOM 899 N GLU A 99 34.651 104.799 155.976 1.00 40.82 N ATOM 900 CA GLU A 99 35.819 104.632 155.115 1.00 38.98 C ATOM 901 C GLU A 99 36.046 103.173 154.743 1.00 36.34 C ATOM 902 O GLU A 99 36.601 102.888 153.680 1.00 39.32 O ATOM 903 CB GLU A 99 37.063 105.225 155.798 1.00 36.77 C ATOM 904 CG GLU A 99 37.047 106.737 155.943 1.00 37.40 C ATOM 905 CD GLU A 99 37.000 107.452 154.600 1.00 45.34 C ATOM 906 OE1 GLU A 99 37.411 106.861 153.584 1.00 48.81 O ATOM 907 OE2 GLU A 99 36.545 108.612 154.565 1.00 48.57 O ATOM 908 H GLU A 99 34.779 105.206 156.924 1.00 0.00 H ATOM 909 N MET A 100 35.628 102.246 155.590 1.00 41.22 N ATOM 910 CA MET A 100 35.762 100.823 155.309 1.00 44.42 C ATOM 911 C MET A 100 34.753 100.376 154.259 1.00 40.75 C ATOM 912 O MET A 100 35.107 99.643 153.331 1.00 36.22 O ATOM 913 CB MET A 100 35.566 100.013 156.592 1.00 47.10 C ATOM 914 CG MET A 100 36.423 100.502 157.724 1.00 62.62 C ATOM 915 SD MET A 100 38.074 99.807 157.685 1.00 74.60 S ATOM 916 CE MET A 100 37.670 98.212 158.405 1.00 66.74 C ATOM 917 H MET A 100 35.190 102.543 156.485 1.00 0.00 H ATOM 918 N GLN A 101 33.486 100.773 154.406 1.00 36.95 N ATOM 919 CA GLN A 101 32.494 100.469 153.382 1.00 35.17 C ATOM 920 C GLN A 101 32.971 101.035 152.052 1.00 37.84 C ATOM 921 O GLN A 101 32.891 100.377 151.006 1.00 42.88 O ATOM 922 CB GLN A 101 31.151 101.091 153.753 1.00 34.75 C ATOM 923 CG GLN A 101 30.771 100.921 155.191 1.00 37.93 C ATOM 924 CD GLN A 101 29.299 101.074 155.444 1.00 45.57 C ATOM 925 OE1 GLN A 101 28.620 101.851 154.773 1.00 47.35 O ATOM 926 NE2 GLN A 101 28.790 100.332 156.423 1.00 55.76 N ATOM 927 HE22 GLN A 101 29.405 99.690 156.962 1.00 0.00 H ATOM 928 HE21 GLN A 101 27.777 100.394 156.650 1.00 0.00 H ATOM 929 H GLN A 101 33.206 101.302 155.256 1.00 0.00 H ATOM 930 N LEU A 102 33.478 102.275 152.084 1.00 33.88 N ATOM 931 CA LEU A 102 33.982 102.896 150.867 1.00 35.24 C ATOM 932 C LEU A 102 35.108 102.069 150.251 1.00 34.36 C ATOM 933 O LEU A 102 35.036 101.674 149.073 1.00 31.15 O ATOM 934 CB LEU A 102 34.492 104.301 151.171 1.00 37.62 C ATOM 935 CG LEU A 102 33.854 105.396 150.341 1.00 38.60 C ATOM 936 CD1 LEU A 102 32.349 105.379 150.552 1.00 42.24 C ATOM 937 CD2 LEU A 102 34.458 106.712 150.761 1.00 38.16 C ATOM 938 H LEU A 102 33.512 102.797 152.983 1.00 0.00 H ATOM 939 N ALA A 103 36.145 101.787 151.030 1.00 34.35 N ATOM 940 CA ALA A 103 37.329 101.132 150.494 1.00 34.16 C ATOM 941 C ALA A 103 37.000 99.745 149.948 1.00 31.09 C ATOM 942 O ALA A 103 37.518 99.337 148.894 1.00 26.97 O ATOM 943 CB ALA A 103 38.404 101.074 151.569 1.00 26.43 C ATOM 944 H ALA A 103 36.111 102.038 152.039 1.00 0.00 H ATOM 945 N HIS A 104 36.128 99.015 150.644 1.00 25.93 N ATOM 946 CA HIS A 104 35.687 97.726 150.134 1.00 27.71 C ATOM 947 C HIS A 104 34.885 97.885 148.849 1.00 26.88 C ATOM 948 O HIS A 104 34.981 97.047 147.948 1.00 29.21 O ATOM 949 CB HIS A 104 34.879 96.989 151.196 1.00 25.50 C ATOM 950 CG HIS A 104 35.721 96.365 152.260 1.00 24.81 C ATOM 951 ND1 HIS A 104 35.686 96.778 153.574 1.00 24.81 N ATOM 952 CD2 HIS A 104 36.628 95.362 152.204 1.00 23.32 C ATOM 953 CE1 HIS A 104 36.525 96.050 154.286 1.00 24.72 C ATOM 954 NE2 HIS A 104 37.116 95.188 153.477 1.00 28.62 N ATOM 955 H HIS A 104 35.763 99.367 151.552 1.00 0.00 H ATOM 956 N MET A 105 34.078 98.944 148.748 1.00 29.71 N ATOM 957 CA MET A 105 33.365 99.197 147.500 1.00 33.35 C ATOM 958 C MET A 105 34.342 99.525 146.384 1.00 40.25 C ATOM 959 O MET A 105 34.241 98.980 145.277 1.00 44.11 O ATOM 960 CB MET A 105 32.361 100.332 147.682 1.00 28.91 C ATOM 961 CG MET A 105 31.433 100.564 146.493 1.00 30.48 C ATOM 962 SD MET A 105 30.666 99.075 145.820 1.00 31.97 S ATOM 963 CE MET A 105 29.285 98.876 146.940 1.00 26.37 C ATOM 964 H MET A 105 33.958 99.587 149.557 1.00 0.00 H ATOM 965 N ASN A 106 35.315 100.388 146.671 1.00 38.64 N ATOM 966 CA ASN A 106 36.318 100.730 145.676 1.00 34.54 C ATOM 967 C ASN A 106 37.178 99.524 145.324 1.00 40.32 C ATOM 968 O ASN A 106 37.620 99.395 144.176 1.00 35.91 O ATOM 969 CB ASN A 106 37.177 101.881 146.194 1.00 32.74 C ATOM 970 CG ASN A 106 36.483 103.223 146.079 1.00 32.25 C ATOM 971 OD1 ASN A 106 35.636 103.422 145.211 1.00 42.43 O ATOM 972 ND2 ASN A 106 36.827 104.150 146.969 1.00 28.14 N ATOM 973 HD22 ASN A 106 37.549 103.939 147.687 1.00 0.00 H ATOM 974 HD21 ASN A 106 36.374 105.086 146.947 1.00 0.00 H ATOM 975 H ASN A 106 35.358 100.821 147.616 1.00 0.00 H ATOM 976 N ARG A 107 37.403 98.617 146.282 1.00 38.68 N ATOM 977 CA ARG A 107 38.158 97.408 145.971 1.00 38.31 C ATOM 978 C ARG A 107 37.367 96.503 145.039 1.00 37.77 C ATOM 979 O ARG A 107 37.925 95.931 144.097 1.00 44.51 O ATOM 980 CB ARG A 107 38.523 96.655 147.253 1.00 42.21 C ATOM 981 CG ARG A 107 39.642 95.637 147.073 1.00 38.65 C ATOM 982 CD ARG A 107 40.029 94.999 148.388 1.00 33.24 C ATOM 983 NE ARG A 107 40.999 95.788 149.137 1.00 34.53 N ATOM 984 CZ ARG A 107 41.212 95.655 150.444 1.00 34.50 C ATOM 985 NH1 ARG A 107 40.519 94.764 151.142 1.00 27.22 N ATOM 986 NH2 ARG A 107 42.116 96.414 151.052 1.00 35.30 N ATOM 987 HE ARG A 107 41.558 96.497 148.620 1.00 0.00 H ATOM 988 HH12 ARG A 107 40.685 94.660 152.163 1.00 0.00 H ATOM 989 HH11 ARG A 107 39.809 94.170 150.668 1.00 0.00 H ATOM 990 HH22 ARG A 107 42.281 96.309 152.073 1.00 0.00 H ATOM 991 HH21 ARG A 107 42.659 97.114 150.507 1.00 0.00 H ATOM 992 H ARG A 107 37.041 98.773 147.244 1.00 0.00 H ATOM 993 N HIS A 108 36.062 96.372 145.287 1.00 35.13 N ATOM 994 CA HIS A 108 35.187 95.633 144.384 1.00 35.20 C ATOM 995 C HIS A 108 35.247 96.180 142.963 1.00 36.97 C ATOM 996 O HIS A 108 35.298 95.414 141.995 1.00 43.08 O ATOM 997 CB HIS A 108 33.752 95.693 144.895 1.00 34.64 C ATOM 998 CG HIS A 108 32.760 95.081 143.956 1.00 42.29 C ATOM 999 ND1 HIS A 108 32.566 93.719 143.867 1.00 41.38 N ATOM 1000 CD2 HIS A 108 31.932 95.642 143.042 1.00 39.77 C ATOM 1001 CE1 HIS A 108 31.643 93.469 142.954 1.00 38.22 C ATOM 1002 NE2 HIS A 108 31.245 94.618 142.438 1.00 39.44 N ATOM 1003 H HIS A 108 35.661 96.806 146.143 1.00 0.00 H ATOM 1004 N LEU A 109 35.215 97.502 142.816 1.00 37.53 N ATOM 1005 CA LEU A 109 35.156 98.119 141.499 1.00 38.29 C ATOM 1006 C LEU A 109 36.515 98.156 140.813 1.00 38.90 C ATOM 1007 O LEU A 109 36.583 98.117 139.581 1.00 43.94 O ATOM 1008 CB LEU A 109 34.576 99.527 141.624 1.00 36.47 C ATOM 1009 CG LEU A 109 33.162 99.521 142.208 1.00 37.86 C ATOM 1010 CD1 LEU A 109 32.746 100.898 142.683 1.00 34.89 C ATOM 1011 CD2 LEU A 109 32.179 98.978 141.178 1.00 41.23 C ATOM 1012 H LEU A 109 35.233 98.108 143.661 1.00 0.00 H ATOM 1013 N MET A 110 37.597 98.220 141.584 1.00 43.23 N ATOM 1014 CA MET A 110 38.950 98.274 141.032 1.00 39.33 C ATOM 1015 C MET A 110 39.864 97.560 142.012 1.00 40.56 C ATOM 1016 O MET A 110 40.456 98.181 142.905 1.00 37.50 O ATOM 1017 CB MET A 110 39.408 99.712 140.795 1.00 36.26 C ATOM 1018 CG MET A 110 40.623 99.869 139.898 1.00 36.02 C ATOM 1019 SD MET A 110 41.046 101.607 139.677 1.00 35.71 S ATOM 1020 CE MET A 110 42.804 101.497 139.378 1.00 36.47 C ATOM 1021 H MET A 110 37.476 98.232 142.617 1.00 0.00 H ATOM 1022 N PRO A 111 40.000 96.238 141.876 1.00 43.08 N ATOM 1023 CA PRO A 111 40.790 95.469 142.853 1.00 41.36 C ATOM 1024 C PRO A 111 42.217 95.953 143.039 1.00 39.42 C ATOM 1025 O PRO A 111 42.739 95.863 144.155 1.00 48.47 O ATOM 1026 CB PRO A 111 40.746 94.048 142.274 1.00 40.99 C ATOM 1027 CG PRO A 111 39.431 94.002 141.556 1.00 42.36 C ATOM 1028 CD PRO A 111 39.311 95.358 140.913 1.00 42.14 C ATOM 1029 N GLU A 112 42.873 96.458 141.999 1.00 40.77 N ATOM 1030 CA GLU A 112 44.262 96.873 142.153 1.00 42.41 C ATOM 1031 C GLU A 112 44.398 98.275 142.729 1.00 44.85 C ATOM 1032 O GLU A 112 45.524 98.741 142.922 1.00 56.21 O ATOM 1033 CB GLU A 112 44.996 96.796 140.812 1.00 43.92 C ATOM 1034 CG GLU A 112 44.638 97.897 139.823 1.00 46.70 C ATOM 1035 CD GLU A 112 43.328 97.662 139.096 1.00 52.12 C ATOM 1036 OE1 GLU A 112 42.549 96.775 139.514 1.00 48.49 O ATOM 1037 OE2 GLU A 112 43.085 98.366 138.090 1.00 58.91 O ATOM 1038 H GLU A 112 42.397 96.557 141.079 1.00 0.00 H ATOM 1039 N LEU A 113 43.294 98.952 143.020 1.00 39.72 N ATOM 1040 CA LEU A 113 43.341 100.275 143.626 1.00 41.80 C ATOM 1041 C LEU A 113 43.282 100.087 145.134 1.00 38.38 C ATOM 1042 O LEU A 113 42.236 99.729 145.688 1.00 34.96 O ATOM 1043 CB LEU A 113 42.184 101.140 143.126 1.00 39.63 C ATOM 1044 CG LEU A 113 42.045 102.511 143.790 1.00 29.32 C ATOM 1045 CD1 LEU A 113 43.187 103.439 143.399 1.00 22.75 C ATOM 1046 CD2 LEU A 113 40.696 103.114 143.474 1.00 24.17 C ATOM 1047 H LEU A 113 42.369 98.525 142.809 1.00 0.00 H ATOM 1048 N GLU A 114 44.388 100.383 145.797 1.00 35.44 N ATOM 1049 CA GLU A 114 44.562 100.074 147.205 1.00 33.82 C ATOM 1050 C GLU A 114 44.300 101.326 148.030 1.00 32.86 C ATOM 1051 O GLU A 114 44.884 102.380 147.765 1.00 44.59 O ATOM 1052 CB GLU A 114 45.982 99.549 147.435 1.00 34.12 C ATOM 1053 CG GLU A 114 46.205 98.726 148.688 1.00 43.97 C ATOM 1054 CD GLU A 114 45.318 97.504 148.762 1.00 44.54 C ATOM 1055 OE1 GLU A 114 45.364 96.669 147.827 1.00 42.65 O ATOM 1056 OE2 GLU A 114 44.580 97.382 149.761 1.00 45.78 O ATOM 1057 H GLU A 114 45.163 100.856 145.290 1.00 0.00 H ATOM 1058 N SER A 115 43.435 101.208 149.032 1.00 32.96 N ATOM 1059 CA SER A 115 43.133 102.316 149.931 1.00 32.67 C ATOM 1060 C SER A 115 44.127 102.321 151.085 1.00 39.39 C ATOM 1061 O SER A 115 44.384 101.279 151.700 1.00 48.85 O ATOM 1062 CB SER A 115 41.706 102.208 150.473 1.00 32.01 C ATOM 1063 OG SER A 115 40.744 102.647 149.529 1.00 33.76 O ATOM 1064 HG SER A 115 39.838 102.561 149.918 1.00 0.00 H ATOM 1065 H SER A 115 42.958 100.296 149.180 1.00 0.00 H ATOM 1066 N VAL A 116 44.700 103.486 151.369 1.00 35.40 N ATOM 1067 CA VAL A 116 45.625 103.632 152.484 1.00 41.15 C ATOM 1068 C VAL A 116 45.186 104.822 153.322 1.00 36.91 C ATOM 1069 O VAL A 116 44.742 105.849 152.796 1.00 37.96 O ATOM 1070 CB VAL A 116 47.095 103.783 152.030 1.00 42.04 C ATOM 1071 CG1 VAL A 116 47.426 102.761 150.960 1.00 49.73 C ATOM 1072 CG2 VAL A 116 47.388 105.184 151.553 1.00 35.97 C ATOM 1073 H VAL A 116 44.482 104.315 150.780 1.00 0.00 H ATOM 1074 N PHE A 117 45.287 104.669 154.631 1.00 34.09 N ATOM 1075 CA PHE A 117 44.774 105.648 155.565 1.00 32.51 C ATOM 1076 C PHE A 117 45.928 106.293 156.307 1.00 34.21 C ATOM 1077 O PHE A 117 46.776 105.605 156.890 1.00 34.12 O ATOM 1078 CB PHE A 117 43.780 105.003 156.525 1.00 34.06 C ATOM 1079 CG PHE A 117 42.618 104.354 155.830 1.00 41.36 C ATOM 1080 CD1 PHE A 117 41.489 105.095 155.497 1.00 46.15 C ATOM 1081 CD2 PHE A 117 42.661 103.016 155.483 1.00 36.76 C ATOM 1082 CE1 PHE A 117 40.417 104.504 154.840 1.00 45.74 C ATOM 1083 CE2 PHE A 117 41.595 102.417 154.829 1.00 40.84 C ATOM 1084 CZ PHE A 117 40.469 103.161 154.509 1.00 44.85 C ATOM 1085 H PHE A 117 45.751 103.816 155.002 1.00 0.00 H ATOM 1086 N LEU A 118 45.972 107.607 156.242 1.00 30.45 N ATOM 1087 CA LEU A 118 46.936 108.390 156.979 1.00 29.94 C ATOM 1088 C LEU A 118 46.231 109.023 158.163 1.00 32.68 C ATOM 1089 O LEU A 118 45.014 109.218 158.163 1.00 33.68 O ATOM 1090 CB LEU A 118 47.553 109.476 156.093 1.00 33.43 C ATOM 1091 CG LEU A 118 48.296 109.020 154.837 1.00 34.16 C ATOM 1092 CD1 LEU A 118 48.998 110.193 154.171 1.00 32.02 C ATOM 1093 CD2 LEU A 118 49.294 107.936 155.185 1.00 34.92 C ATOM 1094 H LEU A 118 45.286 108.101 155.636 1.00 0.00 H ATOM 1095 N MET A 119 47.006 109.342 159.170 1.00 33.36 N ATOM 1096 CA MET A 119 46.464 109.890 160.388 1.00 38.02 C ATOM 1097 C MET A 119 46.937 111.331 160.509 1.00 42.48 C ATOM 1098 O MET A 119 48.142 111.584 160.378 1.00 40.64 O ATOM 1099 CB MET A 119 46.927 109.066 161.585 1.00 40.64 C ATOM 1100 CG MET A 119 46.423 109.544 162.916 1.00 54.32 C ATOM 1101 SD MET A 119 47.324 108.676 164.207 1.00 59.64 S ATOM 1102 CE MET A 119 48.925 109.478 164.060 1.00 54.26 C ATOM 1103 H MET A 119 48.033 109.197 159.089 1.00 0.00 H ATOM 1104 N PRO A 120 46.060 112.305 160.700 1.00 43.77 N ATOM 1105 CA PRO A 120 46.501 113.696 160.716 1.00 42.19 C ATOM 1106 C PRO A 120 47.189 113.970 162.047 1.00 39.57 C ATOM 1107 O PRO A 120 47.127 113.177 162.983 1.00 38.18 O ATOM 1108 CB PRO A 120 45.195 114.473 160.617 1.00 43.32 C ATOM 1109 CG PRO A 120 44.234 113.587 161.387 1.00 42.79 C ATOM 1110 CD PRO A 120 44.607 112.201 160.911 1.00 41.67 C ATOM 1111 N SER A 121 47.818 115.134 162.131 1.00 35.25 N ATOM 1112 CA SER A 121 48.397 115.568 163.391 1.00 34.20 C ATOM 1113 C SER A 121 47.293 115.810 164.429 1.00 31.88 C ATOM 1114 O SER A 121 46.129 116.024 164.101 1.00 31.32 O ATOM 1115 CB SER A 121 49.249 116.821 163.151 1.00 32.38 C ATOM 1116 OG SER A 121 49.249 117.724 164.236 1.00 43.29 O ATOM 1117 HG SER A 121 49.815 118.505 164.014 1.00 0.00 H ATOM 1118 H SER A 121 47.898 115.740 161.290 1.00 0.00 H ATOM 1119 N LYS A 122 47.668 115.749 165.707 1.00 36.94 N ATOM 1120 CA LYS A 122 46.701 116.017 166.773 1.00 38.38 C ATOM 1121 C LYS A 122 46.065 117.393 166.591 1.00 34.37 C ATOM 1122 O LYS A 122 44.884 117.591 166.903 1.00 30.05 O ATOM 1123 CB LYS A 122 47.373 115.901 168.142 1.00 43.68 C ATOM 1124 CG LYS A 122 48.258 114.666 168.316 1.00 54.87 C ATOM 1125 CD LYS A 122 48.639 114.453 169.772 1.00 53.62 C ATOM 1126 CE LYS A 122 49.687 115.458 170.220 1.00 53.41 C ATOM 1127 NZ LYS A 122 50.997 115.320 169.512 1.00 59.28 N ATOM 1128 HZ1 LYS A 122 51.385 114.371 169.685 1.00 0.00 H ATOM 1129 HZ2 LYS A 122 50.854 115.457 168.491 1.00 0.00 H ATOM 1130 HZ3 LYS A 122 51.660 116.037 169.869 1.00 0.00 H ATOM 1131 H LYS A 122 48.651 115.510 165.948 1.00 0.00 H ATOM 1132 N GLU A 123 46.841 118.359 166.092 1.00 30.18 N ATOM 1133 CA GLU A 123 46.379 119.719 165.817 1.00 29.88 C ATOM 1134 C GLU A 123 45.048 119.741 165.066 1.00 30.72 C ATOM 1135 O GLU A 123 44.158 120.529 165.407 1.00 34.59 O ATOM 1136 CB GLU A 123 47.457 120.466 165.031 1.00 32.15 C ATOM 1137 CG GLU A 123 47.426 121.973 165.161 1.00 34.00 C ATOM 1138 CD GLU A 123 47.209 122.424 166.599 1.00 42.43 C ATOM 1139 OE1 GLU A 123 47.852 121.869 167.520 1.00 46.80 O ATOM 1140 OE2 GLU A 123 46.395 123.350 166.809 1.00 41.76 O ATOM 1141 H GLU A 123 47.834 118.130 165.886 1.00 0.00 H ATOM 1142 N TRP A 124 44.898 118.868 164.064 1.00 29.17 N ATOM 1143 CA TRP A 124 43.729 118.799 163.186 1.00 34.07 C ATOM 1144 C TRP A 124 42.867 117.563 163.432 1.00 37.31 C ATOM 1145 O TRP A 124 42.007 117.230 162.608 1.00 40.83 O ATOM 1146 CB TRP A 124 44.163 118.840 161.728 1.00 29.74 C ATOM 1147 CG TRP A 124 45.327 119.752 161.517 1.00 29.44 C ATOM 1148 CD1 TRP A 124 46.564 119.412 161.053 1.00 27.42 C ATOM 1149 CD2 TRP A 124 45.383 121.153 161.811 1.00 31.20 C ATOM 1150 NE1 TRP A 124 47.376 120.517 161.011 1.00 29.29 N ATOM 1151 CE2 TRP A 124 46.678 121.599 161.475 1.00 35.09 C ATOM 1152 CE3 TRP A 124 44.461 122.078 162.313 1.00 30.32 C ATOM 1153 CZ2 TRP A 124 47.075 122.930 161.629 1.00 39.72 C ATOM 1154 CZ3 TRP A 124 44.858 123.394 162.467 1.00 39.40 C ATOM 1155 CH2 TRP A 124 46.152 123.810 162.127 1.00 41.10 C ATOM 1156 HE1 TRP A 124 48.362 120.530 160.680 1.00 0.00 H ATOM 1157 H TRP A 124 45.668 118.189 163.897 1.00 0.00 H ATOM 1158 N SER A 125 43.067 116.873 164.546 1.00 40.30 N ATOM 1159 CA SER A 125 42.337 115.632 164.792 1.00 39.58 C ATOM 1160 C SER A 125 40.885 115.850 165.205 1.00 36.58 C ATOM 1161 O SER A 125 40.158 114.870 165.376 1.00 36.75 O ATOM 1162 CB SER A 125 43.055 114.802 165.865 1.00 39.97 C ATOM 1163 OG SER A 125 44.068 114.007 165.281 1.00 52.68 O ATOM 1164 HG SER A 125 44.728 114.593 164.832 1.00 0.00 H ATOM 1165 H SER A 125 43.749 117.218 165.251 1.00 0.00 H ATOM 1166 N PHE A 126 40.437 117.094 165.370 1.00 39.78 N ATOM 1167 CA PHE A 126 39.073 117.352 165.819 1.00 36.66 C ATOM 1168 C PHE A 126 38.346 118.379 164.966 1.00 34.44 C ATOM 1169 O PHE A 126 37.310 118.893 165.395 1.00 34.67 O ATOM 1170 CB PHE A 126 39.056 117.798 167.286 1.00 41.82 C ATOM 1171 CG PHE A 126 39.680 116.806 168.218 1.00 42.11 C ATOM 1172 CD1 PHE A 126 38.943 115.740 168.711 1.00 40.65 C ATOM 1173 CD2 PHE A 126 41.010 116.926 168.589 1.00 40.47 C ATOM 1174 CE1 PHE A 126 39.522 114.817 169.560 1.00 42.12 C ATOM 1175 CE2 PHE A 126 41.594 116.007 169.437 1.00 41.11 C ATOM 1176 CZ PHE A 126 40.853 114.951 169.922 1.00 43.77 C ATOM 1177 H PHE A 126 41.071 117.895 165.175 1.00 0.00 H ATOM 1178 N ILE A 127 38.860 118.711 163.791 1.00 36.58 N ATOM 1179 CA ILE A 127 38.185 119.654 162.921 1.00 31.32 C ATOM 1180 C ILE A 127 37.674 118.915 161.697 1.00 30.52 C ATOM 1181 O ILE A 127 38.107 117.809 161.365 1.00 29.45 O ATOM 1182 CB ILE A 127 39.079 120.840 162.505 1.00 35.18 C ATOM 1183 CG1 ILE A 127 40.288 120.360 161.711 1.00 37.62 C ATOM 1184 CG2 ILE A 127 39.519 121.629 163.735 1.00 35.42 C ATOM 1185 CD1 ILE A 127 40.879 121.436 160.839 1.00 35.70 C ATOM 1186 H ILE A 127 39.761 118.289 163.488 1.00 0.00 H ATOM 1187 N SER A 128 36.726 119.556 161.027 1.00 34.90 N ATOM 1188 CA SER A 128 36.152 119.090 159.781 1.00 36.98 C ATOM 1189 C SER A 128 35.765 120.327 158.994 1.00 37.20 C ATOM 1190 O SER A 128 35.654 121.420 159.557 1.00 37.72 O ATOM 1191 CB SER A 128 34.932 118.198 160.019 1.00 34.68 C ATOM 1192 OG SER A 128 33.923 118.909 160.712 1.00 37.98 O ATOM 1193 HG SER A 128 33.143 118.316 160.856 1.00 0.00 H ATOM 1194 H SER A 128 36.372 120.451 161.421 1.00 0.00 H ATOM 1195 N SER A 129 35.566 120.153 157.684 1.00 36.28 N ATOM 1196 CA SER A 129 35.033 121.249 156.882 1.00 37.26 C ATOM 1197 C SER A 129 33.726 121.749 157.481 1.00 37.79 C ATOM 1198 O SER A 129 33.528 122.956 157.665 1.00 42.11 O ATOM 1199 CB SER A 129 34.818 120.789 155.438 1.00 40.47 C ATOM 1200 OG SER A 129 36.006 120.836 154.661 1.00 46.55 O ATOM 1201 HG SER A 129 36.345 121.766 154.635 1.00 0.00 H ATOM 1202 H SER A 129 35.790 119.240 157.238 1.00 0.00 H ATOM 1203 N SER A 130 32.851 120.816 157.860 1.00 36.07 N ATOM 1204 CA SER A 130 31.544 121.158 158.418 1.00 35.60 C ATOM 1205 C SER A 130 31.675 122.009 159.674 1.00 36.23 C ATOM 1206 O SER A 130 30.994 123.029 159.826 1.00 37.08 O ATOM 1207 CB SER A 130 30.778 119.870 158.723 1.00 38.41 C ATOM 1208 OG SER A 130 29.513 120.136 159.304 1.00 51.05 O ATOM 1209 HG SER A 130 29.049 119.281 159.487 1.00 0.00 H ATOM 1210 H SER A 130 33.107 119.813 157.755 1.00 0.00 H ATOM 1211 N LEU A 131 32.549 121.596 160.591 1.00 35.28 N ATOM 1212 CA LEU A 131 32.680 122.279 161.870 1.00 32.20 C ATOM 1213 C LEU A 131 33.201 123.698 161.686 1.00 32.79 C ATOM 1214 O LEU A 131 32.659 124.649 162.264 1.00 25.82 O ATOM 1215 CB LEU A 131 33.623 121.484 162.761 1.00 31.45 C ATOM 1216 CG LEU A 131 33.724 121.981 164.201 1.00 37.56 C ATOM 1217 CD1 LEU A 131 32.434 121.597 164.879 1.00 35.18 C ATOM 1218 CD2 LEU A 131 34.932 121.392 164.917 1.00 39.84 C ATOM 1219 H LEU A 131 33.149 120.771 160.389 1.00 0.00 H ATOM 1220 N VAL A 132 34.238 123.858 160.867 1.00 30.79 N ATOM 1221 CA VAL A 132 34.795 125.175 160.602 1.00 30.51 C ATOM 1222 C VAL A 132 33.737 126.089 159.995 1.00 32.06 C ATOM 1223 O VAL A 132 33.589 127.244 160.409 1.00 34.52 O ATOM 1224 CB VAL A 132 36.032 125.027 159.698 1.00 26.33 C ATOM 1225 CG1 VAL A 132 36.527 126.386 159.217 1.00 20.91 C ATOM 1226 CG2 VAL A 132 37.154 124.259 160.418 1.00 25.39 C ATOM 1227 H VAL A 132 34.658 123.025 160.408 1.00 0.00 H ATOM 1228 N LYS A 133 32.940 125.569 159.053 1.00 35.09 N ATOM 1229 CA LYS A 133 31.915 126.394 158.416 1.00 35.15 C ATOM 1230 C LYS A 133 30.868 126.866 159.422 1.00 36.24 C ATOM 1231 O LYS A 133 30.486 128.042 159.416 1.00 33.82 O ATOM 1232 CB LYS A 133 31.263 125.620 157.274 1.00 32.39 C ATOM 1233 CG LYS A 133 32.021 125.699 155.959 1.00 34.56 C ATOM 1234 CD LYS A 133 31.323 124.950 154.845 1.00 36.80 C ATOM 1235 CE LYS A 133 31.214 123.469 155.181 1.00 38.91 C ATOM 1236 NZ LYS A 133 30.538 122.687 154.108 1.00 39.50 N ATOM 1237 HZ1 LYS A 133 29.576 123.055 153.967 1.00 0.00 H ATOM 1238 HZ2 LYS A 133 31.078 122.776 153.224 1.00 0.00 H ATOM 1239 HZ3 LYS A 133 30.490 121.686 154.388 1.00 0.00 H ATOM 1240 H LYS A 133 33.051 124.573 158.773 1.00 0.00 H ATOM 1241 N GLU A 134 30.419 125.977 160.318 1.00 35.43 N ATOM 1242 CA GLU A 134 29.426 126.376 161.314 1.00 39.75 C ATOM 1243 C GLU A 134 29.985 127.456 162.234 1.00 44.60 C ATOM 1244 O GLU A 134 29.275 128.409 162.586 1.00 43.86 O ATOM 1245 CB GLU A 134 28.944 125.159 162.109 1.00 46.27 C ATOM 1246 CG GLU A 134 27.691 125.405 162.969 1.00 54.23 C ATOM 1247 CD GLU A 134 26.497 125.937 162.165 1.00 70.47 C ATOM 1248 OE1 GLU A 134 26.351 125.586 160.971 1.00 71.99 O ATOM 1249 OE2 GLU A 134 25.695 126.710 162.734 1.00 71.79 O ATOM 1250 H GLU A 134 30.778 125.001 160.305 1.00 0.00 H ATOM 1251 N VAL A 135 31.255 127.321 162.634 1.00 38.32 N ATOM 1252 CA VAL A 135 31.896 128.331 163.472 1.00 31.04 C ATOM 1253 C VAL A 135 31.985 129.659 162.737 1.00 31.20 C ATOM 1254 O VAL A 135 31.766 130.724 163.324 1.00 33.12 O ATOM 1255 CB VAL A 135 33.289 127.853 163.915 1.00 23.02 C ATOM 1256 CG1 VAL A 135 34.067 129.013 164.530 1.00 24.32 C ATOM 1257 CG2 VAL A 135 33.177 126.723 164.920 1.00 21.23 C ATOM 1258 H VAL A 135 31.795 126.481 162.343 1.00 0.00 H ATOM 1259 N ALA A 136 32.267 129.621 161.436 1.00 27.42 N ATOM 1260 CA ALA A 136 32.383 130.851 160.665 1.00 24.80 C ATOM 1261 C ALA A 136 31.022 131.504 160.428 1.00 26.86 C ATOM 1262 O ALA A 136 30.951 132.726 160.267 1.00 30.48 O ATOM 1263 CB ALA A 136 33.091 130.569 159.336 1.00 23.18 C ATOM 1264 H ALA A 136 32.406 128.704 160.966 1.00 0.00 H ATOM 1265 N ARG A 137 29.941 130.727 160.425 1.00 29.13 N ATOM 1266 CA ARG A 137 28.606 131.303 160.272 1.00 36.00 C ATOM 1267 C ARG A 137 28.233 132.165 161.462 1.00 39.14 C ATOM 1268 O ARG A 137 27.397 133.064 161.344 1.00 41.22 O ATOM 1269 CB ARG A 137 27.550 130.215 160.109 1.00 41.28 C ATOM 1270 CG ARG A 137 27.385 129.722 158.715 1.00 43.64 C ATOM 1271 CD ARG A 137 26.391 128.593 158.684 1.00 49.50 C ATOM 1272 NE ARG A 137 26.571 127.803 157.476 1.00 58.03 N ATOM 1273 CZ ARG A 137 26.911 126.518 157.468 1.00 66.19 C ATOM 1274 NH1 ARG A 137 27.071 125.886 156.312 1.00 69.42 N ATOM 1275 NH2 ARG A 137 27.069 125.858 158.611 1.00 68.30 N ATOM 1276 HE ARG A 137 26.424 128.274 156.560 1.00 0.00 H ATOM 1277 HH12 ARG A 137 27.337 124.881 156.301 1.00 0.00 H ATOM 1278 HH11 ARG A 137 26.930 126.396 155.417 1.00 0.00 H ATOM 1279 HH22 ARG A 137 27.335 124.853 158.598 1.00 0.00 H ATOM 1280 HH21 ARG A 137 26.927 126.347 159.518 1.00 0.00 H ATOM 1281 H ARG A 137 30.047 129.698 160.533 1.00 0.00 H ATOM 1282 N HIS A 138 28.835 131.910 162.612 1.00 41.71 N ATOM 1283 CA HIS A 138 28.564 132.689 163.806 1.00 38.08 C ATOM 1284 C HIS A 138 29.697 133.681 164.056 1.00 40.70 C ATOM 1285 O HIS A 138 29.915 134.126 165.182 1.00 42.99 O ATOM 1286 CB HIS A 138 28.347 131.735 164.983 1.00 38.40 C ATOM 1287 CG HIS A 138 27.169 130.816 164.806 1.00 39.64 C ATOM 1288 ND1 HIS A 138 25.861 131.240 164.896 1.00 45.20 N ATOM 1289 CD2 HIS A 138 27.113 129.492 164.523 1.00 43.92 C ATOM 1290 CE1 HIS A 138 25.053 130.216 164.691 1.00 43.97 C ATOM 1291 NE2 HIS A 138 25.787 129.145 164.460 1.00 44.21 N ATOM 1292 H HIS A 138 29.521 131.130 162.662 1.00 0.00 H ATOM 1293 N GLN A 139 30.416 134.042 162.992 1.00 43.36 N ATOM 1294 CA GLN A 139 31.511 135.011 163.016 1.00 47.38 C ATOM 1295 C GLN A 139 32.629 134.602 163.967 1.00 43.06 C ATOM 1296 O GLN A 139 33.359 135.459 164.473 1.00 39.40 O ATOM 1297 CB GLN A 139 31.024 136.427 163.332 1.00 55.89 C ATOM 1298 CG GLN A 139 30.313 137.150 162.185 1.00 68.90 C ATOM 1299 CD GLN A 139 28.979 136.538 161.824 1.00 82.91 C ATOM 1300 OE1 GLN A 139 28.073 136.470 162.654 1.00 95.34 O ATOM 1301 NE2 GLN A 139 28.846 136.092 160.580 1.00 86.76 N ATOM 1302 HE22 GLN A 139 29.639 136.170 159.912 1.00 0.00 H ATOM 1303 HE21 GLN A 139 27.949 135.665 160.274 1.00 0.00 H ATOM 1304 H GLN A 139 30.181 133.603 162.079 1.00 0.00 H ATOM 1305 N GLY A 140 32.844 133.301 164.147 1.00 33.63 N ATOM 1306 CA GLY A 140 33.922 132.840 164.995 1.00 32.74 C ATOM 1307 C GLY A 140 35.234 132.723 164.239 1.00 35.72 C ATOM 1308 O GLY A 140 35.261 132.507 163.032 1.00 33.27 O ATOM 1309 H GLY A 140 32.230 132.608 163.673 1.00 0.00 H ATOM 1310 N ASP A 141 36.330 132.875 164.983 1.00 36.16 N ATOM 1311 CA ASP A 141 37.672 132.887 164.407 1.00 33.30 C ATOM 1312 C ASP A 141 38.067 131.479 163.943 1.00 32.08 C ATOM 1313 O ASP A 141 38.222 130.557 164.757 1.00 35.21 O ATOM 1314 CB ASP A 141 38.666 133.423 165.435 1.00 34.88 C ATOM 1315 CG ASP A 141 40.019 133.767 164.827 1.00 43.05 C ATOM 1316 OD1 ASP A 141 40.171 133.676 163.599 1.00 45.79 O ATOM 1317 OD2 ASP A 141 40.955 134.103 165.570 1.00 48.69 O ATOM 1318 H ASP A 141 36.225 132.989 166.011 1.00 0.00 H ATOM 1319 N VAL A 142 38.248 131.307 162.632 1.00 28.82 N ATOM 1320 CA VAL A 142 38.687 130.056 162.023 1.00 32.20 C ATOM 1321 C VAL A 142 40.041 130.212 161.342 1.00 36.58 C ATOM 1322 O VAL A 142 40.482 129.307 160.631 1.00 38.48 O ATOM 1323 CB VAL A 142 37.631 129.508 161.036 1.00 31.74 C ATOM 1324 CG1 VAL A 142 36.340 129.095 161.765 1.00 36.21 C ATOM 1325 CG2 VAL A 142 37.320 130.530 159.961 1.00 26.90 C ATOM 1326 H VAL A 142 38.064 132.116 162.005 1.00 0.00 H ATOM 1327 N THR A 143 40.726 131.329 161.611 1.00 34.58 N ATOM 1328 CA THR A 143 42.053 131.618 161.078 1.00 33.61 C ATOM 1329 C THR A 143 43.015 130.454 161.276 1.00 32.12 C ATOM 1330 O THR A 143 43.785 130.110 160.371 1.00 29.34 O ATOM 1331 CB THR A 143 42.587 132.863 161.797 1.00 41.52 C ATOM 1332 OG1 THR A 143 42.137 134.053 161.135 1.00 48.80 O ATOM 1333 CG2 THR A 143 44.123 132.870 161.926 1.00 57.26 C ATOM 1334 HG1 THR A 143 42.489 134.847 161.610 1.00 0.00 H ATOM 1335 H THR A 143 40.286 132.033 162.237 1.00 0.00 H ATOM 1336 N HIS A 144 42.968 129.818 162.446 1.00 32.54 N ATOM 1337 CA HIS A 144 43.904 128.747 162.778 1.00 32.78 C ATOM 1338 C HIS A 144 43.697 127.477 161.959 1.00 29.34 C ATOM 1339 O HIS A 144 44.641 126.698 161.810 1.00 29.90 O ATOM 1340 CB HIS A 144 43.783 128.414 164.265 1.00 36.11 C ATOM 1341 CG HIS A 144 44.789 127.415 164.752 1.00 43.44 C ATOM 1342 ND1 HIS A 144 46.148 127.652 164.727 1.00 43.37 N ATOM 1343 CD2 HIS A 144 44.633 126.168 165.254 1.00 41.44 C ATOM 1344 CE1 HIS A 144 46.781 126.600 165.208 1.00 43.99 C ATOM 1345 NE2 HIS A 144 45.885 125.686 165.533 1.00 45.96 N ATOM 1346 H HIS A 144 42.245 130.092 163.142 1.00 0.00 H ATOM 1347 N PHE A 145 42.520 127.261 161.386 1.00 29.95 N ATOM 1348 CA PHE A 145 42.171 125.983 160.765 1.00 28.52 C ATOM 1349 C PHE A 145 42.265 125.984 159.244 1.00 30.26 C ATOM 1350 O PHE A 145 42.108 124.924 158.624 1.00 34.29 O ATOM 1351 CB PHE A 145 40.757 125.592 161.182 1.00 28.22 C ATOM 1352 CG PHE A 145 40.548 125.667 162.656 1.00 31.87 C ATOM 1353 CD1 PHE A 145 41.220 124.794 163.501 1.00 29.67 C ATOM 1354 CD2 PHE A 145 39.754 126.648 163.216 1.00 31.15 C ATOM 1355 CE1 PHE A 145 41.062 124.869 164.867 1.00 28.55 C ATOM 1356 CE2 PHE A 145 39.598 126.737 164.593 1.00 32.15 C ATOM 1357 CZ PHE A 145 40.251 125.843 165.416 1.00 32.48 C ATOM 1358 H PHE A 145 41.819 128.029 161.378 1.00 0.00 H ATOM 1359 N LEU A 146 42.540 127.123 158.625 1.00 35.22 N ATOM 1360 CA LEU A 146 42.423 127.217 157.184 1.00 36.36 C ATOM 1361 C LEU A 146 43.654 127.863 156.576 1.00 42.04 C ATOM 1362 O LEU A 146 44.344 128.651 157.235 1.00 46.93 O ATOM 1363 CB LEU A 146 41.183 128.029 156.793 1.00 36.00 C ATOM 1364 CG LEU A 146 39.861 127.479 157.309 1.00 35.62 C ATOM 1365 CD1 LEU A 146 38.790 128.464 156.960 1.00 39.24 C ATOM 1366 CD2 LEU A 146 39.551 126.114 156.708 1.00 31.76 C ATOM 1367 H LEU A 146 42.841 127.952 159.176 1.00 0.00 H ATOM 1368 N PRO A 147 43.965 127.527 155.328 1.00 40.23 N ATOM 1369 CA PRO A 147 44.928 128.332 154.579 1.00 39.53 C ATOM 1370 C PRO A 147 44.392 129.746 154.430 1.00 43.80 C ATOM 1371 O PRO A 147 43.178 129.969 154.404 1.00 43.10 O ATOM 1372 CB PRO A 147 45.024 127.612 153.227 1.00 40.31 C ATOM 1373 CG PRO A 147 44.541 126.220 153.493 1.00 38.01 C ATOM 1374 CD PRO A 147 43.536 126.325 154.598 1.00 37.46 C ATOM 1375 N GLU A 148 45.315 130.710 154.356 1.00 47.93 N ATOM 1376 CA GLU A 148 44.931 132.120 154.295 1.00 48.76 C ATOM 1377 C GLU A 148 43.952 132.391 153.158 1.00 45.48 C ATOM 1378 O GLU A 148 42.910 133.021 153.360 1.00 44.56 O ATOM 1379 CB GLU A 148 46.179 132.994 154.149 1.00 55.84 C ATOM 1380 H GLU A 148 46.323 130.453 154.342 1.00 0.00 H ATOM 1381 N ASN A 149 44.264 131.906 151.955 1.00 50.40 N ATOM 1382 CA ASN A 149 43.365 132.125 150.826 1.00 48.37 C ATOM 1383 C ASN A 149 41.993 131.518 151.077 1.00 44.96 C ATOM 1384 O ASN A 149 40.982 132.065 150.624 1.00 45.23 O ATOM 1385 CB ASN A 149 43.974 131.553 149.544 1.00 45.20 C ATOM 1386 CG ASN A 149 43.934 130.034 149.506 1.00 45.79 C ATOM 1387 OD1 ASN A 149 44.524 129.367 150.357 1.00 45.01 O ATOM 1388 ND2 ASN A 149 43.208 129.483 148.542 1.00 44.42 N ATOM 1389 HD22 ASN A 149 42.727 130.086 147.844 1.00 0.00 H ATOM 1390 HD21 ASN A 149 43.120 128.448 148.484 1.00 0.00 H ATOM 1391 H ASN A 149 45.147 131.372 151.822 1.00 0.00 H ATOM 1392 N VAL A 150 41.931 130.418 151.825 1.00 40.66 N ATOM 1393 CA VAL A 150 40.650 129.755 152.044 1.00 38.63 C ATOM 1394 C VAL A 150 39.852 130.469 153.119 1.00 38.31 C ATOM 1395 O VAL A 150 38.634 130.642 152.991 1.00 34.36 O ATOM 1396 CB VAL A 150 40.881 128.275 152.400 1.00 41.99 C ATOM 1397 CG1 VAL A 150 39.585 127.623 152.837 1.00 35.35 C ATOM 1398 CG2 VAL A 150 41.488 127.530 151.215 1.00 39.34 C ATOM 1399 H VAL A 150 42.796 130.031 152.253 1.00 0.00 H ATOM 1400 N HIS A 151 40.533 130.933 154.172 1.00 41.87 N ATOM 1401 CA HIS A 151 39.860 131.702 155.214 1.00 45.82 C ATOM 1402 C HIS A 151 39.360 133.017 154.648 1.00 47.27 C ATOM 1403 O HIS A 151 38.251 133.468 154.958 1.00 43.63 O ATOM 1404 CB HIS A 151 40.822 131.973 156.364 1.00 47.84 C ATOM 1405 CG HIS A 151 40.250 132.854 157.426 1.00 55.08 C ATOM 1406 ND1 HIS A 151 40.760 134.100 157.719 1.00 58.57 N ATOM 1407 CD2 HIS A 151 39.220 132.658 158.282 1.00 58.75 C ATOM 1408 CE1 HIS A 151 40.056 134.643 158.697 1.00 59.21 C ATOM 1409 NE2 HIS A 151 39.119 133.786 159.061 1.00 57.63 N ATOM 1410 H HIS A 151 41.553 130.744 154.249 1.00 0.00 H ATOM 1411 N GLN A 152 40.166 133.612 153.773 1.00 52.03 N ATOM 1412 CA GLN A 152 39.814 134.853 153.104 1.00 50.58 C ATOM 1413 C GLN A 152 38.565 134.667 152.260 1.00 48.85 C ATOM 1414 O GLN A 152 37.653 135.500 152.283 1.00 43.87 O ATOM 1415 CB GLN A 152 40.994 135.237 152.213 1.00 59.47 C ATOM 1416 CG GLN A 152 41.314 136.686 151.962 1.00 71.01 C ATOM 1417 CD GLN A 152 42.745 136.827 151.435 1.00 81.71 C ATOM 1418 OE1 GLN A 152 43.693 136.333 152.052 1.00 83.40 O ATOM 1419 NE2 GLN A 152 42.900 137.467 150.281 1.00 89.18 N ATOM 1420 HE22 GLN A 152 42.073 137.868 149.794 1.00 0.00 H ATOM 1421 HE21 GLN A 152 43.848 137.566 149.865 1.00 0.00 H ATOM 1422 H GLN A 152 41.084 133.172 153.559 1.00 0.00 H ATOM 1423 N ALA A 153 38.489 133.540 151.551 1.00 48.99 N ATOM 1424 CA ALA A 153 37.357 133.261 150.676 1.00 41.69 C ATOM 1425 C ALA A 153 36.127 132.822 151.455 1.00 46.63 C ATOM 1426 O ALA A 153 34.996 133.081 151.026 1.00 47.13 O ATOM 1427 CB ALA A 153 37.747 132.206 149.648 1.00 40.35 C ATOM 1428 H ALA A 153 39.257 132.842 151.624 1.00 0.00 H ATOM 1429 N LEU A 154 36.321 132.138 152.590 1.00 49.91 N ATOM 1430 CA LEU A 154 35.185 131.667 153.383 1.00 45.74 C ATOM 1431 C LEU A 154 34.435 132.831 154.014 1.00 48.88 C ATOM 1432 O LEU A 154 33.200 132.832 154.052 1.00 51.95 O ATOM 1433 CB LEU A 154 35.676 130.708 154.467 1.00 42.42 C ATOM 1434 CG LEU A 154 34.726 130.176 155.548 1.00 36.67 C ATOM 1435 CD1 LEU A 154 33.546 129.383 155.019 1.00 33.81 C ATOM 1436 CD2 LEU A 154 35.518 129.366 156.544 1.00 41.39 C ATOM 1437 H LEU A 154 37.290 131.939 152.911 1.00 0.00 H ATOM 1438 N MET A 155 35.162 133.840 154.496 1.00 48.21 N ATOM 1439 CA MET A 155 34.514 135.028 155.036 1.00 49.69 C ATOM 1440 C MET A 155 33.733 135.756 153.954 1.00 54.57 C ATOM 1441 O MET A 155 32.599 136.190 154.176 1.00 54.96 O ATOM 1442 CB MET A 155 35.558 135.945 155.654 1.00 51.71 C ATOM 1443 CG MET A 155 35.828 135.646 157.098 1.00 58.17 C ATOM 1444 SD MET A 155 36.730 136.994 157.841 1.00 70.56 S ATOM 1445 CE MET A 155 38.206 136.933 156.840 1.00 69.96 C ATOM 1446 H MET A 155 36.200 133.778 154.486 1.00 0.00 H ATOM 1447 N ALA A 156 34.327 135.899 152.769 1.00 56.53 N ATOM 1448 CA ALA A 156 33.634 136.577 151.681 1.00 52.89 C ATOM 1449 C ALA A 156 32.325 135.872 151.339 1.00 51.29 C ATOM 1450 O ALA A 156 31.297 136.518 151.121 1.00 55.40 O ATOM 1451 CB ALA A 156 34.545 136.657 150.459 1.00 50.12 C ATOM 1452 H ALA A 156 35.286 135.526 152.621 1.00 0.00 H ATOM 1453 N LYS A 157 32.331 134.537 151.334 1.00 55.35 N ATOM 1454 CA LYS A 157 31.121 133.797 150.979 1.00 59.26 C ATOM 1455 C LYS A 157 30.056 133.877 152.070 1.00 60.47 C ATOM 1456 O LYS A 157 28.862 133.769 151.773 1.00 58.11 O ATOM 1457 CB LYS A 157 31.476 132.341 150.687 1.00 56.78 C ATOM 1458 CG LYS A 157 30.343 131.523 150.104 1.00 55.36 C ATOM 1459 CD LYS A 157 30.436 131.472 148.599 1.00 57.75 C ATOM 1460 CE LYS A 157 29.176 130.877 147.998 1.00 65.33 C ATOM 1461 NZ LYS A 157 29.437 130.303 146.644 1.00 68.59 N ATOM 1462 HZ1 LYS A 157 29.783 131.053 146.012 1.00 0.00 H ATOM 1463 HZ2 LYS A 157 30.154 129.553 146.719 1.00 0.00 H ATOM 1464 HZ3 LYS A 157 28.556 129.905 146.262 1.00 0.00 H ATOM 1465 H LYS A 157 33.199 134.022 151.583 1.00 0.00 H ATOM 1466 N LEU A 158 30.453 134.075 153.326 1.00 64.96 N ATOM 1467 CA LEU A 158 29.485 134.178 154.414 1.00 67.33 C ATOM 1468 C LEU A 158 29.023 135.603 154.684 1.00 76.18 C ATOM 1469 O LEU A 158 28.072 135.786 155.451 1.00 79.46 O ATOM 1470 CB LEU A 158 30.035 133.567 155.705 1.00 57.05 C ATOM 1471 CG LEU A 158 30.078 132.043 155.709 1.00 53.05 C ATOM 1472 CD1 LEU A 158 30.685 131.556 156.999 1.00 49.88 C ATOM 1473 CD2 LEU A 158 28.680 131.479 155.524 1.00 48.38 C ATOM 1474 H LEU A 158 31.468 134.158 153.535 1.00 0.00 H ATOM 1475 N ALA A 159 29.686 136.607 154.113 1.00 74.70 N ATOM 1476 CA ALA A 159 29.284 138.000 154.298 1.00 77.13 C ATOM 1477 C ALA A 159 27.820 138.226 153.932 1.00 78.48 C ATOM 1478 O ALA A 159 27.073 138.869 154.674 1.00 79.10 O ATOM 1479 CB ALA A 159 30.174 138.919 153.465 1.00 78.44 C ATOM 1480 H ALA A 159 30.513 136.394 153.519 1.00 0.00 H TER 1481 ALA A 159 ATOM 1482 N LYS B 3 29.792 130.708 190.709 1.00 67.69 N ATOM 1483 CA LYS B 3 30.055 129.686 189.706 1.00 61.44 C ATOM 1484 C LYS B 3 28.848 129.490 188.789 1.00 56.89 C ATOM 1485 O LYS B 3 27.783 129.026 189.207 1.00 55.20 O ATOM 1486 CB LYS B 3 30.431 128.369 190.344 1.00 60.34 C ATOM 1487 CG LYS B 3 31.324 127.495 189.482 1.00 62.44 C ATOM 1488 CD LYS B 3 32.719 128.046 189.294 1.00 64.19 C ATOM 1489 CE LYS B 3 33.429 127.246 188.212 1.00 60.70 C ATOM 1490 NZ LYS B 3 34.741 127.819 187.811 1.00 61.14 N ATOM 1491 HZ1 LYS B 3 34.600 128.782 187.444 1.00 0.00 H ATOM 1492 HZ2 LYS B 3 35.371 127.851 188.638 1.00 0.00 H ATOM 1493 HZ3 LYS B 3 35.167 127.224 187.072 1.00 0.00 H ATOM 1494 HN3 LYS B 3 28.977 130.422 191.288 1.00 0.00 H ATOM 1495 HN2 LYS B 3 29.583 131.610 190.236 1.00 0.00 H ATOM 1496 HN1 LYS B 3 30.629 130.819 191.317 1.00 0.00 H ATOM 1497 N ARG B 4 29.074 129.826 187.522 1.00 49.40 N ATOM 1498 CA ARG B 4 28.038 129.939 186.520 1.00 46.91 C ATOM 1499 C ARG B 4 28.309 128.958 185.394 1.00 41.95 C ATOM 1500 O ARG B 4 29.375 128.995 184.791 1.00 42.21 O ATOM 1501 CB ARG B 4 27.996 131.370 185.990 1.00 47.85 C ATOM 1502 CG ARG B 4 27.326 132.335 186.938 1.00 43.38 C ATOM 1503 CD ARG B 4 27.540 133.739 186.443 1.00 41.15 C ATOM 1504 NE ARG B 4 26.705 134.028 185.288 1.00 46.77 N ATOM 1505 CZ ARG B 4 25.401 134.261 185.347 1.00 42.24 C ATOM 1506 NH1 ARG B 4 24.778 134.273 186.522 1.00 37.78 N ATOM 1507 NH2 ARG B 4 24.735 134.522 184.232 1.00 44.92 N ATOM 1508 HE ARG B 4 27.161 134.054 184.354 1.00 0.00 H ATOM 1509 HH12 ARG B 4 23.755 134.456 186.566 1.00 0.00 H ATOM 1510 HH11 ARG B 4 25.314 134.099 187.396 1.00 0.00 H ATOM 1511 HH22 ARG B 4 23.712 134.706 184.268 1.00 0.00 H ATOM 1512 HH21 ARG B 4 25.235 134.543 183.320 1.00 0.00 H ATOM 1513 H ARG B 4 30.055 130.019 187.235 1.00 0.00 H ATOM 1514 N ALA B 5 27.339 128.091 185.084 1.00 35.40 N ATOM 1515 CA ALA B 5 27.495 127.097 184.029 1.00 30.82 C ATOM 1516 C ALA B 5 26.377 127.259 183.001 1.00 28.23 C ATOM 1517 O ALA B 5 25.255 127.698 183.325 1.00 32.07 O ATOM 1518 CB ALA B 5 27.415 125.674 184.607 1.00 30.84 C ATOM 1519 H ALA B 5 26.444 128.127 185.613 1.00 0.00 H ATOM 1520 N ILE B 6 26.686 126.915 181.751 1.00 25.41 N ATOM 1521 CA ILE B 6 25.722 126.939 180.652 1.00 29.40 C ATOM 1522 C ILE B 6 25.500 125.519 180.155 1.00 35.30 C ATOM 1523 O ILE B 6 26.456 124.775 179.890 1.00 43.11 O ATOM 1524 CB ILE B 6 26.173 127.822 179.480 1.00 30.48 C ATOM 1525 CG1 ILE B 6 26.325 129.260 179.952 1.00 39.83 C ATOM 1526 CG2 ILE B 6 25.146 127.772 178.358 1.00 27.92 C ATOM 1527 CD1 ILE B 6 26.956 130.154 178.926 1.00 50.57 C ATOM 1528 H ILE B 6 27.661 126.615 181.547 1.00 0.00 H ATOM 1529 N TYR B 7 24.230 125.162 179.989 1.00 27.96 N ATOM 1530 CA TYR B 7 23.839 123.904 179.373 1.00 27.85 C ATOM 1531 C TYR B 7 23.220 124.269 178.038 1.00 31.61 C ATOM 1532 O TYR B 7 22.028 124.623 177.977 1.00 30.12 O ATOM 1533 CB TYR B 7 22.841 123.168 180.263 1.00 28.80 C ATOM 1534 CG TYR B 7 22.330 121.839 179.745 1.00 27.83 C ATOM 1535 CD1 TYR B 7 23.035 121.115 178.797 1.00 26.71 C ATOM 1536 CD2 TYR B 7 21.155 121.292 180.243 1.00 29.98 C ATOM 1537 CE1 TYR B 7 22.571 119.882 178.346 1.00 32.05 C ATOM 1538 CE2 TYR B 7 20.683 120.071 179.805 1.00 34.67 C ATOM 1539 CZ TYR B 7 21.390 119.368 178.860 1.00 35.65 C ATOM 1540 OH TYR B 7 20.898 118.153 178.444 1.00 34.92 O ATOM 1541 HH TYR B 7 21.508 117.766 177.767 1.00 0.00 H ATOM 1542 H TYR B 7 23.484 125.810 180.314 1.00 0.00 H ATOM 1543 N PRO B 8 23.971 124.221 176.943 1.00 30.45 N ATOM 1544 CA PRO B 8 23.411 124.646 175.657 1.00 28.52 C ATOM 1545 C PRO B 8 22.880 123.465 174.877 1.00 26.42 C ATOM 1546 O PRO B 8 23.283 122.324 175.128 1.00 27.37 O ATOM 1547 CB PRO B 8 24.607 125.280 174.956 1.00 30.20 C ATOM 1548 CG PRO B 8 25.759 124.436 175.437 1.00 31.24 C ATOM 1549 CD PRO B 8 25.423 124.019 176.866 1.00 25.50 C ATOM 1550 N GLY B 9 21.980 123.726 173.943 1.00 23.80 N ATOM 1551 CA GLY B 9 21.431 122.666 173.132 1.00 23.71 C ATOM 1552 C GLY B 9 20.321 123.210 172.263 1.00 26.33 C ATOM 1553 O GLY B 9 19.934 124.379 172.359 1.00 30.82 O ATOM 1554 H GLY B 9 21.665 124.705 173.792 1.00 0.00 H ATOM 1555 N THR B 10 19.821 122.330 171.396 1.00 24.15 N ATOM 1556 CA THR B 10 18.713 122.682 170.508 1.00 26.01 C ATOM 1557 C THR B 10 17.381 122.550 171.231 1.00 26.89 C ATOM 1558 O THR B 10 16.472 123.349 170.997 1.00 29.03 O ATOM 1559 CB THR B 10 18.773 121.829 169.231 1.00 31.71 C ATOM 1560 OG1 THR B 10 20.013 122.096 168.552 1.00 29.47 O ATOM 1561 CG2 THR B 10 17.622 122.143 168.271 1.00 39.05 C ATOM 1562 HG1 THR B 10 20.059 123.057 168.317 1.00 0.00 H ATOM 1563 H THR B 10 20.227 121.374 171.350 1.00 0.00 H ATOM 1564 N PHE B 11 17.271 121.582 172.137 1.00 26.97 N ATOM 1565 CA PHE B 11 16.072 121.324 172.948 1.00 27.68 C ATOM 1566 C PHE B 11 14.806 121.424 172.095 1.00 34.55 C ATOM 1567 O PHE B 11 13.932 122.263 172.309 1.00 36.75 O ATOM 1568 CB PHE B 11 16.014 122.270 174.158 1.00 25.89 C ATOM 1569 CG PHE B 11 17.279 122.279 174.988 1.00 29.42 C ATOM 1570 CD1 PHE B 11 17.618 121.195 175.777 1.00 27.86 C ATOM 1571 CD2 PHE B 11 18.125 123.385 174.989 1.00 31.72 C ATOM 1572 CE1 PHE B 11 18.791 121.207 176.532 1.00 28.80 C ATOM 1573 CE2 PHE B 11 19.291 123.395 175.755 1.00 21.98 C ATOM 1574 CZ PHE B 11 19.616 122.311 176.518 1.00 23.13 C ATOM 1575 H PHE B 11 18.093 120.962 172.282 1.00 0.00 H ATOM 1576 N ASP B 12 14.712 120.532 171.113 1.00 29.07 N ATOM 1577 CA ASP B 12 13.637 120.560 170.123 1.00 28.39 C ATOM 1578 C ASP B 12 12.811 119.280 170.118 1.00 28.47 C ATOM 1579 O ASP B 12 12.926 118.477 169.180 1.00 28.70 O ATOM 1580 CB ASP B 12 14.245 120.790 168.740 1.00 27.30 C ATOM 1581 CG ASP B 12 13.201 120.951 167.669 1.00 29.98 C ATOM 1582 OD1 ASP B 12 12.258 121.713 167.908 1.00 32.76 O ATOM 1583 OD2 ASP B 12 13.313 120.312 166.599 1.00 29.66 O ATOM 1584 H ASP B 12 15.432 119.785 171.047 1.00 0.00 H ATOM 1585 N PRO B 13 11.956 119.053 171.134 1.00 26.80 N ATOM 1586 CA PRO B 13 11.797 119.843 172.360 1.00 26.38 C ATOM 1587 C PRO B 13 12.647 119.302 173.491 1.00 25.49 C ATOM 1588 O PRO B 13 13.256 118.239 173.325 1.00 24.21 O ATOM 1589 CB PRO B 13 10.335 119.651 172.708 1.00 31.78 C ATOM 1590 CG PRO B 13 10.079 118.231 172.305 1.00 27.39 C ATOM 1591 CD PRO B 13 10.970 117.949 171.108 1.00 27.07 C ATOM 1592 N ILE B 14 12.661 119.989 174.629 1.00 23.59 N ATOM 1593 CA ILE B 14 13.377 119.509 175.803 1.00 26.90 C ATOM 1594 C ILE B 14 12.722 118.216 176.282 1.00 27.31 C ATOM 1595 O ILE B 14 11.491 118.084 176.280 1.00 23.50 O ATOM 1596 CB ILE B 14 13.369 120.612 176.883 1.00 27.70 C ATOM 1597 CG1 ILE B 14 14.172 120.228 178.122 1.00 31.00 C ATOM 1598 CG2 ILE B 14 11.936 121.002 177.255 1.00 29.86 C ATOM 1599 CD1 ILE B 14 14.482 121.444 179.002 1.00 30.89 C ATOM 1600 H ILE B 14 12.148 120.892 174.682 1.00 0.00 H ATOM 1601 N THR B 15 13.538 117.246 176.686 1.00 22.74 N ATOM 1602 CA THR B 15 13.060 115.934 177.130 1.00 22.85 C ATOM 1603 C THR B 15 13.404 115.713 178.600 1.00 28.27 C ATOM 1604 O THR B 15 14.040 116.549 179.252 1.00 32.44 O ATOM 1605 CB THR B 15 13.659 114.802 176.297 1.00 22.24 C ATOM 1606 OG1 THR B 15 15.006 114.566 176.740 1.00 18.71 O ATOM 1607 CG2 THR B 15 13.659 115.161 174.819 1.00 23.05 C ATOM 1608 HG1 THR B 15 15.404 113.833 176.206 1.00 0.00 H ATOM 1609 H THR B 15 14.562 117.427 176.687 1.00 0.00 H ATOM 1610 N ASN B 16 12.952 114.570 179.130 1.00 27.34 N ATOM 1611 CA ASN B 16 13.275 114.213 180.508 1.00 26.59 C ATOM 1612 C ASN B 16 14.754 113.898 180.668 1.00 26.41 C ATOM 1613 O ASN B 16 15.280 114.007 181.779 1.00 32.16 O ATOM 1614 CB ASN B 16 12.425 113.023 180.962 1.00 28.19 C ATOM 1615 CG ASN B 16 10.971 113.401 181.207 1.00 28.26 C ATOM 1616 OD1 ASN B 16 10.627 114.582 181.291 1.00 29.84 O ATOM 1617 ND2 ASN B 16 10.109 112.396 181.311 1.00 26.85 N ATOM 1618 HD22 ASN B 16 10.443 111.414 181.234 1.00 0.00 H ATOM 1619 HD21 ASN B 16 9.100 112.591 181.470 1.00 0.00 H ATOM 1620 H ASN B 16 12.366 113.931 178.555 1.00 0.00 H ATOM 1621 N GLY B 17 15.432 113.503 179.583 1.00 25.79 N ATOM 1622 CA GLY B 17 16.884 113.413 179.621 1.00 29.22 C ATOM 1623 C GLY B 17 17.536 114.766 179.835 1.00 33.22 C ATOM 1624 O GLY B 17 18.481 114.896 180.618 1.00 31.12 O ATOM 1625 H GLY B 17 14.920 113.260 178.711 1.00 0.00 H ATOM 1626 N HIS B 18 17.032 115.796 179.149 1.00 33.29 N ATOM 1627 CA HIS B 18 17.534 117.148 179.366 1.00 24.94 C ATOM 1628 C HIS B 18 17.220 117.626 180.773 1.00 25.27 C ATOM 1629 O HIS B 18 18.025 118.326 181.396 1.00 27.18 O ATOM 1630 CB HIS B 18 16.928 118.105 178.349 1.00 25.55 C ATOM 1631 CG HIS B 18 17.247 117.765 176.930 1.00 28.20 C ATOM 1632 ND1 HIS B 18 16.269 117.579 175.977 1.00 28.52 N ATOM 1633 CD2 HIS B 18 18.429 117.591 176.295 1.00 26.22 C ATOM 1634 CE1 HIS B 18 16.832 117.295 174.819 1.00 25.77 C ATOM 1635 NE2 HIS B 18 18.143 117.296 174.984 1.00 30.02 N ATOM 1636 H HIS B 18 16.275 115.632 178.455 1.00 0.00 H ATOM 1637 N ILE B 19 16.038 117.283 181.281 1.00 26.71 N ATOM 1638 CA ILE B 19 15.709 117.674 182.643 1.00 32.20 C ATOM 1639 C ILE B 19 16.652 116.981 183.610 1.00 35.09 C ATOM 1640 O ILE B 19 17.157 117.591 184.562 1.00 30.29 O ATOM 1641 CB ILE B 19 14.237 117.342 182.956 1.00 33.12 C ATOM 1642 CG1 ILE B 19 13.287 118.141 182.062 1.00 31.26 C ATOM 1643 CG2 ILE B 19 13.933 117.585 184.432 1.00 28.95 C ATOM 1644 CD1 ILE B 19 13.583 119.628 182.006 1.00 34.75 C ATOM 1645 H ILE B 19 15.358 116.742 180.710 1.00 0.00 H ATOM 1646 N ASP B 20 16.929 115.700 183.357 1.00 28.92 N ATOM 1647 CA ASP B 20 17.880 114.955 184.171 1.00 30.34 C ATOM 1648 C ASP B 20 19.223 115.672 184.253 1.00 27.81 C ATOM 1649 O ASP B 20 19.731 115.933 185.347 1.00 28.44 O ATOM 1650 CB ASP B 20 18.040 113.546 183.590 1.00 33.02 C ATOM 1651 CG ASP B 20 18.931 112.668 184.431 1.00 41.10 C ATOM 1652 OD1 ASP B 20 18.422 112.022 185.371 1.00 48.03 O ATOM 1653 OD2 ASP B 20 20.148 112.641 184.158 1.00 41.05 O ATOM 1654 H ASP B 20 16.456 115.224 182.562 1.00 0.00 H ATOM 1655 N ILE B 21 19.789 116.040 183.101 1.00 22.77 N ATOM 1656 CA ILE B 21 21.109 116.660 183.077 1.00 23.16 C ATOM 1657 C ILE B 21 21.091 118.022 183.758 1.00 26.08 C ATOM 1658 O ILE B 21 21.937 118.310 184.612 1.00 27.17 O ATOM 1659 CB ILE B 21 21.628 116.761 181.632 1.00 21.86 C ATOM 1660 CG1 ILE B 21 21.713 115.367 180.997 1.00 25.04 C ATOM 1661 CG2 ILE B 21 22.974 117.438 181.605 1.00 16.42 C ATOM 1662 CD1 ILE B 21 22.835 114.497 181.565 1.00 17.84 C ATOM 1663 H ILE B 21 19.281 115.882 182.207 1.00 0.00 H ATOM 1664 N VAL B 22 20.110 118.867 183.427 1.00 24.92 N ATOM 1665 CA VAL B 22 20.100 120.201 184.017 1.00 23.83 C ATOM 1666 C VAL B 22 19.914 120.125 185.529 1.00 25.44 C ATOM 1667 O VAL B 22 20.483 120.943 186.261 1.00 29.78 O ATOM 1668 CB VAL B 22 19.033 121.095 183.343 1.00 22.87 C ATOM 1669 CG1 VAL B 22 17.700 121.044 184.086 1.00 22.59 C ATOM 1670 CG2 VAL B 22 19.519 122.547 183.220 1.00 21.97 C ATOM 1671 H VAL B 22 19.366 118.578 182.760 1.00 0.00 H ATOM 1672 N THR B 23 19.173 119.128 186.033 1.00 27.67 N ATOM 1673 CA THR B 23 18.973 119.011 187.480 1.00 28.85 C ATOM 1674 C THR B 23 20.264 118.630 188.176 1.00 32.62 C ATOM 1675 O THR B 23 20.566 119.139 189.256 1.00 35.99 O ATOM 1676 CB THR B 23 17.880 117.989 187.799 1.00 31.50 C ATOM 1677 OG1 THR B 23 16.673 118.341 187.105 1.00 37.59 O ATOM 1678 CG2 THR B 23 17.574 117.959 189.313 1.00 30.65 C ATOM 1679 HG1 THR B 23 16.844 118.347 186.130 1.00 0.00 H ATOM 1680 H THR B 23 18.737 118.433 185.393 1.00 0.00 H ATOM 1681 N ARG B 24 21.055 117.765 187.552 1.00 36.54 N ATOM 1682 CA ARG B 24 22.343 117.403 188.121 1.00 33.01 C ATOM 1683 C ARG B 24 23.283 118.593 188.110 1.00 35.46 C ATOM 1684 O ARG B 24 24.096 118.750 189.021 1.00 40.98 O ATOM 1685 CB ARG B 24 22.955 116.242 187.337 1.00 31.99 C ATOM 1686 CG ARG B 24 22.170 114.953 187.425 1.00 32.80 C ATOM 1687 CD ARG B 24 22.770 113.876 186.537 1.00 33.00 C ATOM 1688 NE ARG B 24 21.866 112.739 186.431 1.00 37.77 N ATOM 1689 CZ ARG B 24 21.706 111.830 187.389 1.00 42.76 C ATOM 1690 NH1 ARG B 24 22.408 111.924 188.514 1.00 42.42 N ATOM 1691 NH2 ARG B 24 20.852 110.824 187.228 1.00 36.39 N ATOM 1692 HE ARG B 24 21.314 112.632 185.556 1.00 0.00 H ATOM 1693 HH12 ARG B 24 22.285 111.215 189.265 1.00 0.00 H ATOM 1694 HH11 ARG B 24 23.080 112.707 188.644 1.00 0.00 H ATOM 1695 HH22 ARG B 24 20.733 110.117 187.982 1.00 0.00 H ATOM 1696 HH21 ARG B 24 20.303 110.744 186.348 1.00 0.00 H ATOM 1697 H ARG B 24 20.751 117.344 186.651 1.00 0.00 H ATOM 1698 N ALA B 25 23.164 119.455 187.107 1.00 36.99 N ATOM 1699 CA ALA B 25 24.017 120.630 187.037 1.00 34.83 C ATOM 1700 C ALA B 25 23.687 121.633 188.133 1.00 34.36 C ATOM 1701 O ALA B 25 24.587 122.321 188.629 1.00 31.75 O ATOM 1702 CB ALA B 25 23.876 121.282 185.664 1.00 30.78 C ATOM 1703 H ALA B 25 22.454 119.288 186.365 1.00 0.00 H ATOM 1704 N THR B 26 22.428 121.704 188.560 1.00 40.15 N ATOM 1705 CA THR B 26 22.046 122.629 189.626 1.00 43.84 C ATOM 1706 C THR B 26 22.495 122.142 190.997 1.00 44.09 C ATOM 1707 O THR B 26 22.666 122.968 191.899 1.00 43.89 O ATOM 1708 CB THR B 26 20.525 122.880 189.635 1.00 38.51 C ATOM 1709 OG1 THR B 26 19.823 121.640 189.814 1.00 39.42 O ATOM 1710 CG2 THR B 26 20.075 123.518 188.338 1.00 37.04 C ATOM 1711 HG1 THR B 26 20.048 121.025 189.072 1.00 0.00 H ATOM 1712 H THR B 26 21.706 121.093 188.129 1.00 0.00 H ATOM 1713 N GLN B 27 22.704 120.842 191.181 1.00 46.67 N ATOM 1714 CA GLN B 27 23.256 120.321 192.427 1.00 46.37 C ATOM 1715 C GLN B 27 24.761 120.509 192.516 1.00 40.73 C ATOM 1716 O GLN B 27 25.344 120.291 193.587 1.00 41.38 O ATOM 1717 CB GLN B 27 22.902 118.836 192.573 1.00 50.09 C ATOM 1718 CG GLN B 27 21.405 118.625 192.642 1.00 56.28 C ATOM 1719 CD GLN B 27 20.965 117.228 192.222 1.00 67.45 C ATOM 1720 OE1 GLN B 27 21.716 116.469 191.592 1.00 69.63 O ATOM 1721 NE2 GLN B 27 19.730 116.885 192.565 1.00 66.28 N ATOM 1722 HE22 GLN B 27 19.133 117.552 193.094 1.00 0.00 H ATOM 1723 HE21 GLN B 27 19.359 115.949 192.305 1.00 0.00 H ATOM 1724 H GLN B 27 22.468 120.178 190.416 1.00 0.00 H ATOM 1725 N MET B 28 25.387 120.938 191.430 1.00 31.77 N ATOM 1726 CA MET B 28 26.828 121.009 191.298 1.00 33.18 C ATOM 1727 C MET B 28 27.335 122.430 191.079 1.00 38.46 C ATOM 1728 O MET B 28 28.466 122.741 191.478 1.00 34.37 O ATOM 1729 CB MET B 28 27.253 120.096 190.139 1.00 42.12 C ATOM 1730 CG MET B 28 28.693 120.093 189.739 1.00 51.62 C ATOM 1731 SD MET B 28 28.892 118.854 188.432 1.00 52.42 S ATOM 1732 CE MET B 28 28.303 117.434 189.292 1.00 47.80 C ATOM 1733 H MET B 28 24.808 121.243 190.622 1.00 0.00 H ATOM 1734 N PHE B 29 26.519 123.302 190.480 1.00 38.68 N ATOM 1735 CA PHE B 29 26.878 124.688 190.220 1.00 39.45 C ATOM 1736 C PHE B 29 25.790 125.624 190.751 1.00 43.96 C ATOM 1737 O PHE B 29 24.623 125.254 190.873 1.00 47.55 O ATOM 1738 CB PHE B 29 27.145 124.906 188.722 1.00 34.82 C ATOM 1739 CG PHE B 29 28.274 124.052 188.177 1.00 36.43 C ATOM 1740 CD1 PHE B 29 29.598 124.358 188.485 1.00 33.22 C ATOM 1741 CD2 PHE B 29 28.022 122.925 187.405 1.00 31.32 C ATOM 1742 CE1 PHE B 29 30.635 123.567 188.009 1.00 34.17 C ATOM 1743 CE2 PHE B 29 29.054 122.136 186.930 1.00 30.95 C ATOM 1744 CZ PHE B 29 30.358 122.459 187.229 1.00 30.06 C ATOM 1745 H PHE B 29 25.578 122.973 190.184 1.00 0.00 H ATOM 1746 N ASP B 30 26.192 126.865 191.045 1.00 48.84 N ATOM 1747 CA ASP B 30 25.304 127.834 191.689 1.00 53.83 C ATOM 1748 C ASP B 30 24.188 128.301 190.764 1.00 50.69 C ATOM 1749 O ASP B 30 23.018 128.345 191.164 1.00 56.31 O ATOM 1750 CB ASP B 30 26.118 129.045 192.155 1.00 62.51 C ATOM 1751 CG ASP B 30 27.071 128.721 193.281 1.00 65.54 C ATOM 1752 OD1 ASP B 30 26.607 128.223 194.323 1.00 68.58 O ATOM 1753 OD2 ASP B 30 28.279 128.948 193.121 1.00 67.43 O ATOM 1754 H ASP B 30 27.164 127.150 190.809 1.00 0.00 H ATOM 1755 N HIS B 31 24.525 128.640 189.523 1.00 46.80 N ATOM 1756 CA HIS B 31 23.566 129.154 188.557 1.00 42.23 C ATOM 1757 C HIS B 31 23.805 128.421 187.245 1.00 36.47 C ATOM 1758 O HIS B 31 24.948 128.334 186.773 1.00 34.43 O ATOM 1759 CB HIS B 31 23.741 130.661 188.363 1.00 47.52 C ATOM 1760 CG HIS B 31 22.603 131.326 187.646 1.00 48.05 C ATOM 1761 ND1 HIS B 31 21.343 131.430 188.193 1.00 47.90 N ATOM 1762 CD2 HIS B 31 22.535 131.923 186.432 1.00 47.67 C ATOM 1763 CE1 HIS B 31 20.550 132.066 187.350 1.00 48.21 C ATOM 1764 NE2 HIS B 31 21.248 132.374 186.273 1.00 45.97 N ATOM 1765 H HIS B 31 25.517 128.533 189.230 1.00 0.00 H ATOM 1766 N VAL B 32 22.738 127.880 186.663 1.00 33.75 N ATOM 1767 CA VAL B 32 22.813 127.166 185.398 1.00 34.12 C ATOM 1768 C VAL B 32 21.951 127.909 184.399 1.00 36.21 C ATOM 1769 O VAL B 32 20.792 128.228 184.685 1.00 36.55 O ATOM 1770 CB VAL B 32 22.360 125.701 185.537 1.00 32.17 C ATOM 1771 CG1 VAL B 32 22.517 124.975 184.223 1.00 28.48 C ATOM 1772 CG2 VAL B 32 23.162 125.009 186.611 1.00 29.51 C ATOM 1773 H VAL B 32 21.814 127.971 187.131 1.00 0.00 H ATOM 1774 N ILE B 33 22.510 128.177 183.234 1.00 33.97 N ATOM 1775 CA ILE B 33 21.778 128.818 182.160 1.00 32.51 C ATOM 1776 C ILE B 33 21.465 127.740 181.138 1.00 33.22 C ATOM 1777 O ILE B 33 22.358 127.257 180.434 1.00 35.83 O ATOM 1778 CB ILE B 33 22.578 129.965 181.534 1.00 32.89 C ATOM 1779 CG1 ILE B 33 22.703 131.120 182.524 1.00 38.41 C ATOM 1780 CG2 ILE B 33 21.924 130.434 180.236 1.00 28.27 C ATOM 1781 CD1 ILE B 33 23.898 131.978 182.268 1.00 42.59 C ATOM 1782 H ILE B 33 23.506 127.920 183.082 1.00 0.00 H ATOM 1783 N LEU B 34 20.196 127.365 181.039 1.00 35.97 N ATOM 1784 CA LEU B 34 19.784 126.477 179.965 1.00 33.66 C ATOM 1785 C LEU B 34 19.667 127.352 178.727 1.00 28.97 C ATOM 1786 O LEU B 34 18.741 128.165 178.616 1.00 29.02 O ATOM 1787 CB LEU B 34 18.470 125.781 180.310 1.00 40.57 C ATOM 1788 CG LEU B 34 18.154 124.531 179.483 1.00 40.95 C ATOM 1789 CD1 LEU B 34 17.356 123.514 180.265 1.00 37.11 C ATOM 1790 CD2 LEU B 34 17.368 124.950 178.247 1.00 42.83 C ATOM 1791 H LEU B 34 19.497 127.706 181.729 1.00 0.00 H ATOM 1792 N ALA B 35 20.630 127.212 177.819 1.00 30.55 N ATOM 1793 CA ALA B 35 20.755 128.091 176.667 1.00 28.54 C ATOM 1794 C ALA B 35 20.239 127.347 175.443 1.00 27.30 C ATOM 1795 O ALA B 35 20.747 126.272 175.111 1.00 36.66 O ATOM 1796 CB ALA B 35 22.200 128.512 176.462 1.00 28.78 C ATOM 1797 H ALA B 35 21.321 126.444 177.938 1.00 0.00 H ATOM 1798 N ILE B 36 19.225 127.881 174.783 1.00 27.13 N ATOM 1799 CA ILE B 36 18.610 127.200 173.657 1.00 25.39 C ATOM 1800 C ILE B 36 19.160 127.831 172.387 1.00 26.41 C ATOM 1801 O ILE B 36 19.014 129.042 172.157 1.00 29.72 O ATOM 1802 CB ILE B 36 17.083 127.280 173.750 1.00 30.86 C ATOM 1803 CG1 ILE B 36 16.642 126.765 175.126 1.00 27.39 C ATOM 1804 CG2 ILE B 36 16.420 126.370 172.710 1.00 30.75 C ATOM 1805 CD1 ILE B 36 15.133 126.521 175.258 1.00 27.63 C ATOM 1806 H ILE B 36 18.860 128.809 175.077 1.00 0.00 H ATOM 1807 N ALA B 37 19.854 127.023 171.594 1.00 25.65 N ATOM 1808 CA ALA B 37 20.446 127.516 170.359 1.00 28.73 C ATOM 1809 C ALA B 37 19.358 127.572 169.294 1.00 29.17 C ATOM 1810 O ALA B 37 18.503 126.683 169.206 1.00 31.61 O ATOM 1811 CB ALA B 37 21.601 126.629 169.918 1.00 25.48 C ATOM 1812 H ALA B 37 19.976 126.025 171.859 1.00 0.00 H ATOM 1813 N ALA B 38 19.366 128.646 168.501 1.00 29.63 N ATOM 1814 CA ALA B 38 18.342 128.792 167.472 1.00 34.10 C ATOM 1815 C ALA B 38 18.437 127.656 166.469 1.00 37.01 C ATOM 1816 O ALA B 38 17.409 127.124 166.027 1.00 41.41 O ATOM 1817 CB ALA B 38 18.485 130.140 166.775 1.00 29.74 C ATOM 1818 H ALA B 38 20.099 129.375 168.616 1.00 0.00 H ATOM 1819 N SER B 39 19.665 127.256 166.126 1.00 37.89 N ATOM 1820 CA SER B 39 19.984 126.119 165.267 1.00 44.67 C ATOM 1821 C SER B 39 19.061 126.025 164.019 1.00 48.27 C ATOM 1822 O SER B 39 18.412 125.017 163.831 1.00 43.90 O ATOM 1823 CB SER B 39 19.935 124.821 166.062 1.00 50.13 C ATOM 1824 OG SER B 39 21.019 124.721 166.974 1.00 53.61 O ATOM 1825 HG SER B 39 20.953 123.867 167.471 1.00 0.00 H ATOM 1826 H SER B 39 20.465 127.803 166.504 1.00 0.00 H ATOM 1827 N PRO B 40 19.036 127.077 163.196 1.00 54.91 N ATOM 1828 CA PRO B 40 18.108 127.036 162.042 1.00 57.41 C ATOM 1829 C PRO B 40 18.549 126.066 160.955 1.00 62.32 C ATOM 1830 O PRO B 40 17.725 125.684 160.116 1.00 66.73 O ATOM 1831 CB PRO B 40 18.124 128.489 161.539 1.00 53.44 C ATOM 1832 CG PRO B 40 19.455 128.985 161.969 1.00 50.18 C ATOM 1833 CD PRO B 40 19.699 128.385 163.303 1.00 48.96 C ATOM 1834 N SER B 41 19.819 125.644 160.972 1.00 62.32 N ATOM 1835 CA SER B 41 20.336 124.632 160.061 1.00 60.43 C ATOM 1836 C SER B 41 19.685 123.280 160.307 1.00 63.51 C ATOM 1837 O SER B 41 19.724 122.415 159.427 1.00 69.83 O ATOM 1838 CB SER B 41 21.864 124.525 160.196 1.00 61.76 C ATOM 1839 OG SER B 41 22.231 124.091 161.495 1.00 67.99 O ATOM 1840 HG SER B 41 23.217 124.031 161.555 1.00 0.00 H ATOM 1841 H SER B 41 20.469 126.059 161.670 1.00 0.00 H ATOM 1842 N LYS B 42 19.150 123.058 161.505 1.00 58.71 N ATOM 1843 CA LYS B 42 18.503 121.809 161.897 1.00 53.90 C ATOM 1844 C LYS B 42 17.022 121.761 161.555 1.00 56.88 C ATOM 1845 O LYS B 42 16.394 120.718 161.771 1.00 62.75 O ATOM 1846 CB LYS B 42 18.651 121.575 163.405 1.00 51.92 C ATOM 1847 CG LYS B 42 19.870 120.779 163.733 1.00 51.73 C ATOM 1848 CD LYS B 42 20.210 120.862 165.186 1.00 52.35 C ATOM 1849 CE LYS B 42 21.608 120.351 165.381 1.00 57.17 C ATOM 1850 NZ LYS B 42 21.905 120.207 166.821 1.00 61.98 N ATOM 1851 HZ1 LYS B 42 21.813 121.132 167.287 1.00 0.00 H ATOM 1852 HZ2 LYS B 42 21.235 119.535 167.246 1.00 0.00 H ATOM 1853 HZ3 LYS B 42 22.876 119.853 166.940 1.00 0.00 H ATOM 1854 H LYS B 42 19.196 123.824 162.208 1.00 0.00 H ATOM 1855 N LYS B 43 16.454 122.856 161.047 1.00 56.17 N ATOM 1856 CA LYS B 43 15.030 122.980 160.760 1.00 55.96 C ATOM 1857 C LYS B 43 14.257 122.496 161.981 1.00 52.44 C ATOM 1858 O LYS B 43 13.552 121.482 161.873 1.00 55.03 O ATOM 1859 CB LYS B 43 14.636 122.164 159.529 1.00 57.55 C ATOM 1860 H LYS B 43 17.065 123.672 160.843 1.00 0.00 H ATOM 1861 N PRO B 44 14.377 123.143 163.153 1.00 52.94 N ATOM 1862 CA PRO B 44 13.713 122.593 164.345 1.00 49.69 C ATOM 1863 C PRO B 44 12.200 122.610 164.187 1.00 43.09 C ATOM 1864 O PRO B 44 11.639 123.451 163.484 1.00 43.90 O ATOM 1865 CB PRO B 44 14.176 123.508 165.485 1.00 54.73 C ATOM 1866 CG PRO B 44 14.758 124.714 164.849 1.00 56.62 C ATOM 1867 CD PRO B 44 15.194 124.335 163.465 1.00 57.27 C ATOM 1868 N MET B 45 11.539 121.644 164.828 1.00 40.74 N ATOM 1869 CA MET B 45 10.078 121.577 164.761 1.00 39.51 C ATOM 1870 C MET B 45 9.442 122.762 165.478 1.00 39.17 C ATOM 1871 O MET B 45 8.452 123.325 165.000 1.00 46.63 O ATOM 1872 CB MET B 45 9.580 120.254 165.349 1.00 38.82 C ATOM 1873 CG MET B 45 8.102 120.218 165.720 1.00 42.18 C ATOM 1874 SD MET B 45 7.648 118.583 166.340 1.00 44.74 S ATOM 1875 CE MET B 45 7.871 117.591 164.858 1.00 38.06 C ATOM 1876 H MET B 45 12.065 120.935 165.378 1.00 0.00 H ATOM 1877 N PHE B 46 9.986 123.148 166.631 1.00 37.44 N ATOM 1878 CA PHE B 46 9.474 124.261 167.411 1.00 37.07 C ATOM 1879 C PHE B 46 10.335 125.499 167.172 1.00 40.38 C ATOM 1880 O PHE B 46 11.552 125.409 166.987 1.00 41.57 O ATOM 1881 CB PHE B 46 9.462 123.913 168.895 1.00 36.27 C ATOM 1882 CG PHE B 46 8.547 122.779 169.247 1.00 36.26 C ATOM 1883 CD1 PHE B 46 9.002 121.474 169.205 1.00 37.18 C ATOM 1884 CD2 PHE B 46 7.225 123.005 169.606 1.00 38.89 C ATOM 1885 CE1 PHE B 46 8.161 120.409 169.514 1.00 39.73 C ATOM 1886 CE2 PHE B 46 6.378 121.939 169.915 1.00 39.17 C ATOM 1887 CZ PHE B 46 6.849 120.647 169.870 1.00 38.51 C ATOM 1888 H PHE B 46 10.814 122.630 166.988 1.00 0.00 H ATOM 1889 N THR B 47 9.693 126.665 167.205 1.00 40.83 N ATOM 1890 CA THR B 47 10.428 127.915 167.099 1.00 42.49 C ATOM 1891 C THR B 47 11.247 128.130 168.366 1.00 46.60 C ATOM 1892 O THR B 47 11.004 127.511 169.407 1.00 46.24 O ATOM 1893 CB THR B 47 9.477 129.094 166.871 1.00 43.77 C ATOM 1894 OG1 THR B 47 8.689 129.316 168.053 1.00 43.28 O ATOM 1895 CG2 THR B 47 8.564 128.838 165.689 1.00 44.21 C ATOM 1896 HG1 THR B 47 8.162 128.503 168.254 1.00 0.00 H ATOM 1897 H THR B 47 8.658 126.682 167.307 1.00 0.00 H ATOM 1898 N LEU B 48 12.250 129.001 168.262 1.00 41.70 N ATOM 1899 CA LEU B 48 13.066 129.294 169.432 1.00 34.53 C ATOM 1900 C LEU B 48 12.217 129.828 170.572 1.00 36.45 C ATOM 1901 O LEU B 48 12.431 129.472 171.739 1.00 38.13 O ATOM 1902 CB LEU B 48 14.156 130.293 169.076 1.00 29.69 C ATOM 1903 CG LEU B 48 15.103 130.593 170.235 1.00 31.05 C ATOM 1904 CD1 LEU B 48 15.829 129.352 170.745 1.00 26.19 C ATOM 1905 CD2 LEU B 48 16.077 131.638 169.783 1.00 30.72 C ATOM 1906 H LEU B 48 12.448 129.467 167.354 1.00 0.00 H ATOM 1907 N GLU B 49 11.226 130.656 170.255 1.00 38.88 N ATOM 1908 CA GLU B 49 10.358 131.165 171.308 1.00 43.44 C ATOM 1909 C GLU B 49 9.517 130.045 171.892 1.00 40.58 C ATOM 1910 O GLU B 49 9.261 130.018 173.100 1.00 40.51 O ATOM 1911 CB GLU B 49 9.480 132.293 170.769 1.00 50.76 C ATOM 1912 CG GLU B 49 10.267 133.460 170.205 1.00 61.70 C ATOM 1913 CD GLU B 49 10.273 133.473 168.693 1.00 70.27 C ATOM 1914 OE1 GLU B 49 9.835 134.489 168.110 1.00 77.53 O ATOM 1915 OE2 GLU B 49 10.698 132.463 168.090 1.00 64.89 O ATOM 1916 H GLU B 49 11.072 130.937 169.266 1.00 0.00 H ATOM 1917 N GLU B 50 9.108 129.098 171.054 1.00 38.86 N ATOM 1918 CA GLU B 50 8.369 127.947 171.560 1.00 45.43 C ATOM 1919 C GLU B 50 9.237 127.095 172.477 1.00 38.14 C ATOM 1920 O GLU B 50 8.838 126.750 173.595 1.00 36.85 O ATOM 1921 CB GLU B 50 7.844 127.125 170.373 1.00 49.03 C ATOM 1922 CG GLU B 50 6.519 127.577 169.777 1.00 51.78 C ATOM 1923 CD GLU B 50 6.223 126.891 168.453 1.00 58.20 C ATOM 1924 OE1 GLU B 50 7.178 126.480 167.768 1.00 55.64 O ATOM 1925 OE2 GLU B 50 5.037 126.743 168.100 1.00 65.98 O ATOM 1926 H GLU B 50 9.315 129.178 170.038 1.00 0.00 H ATOM 1927 N ARG B 51 10.453 126.793 172.031 1.00 33.16 N ATOM 1928 CA ARG B 51 11.381 125.980 172.811 1.00 30.52 C ATOM 1929 C ARG B 51 11.763 126.659 174.129 1.00 32.88 C ATOM 1930 O ARG B 51 11.839 125.989 175.177 1.00 37.94 O ATOM 1931 CB ARG B 51 12.588 125.643 171.943 1.00 26.58 C ATOM 1932 CG ARG B 51 12.261 124.688 170.804 1.00 28.94 C ATOM 1933 CD ARG B 51 13.443 124.390 169.894 1.00 30.76 C ATOM 1934 NE ARG B 51 13.641 125.387 168.836 1.00 30.52 N ATOM 1935 CZ ARG B 51 14.820 125.920 168.526 1.00 28.23 C ATOM 1936 NH1 ARG B 51 14.931 126.809 167.544 1.00 22.89 N ATOM 1937 NH2 ARG B 51 15.901 125.542 169.192 1.00 33.20 N ATOM 1938 HE ARG B 51 12.808 125.696 168.295 1.00 0.00 H ATOM 1939 HH12 ARG B 51 15.860 127.216 167.314 1.00 0.00 H ATOM 1940 HH11 ARG B 51 14.089 127.097 167.006 1.00 0.00 H ATOM 1941 HH22 ARG B 51 16.827 125.953 168.957 1.00 0.00 H ATOM 1942 HH21 ARG B 51 15.824 124.834 169.950 1.00 0.00 H ATOM 1943 H ARG B 51 10.751 127.146 171.099 1.00 0.00 H ATOM 1944 N VAL B 52 12.020 127.993 174.089 1.00 30.54 N ATOM 1945 CA VAL B 52 12.314 128.694 175.349 1.00 31.46 C ATOM 1946 C VAL B 52 11.122 128.627 176.312 1.00 36.46 C ATOM 1947 O VAL B 52 11.287 128.340 177.498 1.00 34.45 O ATOM 1948 CB VAL B 52 12.737 130.134 175.047 1.00 31.73 C ATOM 1949 CG1 VAL B 52 12.833 131.012 176.320 1.00 24.01 C ATOM 1950 CG2 VAL B 52 14.114 130.191 174.325 1.00 25.45 C ATOM 1951 H VAL B 52 12.009 128.508 173.186 1.00 0.00 H ATOM 1952 N ALA B 53 9.885 128.843 175.801 1.00 37.19 N ATOM 1953 CA ALA B 53 8.698 128.756 176.664 1.00 34.54 C ATOM 1954 C ALA B 53 8.536 127.355 177.244 1.00 34.80 C ATOM 1955 O ALA B 53 8.293 127.196 178.447 1.00 35.85 O ATOM 1956 CB ALA B 53 7.459 129.149 175.879 1.00 35.36 C ATOM 1957 H ALA B 53 9.775 129.072 174.792 1.00 0.00 H ATOM 1958 N LEU B 54 8.657 126.326 176.406 1.00 33.29 N ATOM 1959 CA LEU B 54 8.515 124.957 176.893 1.00 32.57 C ATOM 1960 C LEU B 54 9.533 124.646 177.978 1.00 33.32 C ATOM 1961 O LEU B 54 9.187 124.061 179.011 1.00 35.77 O ATOM 1962 CB LEU B 54 8.672 123.983 175.732 1.00 34.89 C ATOM 1963 CG LEU B 54 7.529 123.996 174.710 1.00 39.49 C ATOM 1964 CD1 LEU B 54 7.843 123.152 173.488 1.00 38.13 C ATOM 1965 CD2 LEU B 54 6.226 123.529 175.362 1.00 38.87 C ATOM 1966 H LEU B 54 8.854 126.499 175.400 1.00 0.00 H ATOM 1967 N ALA B 55 10.785 125.064 177.779 1.00 30.19 N ATOM 1968 CA ALA B 55 11.831 124.756 178.749 1.00 29.22 C ATOM 1969 C ALA B 55 11.652 125.549 180.040 1.00 31.66 C ATOM 1970 O ALA B 55 11.898 125.021 181.133 1.00 29.55 O ATOM 1971 CB ALA B 55 13.207 125.023 178.131 1.00 27.75 C ATOM 1972 H ALA B 55 11.017 125.613 176.927 1.00 0.00 H ATOM 1973 N GLN B 56 11.215 126.812 179.936 1.00 35.18 N ATOM 1974 CA GLN B 56 10.972 127.619 181.132 1.00 41.57 C ATOM 1975 C GLN B 56 9.935 126.949 182.017 1.00 43.23 C ATOM 1976 O GLN B 56 10.143 126.767 183.222 1.00 42.83 O ATOM 1977 CB GLN B 56 10.497 129.017 180.745 1.00 46.45 C ATOM 1978 CG GLN B 56 11.584 130.039 180.512 1.00 54.91 C ATOM 1979 CD GLN B 56 11.036 131.291 179.855 1.00 60.28 C ATOM 1980 OE1 GLN B 56 9.899 131.302 179.377 1.00 59.77 O ATOM 1981 NE2 GLN B 56 11.843 132.347 179.817 1.00 60.48 N ATOM 1982 HE22 GLN B 56 12.794 132.290 180.234 1.00 0.00 H ATOM 1983 HE21 GLN B 56 11.523 133.230 179.370 1.00 0.00 H ATOM 1984 H GLN B 56 11.047 127.223 178.995 1.00 0.00 H ATOM 1985 N GLN B 57 8.821 126.539 181.414 1.00 49.05 N ATOM 1986 CA GLN B 57 7.761 125.883 182.165 1.00 56.18 C ATOM 1987 C GLN B 57 8.223 124.542 182.703 1.00 51.64 C ATOM 1988 O GLN B 57 7.963 124.210 183.865 1.00 52.04 O ATOM 1989 CB GLN B 57 6.547 125.683 181.257 1.00 68.78 C ATOM 1990 CG GLN B 57 5.364 124.998 181.913 1.00 83.06 C ATOM 1991 CD GLN B 57 4.327 125.961 182.433 1.00100.14 C ATOM 1992 OE1 GLN B 57 4.624 126.823 183.259 1.00109.06 O ATOM 1993 NE2 GLN B 57 3.096 125.823 181.948 1.00101.15 N ATOM 1994 HE22 GLN B 57 2.892 125.079 181.251 1.00 0.00 H ATOM 1995 HE21 GLN B 57 2.337 126.459 182.266 1.00 0.00 H ATOM 1996 H GLN B 57 8.707 126.690 180.391 1.00 0.00 H ATOM 1997 N ALA B 58 8.987 123.799 181.903 1.00 43.59 N ATOM 1998 CA ALA B 58 9.433 122.482 182.326 1.00 35.64 C ATOM 1999 C ALA B 58 10.498 122.548 183.408 1.00 39.43 C ATOM 2000 O ALA B 58 10.747 121.534 184.067 1.00 37.74 O ATOM 2001 CB ALA B 58 9.958 121.695 181.127 1.00 30.19 C ATOM 2002 H ALA B 58 9.266 124.164 180.970 1.00 0.00 H ATOM 2003 N THR B 59 11.122 123.709 183.619 1.00 41.83 N ATOM 2004 CA THR B 59 12.195 123.847 184.596 1.00 42.09 C ATOM 2005 C THR B 59 11.851 124.804 185.732 1.00 43.16 C ATOM 2006 O THR B 59 12.727 125.130 186.539 1.00 42.86 O ATOM 2007 CB THR B 59 13.486 124.313 183.913 1.00 37.87 C ATOM 2008 OG1 THR B 59 13.241 125.527 183.197 1.00 36.25 O ATOM 2009 CG2 THR B 59 14.005 123.247 182.953 1.00 37.11 C ATOM 2010 HG1 THR B 59 12.544 125.370 182.511 1.00 0.00 H ATOM 2011 H THR B 59 10.833 124.543 183.068 1.00 0.00 H ATOM 2012 N ALA B 60 10.598 125.250 185.823 1.00 44.70 N ATOM 2013 CA ALA B 60 10.263 126.317 186.760 1.00 50.65 C ATOM 2014 C ALA B 60 10.512 125.913 188.209 1.00 53.80 C ATOM 2015 O ALA B 60 10.882 126.759 189.032 1.00 52.75 O ATOM 2016 CB ALA B 60 8.806 126.737 186.566 1.00 45.96 C ATOM 2017 H ALA B 60 9.856 124.836 185.223 1.00 0.00 H ATOM 2018 N HIS B 61 10.370 124.626 188.528 1.00 54.14 N ATOM 2019 CA HIS B 61 10.564 124.131 189.886 1.00 59.67 C ATOM 2020 C HIS B 61 12.024 124.089 190.300 1.00 63.36 C ATOM 2021 O HIS B 61 12.319 123.701 191.435 1.00 69.11 O ATOM 2022 CB HIS B 61 9.989 122.725 189.996 1.00 64.05 C ATOM 2023 CG HIS B 61 10.715 121.723 189.153 1.00 70.47 C ATOM 2024 ND1 HIS B 61 10.559 121.646 187.786 1.00 71.99 N ATOM 2025 CD2 HIS B 61 11.615 120.766 189.484 1.00 69.89 C ATOM 2026 CE1 HIS B 61 11.329 120.683 187.310 1.00 70.68 C ATOM 2027 NE2 HIS B 61 11.977 120.132 188.320 1.00 70.28 N ATOM 2028 H HIS B 61 10.111 123.950 187.781 1.00 0.00 H ATOM 2029 N LEU B 62 12.934 124.462 189.416 1.00 63.31 N ATOM 2030 CA LEU B 62 14.362 124.465 189.693 1.00 60.35 C ATOM 2031 C LEU B 62 14.771 125.924 189.842 1.00 62.96 C ATOM 2032 O LEU B 62 14.713 126.695 188.878 1.00 66.09 O ATOM 2033 CB LEU B 62 15.116 123.755 188.574 1.00 58.44 C ATOM 2034 CG LEU B 62 14.972 122.252 188.352 1.00 56.38 C ATOM 2035 CD1 LEU B 62 15.658 121.842 187.064 1.00 50.71 C ATOM 2036 CD2 LEU B 62 15.606 121.519 189.520 1.00 54.86 C ATOM 2037 H LEU B 62 12.613 124.769 188.476 1.00 0.00 H ATOM 2038 N GLY B 63 15.169 126.303 191.056 1.00 66.18 N ATOM 2039 CA GLY B 63 15.304 127.713 191.372 1.00 64.17 C ATOM 2040 C GLY B 63 16.443 128.409 190.662 1.00 59.24 C ATOM 2041 O GLY B 63 16.334 129.592 190.329 1.00 59.20 O ATOM 2042 H GLY B 63 15.383 125.587 191.779 1.00 0.00 H ATOM 2043 N ASN B 64 17.539 127.698 190.405 1.00 58.98 N ATOM 2044 CA ASN B 64 18.745 128.335 189.895 1.00 62.34 C ATOM 2045 C ASN B 64 19.010 128.006 188.427 1.00 53.21 C ATOM 2046 O ASN B 64 20.166 127.955 187.996 1.00 50.27 O ATOM 2047 CB ASN B 64 19.954 127.986 190.766 1.00 71.28 C ATOM 2048 CG ASN B 64 20.157 126.490 190.940 1.00 71.29 C ATOM 2049 OD1 ASN B 64 19.207 125.706 190.892 1.00 72.62 O ATOM 2050 ND2 ASN B 64 21.410 126.090 191.149 1.00 69.10 N ATOM 2051 HD22 ASN B 64 22.180 126.788 191.182 1.00 0.00 H ATOM 2052 HD21 ASN B 64 21.618 125.079 191.280 1.00 0.00 H ATOM 2053 H ASN B 64 17.534 126.671 190.571 1.00 0.00 H ATOM 2054 N VAL B 65 17.950 127.809 187.642 1.00 47.77 N ATOM 2055 CA VAL B 65 18.011 127.635 186.192 1.00 45.57 C ATOM 2056 C VAL B 65 17.401 128.867 185.538 1.00 43.08 C ATOM 2057 O VAL B 65 16.265 129.229 185.870 1.00 37.80 O ATOM 2058 CB VAL B 65 17.244 126.375 185.752 1.00 41.43 C ATOM 2059 CG1 VAL B 65 17.078 126.345 184.246 1.00 39.32 C ATOM 2060 CG2 VAL B 65 17.928 125.132 186.243 1.00 40.97 C ATOM 2061 H VAL B 65 17.014 127.777 188.094 1.00 0.00 H ATOM 2062 N GLU B 66 18.125 129.484 184.619 1.00 39.70 N ATOM 2063 CA GLU B 66 17.654 130.592 183.809 1.00 40.14 C ATOM 2064 C GLU B 66 17.639 130.093 182.372 1.00 41.10 C ATOM 2065 O GLU B 66 18.672 129.647 181.863 1.00 44.76 O ATOM 2066 CB GLU B 66 18.576 131.798 183.989 1.00 39.40 C ATOM 2067 CG GLU B 66 18.312 132.970 183.096 1.00 42.34 C ATOM 2068 CD GLU B 66 19.447 133.970 183.134 1.00 47.26 C ATOM 2069 OE1 GLU B 66 19.410 134.940 182.348 1.00 50.82 O ATOM 2070 OE2 GLU B 66 20.389 133.774 183.933 1.00 47.09 O ATOM 2071 H GLU B 66 19.099 129.152 184.466 1.00 0.00 H ATOM 2072 N VAL B 67 16.473 130.102 181.742 1.00 36.27 N ATOM 2073 CA VAL B 67 16.353 129.657 180.360 1.00 33.21 C ATOM 2074 C VAL B 67 16.489 130.860 179.441 1.00 30.91 C ATOM 2075 O VAL B 67 15.852 131.896 179.654 1.00 34.04 O ATOM 2076 CB VAL B 67 15.027 128.916 180.124 1.00 31.03 C ATOM 2077 CG1 VAL B 67 14.948 128.411 178.689 1.00 28.11 C ATOM 2078 CG2 VAL B 67 14.907 127.752 181.091 1.00 31.88 C ATOM 2079 H VAL B 67 15.625 130.434 182.245 1.00 0.00 H ATOM 2080 N VAL B 68 17.340 130.730 178.432 1.00 32.80 N ATOM 2081 CA VAL B 68 17.655 131.807 177.506 1.00 32.96 C ATOM 2082 C VAL B 68 17.795 131.201 176.119 1.00 33.42 C ATOM 2083 O VAL B 68 18.318 130.094 175.972 1.00 36.33 O ATOM 2084 CB VAL B 68 18.952 132.539 177.913 1.00 40.67 C ATOM 2085 CG1 VAL B 68 19.251 133.674 176.952 1.00 52.86 C ATOM 2086 CG2 VAL B 68 18.866 133.061 179.345 1.00 39.27 C ATOM 2087 H VAL B 68 17.806 129.810 178.296 1.00 0.00 H ATOM 2088 N GLY B 69 17.309 131.917 175.098 1.00 28.97 N ATOM 2089 CA GLY B 69 17.616 131.561 173.733 1.00 26.28 C ATOM 2090 C GLY B 69 18.780 132.370 173.203 1.00 31.18 C ATOM 2091 O GLY B 69 19.087 133.441 173.719 1.00 31.63 O ATOM 2092 H GLY B 69 16.703 132.740 175.290 1.00 0.00 H ATOM 2093 N PHE B 70 19.438 131.841 172.172 1.00 26.88 N ATOM 2094 CA PHE B 70 20.575 132.545 171.599 1.00 26.67 C ATOM 2095 C PHE B 70 20.861 132.016 170.203 1.00 33.50 C ATOM 2096 O PHE B 70 20.627 130.842 169.905 1.00 31.05 O ATOM 2097 CB PHE B 70 21.814 132.418 172.495 1.00 22.14 C ATOM 2098 CG PHE B 70 22.488 131.069 172.444 1.00 21.58 C ATOM 2099 CD1 PHE B 70 21.931 129.972 173.094 1.00 24.09 C ATOM 2100 CD2 PHE B 70 23.711 130.914 171.805 1.00 26.10 C ATOM 2101 CE1 PHE B 70 22.553 128.727 173.072 1.00 23.92 C ATOM 2102 CE2 PHE B 70 24.352 129.673 171.780 1.00 31.81 C ATOM 2103 CZ PHE B 70 23.765 128.572 172.418 1.00 30.03 C ATOM 2104 H PHE B 70 19.139 130.926 171.778 1.00 0.00 H ATOM 2105 N SER B 71 21.373 132.904 169.354 1.00 29.88 N ATOM 2106 CA SER B 71 21.809 132.548 168.011 1.00 30.01 C ATOM 2107 C SER B 71 23.282 132.861 167.813 1.00 31.02 C ATOM 2108 O SER B 71 23.796 132.730 166.697 1.00 36.49 O ATOM 2109 CB SER B 71 20.961 133.263 166.955 1.00 26.72 C ATOM 2110 OG SER B 71 20.945 134.659 167.184 1.00 37.06 O ATOM 2111 HG SER B 71 21.870 135.010 167.142 1.00 0.00 H ATOM 2112 H SER B 71 21.465 133.893 169.662 1.00 0.00 H ATOM 2113 N ASP B 72 23.970 133.269 168.870 1.00 32.30 N ATOM 2114 CA ASP B 72 25.376 133.634 168.801 1.00 37.24 C ATOM 2115 C ASP B 72 26.290 132.423 168.646 1.00 38.08 C ATOM 2116 O ASP B 72 25.878 131.258 168.659 1.00 35.46 O ATOM 2117 CB ASP B 72 25.803 134.362 170.070 1.00 42.13 C ATOM 2118 CG ASP B 72 25.160 135.703 170.214 1.00 50.47 C ATOM 2119 OD1 ASP B 72 24.489 136.144 169.259 1.00 57.36 O ATOM 2120 OD2 ASP B 72 25.340 136.326 171.278 1.00 55.41 O ATOM 2121 H ASP B 72 23.484 133.331 169.787 1.00 0.00 H ATOM 2122 N LEU B 73 27.570 132.740 168.526 1.00 33.83 N ATOM 2123 CA LEU B 73 28.611 131.749 168.684 1.00 28.53 C ATOM 2124 C LEU B 73 28.616 131.327 170.144 1.00 26.84 C ATOM 2125 O LEU B 73 28.512 132.169 171.035 1.00 29.18 O ATOM 2126 CB LEU B 73 29.962 132.357 168.307 1.00 25.90 C ATOM 2127 CG LEU B 73 31.204 131.469 168.350 1.00 25.04 C ATOM 2128 CD1 LEU B 73 31.272 130.625 167.088 1.00 17.84 C ATOM 2129 CD2 LEU B 73 32.486 132.276 168.577 1.00 32.03 C ATOM 2130 H LEU B 73 27.832 133.724 168.313 1.00 0.00 H ATOM 2131 N MET B 74 28.703 130.019 170.390 1.00 29.50 N ATOM 2132 CA MET B 74 28.644 129.513 171.760 1.00 29.60 C ATOM 2133 C MET B 74 29.662 130.206 172.657 1.00 32.95 C ATOM 2134 O MET B 74 29.341 130.610 173.781 1.00 32.70 O ATOM 2135 CB MET B 74 28.887 128.003 171.771 1.00 36.05 C ATOM 2136 CG MET B 74 28.959 127.406 173.166 1.00 32.61 C ATOM 2137 SD MET B 74 27.280 127.117 173.745 1.00 36.30 S ATOM 2138 CE MET B 74 27.090 128.333 175.040 1.00 35.51 C ATOM 2139 H MET B 74 28.814 129.353 169.599 1.00 0.00 H ATOM 2140 N ALA B 75 30.904 130.333 172.182 1.00 39.07 N ATOM 2141 CA ALA B 75 31.956 130.888 173.027 1.00 36.09 C ATOM 2142 C ALA B 75 31.650 132.334 173.405 1.00 35.45 C ATOM 2143 O ALA B 75 31.861 132.739 174.556 1.00 43.57 O ATOM 2144 CB ALA B 75 33.311 130.776 172.327 1.00 36.42 C ATOM 2145 H ALA B 75 31.121 130.036 171.209 1.00 0.00 H ATOM 2146 N ASN B 76 31.128 133.119 172.457 1.00 32.14 N ATOM 2147 CA ASN B 76 30.760 134.502 172.739 1.00 29.70 C ATOM 2148 C ASN B 76 29.619 134.560 173.733 1.00 29.02 C ATOM 2149 O ASN B 76 29.657 135.340 174.687 1.00 30.79 O ATOM 2150 CB ASN B 76 30.354 135.212 171.449 1.00 28.64 C ATOM 2151 CG ASN B 76 31.518 135.472 170.540 1.00 27.46 C ATOM 2152 OD1 ASN B 76 32.661 135.466 170.972 1.00 30.09 O ATOM 2153 ND2 ASN B 76 31.238 135.678 169.267 1.00 25.94 N ATOM 2154 HD22 ASN B 76 30.249 135.674 168.945 1.00 0.00 H ATOM 2155 HD21 ASN B 76 32.006 135.844 168.586 1.00 0.00 H ATOM 2156 H ASN B 76 30.982 132.737 171.501 1.00 0.00 H ATOM 2157 N PHE B 77 28.641 133.675 173.581 1.00 34.78 N ATOM 2158 CA PHE B 77 27.496 133.699 174.478 1.00 35.20 C ATOM 2159 C PHE B 77 27.911 133.278 175.882 1.00 38.55 C ATOM 2160 O PHE B 77 27.395 133.804 176.873 1.00 35.13 O ATOM 2161 CB PHE B 77 26.392 132.800 173.925 1.00 38.60 C ATOM 2162 CG PHE B 77 25.158 132.761 174.772 1.00 40.14 C ATOM 2163 CD1 PHE B 77 24.190 133.737 174.630 1.00 37.63 C ATOM 2164 CD2 PHE B 77 24.971 131.765 175.722 1.00 33.72 C ATOM 2165 CE1 PHE B 77 23.051 133.712 175.406 1.00 34.12 C ATOM 2166 CE2 PHE B 77 23.836 131.742 176.505 1.00 30.41 C ATOM 2167 CZ PHE B 77 22.875 132.714 176.345 1.00 30.32 C ATOM 2168 H PHE B 77 28.693 132.966 172.822 1.00 0.00 H ATOM 2169 N ALA B 78 28.840 132.322 175.987 1.00 44.58 N ATOM 2170 CA ALA B 78 29.323 131.903 177.301 1.00 42.61 C ATOM 2171 C ALA B 78 30.086 133.021 177.999 1.00 41.51 C ATOM 2172 O ALA B 78 29.950 133.211 179.214 1.00 42.88 O ATOM 2173 CB ALA B 78 30.204 130.664 177.170 1.00 41.34 C ATOM 2174 H ALA B 78 29.221 131.874 175.129 1.00 0.00 H ATOM 2175 N ARG B 79 30.895 133.766 177.247 1.00 39.46 N ATOM 2176 CA ARG B 79 31.579 134.920 177.816 1.00 37.87 C ATOM 2177 C ARG B 79 30.578 135.970 178.279 1.00 41.06 C ATOM 2178 O ARG B 79 30.656 136.465 179.409 1.00 37.97 O ATOM 2179 CB ARG B 79 32.563 135.493 176.797 1.00 38.42 C ATOM 2180 CG ARG B 79 33.623 136.396 177.392 1.00 39.19 C ATOM 2181 CD ARG B 79 34.633 136.893 176.365 1.00 41.59 C ATOM 2182 NE ARG B 79 35.520 135.843 175.863 1.00 44.57 N ATOM 2183 CZ ARG B 79 35.326 135.113 174.764 1.00 49.83 C ATOM 2184 NH1 ARG B 79 36.227 134.202 174.420 1.00 47.08 N ATOM 2185 NH2 ARG B 79 34.250 135.284 174.007 1.00 47.89 N ATOM 2186 HE ARG B 79 36.380 135.648 176.414 1.00 0.00 H ATOM 2187 HH12 ARG B 79 36.085 133.627 173.565 1.00 0.00 H ATOM 2188 HH11 ARG B 79 37.075 134.062 175.006 1.00 0.00 H ATOM 2189 HH22 ARG B 79 34.117 134.705 173.154 1.00 0.00 H ATOM 2190 HH21 ARG B 79 33.539 135.998 174.267 1.00 0.00 H ATOM 2191 H ARG B 79 31.039 133.522 176.246 1.00 0.00 H ATOM 2192 N ASN B 80 29.590 136.277 177.436 1.00 40.54 N ATOM 2193 CA ASN B 80 28.634 137.326 177.747 1.00 37.14 C ATOM 2194 C ASN B 80 27.775 136.970 178.950 1.00 37.42 C ATOM 2195 O ASN B 80 27.217 137.870 179.587 1.00 49.41 O ATOM 2196 CB ASN B 80 27.768 137.590 176.512 1.00 36.93 C ATOM 2197 CG ASN B 80 28.586 138.067 175.319 1.00 35.47 C ATOM 2198 OD1 ASN B 80 29.766 138.386 175.443 1.00 37.37 O ATOM 2199 ND2 ASN B 80 27.963 138.093 174.150 1.00 35.70 N ATOM 2200 HD22 ASN B 80 26.963 137.815 174.088 1.00 0.00 H ATOM 2201 HD21 ASN B 80 28.474 138.391 173.295 1.00 0.00 H ATOM 2202 H ASN B 80 29.503 135.756 176.540 1.00 0.00 H ATOM 2203 N GLN B 81 27.655 135.682 179.276 1.00 37.12 N ATOM 2204 CA GLN B 81 26.915 135.221 180.441 1.00 39.31 C ATOM 2205 C GLN B 81 27.831 134.990 181.627 1.00 36.85 C ATOM 2206 O GLN B 81 27.367 134.545 182.683 1.00 39.16 O ATOM 2207 CB GLN B 81 26.140 133.933 180.117 1.00 49.97 C ATOM 2208 CG GLN B 81 25.056 134.082 179.061 1.00 57.30 C ATOM 2209 CD GLN B 81 23.977 135.053 179.486 1.00 65.53 C ATOM 2210 OE1 GLN B 81 23.327 134.868 180.511 1.00 67.06 O ATOM 2211 NE2 GLN B 81 23.770 136.094 178.681 1.00 68.00 N ATOM 2212 HE22 GLN B 81 24.346 136.210 177.823 1.00 0.00 H ATOM 2213 HE21 GLN B 81 23.033 136.791 178.911 1.00 0.00 H ATOM 2214 H GLN B 81 28.113 134.973 178.668 1.00 0.00 H ATOM 2215 N HIS B 82 29.111 135.301 181.489 1.00 36.45 N ATOM 2216 CA HIS B 82 30.058 135.154 182.584 1.00 39.92 C ATOM 2217 C HIS B 82 30.127 133.709 183.067 1.00 41.24 C ATOM 2218 O HIS B 82 30.270 133.430 184.255 1.00 41.46 O ATOM 2219 CB HIS B 82 29.701 136.115 183.717 1.00 40.75 C ATOM 2220 CG HIS B 82 29.535 137.534 183.258 1.00 48.30 C ATOM 2221 ND1 HIS B 82 28.803 138.474 183.951 1.00 52.67 N ATOM 2222 CD2 HIS B 82 30.023 138.174 182.168 1.00 51.04 C ATOM 2223 CE1 HIS B 82 28.843 139.626 183.303 1.00 52.21 C ATOM 2224 NE2 HIS B 82 29.574 139.469 182.216 1.00 48.24 N ATOM 2225 H HIS B 82 29.448 135.660 180.573 1.00 0.00 H ATOM 2226 N ALA B 83 29.999 132.773 182.135 1.00 40.39 N ATOM 2227 CA ALA B 83 30.130 131.359 182.442 1.00 34.64 C ATOM 2228 C ALA B 83 31.545 130.894 182.125 1.00 33.83 C ATOM 2229 O ALA B 83 32.170 131.344 181.161 1.00 34.00 O ATOM 2230 CB ALA B 83 29.118 130.522 181.664 1.00 32.97 C ATOM 2231 H ALA B 83 29.799 133.060 181.156 1.00 0.00 H ATOM 2232 N THR B 84 32.045 130.002 182.966 1.00 36.15 N ATOM 2233 CA THR B 84 33.318 129.345 182.769 1.00 37.39 C ATOM 2234 C THR B 84 33.152 127.842 182.586 1.00 40.92 C ATOM 2235 O THR B 84 34.146 127.138 182.359 1.00 43.25 O ATOM 2236 CB THR B 84 34.242 129.618 183.964 1.00 44.17 C ATOM 2237 OG1 THR B 84 33.574 129.218 185.165 1.00 49.31 O ATOM 2238 CG2 THR B 84 34.552 131.097 184.066 1.00 45.12 C ATOM 2239 HG1 THR B 84 32.736 129.736 185.263 1.00 0.00 H ATOM 2240 H THR B 84 31.493 129.761 183.814 1.00 0.00 H ATOM 2241 N VAL B 85 31.927 127.329 182.680 1.00 38.67 N ATOM 2242 CA VAL B 85 31.638 125.904 182.579 1.00 31.24 C ATOM 2243 C VAL B 85 30.588 125.701 181.494 1.00 32.05 C ATOM 2244 O VAL B 85 29.551 126.382 181.488 1.00 29.38 O ATOM 2245 CB VAL B 85 31.147 125.332 183.925 1.00 28.80 C ATOM 2246 CG1 VAL B 85 30.851 123.836 183.822 1.00 33.62 C ATOM 2247 CG2 VAL B 85 32.167 125.595 185.040 1.00 26.58 C ATOM 2248 H VAL B 85 31.132 127.981 182.834 1.00 0.00 H ATOM 2249 N LEU B 86 30.850 124.765 180.586 1.00 29.26 N ATOM 2250 CA LEU B 86 29.887 124.353 179.572 1.00 31.63 C ATOM 2251 C LEU B 86 29.466 122.918 179.871 1.00 28.33 C ATOM 2252 O LEU B 86 30.316 122.016 179.920 1.00 29.52 O ATOM 2253 CB LEU B 86 30.493 124.449 178.184 1.00 36.40 C ATOM 2254 CG LEU B 86 29.596 125.017 177.084 1.00 43.86 C ATOM 2255 CD1 LEU B 86 29.116 126.410 177.465 1.00 47.52 C ATOM 2256 CD2 LEU B 86 30.366 125.041 175.780 1.00 52.93 C ATOM 2257 H LEU B 86 31.783 124.307 180.600 1.00 0.00 H ATOM 2258 N ILE B 87 28.165 122.697 180.060 1.00 28.75 N ATOM 2259 CA ILE B 87 27.639 121.378 180.395 1.00 29.58 C ATOM 2260 C ILE B 87 27.016 120.747 179.169 1.00 29.35 C ATOM 2261 O ILE B 87 26.283 121.406 178.415 1.00 34.15 O ATOM 2262 CB ILE B 87 26.627 121.453 181.540 1.00 32.49 C ATOM 2263 CG1 ILE B 87 27.355 121.864 182.817 1.00 39.79 C ATOM 2264 CG2 ILE B 87 25.848 120.133 181.674 1.00 28.76 C ATOM 2265 CD1 ILE B 87 26.456 122.519 183.829 1.00 44.60 C ATOM 2266 H ILE B 87 27.502 123.493 179.965 1.00 0.00 H ATOM 2267 N ARG B 88 27.368 119.487 178.940 1.00 29.79 N ATOM 2268 CA ARG B 88 26.822 118.667 177.871 1.00 31.17 C ATOM 2269 C ARG B 88 26.540 117.293 178.455 1.00 29.12 C ATOM 2270 O ARG B 88 27.293 116.800 179.315 1.00 25.73 O ATOM 2271 CB ARG B 88 27.800 118.554 176.693 1.00 37.05 C ATOM 2272 CG ARG B 88 28.005 119.872 175.955 1.00 35.75 C ATOM 2273 CD ARG B 88 26.746 120.312 175.205 1.00 35.49 C ATOM 2274 NE ARG B 88 26.765 119.792 173.843 1.00 40.09 N ATOM 2275 CZ ARG B 88 25.742 119.828 172.995 1.00 50.55 C ATOM 2276 NH1 ARG B 88 24.581 120.348 173.361 1.00 56.76 N ATOM 2277 NH2 ARG B 88 25.879 119.328 171.774 1.00 55.42 N ATOM 2278 HE ARG B 88 27.649 119.358 173.508 1.00 0.00 H ATOM 2279 HH12 ARG B 88 23.787 120.371 172.690 1.00 0.00 H ATOM 2280 HH11 ARG B 88 24.463 120.733 174.320 1.00 0.00 H ATOM 2281 HH22 ARG B 88 25.080 119.355 171.108 1.00 0.00 H ATOM 2282 HH21 ARG B 88 26.785 118.909 171.482 1.00 0.00 H ATOM 2283 H ARG B 88 28.080 119.059 179.566 1.00 0.00 H ATOM 2284 N GLY B 89 25.457 116.676 177.990 1.00 29.37 N ATOM 2285 CA GLY B 89 25.103 115.357 178.448 1.00 27.74 C ATOM 2286 C GLY B 89 25.700 114.344 177.487 1.00 29.78 C ATOM 2287 O GLY B 89 25.725 114.551 176.271 1.00 41.05 O ATOM 2288 H GLY B 89 24.858 117.153 177.286 1.00 0.00 H ATOM 2289 N LEU B 90 26.201 113.259 178.049 1.00 35.94 N ATOM 2290 CA LEU B 90 26.853 112.210 177.285 1.00 43.75 C ATOM 2291 C LEU B 90 25.938 111.005 177.227 1.00 55.75 C ATOM 2292 O LEU B 90 25.621 110.408 178.267 1.00 72.16 O ATOM 2293 CB LEU B 90 28.182 111.834 177.927 1.00 47.75 C ATOM 2294 CG LEU B 90 29.345 112.630 177.337 1.00 54.99 C ATOM 2295 CD1 LEU B 90 30.674 112.040 177.755 1.00 53.63 C ATOM 2296 CD2 LEU B 90 29.219 112.646 175.818 1.00 59.48 C ATOM 2297 H LEU B 90 26.126 113.151 179.081 1.00 0.00 H ATOM 2298 N ARG B 91 25.534 110.631 176.015 1.00 54.61 N ATOM 2299 CA ARG B 91 24.651 109.488 175.814 1.00 60.75 C ATOM 2300 C ARG B 91 25.412 108.304 175.227 1.00 62.12 C ATOM 2301 O ARG B 91 25.662 107.321 175.926 1.00 60.81 O ATOM 2302 CB ARG B 91 23.481 109.877 174.916 1.00 66.07 C ATOM 2303 CG ARG B 91 22.129 109.596 175.532 1.00 73.23 C ATOM 2304 CD ARG B 91 21.076 109.528 174.457 1.00 78.71 C ATOM 2305 NE ARG B 91 21.478 110.308 173.295 1.00 80.26 N ATOM 2306 CZ ARG B 91 20.996 111.508 172.999 1.00 80.41 C ATOM 2307 NH1 ARG B 91 21.431 112.146 171.924 1.00 80.59 N ATOM 2308 NH2 ARG B 91 20.072 112.063 173.769 1.00 83.02 N ATOM 2309 HE ARG B 91 22.189 109.898 172.656 1.00 0.00 H ATOM 2310 HH12 ARG B 91 21.055 113.087 171.690 1.00 0.00 H ATOM 2311 HH11 ARG B 91 22.149 111.706 171.313 1.00 0.00 H ATOM 2312 HH22 ARG B 91 19.696 113.004 173.534 1.00 0.00 H ATOM 2313 HH21 ARG B 91 19.722 111.558 174.608 1.00 0.00 H ATOM 2314 H ARG B 91 25.858 111.170 175.187 1.00 0.00 H ATOM 2315 N ALA B 92 25.858 108.397 173.975 1.00 65.60 N ATOM 2316 CA ALA B 92 26.463 107.252 173.307 1.00 64.34 C ATOM 2317 C ALA B 92 27.784 107.629 172.631 1.00 67.48 C ATOM 2318 O ALA B 92 28.190 108.798 172.579 1.00 74.13 O ATOM 2319 CB ALA B 92 25.498 106.652 172.277 1.00 62.25 C ATOM 2320 H ALA B 92 25.773 109.300 173.467 1.00 0.00 H ATOM 2321 N VAL B 93 28.432 106.597 172.075 1.00 64.32 N ATOM 2322 CA VAL B 93 29.755 106.733 171.458 1.00 64.03 C ATOM 2323 C VAL B 93 29.731 107.706 170.280 1.00 69.90 C ATOM 2324 O VAL B 93 30.680 108.472 170.069 1.00 74.04 O ATOM 2325 CB VAL B 93 30.264 105.335 171.045 1.00 62.22 C ATOM 2326 CG1 VAL B 93 31.073 105.384 169.744 1.00 64.78 C ATOM 2327 CG2 VAL B 93 31.069 104.682 172.175 1.00 56.69 C ATOM 2328 H VAL B 93 27.978 105.661 172.081 1.00 0.00 H ATOM 2329 N ALA B 94 28.614 107.766 169.552 1.00 67.71 N ATOM 2330 CA ALA B 94 28.552 108.649 168.389 1.00 63.00 C ATOM 2331 C ALA B 94 28.355 110.108 168.793 1.00 63.19 C ATOM 2332 O ALA B 94 28.859 111.010 168.112 1.00 62.03 O ATOM 2333 CB ALA B 94 27.444 108.178 167.448 1.00 64.71 C ATOM 2334 H ALA B 94 27.790 107.186 169.811 1.00 0.00 H ATOM 2335 N ASP B 95 27.673 110.360 169.911 1.00 61.97 N ATOM 2336 CA ASP B 95 27.563 111.720 170.427 1.00 62.91 C ATOM 2337 C ASP B 95 28.911 112.163 170.961 1.00 53.12 C ATOM 2338 O ASP B 95 29.364 113.284 170.705 1.00 55.02 O ATOM 2339 CB ASP B 95 26.514 111.791 171.546 1.00 73.60 C ATOM 2340 CG ASP B 95 25.208 111.107 171.178 1.00 81.78 C ATOM 2341 OD1 ASP B 95 24.755 111.261 170.030 1.00 83.83 O ATOM 2342 OD2 ASP B 95 24.658 110.373 172.026 1.00 83.72 O ATOM 2343 H ASP B 95 27.214 109.578 170.421 1.00 0.00 H ATOM 2344 N PHE B 96 29.575 111.254 171.673 1.00 47.20 N ATOM 2345 CA PHE B 96 30.870 111.511 172.288 1.00 45.82 C ATOM 2346 C PHE B 96 31.897 112.095 171.321 1.00 40.98 C ATOM 2347 O PHE B 96 32.494 113.135 171.603 1.00 36.77 O ATOM 2348 CB PHE B 96 31.365 110.202 172.894 1.00 49.39 C ATOM 2349 CG PHE B 96 32.756 110.265 173.406 1.00 52.97 C ATOM 2350 CD1 PHE B 96 33.055 110.955 174.563 1.00 59.36 C ATOM 2351 CD2 PHE B 96 33.777 109.629 172.720 1.00 48.25 C ATOM 2352 CE1 PHE B 96 34.352 111.019 175.026 1.00 58.59 C ATOM 2353 CE2 PHE B 96 35.074 109.685 173.181 1.00 52.24 C ATOM 2354 CZ PHE B 96 35.360 110.382 174.338 1.00 54.37 C ATOM 2355 H PHE B 96 29.147 110.314 171.796 1.00 0.00 H ATOM 2356 N GLU B 97 32.102 111.464 170.166 1.00 39.24 N ATOM 2357 CA GLU B 97 33.139 111.954 169.262 1.00 40.84 C ATOM 2358 C GLU B 97 32.814 113.346 168.738 1.00 39.29 C ATOM 2359 O GLU B 97 33.712 114.184 168.586 1.00 36.96 O ATOM 2360 CB GLU B 97 33.345 110.969 168.126 1.00 49.58 C ATOM 2361 CG GLU B 97 34.454 110.002 168.466 1.00 65.17 C ATOM 2362 CD GLU B 97 34.704 108.959 167.411 1.00 72.52 C ATOM 2363 OE1 GLU B 97 33.773 108.635 166.645 1.00 75.94 O ATOM 2364 OE2 GLU B 97 35.852 108.472 167.352 1.00 69.05 O ATOM 2365 H GLU B 97 31.531 110.633 169.911 1.00 0.00 H ATOM 2366 N TYR B 98 31.538 113.639 168.521 1.00 34.58 N ATOM 2367 CA TYR B 98 31.171 114.971 168.076 1.00 30.86 C ATOM 2368 C TYR B 98 31.334 115.975 169.202 1.00 34.55 C ATOM 2369 O TYR B 98 31.812 117.087 168.968 1.00 39.10 O ATOM 2370 CB TYR B 98 29.721 114.976 167.575 1.00 33.37 C ATOM 2371 CG TYR B 98 29.210 116.345 167.176 1.00 39.30 C ATOM 2372 CD1 TYR B 98 29.809 117.060 166.154 1.00 41.03 C ATOM 2373 CD2 TYR B 98 28.134 116.926 167.832 1.00 42.68 C ATOM 2374 CE1 TYR B 98 29.345 118.309 165.783 1.00 41.35 C ATOM 2375 CE2 TYR B 98 27.659 118.176 167.469 1.00 36.55 C ATOM 2376 CZ TYR B 98 28.267 118.862 166.447 1.00 42.00 C ATOM 2377 OH TYR B 98 27.810 120.107 166.078 1.00 46.93 O ATOM 2378 HH TYR B 98 28.361 120.451 165.331 1.00 0.00 H ATOM 2379 H TYR B 98 30.804 112.917 168.669 1.00 0.00 H ATOM 2380 N GLU B 99 30.981 115.584 170.431 1.00 40.82 N ATOM 2381 CA GLU B 99 31.148 116.445 171.599 1.00 38.98 C ATOM 2382 C GLU B 99 32.607 116.817 171.826 1.00 36.34 C ATOM 2383 O GLU B 99 32.892 117.880 172.381 1.00 39.32 O ATOM 2384 CB GLU B 99 30.555 115.762 172.843 1.00 36.77 C ATOM 2385 CG GLU B 99 29.043 115.617 172.827 1.00 37.40 C ATOM 2386 CD GLU B 99 28.328 116.960 172.780 1.00 45.34 C ATOM 2387 OE1 GLU B 99 28.919 117.976 173.191 1.00 48.81 O ATOM 2388 OE2 GLU B 99 27.168 116.995 172.325 1.00 48.57 O ATOM 2389 H GLU B 99 30.574 114.636 170.559 1.00 0.00 H ATOM 2390 N MET B 100 33.534 115.970 171.408 1.00 41.22 N ATOM 2391 CA MET B 100 34.957 116.251 171.542 1.00 44.42 C ATOM 2392 C MET B 100 35.404 117.301 170.533 1.00 40.75 C ATOM 2393 O MET B 100 36.137 118.229 170.887 1.00 36.22 O ATOM 2394 CB MET B 100 35.767 114.968 171.346 1.00 47.10 C ATOM 2395 CG MET B 100 35.278 113.836 172.203 1.00 62.62 C ATOM 2396 SD MET B 100 35.973 113.875 173.854 1.00 74.60 S ATOM 2397 CE MET B 100 37.568 113.155 173.450 1.00 66.74 C ATOM 2398 H MET B 100 33.237 115.075 170.970 1.00 0.00 H ATOM 2399 N GLN B 101 35.007 117.154 169.266 1.00 36.95 N ATOM 2400 CA GLN B 101 35.311 118.178 168.274 1.00 35.17 C ATOM 2401 C GLN B 101 34.745 119.508 168.751 1.00 37.84 C ATOM 2402 O GLN B 101 35.403 120.554 168.671 1.00 42.88 O ATOM 2403 CB GLN B 101 34.689 117.807 166.931 1.00 34.75 C ATOM 2404 CG GLN B 101 34.859 116.369 166.551 1.00 37.93 C ATOM 2405 CD GLN B 101 34.706 116.116 165.079 1.00 45.57 C ATOM 2406 OE1 GLN B 101 33.929 116.787 164.400 1.00 47.35 O ATOM 2407 NE2 GLN B 101 35.448 115.137 164.570 1.00 55.76 N ATOM 2408 HE22 GLN B 101 36.090 114.598 165.185 1.00 0.00 H ATOM 2409 HE21 GLN B 101 35.386 114.910 163.557 1.00 0.00 H ATOM 2410 H GLN B 101 34.478 116.304 168.986 1.00 0.00 H ATOM 2411 N LEU B 102 33.505 119.476 169.258 1.00 33.88 N ATOM 2412 CA LEU B 102 32.884 120.693 169.762 1.00 35.24 C ATOM 2413 C LEU B 102 33.711 121.309 170.888 1.00 34.36 C ATOM 2414 O LEU B 102 34.106 122.487 170.816 1.00 31.15 O ATOM 2415 CB LEU B 102 31.479 120.389 170.272 1.00 37.62 C ATOM 2416 CG LEU B 102 30.384 121.219 169.634 1.00 38.60 C ATOM 2417 CD1 LEU B 102 30.401 121.008 168.129 1.00 42.24 C ATOM 2418 CD2 LEU B 102 29.068 120.799 170.238 1.00 38.16 C ATOM 2419 H LEU B 102 32.983 118.577 169.292 1.00 0.00 H ATOM 2420 N ALA B 103 33.993 120.530 171.925 1.00 34.35 N ATOM 2421 CA ALA B 103 34.648 121.066 173.109 1.00 34.16 C ATOM 2422 C ALA B 103 36.035 121.612 172.780 1.00 31.09 C ATOM 2423 O ALA B 103 36.443 122.666 173.298 1.00 26.97 O ATOM 2424 CB ALA B 103 34.706 119.991 174.184 1.00 26.43 C ATOM 2425 H ALA B 103 33.742 119.521 171.891 1.00 0.00 H ATOM 2426 N HIS B 104 36.765 120.916 171.908 1.00 25.93 N ATOM 2427 CA HIS B 104 38.054 121.426 171.467 1.00 27.71 C ATOM 2428 C HIS B 104 37.895 122.711 170.665 1.00 26.88 C ATOM 2429 O HIS B 104 38.733 123.612 170.761 1.00 29.21 O ATOM 2430 CB HIS B 104 38.791 120.364 170.659 1.00 25.50 C ATOM 2431 CG HIS B 104 39.415 119.300 171.501 1.00 24.81 C ATOM 2432 ND1 HIS B 104 39.002 117.986 171.466 1.00 24.81 N ATOM 2433 CD2 HIS B 104 40.418 119.356 172.408 1.00 23.32 C ATOM 2434 CE1 HIS B 104 39.730 117.274 172.305 1.00 24.72 C ATOM 2435 NE2 HIS B 104 40.592 118.083 172.896 1.00 28.62 N ATOM 2436 H HIS B 104 36.413 120.008 171.543 1.00 0.00 H ATOM 2437 N MET B 105 36.836 122.812 169.858 1.00 29.71 N ATOM 2438 CA MET B 105 36.583 124.060 169.145 1.00 33.35 C ATOM 2439 C MET B 105 36.255 125.176 170.122 1.00 40.25 C ATOM 2440 O MET B 105 36.800 126.283 170.021 1.00 44.11 O ATOM 2441 CB MET B 105 35.448 123.878 168.141 1.00 28.91 C ATOM 2442 CG MET B 105 35.216 125.067 167.213 1.00 30.48 C ATOM 2443 SD MET B 105 36.705 125.740 166.446 1.00 31.97 S ATOM 2444 CE MET B 105 36.904 124.620 165.065 1.00 26.37 C ATOM 2445 H MET B 105 36.193 122.003 169.738 1.00 0.00 H ATOM 2446 N ASN B 106 35.392 124.889 171.095 1.00 38.64 N ATOM 2447 CA ASN B 106 35.050 125.884 172.098 1.00 34.54 C ATOM 2448 C ASN B 106 36.256 126.236 172.958 1.00 40.32 C ATOM 2449 O ASN B 106 36.385 127.384 173.400 1.00 35.91 O ATOM 2450 CB ASN B 106 33.899 125.366 172.957 1.00 32.74 C ATOM 2451 CG ASN B 106 32.557 125.481 172.263 1.00 32.25 C ATOM 2452 OD1 ASN B 106 32.358 126.349 171.416 1.00 42.43 O ATOM 2453 ND2 ASN B 106 31.630 124.591 172.607 1.00 28.14 N ATOM 2454 HD22 ASN B 106 31.841 123.873 173.329 1.00 0.00 H ATOM 2455 HD21 ASN B 106 30.694 124.613 172.154 1.00 0.00 H ATOM 2456 H ASN B 106 34.959 123.944 171.138 1.00 0.00 H ATOM 2457 N ARG B 107 37.163 125.278 173.183 1.00 38.68 N ATOM 2458 CA ARG B 107 38.372 125.589 173.938 1.00 38.31 C ATOM 2459 C ARG B 107 39.277 126.521 173.147 1.00 37.77 C ATOM 2460 O ARG B 107 39.849 127.463 173.705 1.00 44.51 O ATOM 2461 CB ARG B 107 39.125 124.307 174.303 1.00 42.21 C ATOM 2462 CG ARG B 107 40.143 124.487 175.422 1.00 38.65 C ATOM 2463 CD ARG B 107 40.781 123.172 175.809 1.00 33.24 C ATOM 2464 NE ARG B 107 39.992 122.423 176.779 1.00 34.53 N ATOM 2465 CZ ARG B 107 40.125 121.116 176.992 1.00 34.50 C ATOM 2466 NH1 ARG B 107 41.016 120.418 176.299 1.00 27.22 N ATOM 2467 NH2 ARG B 107 39.366 120.508 177.896 1.00 35.30 N ATOM 2468 HE ARG B 107 39.283 122.940 177.338 1.00 0.00 H ATOM 2469 HH12 ARG B 107 41.120 119.397 176.465 1.00 0.00 H ATOM 2470 HH11 ARG B 107 41.610 120.892 175.589 1.00 0.00 H ATOM 2471 HH22 ARG B 107 39.471 119.487 178.061 1.00 0.00 H ATOM 2472 HH21 ARG B 107 38.666 121.053 178.439 1.00 0.00 H ATOM 2473 H ARG B 107 37.007 124.316 172.821 1.00 0.00 H ATOM 2474 N HIS B 108 39.408 126.273 171.842 1.00 35.13 N ATOM 2475 CA HIS B 108 40.147 127.176 170.967 1.00 35.20 C ATOM 2476 C HIS B 108 39.600 128.597 171.027 1.00 36.97 C ATOM 2477 O HIS B 108 40.366 129.565 171.078 1.00 43.08 O ATOM 2478 CB HIS B 108 40.087 126.665 169.532 1.00 34.64 C ATOM 2479 CG HIS B 108 40.699 127.604 168.540 1.00 42.29 C ATOM 2480 ND1 HIS B 108 42.061 127.693 168.346 1.00 41.38 N ATOM 2481 CD2 HIS B 108 40.138 128.518 167.712 1.00 39.77 C ATOM 2482 CE1 HIS B 108 42.311 128.606 167.423 1.00 38.22 C ATOM 2483 NE2 HIS B 108 41.162 129.122 167.025 1.00 39.44 N ATOM 2484 H HIS B 108 38.974 125.418 171.441 1.00 0.00 H ATOM 2485 N LEU B 109 38.278 128.744 170.995 1.00 37.53 N ATOM 2486 CA LEU B 109 37.661 130.061 170.936 1.00 38.29 C ATOM 2487 C LEU B 109 37.624 130.747 172.295 1.00 38.90 C ATOM 2488 O LEU B 109 37.663 131.979 172.363 1.00 43.94 O ATOM 2489 CB LEU B 109 36.253 129.936 170.356 1.00 36.47 C ATOM 2490 CG LEU B 109 36.259 129.352 168.942 1.00 37.86 C ATOM 2491 CD1 LEU B 109 34.882 128.877 168.526 1.00 34.89 C ATOM 2492 CD2 LEU B 109 36.802 130.382 167.959 1.00 41.23 C ATOM 2493 H LEU B 109 37.672 127.899 171.013 1.00 0.00 H ATOM 2494 N MET B 110 37.560 129.976 173.377 1.00 43.23 N ATOM 2495 CA MET B 110 37.506 130.528 174.730 1.00 39.33 C ATOM 2496 C MET B 110 38.220 129.548 175.644 1.00 40.56 C ATOM 2497 O MET B 110 37.599 128.655 176.236 1.00 37.50 O ATOM 2498 CB MET B 110 36.068 130.765 175.188 1.00 36.26 C ATOM 2499 CG MET B 110 35.911 131.662 176.403 1.00 36.02 C ATOM 2500 SD MET B 110 34.173 131.883 176.826 1.00 35.71 S ATOM 2501 CE MET B 110 34.283 132.182 178.584 1.00 36.47 C ATOM 2502 H MET B 110 37.548 128.943 173.256 1.00 0.00 H ATOM 2503 N PRO B 111 39.542 129.684 175.780 1.00 43.08 N ATOM 2504 CA PRO B 111 40.311 128.707 176.570 1.00 41.36 C ATOM 2505 C PRO B 111 39.827 128.521 177.997 1.00 39.42 C ATOM 2506 O PRO B 111 39.917 127.405 178.519 1.00 48.47 O ATOM 2507 CB PRO B 111 41.732 129.286 176.526 1.00 40.99 C ATOM 2508 CG PRO B 111 41.778 130.004 175.211 1.00 42.36 C ATOM 2509 CD PRO B 111 40.422 130.647 175.091 1.00 42.14 C ATOM 2510 N GLU B 112 39.322 129.561 178.653 1.00 40.77 N ATOM 2511 CA GLU B 112 38.907 129.407 180.042 1.00 42.41 C ATOM 2512 C GLU B 112 37.505 128.831 180.178 1.00 44.85 C ATOM 2513 O GLU B 112 37.039 128.638 181.304 1.00 56.21 O ATOM 2514 CB GLU B 112 38.984 130.748 180.776 1.00 43.92 C ATOM 2515 CG GLU B 112 37.883 131.737 180.418 1.00 46.70 C ATOM 2516 CD GLU B 112 38.118 132.464 179.108 1.00 52.12 C ATOM 2517 OE1 GLU B 112 39.005 132.046 178.329 1.00 48.49 O ATOM 2518 OE2 GLU B 112 37.414 133.470 178.865 1.00 58.91 O ATOM 2519 H GLU B 112 39.223 130.481 178.177 1.00 0.00 H ATOM 2520 N LEU B 113 36.828 128.540 179.074 1.00 39.72 N ATOM 2521 CA LEU B 113 35.505 127.934 179.121 1.00 41.80 C ATOM 2522 C LEU B 113 35.693 126.426 179.062 1.00 38.38 C ATOM 2523 O LEU B 113 36.051 125.872 178.016 1.00 34.96 O ATOM 2524 CB LEU B 113 34.640 128.434 177.964 1.00 39.63 C ATOM 2525 CG LEU B 113 33.269 127.770 177.825 1.00 29.32 C ATOM 2526 CD1 LEU B 113 32.341 128.161 178.967 1.00 22.75 C ATOM 2527 CD2 LEU B 113 32.666 128.086 176.476 1.00 24.17 C ATOM 2528 H LEU B 113 37.255 128.751 178.149 1.00 0.00 H ATOM 2529 N GLU B 114 35.397 125.763 180.168 1.00 35.44 N ATOM 2530 CA GLU B 114 35.706 124.355 180.342 1.00 33.82 C ATOM 2531 C GLU B 114 34.454 123.530 180.080 1.00 32.86 C ATOM 2532 O GLU B 114 33.400 123.795 180.664 1.00 44.59 O ATOM 2533 CB GLU B 114 36.231 124.125 181.762 1.00 34.12 C ATOM 2534 CG GLU B 114 37.054 122.872 181.985 1.00 43.97 C ATOM 2535 CD GLU B 114 38.276 122.798 181.098 1.00 44.54 C ATOM 2536 OE1 GLU B 114 39.111 123.733 181.144 1.00 42.65 O ATOM 2537 OE2 GLU B 114 38.398 121.799 180.360 1.00 45.78 O ATOM 2538 H GLU B 114 34.924 126.270 180.943 1.00 0.00 H ATOM 2539 N SER B 115 34.572 122.528 179.215 1.00 32.96 N ATOM 2540 CA SER B 115 33.464 121.629 178.913 1.00 32.67 C ATOM 2541 C SER B 115 33.459 120.475 179.907 1.00 39.39 C ATOM 2542 O SER B 115 34.501 119.860 180.164 1.00 48.85 O ATOM 2543 CB SER B 115 33.572 121.087 177.486 1.00 32.01 C ATOM 2544 OG SER B 115 33.133 122.031 176.524 1.00 33.76 O ATOM 2545 HG SER B 115 33.219 121.642 175.618 1.00 0.00 H ATOM 2546 H SER B 115 35.484 122.380 178.738 1.00 0.00 H ATOM 2547 N VAL B 116 32.294 120.191 180.480 1.00 35.40 N ATOM 2548 CA VAL B 116 32.148 119.076 181.405 1.00 41.15 C ATOM 2549 C VAL B 116 30.958 118.238 180.966 1.00 36.91 C ATOM 2550 O VAL B 116 29.931 118.764 180.522 1.00 37.96 O ATOM 2551 CB VAL B 116 31.997 119.530 182.875 1.00 42.04 C ATOM 2552 CG1 VAL B 116 33.019 120.600 183.206 1.00 49.73 C ATOM 2553 CG2 VAL B 116 30.596 120.007 183.168 1.00 35.97 C ATOM 2554 H VAL B 116 31.465 120.780 180.262 1.00 0.00 H ATOM 2555 N PHE B 117 31.111 116.929 181.067 1.00 34.09 N ATOM 2556 CA PHE B 117 30.132 115.995 180.554 1.00 32.51 C ATOM 2557 C PHE B 117 29.487 115.253 181.708 1.00 34.21 C ATOM 2558 O PHE B 117 30.175 114.670 182.556 1.00 34.12 O ATOM 2559 CB PHE B 117 30.777 115.035 179.560 1.00 34.06 C ATOM 2560 CG PHE B 117 31.426 115.730 178.398 1.00 41.36 C ATOM 2561 CD1 PHE B 117 30.685 116.063 177.269 1.00 46.15 C ATOM 2562 CD2 PHE B 117 32.764 116.077 178.441 1.00 36.76 C ATOM 2563 CE1 PHE B 117 31.276 116.720 176.197 1.00 45.74 C ATOM 2564 CE2 PHE B 117 33.363 116.731 177.375 1.00 40.84 C ATOM 2565 CZ PHE B 117 32.619 117.051 176.249 1.00 44.85 C ATOM 2566 H PHE B 117 31.964 116.558 181.531 1.00 0.00 H ATOM 2567 N LEU B 118 28.173 115.318 181.752 1.00 30.45 N ATOM 2568 CA LEU B 118 27.390 114.581 182.716 1.00 29.94 C ATOM 2569 C LEU B 118 26.757 113.397 182.011 1.00 32.68 C ATOM 2570 O LEU B 118 26.562 113.397 180.794 1.00 33.68 O ATOM 2571 CB LEU B 118 26.304 115.467 183.333 1.00 33.43 C ATOM 2572 CG LEU B 118 26.760 116.723 184.076 1.00 34.16 C ATOM 2573 CD1 LEU B 118 25.587 117.389 184.778 1.00 32.02 C ATOM 2574 CD2 LEU B 118 27.844 116.375 185.074 1.00 34.92 C ATOM 2575 H LEU B 118 27.679 115.924 181.066 1.00 0.00 H ATOM 2576 N MET B 119 26.438 112.390 182.786 1.00 33.36 N ATOM 2577 CA MET B 119 25.890 111.172 182.244 1.00 38.02 C ATOM 2578 C MET B 119 24.449 111.051 182.717 1.00 42.48 C ATOM 2579 O MET B 119 24.196 111.182 183.922 1.00 40.64 O ATOM 2580 CB MET B 119 26.714 109.975 182.707 1.00 40.64 C ATOM 2581 CG MET B 119 26.236 108.644 182.203 1.00 54.32 C ATOM 2582 SD MET B 119 27.104 107.353 183.104 1.00 59.64 S ATOM 2583 CE MET B 119 26.302 107.500 184.705 1.00 54.26 C ATOM 2584 H MET B 119 26.583 112.471 183.813 1.00 0.00 H ATOM 2585 N PRO B 120 23.475 110.860 181.840 1.00 43.77 N ATOM 2586 CA PRO B 120 22.084 110.844 182.281 1.00 42.19 C ATOM 2587 C PRO B 120 21.810 109.513 182.969 1.00 39.57 C ATOM 2588 O PRO B 120 22.603 108.577 182.907 1.00 38.18 O ATOM 2589 CB PRO B 120 21.307 110.943 180.975 1.00 43.32 C ATOM 2590 CG PRO B 120 22.193 110.173 180.014 1.00 42.79 C ATOM 2591 CD PRO B 120 23.579 110.649 180.387 1.00 41.67 C ATOM 2592 N SER B 121 20.646 109.429 183.598 1.00 35.25 N ATOM 2593 CA SER B 121 20.212 108.169 184.177 1.00 34.20 C ATOM 2594 C SER B 121 19.970 107.131 183.073 1.00 31.88 C ATOM 2595 O SER B 121 19.756 107.459 181.909 1.00 31.32 O ATOM 2596 CB SER B 121 18.959 108.409 185.029 1.00 32.38 C ATOM 2597 OG SER B 121 18.056 107.324 185.029 1.00 43.29 O ATOM 2598 HG SER B 121 17.275 107.546 185.595 1.00 0.00 H ATOM 2599 H SER B 121 20.040 110.270 183.678 1.00 0.00 H ATOM 2600 N LYS B 122 20.031 105.853 183.448 1.00 36.94 N ATOM 2601 CA LYS B 122 19.763 104.787 182.481 1.00 38.38 C ATOM 2602 C LYS B 122 18.387 104.969 181.845 1.00 34.37 C ATOM 2603 O LYS B 122 18.189 104.657 180.664 1.00 30.05 O ATOM 2604 CB LYS B 122 19.879 103.418 183.153 1.00 43.68 C ATOM 2605 CG LYS B 122 21.114 103.244 184.038 1.00 54.87 C ATOM 2606 CD LYS B 122 21.327 101.788 184.419 1.00 53.62 C ATOM 2607 CE LYS B 122 20.322 101.340 185.467 1.00 53.41 C ATOM 2608 NZ LYS B 122 20.460 102.048 186.777 1.00 59.28 N ATOM 2609 HZ1 LYS B 122 21.409 101.875 187.165 1.00 0.00 H ATOM 2610 HZ2 LYS B 122 20.323 103.069 186.634 1.00 0.00 H ATOM 2611 HZ3 LYS B 122 19.743 101.691 187.440 1.00 0.00 H ATOM 2612 H LYS B 122 20.270 105.612 184.431 1.00 0.00 H ATOM 2613 N GLU B 123 17.421 105.468 182.621 1.00 30.18 N ATOM 2614 CA GLU B 123 16.061 105.743 182.159 1.00 29.88 C ATOM 2615 C GLU B 123 16.039 106.494 180.828 1.00 30.72 C ATOM 2616 O GLU B 123 15.251 106.153 179.938 1.00 34.59 O ATOM 2617 CB GLU B 123 15.314 106.529 183.237 1.00 32.15 C ATOM 2618 CG GLU B 123 13.807 106.399 183.206 1.00 34.00 C ATOM 2619 CD GLU B 123 13.356 104.961 182.989 1.00 42.43 C ATOM 2620 OE1 GLU B 123 13.911 104.040 183.632 1.00 46.80 O ATOM 2621 OE2 GLU B 123 12.430 104.751 182.175 1.00 41.76 O ATOM 2622 H GLU B 123 17.650 105.674 183.614 1.00 0.00 H ATOM 2623 N TRP B 124 16.912 107.496 180.678 1.00 29.17 N ATOM 2624 CA TRP B 124 16.981 108.374 179.509 1.00 34.07 C ATOM 2625 C TRP B 124 18.217 108.128 178.647 1.00 37.31 C ATOM 2626 O TRP B 124 18.550 108.952 177.787 1.00 40.83 O ATOM 2627 CB TRP B 124 16.940 109.832 179.943 1.00 29.74 C ATOM 2628 CG TRP B 124 16.028 110.043 181.107 1.00 29.44 C ATOM 2629 CD1 TRP B 124 16.368 110.507 182.344 1.00 27.42 C ATOM 2630 CD2 TRP B 124 14.627 109.749 181.163 1.00 31.20 C ATOM 2631 NE1 TRP B 124 15.263 110.549 183.156 1.00 29.29 N ATOM 2632 CE2 TRP B 124 14.181 110.085 182.458 1.00 35.09 C ATOM 2633 CE3 TRP B 124 13.702 109.247 180.241 1.00 30.32 C ATOM 2634 CZ2 TRP B 124 12.850 109.931 182.855 1.00 39.72 C ATOM 2635 CZ3 TRP B 124 12.386 109.093 180.638 1.00 39.40 C ATOM 2636 CH2 TRP B 124 11.970 109.433 181.932 1.00 41.10 C ATOM 2637 HE1 TRP B 124 15.250 110.880 184.142 1.00 0.00 H ATOM 2638 H TRP B 124 17.591 107.663 181.448 1.00 0.00 H ATOM 2639 N SER B 125 18.907 107.014 178.847 1.00 40.30 N ATOM 2640 CA SER B 125 20.148 106.768 178.117 1.00 39.58 C ATOM 2641 C SER B 125 19.930 106.355 176.665 1.00 36.58 C ATOM 2642 O SER B 125 20.910 106.184 175.938 1.00 36.75 O ATOM 2643 CB SER B 125 20.978 105.695 178.835 1.00 39.97 C ATOM 2644 OG SER B 125 21.773 106.279 179.848 1.00 52.68 O ATOM 2645 HG SER B 125 21.187 106.728 180.508 1.00 0.00 H ATOM 2646 H SER B 125 18.562 106.309 179.529 1.00 0.00 H ATOM 2647 N PHE B 126 18.686 106.190 176.217 1.00 39.78 N ATOM 2648 CA PHE B 126 18.428 105.741 174.853 1.00 36.66 C ATOM 2649 C PHE B 126 17.401 106.594 174.126 1.00 34.44 C ATOM 2650 O PHE B 126 16.887 106.165 173.090 1.00 34.67 O ATOM 2651 CB PHE B 126 17.982 104.274 174.836 1.00 41.82 C ATOM 2652 CG PHE B 126 18.974 103.342 175.460 1.00 42.11 C ATOM 2653 CD1 PHE B 126 20.040 102.849 174.723 1.00 40.65 C ATOM 2654 CD2 PHE B 126 18.854 102.971 176.790 1.00 40.47 C ATOM 2655 CE1 PHE B 126 20.963 102.000 175.302 1.00 42.12 C ATOM 2656 CE2 PHE B 126 19.773 102.123 177.374 1.00 41.11 C ATOM 2657 CZ PHE B 126 20.829 101.638 176.633 1.00 43.77 C ATOM 2658 H PHE B 126 17.885 106.385 176.851 1.00 0.00 H ATOM 2659 N ILE B 127 17.069 107.769 174.640 1.00 36.58 N ATOM 2660 CA ILE B 127 16.126 108.639 173.965 1.00 31.32 C ATOM 2661 C ILE B 127 16.865 109.863 173.454 1.00 30.52 C ATOM 2662 O ILE B 127 17.971 110.195 173.887 1.00 29.45 O ATOM 2663 CB ILE B 127 14.940 109.055 174.859 1.00 35.18 C ATOM 2664 CG1 ILE B 127 15.420 109.849 176.068 1.00 37.62 C ATOM 2665 CG2 ILE B 127 14.151 107.825 175.299 1.00 35.42 C ATOM 2666 CD1 ILE B 127 14.344 110.721 176.659 1.00 35.70 C ATOM 2667 H ILE B 127 17.491 108.072 175.541 1.00 0.00 H ATOM 2668 N SER B 128 16.224 110.533 172.506 1.00 34.90 N ATOM 2669 CA SER B 128 16.690 111.779 171.932 1.00 36.98 C ATOM 2670 C SER B 128 15.453 112.566 171.545 1.00 37.20 C ATOM 2671 O SER B 128 14.360 112.003 171.434 1.00 37.72 O ATOM 2672 CB SER B 128 17.582 111.541 170.712 1.00 34.68 C ATOM 2673 OG SER B 128 16.871 110.848 169.703 1.00 37.98 O ATOM 2674 HG SER B 128 17.464 110.704 168.923 1.00 0.00 H ATOM 2675 H SER B 128 15.329 110.139 172.152 1.00 0.00 H ATOM 2676 N SER B 129 15.627 113.876 171.346 1.00 36.28 N ATOM 2677 CA SER B 129 14.531 114.678 170.813 1.00 37.26 C ATOM 2678 C SER B 129 14.031 114.079 169.506 1.00 37.79 C ATOM 2679 O SER B 129 12.824 113.895 169.308 1.00 42.11 O ATOM 2680 CB SER B 129 14.991 116.122 170.598 1.00 40.47 C ATOM 2681 OG SER B 129 14.944 116.899 171.786 1.00 46.55 O ATOM 2682 HG SER B 129 14.014 116.925 172.125 1.00 0.00 H ATOM 2683 H SER B 129 16.540 114.322 171.570 1.00 0.00 H ATOM 2684 N SER B 130 14.964 113.700 168.631 1.00 36.07 N ATOM 2685 CA SER B 130 14.622 113.142 167.324 1.00 35.60 C ATOM 2686 C SER B 130 13.771 111.886 167.455 1.00 36.23 C ATOM 2687 O SER B 130 12.751 111.734 166.774 1.00 37.08 O ATOM 2688 CB SER B 130 15.910 112.837 166.558 1.00 38.41 C ATOM 2689 OG SER B 130 15.644 112.256 165.293 1.00 51.05 O ATOM 2690 HG SER B 130 16.499 112.073 164.829 1.00 0.00 H ATOM 2691 H SER B 130 15.967 113.805 168.887 1.00 0.00 H ATOM 2692 N LEU B 131 14.184 110.969 168.329 1.00 35.28 N ATOM 2693 CA LEU B 131 13.501 109.690 168.460 1.00 32.20 C ATOM 2694 C LEU B 131 12.082 109.874 168.981 1.00 32.79 C ATOM 2695 O LEU B 131 11.131 109.296 168.439 1.00 25.82 O ATOM 2696 CB LEU B 131 14.296 108.799 169.403 1.00 31.45 C ATOM 2697 CG LEU B 131 13.799 107.359 169.504 1.00 37.56 C ATOM 2698 CD1 LEU B 131 14.183 106.681 168.214 1.00 35.18 C ATOM 2699 CD2 LEU B 131 14.388 106.643 170.712 1.00 39.84 C ATOM 2700 H LEU B 131 15.009 111.171 168.929 1.00 0.00 H ATOM 2701 N VAL B 132 11.922 110.693 170.018 1.00 30.79 N ATOM 2702 CA VAL B 132 10.605 110.958 170.575 1.00 30.51 C ATOM 2703 C VAL B 132 9.691 111.565 169.517 1.00 32.06 C ATOM 2704 O VAL B 132 8.536 111.151 169.369 1.00 34.52 O ATOM 2705 CB VAL B 132 10.753 111.862 171.812 1.00 26.33 C ATOM 2706 CG1 VAL B 132 9.394 112.343 172.307 1.00 20.91 C ATOM 2707 CG2 VAL B 132 11.521 111.142 172.934 1.00 25.39 C ATOM 2708 H VAL B 132 12.755 111.152 170.438 1.00 0.00 H ATOM 2709 N LYS B 133 10.211 112.507 168.720 1.00 35.09 N ATOM 2710 CA LYS B 133 9.386 113.144 167.695 1.00 35.15 C ATOM 2711 C LYS B 133 8.914 112.138 166.648 1.00 36.24 C ATOM 2712 O LYS B 133 7.738 112.144 166.266 1.00 33.82 O ATOM 2713 CB LYS B 133 10.160 114.286 167.043 1.00 32.39 C ATOM 2714 CG LYS B 133 10.081 115.601 167.801 1.00 34.56 C ATOM 2715 CD LYS B 133 10.830 116.715 167.103 1.00 36.80 C ATOM 2716 CE LYS B 133 12.311 116.379 166.994 1.00 38.91 C ATOM 2717 NZ LYS B 133 13.093 117.452 166.318 1.00 39.50 N ATOM 2718 HZ1 LYS B 133 12.725 117.593 165.356 1.00 0.00 H ATOM 2719 HZ2 LYS B 133 13.004 118.336 166.858 1.00 0.00 H ATOM 2720 HZ3 LYS B 133 14.094 117.172 166.270 1.00 0.00 H ATOM 2721 H LYS B 133 11.207 112.787 168.831 1.00 0.00 H ATOM 2722 N GLU B 134 9.803 111.242 166.199 1.00 35.43 N ATOM 2723 CA GLU B 134 9.404 110.246 165.206 1.00 39.75 C ATOM 2724 C GLU B 134 8.324 109.326 165.765 1.00 44.60 C ATOM 2725 O GLU B 134 7.371 108.974 165.055 1.00 43.86 O ATOM 2726 CB GLU B 134 10.621 109.451 164.724 1.00 46.27 C ATOM 2727 CG GLU B 134 10.375 108.591 163.471 1.00 54.23 C ATOM 2728 CD GLU B 134 9.843 109.395 162.277 1.00 70.47 C ATOM 2729 OE1 GLU B 134 10.194 110.589 162.131 1.00 71.99 O ATOM 2730 OE2 GLU B 134 9.070 108.826 161.475 1.00 71.79 O ATOM 2731 H GLU B 134 10.779 111.255 166.558 1.00 0.00 H ATOM 2732 N VAL B 135 8.459 108.926 167.035 1.00 38.32 N ATOM 2733 CA VAL B 135 7.449 108.088 167.676 1.00 31.04 C ATOM 2734 C VAL B 135 6.121 108.823 167.765 1.00 31.20 C ATOM 2735 O VAL B 135 5.056 108.236 167.546 1.00 33.12 O ATOM 2736 CB VAL B 135 7.927 107.645 169.069 1.00 23.02 C ATOM 2737 CG1 VAL B 135 6.767 107.030 169.847 1.00 24.32 C ATOM 2738 CG2 VAL B 135 9.057 106.640 168.957 1.00 21.23 C ATOM 2739 H VAL B 135 9.298 109.217 167.575 1.00 0.00 H ATOM 2740 N ALA B 136 6.159 110.124 168.047 1.00 27.42 N ATOM 2741 CA ALA B 136 4.929 110.895 168.163 1.00 24.80 C ATOM 2742 C ALA B 136 4.276 111.132 166.802 1.00 26.86 C ATOM 2743 O ALA B 136 3.054 111.293 166.731 1.00 30.48 O ATOM 2744 CB ALA B 136 5.211 112.224 168.871 1.00 23.18 C ATOM 2745 H ALA B 136 7.076 110.594 168.186 1.00 0.00 H ATOM 2746 N ARG B 137 5.053 111.135 165.721 1.00 29.13 N ATOM 2747 CA ARG B 137 4.477 111.288 164.386 1.00 36.00 C ATOM 2748 C ARG B 137 3.615 110.098 164.013 1.00 39.14 C ATOM 2749 O ARG B 137 2.716 110.216 163.177 1.00 41.22 O ATOM 2750 CB ARG B 137 5.565 111.451 163.330 1.00 41.28 C ATOM 2751 CG ARG B 137 6.058 112.845 163.165 1.00 43.64 C ATOM 2752 CD ARG B 137 7.187 112.876 162.171 1.00 49.50 C ATOM 2753 NE ARG B 137 7.977 114.084 162.351 1.00 58.03 N ATOM 2754 CZ ARG B 137 9.262 114.092 162.691 1.00 66.19 C ATOM 2755 NH1 ARG B 137 9.894 115.248 162.851 1.00 69.42 N ATOM 2756 NH2 ARG B 137 9.922 112.949 162.849 1.00 68.30 N ATOM 2757 HE ARG B 137 7.506 115.000 162.204 1.00 0.00 H ATOM 2758 HH12 ARG B 137 10.899 115.259 163.117 1.00 0.00 H ATOM 2759 HH11 ARG B 137 9.384 116.143 162.710 1.00 0.00 H ATOM 2760 HH22 ARG B 137 10.927 112.962 163.115 1.00 0.00 H ATOM 2761 HH21 ARG B 137 9.433 112.042 162.707 1.00 0.00 H ATOM 2762 H ARG B 137 6.082 111.027 165.827 1.00 0.00 H ATOM 2763 N HIS B 138 3.870 108.948 164.615 1.00 41.71 N ATOM 2764 CA HIS B 138 3.091 107.754 164.344 1.00 38.08 C ATOM 2765 C HIS B 138 2.099 107.504 165.477 1.00 40.70 C ATOM 2766 O HIS B 138 1.654 106.378 165.695 1.00 42.99 O ATOM 2767 CB HIS B 138 4.045 106.577 164.127 1.00 38.40 C ATOM 2768 CG HIS B 138 4.964 106.754 162.949 1.00 39.64 C ATOM 2769 ND1 HIS B 138 4.540 106.664 161.641 1.00 45.20 N ATOM 2770 CD2 HIS B 138 6.288 107.037 162.893 1.00 43.92 C ATOM 2771 CE1 HIS B 138 5.564 106.869 160.833 1.00 43.97 C ATOM 2772 NE2 HIS B 138 6.635 107.100 161.567 1.00 44.21 N ATOM 2773 H HIS B 138 4.650 108.898 165.301 1.00 0.00 H ATOM 2774 N GLN B 139 1.738 108.568 166.196 1.00 43.36 N ATOM 2775 CA GLN B 139 0.769 108.544 167.291 1.00 47.38 C ATOM 2776 C GLN B 139 1.178 107.593 168.409 1.00 43.06 C ATOM 2777 O GLN B 139 0.321 107.087 169.139 1.00 39.40 O ATOM 2778 CB GLN B 139 -0.647 108.228 166.804 1.00 55.89 C ATOM 2779 CG GLN B 139 -1.370 109.375 166.093 1.00 68.90 C ATOM 2780 CD GLN B 139 -0.758 109.736 164.759 1.00 82.91 C ATOM 2781 OE1 GLN B 139 -0.690 108.906 163.853 1.00 95.34 O ATOM 2782 NE2 GLN B 139 -0.312 110.980 164.626 1.00 86.76 N ATOM 2783 HE22 GLN B 139 -0.390 111.648 165.419 1.00 0.00 H ATOM 2784 HE21 GLN B 139 0.115 111.286 163.729 1.00 0.00 H ATOM 2785 H GLN B 139 2.178 109.481 165.961 1.00 0.00 H ATOM 2786 N GLY B 140 2.479 107.413 168.624 1.00 33.63 N ATOM 2787 CA GLY B 140 2.940 106.565 169.702 1.00 32.74 C ATOM 2788 C GLY B 140 3.057 107.321 171.014 1.00 35.72 C ATOM 2789 O GLY B 140 3.273 108.528 171.041 1.00 33.27 O ATOM 2790 H GLY B 140 3.172 107.887 168.010 1.00 0.00 H ATOM 2791 N ASP B 141 2.905 106.577 172.110 1.00 36.16 N ATOM 2792 CA ASP B 141 2.893 107.153 173.452 1.00 33.30 C ATOM 2793 C ASP B 141 4.301 107.617 173.847 1.00 32.08 C ATOM 2794 O ASP B 141 5.223 106.803 174.002 1.00 35.21 O ATOM 2795 CB ASP B 141 2.357 106.125 174.446 1.00 34.88 C ATOM 2796 CG ASP B 141 2.013 106.733 175.799 1.00 43.05 C ATOM 2797 OD1 ASP B 141 2.104 107.961 175.951 1.00 45.79 O ATOM 2798 OD2 ASP B 141 1.677 105.990 176.735 1.00 48.69 O ATOM 2799 H ASP B 141 2.791 105.549 172.005 1.00 0.00 H ATOM 2800 N VAL B 142 4.473 108.928 174.028 1.00 28.82 N ATOM 2801 CA VAL B 142 5.724 109.537 174.467 1.00 32.20 C ATOM 2802 C VAL B 142 5.568 110.218 175.821 1.00 36.58 C ATOM 2803 O VAL B 142 6.473 110.929 176.262 1.00 38.48 O ATOM 2804 CB VAL B 142 6.272 110.524 173.411 1.00 31.74 C ATOM 2805 CG1 VAL B 142 6.685 109.795 172.120 1.00 36.21 C ATOM 2806 CG2 VAL B 142 5.250 111.599 173.100 1.00 26.90 C ATOM 2807 H VAL B 142 3.664 109.555 173.844 1.00 0.00 H ATOM 2808 N THR B 143 4.451 109.949 176.506 1.00 34.58 N ATOM 2809 CA THR B 143 4.162 110.482 177.833 1.00 33.61 C ATOM 2810 C THR B 143 5.326 110.284 178.795 1.00 32.12 C ATOM 2811 O THR B 143 5.670 111.189 179.565 1.00 29.34 O ATOM 2812 CB THR B 143 2.917 109.763 178.367 1.00 41.52 C ATOM 2813 OG1 THR B 143 1.727 110.425 177.917 1.00 48.80 O ATOM 2814 CG2 THR B 143 2.910 109.634 179.903 1.00 57.26 C ATOM 2815 HG1 THR B 143 0.933 109.950 178.269 1.00 0.00 H ATOM 2816 H THR B 143 3.747 109.323 176.066 1.00 0.00 H ATOM 2817 N HIS B 144 5.962 109.114 178.748 1.00 32.54 N ATOM 2818 CA HIS B 144 7.033 108.782 179.684 1.00 32.78 C ATOM 2819 C HIS B 144 8.303 109.601 179.477 1.00 29.34 C ATOM 2820 O HIS B 144 9.082 109.750 180.421 1.00 29.90 O ATOM 2821 CB HIS B 144 7.366 107.295 179.563 1.00 36.11 C ATOM 2822 CG HIS B 144 8.365 106.808 180.569 1.00 43.44 C ATOM 2823 ND1 HIS B 144 8.128 106.833 181.928 1.00 43.37 N ATOM 2824 CD2 HIS B 144 9.612 106.306 180.413 1.00 41.44 C ATOM 2825 CE1 HIS B 144 9.180 106.352 182.561 1.00 43.99 C ATOM 2826 NE2 HIS B 144 10.094 106.027 181.665 1.00 45.96 N ATOM 2827 H HIS B 144 5.688 108.418 178.025 1.00 0.00 H ATOM 2828 N PHE B 145 8.519 110.174 178.300 1.00 29.95 N ATOM 2829 CA PHE B 145 9.797 110.795 177.951 1.00 28.52 C ATOM 2830 C PHE B 145 9.796 112.316 178.045 1.00 30.26 C ATOM 2831 O PHE B 145 10.856 112.936 177.888 1.00 34.29 O ATOM 2832 CB PHE B 145 10.188 110.378 176.537 1.00 28.22 C ATOM 2833 CG PHE B 145 10.113 108.904 176.328 1.00 31.87 C ATOM 2834 CD1 PHE B 145 10.986 108.059 177.000 1.00 29.67 C ATOM 2835 CD2 PHE B 145 9.132 108.344 175.534 1.00 31.15 C ATOM 2836 CE1 PHE B 145 10.911 106.693 176.842 1.00 28.55 C ATOM 2837 CE2 PHE B 145 9.043 106.967 175.378 1.00 32.15 C ATOM 2838 CZ PHE B 145 9.937 106.144 176.031 1.00 32.48 C ATOM 2839 H PHE B 145 7.751 110.182 177.599 1.00 0.00 H ATOM 2840 N LEU B 146 8.657 112.935 178.320 1.00 35.22 N ATOM 2841 CA LEU B 146 8.563 114.376 178.203 1.00 36.36 C ATOM 2842 C LEU B 146 7.917 114.984 179.434 1.00 42.04 C ATOM 2843 O LEU B 146 7.129 114.325 180.124 1.00 46.93 O ATOM 2844 CB LEU B 146 7.751 114.767 176.963 1.00 36.00 C ATOM 2845 CG LEU B 146 8.301 114.251 175.641 1.00 35.62 C ATOM 2846 CD1 LEU B 146 7.316 114.600 174.570 1.00 39.24 C ATOM 2847 CD2 LEU B 146 9.666 114.852 175.331 1.00 31.76 C ATOM 2848 H LEU B 146 7.828 112.384 178.621 1.00 0.00 H ATOM 2849 N PRO B 147 8.253 116.232 179.745 1.00 40.23 N ATOM 2850 CA PRO B 147 7.448 116.981 180.708 1.00 39.53 C ATOM 2851 C PRO B 147 6.034 117.130 180.172 1.00 43.80 C ATOM 2852 O PRO B 147 5.811 117.156 178.958 1.00 43.10 O ATOM 2853 CB PRO B 147 8.168 118.333 180.804 1.00 40.31 C ATOM 2854 CG PRO B 147 9.560 118.067 180.321 1.00 38.01 C ATOM 2855 CD PRO B 147 9.455 116.962 179.316 1.00 37.46 C ATOM 2856 N GLU B 148 5.070 117.204 181.095 1.00 47.93 N ATOM 2857 CA GLU B 148 3.660 117.265 180.711 1.00 48.76 C ATOM 2858 C GLU B 148 3.389 118.402 179.732 1.00 45.48 C ATOM 2859 O GLU B 148 2.759 118.200 178.690 1.00 44.56 O ATOM 2860 CB GLU B 148 2.786 117.411 181.959 1.00 55.84 C ATOM 2861 H GLU B 148 5.327 117.218 182.103 1.00 0.00 H ATOM 2862 N ASN B 149 3.874 119.605 180.044 1.00 50.40 N ATOM 2863 CA ASN B 149 3.655 120.734 179.145 1.00 48.37 C ATOM 2864 C ASN B 149 4.262 120.483 177.773 1.00 44.96 C ATOM 2865 O ASN B 149 3.715 120.936 176.762 1.00 45.23 O ATOM 2866 CB ASN B 149 4.227 122.016 179.754 1.00 45.20 C ATOM 2867 CG ASN B 149 5.746 122.054 179.714 1.00 45.79 C ATOM 2868 OD1 ASN B 149 6.413 121.203 180.304 1.00 45.01 O ATOM 2869 ND2 ASN B 149 6.297 123.018 178.988 1.00 44.42 N ATOM 2870 HD22 ASN B 149 5.694 123.716 178.507 1.00 0.00 H ATOM 2871 HD21 ASN B 149 7.332 123.076 178.900 1.00 0.00 H ATOM 2872 H ASN B 149 4.408 119.738 180.927 1.00 0.00 H ATOM 2873 N VAL B 150 5.362 119.735 177.711 1.00 40.66 N ATOM 2874 CA VAL B 150 6.025 119.516 176.430 1.00 38.63 C ATOM 2875 C VAL B 150 5.311 118.441 175.632 1.00 38.31 C ATOM 2876 O VAL B 150 5.138 118.569 174.414 1.00 34.36 O ATOM 2877 CB VAL B 150 7.505 119.160 176.661 1.00 41.99 C ATOM 2878 CG1 VAL B 150 8.157 118.723 175.365 1.00 35.35 C ATOM 2879 CG2 VAL B 150 8.250 120.345 177.268 1.00 39.34 C ATOM 2880 H VAL B 150 5.749 119.307 178.576 1.00 0.00 H ATOM 2881 N HIS B 151 4.847 117.388 176.313 1.00 41.87 N ATOM 2882 CA HIS B 151 4.078 116.346 175.640 1.00 45.82 C ATOM 2883 C HIS B 151 2.763 116.912 175.140 1.00 47.27 C ATOM 2884 O HIS B 151 2.312 116.602 174.031 1.00 43.63 O ATOM 2885 CB HIS B 151 3.807 115.196 176.602 1.00 47.84 C ATOM 2886 CG HIS B 151 2.926 114.134 176.030 1.00 55.08 C ATOM 2887 ND1 HIS B 151 1.680 113.841 176.540 1.00 58.57 N ATOM 2888 CD2 HIS B 151 3.122 113.278 175.000 1.00 58.75 C ATOM 2889 CE1 HIS B 151 1.137 112.863 175.836 1.00 59.21 C ATOM 2890 NE2 HIS B 151 1.994 112.499 174.899 1.00 57.63 N ATOM 2891 H HIS B 151 5.036 117.311 177.333 1.00 0.00 H ATOM 2892 N GLN B 152 2.168 117.787 175.946 1.00 52.03 N ATOM 2893 CA GLN B 152 0.927 118.456 175.594 1.00 50.58 C ATOM 2894 C GLN B 152 1.113 119.300 174.345 1.00 48.85 C ATOM 2895 O GLN B 152 0.280 119.277 173.433 1.00 43.87 O ATOM 2896 CB GLN B 152 0.543 119.347 176.774 1.00 59.47 C ATOM 2897 CG GLN B 152 -0.906 119.598 177.094 1.00 71.01 C ATOM 2898 CD GLN B 152 -1.047 120.125 178.525 1.00 81.71 C ATOM 2899 OE1 GLN B 152 -0.553 119.508 179.473 1.00 83.40 O ATOM 2900 NE2 GLN B 152 -1.687 121.279 178.680 1.00 89.18 N ATOM 2901 HE22 GLN B 152 -2.088 121.766 177.853 1.00 0.00 H ATOM 2902 HE21 GLN B 152 -1.786 121.695 179.628 1.00 0.00 H ATOM 2903 H GLN B 152 2.608 118.001 176.864 1.00 0.00 H ATOM 2904 N ALA B 153 2.240 120.009 174.269 1.00 48.99 N ATOM 2905 CA ALA B 153 2.519 120.884 173.137 1.00 41.69 C ATOM 2906 C ALA B 153 2.958 120.105 171.907 1.00 46.63 C ATOM 2907 O ALA B 153 2.699 120.534 170.776 1.00 47.13 O ATOM 2908 CB ALA B 153 3.574 121.912 173.527 1.00 40.35 C ATOM 2909 H ALA B 153 2.938 119.936 175.037 1.00 0.00 H ATOM 2910 N LEU B 154 3.642 118.970 172.101 1.00 49.91 N ATOM 2911 CA LEU B 154 4.113 118.177 170.965 1.00 45.74 C ATOM 2912 C LEU B 154 2.949 117.546 170.215 1.00 48.88 C ATOM 2913 O LEU B 154 2.948 117.508 168.980 1.00 51.95 O ATOM 2914 CB LEU B 154 5.072 117.093 171.456 1.00 42.42 C ATOM 2915 CG LEU B 154 5.604 116.012 170.506 1.00 36.67 C ATOM 2916 CD1 LEU B 154 6.397 116.541 169.326 1.00 33.81 C ATOM 2917 CD2 LEU B 154 6.414 115.016 171.298 1.00 41.39 C ATOM 2918 H LEU B 154 3.841 118.649 173.070 1.00 0.00 H ATOM 2919 N MET B 155 1.940 117.064 170.942 1.00 48.21 N ATOM 2920 CA MET B 155 0.752 116.524 170.294 1.00 49.69 C ATOM 2921 C MET B 155 0.024 117.606 169.513 1.00 54.57 C ATOM 2922 O MET B 155 -0.410 117.384 168.379 1.00 54.96 O ATOM 2923 CB MET B 155 -0.165 115.906 171.338 1.00 51.71 C ATOM 2924 CG MET B 155 0.134 114.462 171.608 1.00 58.17 C ATOM 2925 SD MET B 155 -1.214 113.719 172.510 1.00 70.56 S ATOM 2926 CE MET B 155 -1.153 114.720 173.986 1.00 69.96 C ATOM 2927 H MET B 155 2.002 117.074 171.980 1.00 0.00 H ATOM 2928 N ALA B 156 -0.119 118.791 170.107 1.00 56.53 N ATOM 2929 CA ALA B 156 -0.797 119.879 169.414 1.00 52.89 C ATOM 2930 C ALA B 156 -0.092 120.221 168.105 1.00 51.29 C ATOM 2931 O ALA B 156 -0.738 120.439 167.077 1.00 55.40 O ATOM 2932 CB ALA B 156 -0.877 121.101 170.325 1.00 50.12 C ATOM 2933 H ALA B 156 0.254 118.939 171.066 1.00 0.00 H ATOM 2934 N LYS B 157 1.243 120.226 168.111 1.00 55.35 N ATOM 2935 CA LYS B 157 1.983 120.581 166.901 1.00 59.26 C ATOM 2936 C LYS B 157 1.903 119.490 165.836 1.00 60.47 C ATOM 2937 O LYS B 157 2.011 119.787 164.642 1.00 58.11 O ATOM 2938 CB LYS B 157 3.439 120.873 167.256 1.00 56.78 C ATOM 2939 CG LYS B 157 4.257 121.456 166.123 1.00 55.36 C ATOM 2940 CD LYS B 157 4.308 122.961 166.216 1.00 57.75 C ATOM 2941 CE LYS B 157 4.903 123.562 164.956 1.00 65.33 C ATOM 2942 NZ LYS B 157 5.477 124.916 165.217 1.00 68.59 N ATOM 2943 HZ1 LYS B 157 4.727 125.548 165.563 1.00 0.00 H ATOM 2944 HZ2 LYS B 157 6.227 124.841 165.934 1.00 0.00 H ATOM 2945 HZ3 LYS B 157 5.875 125.298 164.336 1.00 0.00 H ATOM 2946 H LYS B 157 1.758 119.977 168.979 1.00 0.00 H ATOM 2947 N LEU B 158 1.705 118.234 166.233 1.00 64.96 N ATOM 2948 CA LEU B 158 1.602 117.146 165.265 1.00 67.33 C ATOM 2949 C LEU B 158 0.177 116.876 164.803 1.00 76.18 C ATOM 2950 O LEU B 158 -0.006 116.109 163.852 1.00 79.46 O ATOM 2951 CB LEU B 158 2.213 115.855 165.815 1.00 57.05 C ATOM 2952 CG LEU B 158 3.737 115.851 165.858 1.00 53.05 C ATOM 2953 CD1 LEU B 158 4.224 114.561 166.465 1.00 49.88 C ATOM 2954 CD2 LEU B 158 4.301 116.036 164.460 1.00 48.38 C ATOM 2955 H LEU B 158 1.622 118.025 167.248 1.00 0.00 H ATOM 2956 N ALA B 159 -0.827 117.447 165.466 1.00 74.70 N ATOM 2957 CA ALA B 159 -2.220 117.262 165.064 1.00 77.13 C ATOM 2958 C ALA B 159 -2.446 117.628 163.600 1.00 78.48 C ATOM 2959 O ALA B 159 -3.089 116.886 162.853 1.00 79.10 O ATOM 2960 CB ALA B 159 -3.139 118.095 165.954 1.00 78.44 C ATOM 2961 H ALA B 159 -0.614 118.041 166.293 1.00 0.00 H TER 2962 ALA B 159 HETATM 2963 K K A 1 21.315 113.601 177.358 1.00 97.95 K HETATM 2964 K K A 2 41.578 114.465 157.959 1.00 97.95 K HETATM 2965 K K A 3 22.179 94.202 157.095 1.00 97.95 K HETATM 2966 O HOH 4 33.764 106.638 185.339 1.00 34.61 O HETATM 2967 O HOH 5 26.980 112.639 185.803 1.00 34.93 O HETATM 2968 O HOH 6 28.752 108.221 189.224 1.00 24.49 O HETATM 2969 O HOH 7 48.824 112.508 173.086 1.00 30.09 O HETATM 2970 O HOH 8 25.015 110.526 191.013 1.00 41.93 O HETATM 2971 O HOH 9 32.631 107.151 188.094 1.00 37.63 O HETATM 2972 O HOH 10 42.060 110.103 184.252 1.00 44.90 O HETATM 2973 O HOH 11 49.409 122.878 185.972 1.00 38.02 O HETATM 2974 O HOH 12 50.738 108.644 172.110 1.00 48.33 O HETATM 2975 O HOH 13 41.904 123.535 168.619 1.00 35.00 O HETATM 2976 O HOH 14 58.620 118.783 176.600 1.00 53.64 O HETATM 2977 O HOH 15 29.645 113.460 200.470 1.00 33.63 O HETATM 2978 O HOH 16 28.273 120.023 198.404 1.00 47.64 O HETATM 2979 O HOH 17 45.752 122.616 181.695 1.00 36.16 O HETATM 2980 O HOH 18 50.311 119.497 181.909 1.00 40.75 O HETATM 2981 O HOH 19 24.736 116.460 195.950 1.00 59.80 O HETATM 2982 O HOH 20 31.494 124.580 192.248 1.00 45.96 O HETATM 2983 O HOH 21 27.394 117.472 192.582 1.00 43.72 O HETATM 2984 O HOH 22 43.759 124.963 181.658 1.00 60.46 O HETATM 2985 O HOH 23 37.146 127.342 191.822 1.00 45.03 O HETATM 2986 O HOH 24 43.609 126.467 173.666 1.00 46.78 O HETATM 2987 O HOH 25 29.972 125.833 197.048 1.00 40.04 O HETATM 2988 O HOH 26 26.153 114.653 200.153 1.00 51.97 O HETATM 2989 O HOH 27 55.296 119.540 178.249 1.00 66.72 O HETATM 2990 O HOH 28 24.698 100.155 186.471 1.00 42.97 O HETATM 2991 O HOH 29 48.251 122.286 182.661 1.00 61.68 O HETATM 2992 O HOH 30 22.486 111.579 201.281 1.00 65.43 O HETATM 2993 O HOH 31 51.603 121.681 179.398 1.00 66.07 O HETATM 2994 O HOH 32 47.620 124.731 171.986 1.00 56.27 O HETATM 2995 O HOH 33 28.569 126.344 200.881 1.00 71.26 O HETATM 2996 O HOH 34 37.886 131.155 199.036 1.00 62.42 O HETATM 2997 O HOH 35 38.299 134.012 175.505 1.00 59.34 O HETATM 2998 O HOH 36 30.924 119.353 173.648 1.00 30.97 O HETATM 2999 O HOH 37 31.387 130.487 186.845 1.00 54.60 O HETATM 3000 O HOH 38 41.221 130.257 164.787 1.00 38.01 O HETATM 3001 O HOH 39 17.676 114.550 168.871 1.00 34.26 O HETATM 3002 O HOH 40 31.867 122.118 174.335 1.00 35.32 O HETATM 3003 O HOH 41 19.733 118.900 171.871 1.00 25.72 O HETATM 3004 O HOH 42 31.793 137.971 173.926 1.00 42.38 O HETATM 3005 O HOH 43 16.979 113.821 175.193 1.00 36.13 O HETATM 3006 O HOH 44 2.057 110.542 173.160 1.00 37.12 O HETATM 3007 O HOH 45 15.800 120.117 165.761 1.00 31.19 O HETATM 3008 O HOH 46 17.487 104.409 185.974 1.00 54.45 O HETATM 3009 O HOH 47 35.528 123.182 175.733 1.00 28.10 O HETATM 3010 O HOH 48 20.829 130.965 190.768 1.00 53.50 O HETATM 3011 O HOH 49 23.876 136.339 166.658 1.00 40.10 O HETATM 3012 O HOH 50 15.912 111.333 186.053 1.00 40.93 O HETATM 3013 O HOH 51 16.016 105.515 177.434 1.00 36.36 O HETATM 3014 O HOH 52 12.443 122.916 174.537 1.00 31.97 O HETATM 3015 O HOH 53 12.738 105.186 179.339 1.00 47.45 O HETATM 3016 O HOH 54 21.581 135.513 170.404 1.00 47.36 O HETATM 3017 O HOH 55 8.416 109.140 158.712 1.00 43.54 O HETATM 3018 O HOH 56 25.150 121.589 167.378 1.00 50.84 O HETATM 3019 O HOH 57 23.469 129.697 168.678 1.00 28.90 O HETATM 3020 O HOH 58 25.482 113.195 168.008 1.00 55.91 O HETATM 3021 O HOH 59 26.093 138.061 184.959 1.00 45.68 O HETATM 3022 O HOH 60 22.164 128.755 166.332 1.00 50.56 O HETATM 3023 O HOH 61 16.829 118.747 170.164 1.00 28.81 O HETATM 3024 O HOH 62 14.140 117.925 188.518 1.00 42.08 O HETATM 3025 O HOH 63 5.183 120.538 182.889 1.00 42.31 O HETATM 3026 O HOH 64 33.382 134.058 181.217 1.00 52.08 O HETATM 3027 O HOH 65 15.602 134.364 175.277 1.00 52.80 O HETATM 3028 O HOH 66 9.924 116.285 183.698 1.00 53.67 O HETATM 3029 O HOH 67 5.649 108.073 183.167 1.00 52.61 O HETATM 3030 O HOH 68 5.978 116.705 183.950 1.00 49.30 O HETATM 3031 O HOH 69 13.987 131.152 183.175 1.00 55.71 O HETATM 3032 O HOH 70 12.177 118.067 163.453 1.00 47.00 O HETATM 3033 O HOH 71 7.344 113.660 183.116 1.00 43.50 O HETATM 3034 O HOH 72 36.351 134.482 181.607 1.00 44.80 O HETATM 3035 O HOH 73 16.022 116.513 166.794 1.00 50.97 O HETATM 3036 O HOH 74 18.707 112.095 177.235 1.00 46.85 O HETATM 3037 O HOH 75 14.335 128.237 164.736 1.00 54.44 O HETATM 3038 O HOH 76 24.130 104.509 176.085 1.00 57.12 O HETATM 3039 O HOH 77 9.614 132.740 174.776 1.00 34.19 O HETATM 3040 O HOH 78 43.569 125.348 170.070 1.00 45.86 O HETATM 3041 O HOH 79 27.672 137.664 186.926 1.00 39.85 O HETATM 3042 O HOH 80 15.681 101.242 183.739 1.00 52.85 O HETATM 3043 O HOH 81 17.420 131.888 188.172 1.00 55.24 O HETATM 3044 O HOH 82 29.011 121.102 163.121 1.00 57.65 O HETATM 3045 O HOH 83 14.720 134.341 177.674 1.00 50.01 O HETATM 3046 O HOH 84 23.140 100.553 188.132 1.00 34.20 O HETATM 3047 O HOH 85 10.594 126.651 163.373 1.00 59.22 O HETATM 3048 O HOH 86 15.403 108.340 186.849 1.00 52.88 O HETATM 3049 O HOH 87 -1.145 114.247 167.347 1.00 43.25 O HETATM 3050 O HOH 88 13.262 130.611 165.438 1.00 48.70 O HETATM 3051 O HOH 89 21.305 115.554 195.331 1.00 53.52 O HETATM 3052 O HOH 90 11.301 114.888 159.714 1.00 59.81 O HETATM 3053 O HOH 91 21.731 130.853 164.646 1.00 59.92 O HETATM 3054 O HOH 92 18.471 128.026 157.597 1.00 57.08 O HETATM 3055 O HOH 93 3.940 105.710 179.480 1.00 65.23 O HETATM 3056 O HOH 94 17.928 113.828 188.423 1.00 51.42 O HETATM 3057 O HOH 95 13.569 113.713 184.915 1.00 51.86 O HETATM 3058 O HOH 96 16.757 118.865 193.121 1.00 61.31 O HETATM 3059 O HOH 97 11.859 127.436 192.467 1.00 52.75 O HETATM 3060 O HOH 98 1.154 123.460 177.335 1.00 64.49 O HETATM 3061 O HOH 99 -1.455 120.155 162.569 1.00 55.09 O HETATM 3062 O HOH 100 2.336 108.974 159.687 1.00 57.69 O HETATM 3063 O HOH 101 7.705 133.665 181.245 1.00 65.25 O HETATM 3064 O HOH 102 19.971 122.582 194.448 1.00 56.63 O HETATM 3065 O HOH 103 24.791 138.020 182.841 1.00 63.40 O HETATM 3066 O HOH 104 25.523 124.387 194.448 1.00 47.57 O HETATM 3067 O HOH 105 -4.925 118.165 159.769 1.00 68.28 O HETATM 3068 O HOH 106 17.762 134.875 186.486 1.00 56.14 O HETATM 3069 O HOH 107 38.291 109.672 170.064 1.00 73.49 O HETATM 3070 O HOH 108 5.558 130.980 172.613 1.00 51.14 O HETATM 3071 O HOH 109 28.642 129.142 197.514 1.00 66.14 O HETATM 3072 O HOH 110 8.742 117.808 187.800 1.00 59.66 O HETATM 3073 O HOH 111 34.289 131.559 189.256 1.00 53.14 O HETATM 3074 O HOH 112 10.520 112.257 185.328 1.00 49.97 O HETATM 3075 O HOH 113 4.796 126.083 172.709 1.00 43.78 O HETATM 3076 O HOH 114 23.608 132.472 191.632 1.00 57.35 O HETATM 3077 O HOH 115 40.226 121.242 167.608 1.00 45.10 O HETATM 3078 O HOH 116 17.140 118.775 167.489 1.00 32.81 O HETATM 3079 O HOH 117 14.309 117.823 191.243 1.00 53.68 O HETATM 3080 O HOH 118 16.405 110.413 161.006 1.00 59.54 O HETATM 3081 O HOH 119 2.276 125.031 174.520 1.00 49.84 O HETATM 3082 O HOH 120 28.271 131.680 197.462 1.00 62.31 O HETATM 3083 O HOH 121 26.286 114.408 164.904 1.00 65.85 O HETATM 3084 O HOH 122 -0.074 125.857 169.714 1.00 49.84 O HETATM 3085 O HOH 123 20.504 136.279 194.974 1.00 58.02 O HETATM 3086 O HOH 124 49.559 102.016 164.922 1.00 34.61 O HETATM 3087 O HOH 125 53.444 107.028 163.339 1.00 24.49 O HETATM 3088 O HOH 126 37.306 86.956 159.052 1.00 30.09 O HETATM 3089 O HOH 127 55.233 110.765 161.034 1.00 41.93 O HETATM 3090 O HOH 128 52.314 103.149 164.409 1.00 37.63 O HETATM 3091 O HOH 129 48.472 93.720 161.457 1.00 44.90 O HETATM 3092 O HOH 130 50.192 86.371 148.682 1.00 38.02 O HETATM 3093 O HOH 131 32.839 93.876 148.025 1.00 35.00 O HETATM 3094 O HOH 132 64.690 106.135 158.100 1.00 33.63 O HETATM 3095 O HOH 133 62.624 107.507 151.537 1.00 47.64 O HETATM 3096 O HOH 134 45.915 90.028 148.944 1.00 36.16 O HETATM 3097 O HOH 135 46.129 85.469 152.063 1.00 40.75 O HETATM 3098 O HOH 136 60.170 111.044 155.100 1.00 59.80 O HETATM 3099 O HOH 137 56.468 104.286 146.980 1.00 45.96 O HETATM 3100 O HOH 138 56.802 108.386 154.088 1.00 43.72 O HETATM 3101 O HOH 139 45.878 92.021 146.597 1.00 60.46 O HETATM 3102 O HOH 140 56.042 98.634 144.218 1.00 45.03 O HETATM 3103 O HOH 141 37.886 92.171 145.093 1.00 46.78 O HETATM 3104 O HOH 142 61.268 105.808 145.727 1.00 40.04 O HETATM 3105 O HOH 143 64.373 109.627 156.907 1.00 51.97 O HETATM 3106 O HOH 144 50.691 111.082 171.405 1.00 42.97 O HETATM 3107 O HOH 145 46.881 87.529 149.274 1.00 61.68 O HETATM 3108 O HOH 146 65.501 113.294 159.981 1.00 65.43 O HETATM 3109 O HOH 147 43.618 84.177 149.879 1.00 66.07 O HETATM 3110 O HOH 148 36.206 88.160 146.829 1.00 56.27 O HETATM 3111 O HOH 149 65.101 107.211 145.216 1.00 71.26 O HETATM 3112 O HOH 150 63.256 97.894 140.405 1.00 62.42 O HETATM 3113 O HOH 151 39.725 97.481 137.548 1.00 59.34 O HETATM 3114 O HOH 152 37.868 104.856 152.207 1.00 30.97 O HETATM 3115 O HOH 153 51.065 104.393 141.073 1.00 54.60 O HETATM 3116 O HOH 154 29.007 94.559 141.303 1.00 38.01 O HETATM 3117 O HOH 155 33.091 118.104 157.010 1.00 34.26 O HETATM 3118 O HOH 156 38.555 103.913 149.442 1.00 35.32 O HETATM 3119 O HOH 157 36.091 116.047 152.660 1.00 25.72 O HETATM 3120 O HOH 158 38.146 103.987 133.589 1.00 42.38 O HETATM 3121 O HOH 159 37.380 133.723 161.018 1.00 37.12 O HETATM 3122 O HOH 160 29.981 119.980 151.443 1.00 31.19 O HETATM 3123 O HOH 161 39.953 100.252 148.378 1.00 28.10 O HETATM 3124 O HOH 162 30.878 111.904 135.221 1.00 40.10 O HETATM 3125 O HOH 163 50.273 119.868 160.227 1.00 40.93 O HETATM 3126 O HOH 164 41.654 119.764 166.045 1.00 36.36 O HETATM 3127 O HOH 165 38.757 123.337 148.644 1.00 31.97 O HETATM 3128 O HOH 166 43.559 123.042 166.374 1.00 47.45 O HETATM 3129 O HOH 167 34.624 114.199 136.047 1.00 47.36 O HETATM 3130 O HOH 168 22.932 127.364 162.420 1.00 43.54 O HETATM 3131 O HOH 169 31.598 110.630 149.971 1.00 50.84 O HETATM 3132 O HOH 170 32.898 112.311 141.863 1.00 28.90 O HETATM 3133 O HOH 171 32.228 110.298 158.365 1.00 55.91 O HETATM 3134 O HOH 172 49.179 109.687 133.499 1.00 45.68 O HETATM 3135 O HOH 173 30.552 113.616 142.805 1.00 50.56 O HETATM 3136 O HOH 174 34.384 118.951 152.813 1.00 28.81 O HETATM 3137 O HOH 175 52.738 121.640 153.635 1.00 42.08 O HETATM 3138 O HOH 176 47.109 130.597 151.022 1.00 42.31 O HETATM 3139 O HOH 177 45.437 102.398 137.502 1.00 52.08 O HETATM 3140 O HOH 178 39.497 120.178 137.196 1.00 52.80 O HETATM 3141 O HOH 179 47.918 125.856 155.275 1.00 53.67 O HETATM 3142 O HOH 180 47.387 130.131 163.487 1.00 52.61 O HETATM 3143 O HOH 181 48.170 129.802 154.855 1.00 49.30 O HETATM 3144 O HOH 182 47.395 121.793 140.408 1.00 55.71 O HETATM 3145 O HOH 183 27.673 123.603 153.493 1.00 47.00 O HETATM 3146 O HOH 184 47.336 128.436 157.900 1.00 43.50 O HETATM 3147 O HOH 185 31.014 119.758 155.047 1.00 50.97 O HETATM 3148 O HOH 186 41.455 117.073 159.465 1.00 46.85 O HETATM 3149 O HOH 187 28.956 121.445 143.323 1.00 54.44 O HETATM 3150 O HOH 188 40.305 111.650 167.051 1.00 57.12 O HETATM 3151 O HOH 189 38.996 126.166 138.820 1.00 34.19 O HETATM 3152 O HOH 190 34.290 92.211 146.212 1.00 45.86 O HETATM 3153 O HOH 191 51.146 108.108 133.896 1.00 39.85 O HETATM 3154 O HOH 192 47.959 120.099 170.318 1.00 52.85 O HETATM 3155 O HOH 193 52.392 118.360 139.672 1.00 55.24 O HETATM 3156 O HOH 194 27.341 106.769 150.458 1.00 57.65 O HETATM 3157 O HOH 195 41.894 121.060 137.219 1.00 50.01 O HETATM 3158 O HOH 196 52.352 112.640 171.007 1.00 34.20 O HETATM 3159 O HOH 197 27.593 125.186 144.909 1.00 59.22 O HETATM 3160 O HOH 198 51.069 120.377 163.220 1.00 52.88 O HETATM 3161 O HOH 199 29.658 122.518 140.949 1.00 48.70 O HETATM 3162 O HOH 200 59.551 114.475 156.006 1.00 53.52 O HETATM 3163 O HOH 201 23.934 124.479 156.672 1.00 59.81 O HETATM 3164 O HOH 202 28.866 114.049 140.707 1.00 59.92 O HETATM 3165 O HOH 203 21.817 117.309 143.534 1.00 57.08 O HETATM 3166 O HOH 204 43.700 131.840 165.850 1.00 65.23 O HETATM 3167 O HOH 205 52.643 117.852 157.732 1.00 51.42 O HETATM 3168 O HOH 206 49.135 122.211 157.847 1.00 51.86 O HETATM 3169 O HOH 207 57.341 119.023 152.695 1.00 61.31 O HETATM 3170 O HOH 208 56.687 123.921 144.124 1.00 52.75 O HETATM 3171 O HOH 209 41.555 134.626 148.100 1.00 64.49 O HETATM 3172 O HOH 210 26.789 137.235 151.405 1.00 55.09 O HETATM 3173 O HOH 211 23.907 133.444 162.586 1.00 57.69 O HETATM 3174 O HOH 212 45.465 128.075 137.895 1.00 65.25 O HETATM 3175 O HOH 213 58.668 115.809 148.978 1.00 56.63 O HETATM 3176 O HOH 214 47.061 110.989 133.540 1.00 63.40 O HETATM 3177 O HOH 215 58.668 110.257 147.173 1.00 47.57 O HETATM 3178 O HOH 216 23.989 140.705 153.395 1.00 68.28 O HETATM 3179 O HOH 217 50.706 118.018 136.685 1.00 56.14 O HETATM 3180 O HOH 218 34.284 97.489 161.888 1.00 73.49 O HETATM 3181 O HOH 219 36.833 130.222 140.580 1.00 51.14 O HETATM 3182 O HOH 220 61.734 107.138 142.418 1.00 66.14 O HETATM 3183 O HOH 221 52.020 127.038 153.752 1.00 59.66 O HETATM 3184 O HOH 222 53.476 101.491 140.001 1.00 53.14 O HETATM 3185 O HOH 223 49.548 125.260 159.303 1.00 49.97 O HETATM 3186 O HOH 224 36.929 130.984 145.477 1.00 43.78 O HETATM 3187 O HOH 225 55.852 112.172 139.088 1.00 57.35 O HETATM 3188 O HOH 226 31.709 118.640 152.785 1.00 32.81 O HETATM 3189 O HOH 227 55.463 121.471 153.737 1.00 53.68 O HETATM 3190 O HOH 228 25.226 119.375 161.147 1.00 59.54 O HETATM 3191 O HOH 229 38.740 133.504 146.529 1.00 49.84 O HETATM 3192 O HOH 230 61.682 107.509 139.880 1.00 62.31 O HETATM 3193 O HOH 231 29.124 109.494 157.152 1.00 65.85 O HETATM 3194 O HOH 232 33.934 135.854 145.703 1.00 49.84 O HETATM 3195 O HOH 233 23.272 98.474 184.604 1.00 30.09 O HETATM 3196 O HOH 234 27.136 99.450 186.518 1.00 48.33 O HETATM 3197 O HOH 235 12.245 102.941 177.684 1.00 35.00 O HETATM 3198 O HOH 236 16.997 94.960 194.400 1.00 53.64 O HETATM 3199 O HOH 237 9.313 97.894 179.389 1.00 46.78 O HETATM 3200 O HOH 238 16.240 93.311 191.076 1.00 66.72 O HETATM 3201 O HOH 239 14.099 92.162 187.383 1.00 66.07 O HETATM 3202 O HOH 240 11.049 99.574 183.400 1.00 56.27 O HETATM 3203 O HOH 241 1.768 96.055 174.079 1.00 59.34 O HETATM 3204 O HOH 242 16.427 97.912 166.704 1.00 30.97 O HETATM 3205 O HOH 243 5.523 106.773 177.001 1.00 38.01 O HETATM 3206 O HOH 244 21.230 102.689 153.456 1.00 34.26 O HETATM 3207 O HOH 245 13.662 97.225 167.647 1.00 35.32 O HETATM 3208 O HOH 246 16.880 99.689 155.513 1.00 25.72 O HETATM 3209 O HOH 247 -2.191 97.634 167.573 1.00 42.38 O HETATM 3210 O HOH 248 25.238 98.400 137.837 1.00 37.12 O HETATM 3211 O HOH 249 12.598 95.827 171.308 1.00 28.10 O HETATM 3212 O HOH 250 -0.559 104.902 159.656 1.00 40.10 O HETATM 3213 O HOH 251 30.265 94.126 151.796 1.00 36.36 O HETATM 3214 O HOH 252 30.594 92.221 148.518 1.00 47.45 O HETATM 3215 O HOH 253 0.267 101.156 157.361 1.00 47.36 O HETATM 3216 O HOH 254 26.640 112.848 144.196 1.00 43.54 O HETATM 3217 O HOH 255 14.191 104.182 160.930 1.00 50.84 O HETATM 3218 O HOH 256 6.083 102.882 159.249 1.00 28.90 O HETATM 3219 O HOH 257 22.585 103.552 161.262 1.00 55.91 O HETATM 3220 O HOH 258 7.025 105.228 157.944 1.00 50.56 O HETATM 3221 O HOH 259 17.033 101.396 152.609 1.00 28.81 O HETATM 3222 O HOH 260 27.707 88.393 141.429 1.00 52.61 O HETATM 3223 O HOH 261 17.713 108.107 147.957 1.00 47.00 O HETATM 3224 O HOH 262 22.120 88.444 143.124 1.00 43.50 O HETATM 3225 O HOH 263 19.267 104.766 151.802 1.00 50.97 O HETATM 3226 O HOH 264 23.685 94.325 154.487 1.00 46.85 O HETATM 3227 O HOH 265 7.543 106.824 150.115 1.00 54.44 O HETATM 3228 O HOH 266 31.271 95.475 159.910 1.00 57.12 O HETATM 3229 O HOH 267 10.432 101.490 179.349 1.00 45.86 O HETATM 3230 O HOH 268 34.538 87.821 151.461 1.00 52.85 O HETATM 3231 O HOH 269 14.678 108.439 164.791 1.00 57.65 O HETATM 3232 O HOH 270 5.169 106.122 149.042 1.00 48.70 O HETATM 3233 O HOH 271 20.892 111.846 147.081 1.00 59.81 O HETATM 3234 O HOH 272 4.927 106.914 157.511 1.00 59.92 O HETATM 3235 O HOH 273 7.754 113.963 154.251 1.00 57.08 O HETATM 3236 O HOH 274 30.070 92.080 139.720 1.00 65.23 O HETATM 3237 O HOH 275 26.806 111.873 138.116 1.00 57.69 O HETATM 3238 O HOH 276 26.108 101.496 174.071 1.00 73.49 O HETATM 3239 O HOH 277 23.523 86.232 146.300 1.00 49.97 O HETATM 3240 O HOH 278 17.005 104.071 152.920 1.00 32.81 O HETATM 3241 O HOH 279 25.367 110.554 152.185 1.00 59.54 O HETATM 3242 O HOH 280 21.372 106.656 162.066 1.00 65.85 O HETATM 3243 C1 CW A 4 29.144 123.684 165.809 1.00 -0.06 C HETATM 3244 C2 CW A 4 29.977 124.790 165.604 1.00 -0.06 C HETATM 3245 C3 CW A 4 29.772 125.968 166.340 1.00 -0.05 C HETATM 3246 C6 CW A 4 28.743 126.059 167.279 1.00 0.07 C HETATM 3247 C5 CW A 4 27.903 124.966 167.494 1.00 0.02 C HETATM 3248 C10 CW A 4 26.780 125.097 168.544 1.00 0.14 C HETATM 3249 C9 CW A 4 26.250 126.567 168.550 1.00 0.13 C HETATM 3250 C12 CW A 4 25.364 126.834 169.798 1.00 -0.03 C HETATM 3251 H4 CW A 4 25.005 127.874 169.777 1.00 0.03 H HETATM 3252 H5 CW A 4 25.956 126.669 170.710 1.00 0.03 H HETATM 3253 H6 CW A 4 24.503 126.149 169.790 1.00 0.03 H HETATM 3254 C13 CW A 4 25.353 126.811 167.301 1.00 -0.03 C HETATM 3255 H7 CW A 4 25.940 126.633 166.388 1.00 0.03 H HETATM 3256 H8 CW A 4 24.990 127.849 167.307 1.00 0.03 H HETATM 3257 H9 CW A 4 24.495 126.123 167.325 1.00 0.03 H HETATM 3258 O8 CW A 4 27.293 127.581 168.620 1.00 -0.27 O HETATM 3259 C7 CW A 4 28.491 127.317 168.079 1.00 0.26 C HETATM 3260 O11 CW A 4 29.377 128.142 168.249 1.00 -0.36 O HETATM 3261 N14 CW A 4 27.272 124.664 169.869 1.00 -0.23 N HETATM 3262 C15 CW A 4 28.511 124.863 170.213 1.00 0.10 C HETATM 3263 N16 CW A 4 28.747 124.420 171.363 1.00 -0.32 N HETATM 3264 C17 CW A 4 27.552 123.839 171.899 1.00 -0.01 C HETATM 3265 C18 CW A 4 26.658 124.024 170.886 1.00 0.08 C HETATM 3266 C19 CW A 4 25.241 123.564 171.009 1.00 -0.04 C HETATM 3267 C20 CW A 4 24.276 123.542 170.073 1.00 -0.10 C HETATM 3268 H13 CW A 4 23.283 123.173 170.324 1.00 0.04 H HETATM 3269 H14 CW A 4 24.488 123.894 169.064 1.00 0.04 H HETATM 3270 H12 CW A 4 24.950 123.196 171.992 1.00 0.06 H HETATM 3271 H11 CW A 4 27.397 123.369 172.869 1.00 0.05 H HETATM 3272 H10 CW A 4 29.251 125.353 169.582 1.00 0.13 H HETATM 3273 H15 CW A 4 25.950 124.435 168.257 1.00 0.09 H HETATM 3274 C4 CW A 4 28.112 123.792 166.755 1.00 -0.05 C HETATM 3275 H16 CW A 4 27.458 122.944 166.919 1.00 0.06 H HETATM 3276 H3 CW A 4 30.422 126.820 166.177 1.00 0.07 H HETATM 3277 H2 CW A 4 30.780 124.737 164.877 1.00 0.06 H HETATM 3278 H1 CW A 4 29.292 122.766 165.251 1.00 0.06 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 1482 1483 1494 1495 1496 CONECT 1494 1482 CONECT 1495 1482 CONECT 1496 1482 CONECT 3243 3244 3274 3278 CONECT 3244 3243 3245 3277 CONECT 3245 3244 3246 3276 CONECT 3246 3245 3247 3259 CONECT 3247 3246 3248 3274 CONECT 3248 3247 3249 3261 3273 CONECT 3249 3248 3250 3254 3258 CONECT 3250 3249 3251 3252 3253 CONECT 3251 3250 CONECT 3252 3250 CONECT 3253 3250 CONECT 3254 3249 3255 3256 3257 CONECT 3255 3254 CONECT 3256 3254 CONECT 3257 3254 CONECT 3258 3249 3259 CONECT 3259 3246 3258 3260 CONECT 3260 3259 CONECT 3261 3248 3262 3265 CONECT 3262 3261 3263 3272 CONECT 3263 3262 3264 CONECT 3264 3263 3265 3271 CONECT 3265 3261 3264 3266 CONECT 3266 3265 3267 3270 CONECT 3267 3266 3268 3269 CONECT 3268 3267 CONECT 3269 3267 CONECT 3270 3266 CONECT 3271 3264 CONECT 3272 3262 CONECT 3273 3248 CONECT 3274 3243 3247 3275 CONECT 3275 3274 CONECT 3276 3245 CONECT 3277 3244 CONECT 3278 3243 MASTER 0 0 0 0 0 0 0 0 3276 2 44 26 END
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Structure:
Ligand 2D
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Related entries of code: 6b7f
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6b7a
RCSB PDB
PDBbind
167aa, >6B7A_1|Chains... *
6b7b
RCSB PDB
PDBbind
167aa, >6B7B_1|Chains... at 100%
6b7c
RCSB PDB
PDBbind
167aa, >6B7C_1|Chains... at 100%
6b7d
RCSB PDB
PDBbind
167aa, >6B7D_1|Chains... at 100%
6b7e
RCSB PDB
PDBbind
167aa, >6B7E_1|Chains... at 100%
6cck
RCSB PDB
PDBbind
161aa, >6CCK_1|Chains... at 100%
6ccl
RCSB PDB
PDBbind
161aa, >6CCL_1|Chains... at 100%
6ccm
RCSB PDB
PDBbind
161aa, >6CCM_1|Chains... at 100%
6ccn
RCSB PDB
PDBbind
161aa, >6CCN_1|Chains... at 100%
6cco
RCSB PDB
PDBbind
161aa, >6CCO_1|Chains... at 100%
6ccq
RCSB PDB
PDBbind
161aa, >6CCQ_1|Chains... at 100%
6ccs
RCSB PDB
PDBbind
161aa, >6CCS_1|Chains... at 100%
6chl
RCSB PDB
PDBbind
161aa, >6CHL_1|Chains... at 100%
6chm
RCSB PDB
PDBbind
161aa, >6CHM_1|Chains... at 100%
6chn
RCSB PDB
PDBbind
161aa, >6CHN_1|Chains... at 100%
6cho
RCSB PDB
PDBbind
161aa, >6CHO_1|Chains... at 100%
6chp
RCSB PDB
PDBbind
161aa, >6CHP_1|Chains... at 100%
6chq
RCSB PDB
PDBbind
161aa, >6CHQ_1|Chains... at 100%
6ckw
RCSB PDB
PDBbind
161aa, >6CKW_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6b7f
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Phosphopantetheine adenylyltransferase
Ligand Name
CW4
EC.Number
E.C.-.-.-.-
Resolution
2.56(Å)
Affinity (Kd/Ki/IC50)
Kd=136uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Am. Chem. Soc. Vol. 139: pp. 17824-17833
Ligand Properties
Formula
C
1
6
H
1
6
N
2
O
2
Molecular Weight
268.310
Exact Mass
268.121
No. of atoms
36
No. of bonds
38
Polar Surface Area
44.12
LOGP Value
2.70 (
Computed with XLOGP3
)
3.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
C=Cc1cncn1[C@@H]1c2ccccc2C(=O)OC1(C)C
InChI String
InChI=1S/C16H16N2O2/c1-4-11-9-17-10-18(11)14-12-7-5-6-8-13(12)15(19)20-16(14,2)3/h4-10,14H,1H2,2-3H3/t14-/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):
P0A6I6
Entrez Gene ID
NCBI Entrez Gene ID:
61752784
947386
ASD
Information of known allosteric effects of PDB entries
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