Browse entries in the PDBbind-CN Database
HEADER 4LG6_COMPLEX COMPND 4LG6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 163 ALA ASN SER LEU SER VAL HIS GLN LEU ALA ALA GLN GLY SEQRES 2 A 163 GLU MET LEU TYR LEU ALA THR ARG ILE GLU GLN GLU ASN SEQRES 3 A 163 VAL ILE ASN HIS THR ASP GLU GLU GLY PHE THR PRO LEU SEQRES 4 A 163 MET TRP ALA ALA ALA HIS GLY GLN ILE ALA VAL VAL GLU SEQRES 5 A 163 PHE LEU LEU GLN ASN GLY ALA ASP PRO GLN LEU LEU GLY SEQRES 6 A 163 LYS GLY ARG GLU SER ALA LEU SER LEU ALA CYS SER LYS SEQRES 7 A 163 GLY TYR THR ASP ILE VAL LYS MET LEU LEU ASP CYS GLY SEQRES 8 A 163 VAL ASP VAL ASN GLU TYR ASP TRP ASN GLY GLY THR PRO SEQRES 9 A 163 LEU LEU TYR ALA VAL HIS GLY ASN HIS VAL LYS CYS VAL SEQRES 10 A 163 LYS MET LEU LEU GLU SER GLY ALA ASP PRO THR ILE GLU SEQRES 11 A 163 THR ASP SER GLY TYR ASN SER MET ASP LEU ALA VAL ALA SEQRES 12 A 163 LEU GLY TYR ARG SER VAL GLN GLN VAL ILE GLU SER HIS SEQRES 13 A 163 LEU LEU LYS LEU LEU GLN ASN HET HIS A 217 191 ATOM 1 N ALA A 148 31.751 -5.032 28.755 1.00 62.85 N ATOM 2 CA ALA A 148 30.431 -4.338 28.793 1.00 66.44 C ATOM 3 C ALA A 148 30.563 -2.831 29.057 1.00 69.17 C ATOM 4 O ALA A 148 29.775 -2.039 28.535 1.00 73.83 O ATOM 5 CB ALA A 148 29.526 -4.979 29.834 1.00 69.11 C ATOM 6 HN3 ALA A 148 32.233 -4.908 29.668 1.00 0.00 H ATOM 7 HN2 ALA A 148 32.334 -4.624 27.996 1.00 0.00 H ATOM 8 HN1 ALA A 148 31.603 -6.045 28.574 1.00 0.00 H ATOM 9 N ASN A 149 31.550 -2.435 29.866 1.00 68.94 N ATOM 10 CA ASN A 149 31.894 -1.002 30.052 1.00 69.34 C ATOM 11 C ASN A 149 31.939 -0.187 28.723 1.00 68.71 C ATOM 12 O ASN A 149 31.511 0.982 28.668 1.00 67.65 O ATOM 13 CB ASN A 149 33.224 -0.824 30.864 1.00 68.01 C ATOM 14 CG ASN A 149 34.390 -1.727 30.378 1.00 69.99 C ATOM 15 OD1 ASN A 149 34.191 -2.852 29.897 1.00 70.48 O ATOM 16 ND2 ASN A 149 35.622 -1.232 30.543 1.00 68.01 N ATOM 17 HD22 ASN A 149 35.751 -0.284 30.950 1.00 0.00 H ATOM 18 HD21 ASN A 149 36.450 -1.796 30.264 1.00 0.00 H ATOM 19 H ASN A 149 32.096 -3.154 30.383 1.00 0.00 H ATOM 20 N SER A 150 32.444 -0.829 27.668 1.00 66.12 N ATOM 21 CA SER A 150 32.545 -0.231 26.347 1.00 64.07 C ATOM 22 C SER A 150 31.181 -0.103 25.664 1.00 61.52 C ATOM 23 O SER A 150 31.016 0.752 24.802 1.00 62.94 O ATOM 24 CB SER A 150 33.464 -1.081 25.467 1.00 64.29 C ATOM 25 OG SER A 150 34.603 -1.514 26.194 1.00 68.17 O ATOM 26 HG SER A 150 35.181 -2.061 25.605 1.00 0.00 H ATOM 27 H SER A 150 32.782 -1.804 27.797 1.00 0.00 H ATOM 28 N LEU A 151 30.213 -0.944 26.048 1.00 55.70 N ATOM 29 CA LEU A 151 28.920 -1.020 25.337 1.00 54.82 C ATOM 30 C LEU A 151 27.936 0.048 25.765 1.00 47.82 C ATOM 31 O LEU A 151 27.809 0.339 26.933 1.00 51.38 O ATOM 32 CB LEU A 151 28.279 -2.403 25.505 1.00 56.70 C ATOM 33 CG LEU A 151 29.130 -3.597 25.047 1.00 59.71 C ATOM 34 CD1 LEU A 151 28.290 -4.869 25.012 1.00 62.41 C ATOM 35 CD2 LEU A 151 29.772 -3.346 23.686 1.00 58.74 C ATOM 36 H LEU A 151 30.375 -1.561 26.869 1.00 0.00 H ATOM 37 N SER A 152 27.244 0.625 24.783 1.00 44.12 N ATOM 38 CA SER A 152 26.177 1.591 25.022 1.00 37.81 C ATOM 39 C SER A 152 24.958 0.853 25.453 1.00 35.43 C ATOM 40 O SER A 152 24.901 -0.369 25.337 1.00 36.84 O ATOM 41 CB SER A 152 25.853 2.343 23.727 1.00 38.12 C ATOM 42 OG SER A 152 25.535 1.419 22.685 1.00 34.59 O ATOM 43 HG SER A 152 26.309 0.821 22.528 1.00 0.00 H ATOM 44 H SER A 152 27.475 0.375 23.800 1.00 0.00 H ATOM 45 N VAL A 153 23.962 1.593 25.921 1.00 31.55 N ATOM 46 CA VAL A 153 22.654 1.020 26.263 1.00 30.75 C ATOM 47 C VAL A 153 21.955 0.323 25.042 1.00 30.79 C ATOM 48 O VAL A 153 21.228 -0.713 25.175 1.00 27.80 O ATOM 49 CB VAL A 153 21.741 2.133 26.832 1.00 32.86 C ATOM 50 CG1 VAL A 153 21.422 3.206 25.783 1.00 36.12 C ATOM 51 CG2 VAL A 153 20.462 1.551 27.393 1.00 32.50 C ATOM 52 H VAL A 153 24.112 2.614 26.050 1.00 0.00 H ATOM 53 N HIS A 154 22.190 0.905 23.867 1.00 28.39 N ATOM 54 CA HIS A 154 21.637 0.410 22.591 1.00 28.04 C ATOM 55 C HIS A 154 22.191 -0.972 22.290 1.00 27.56 C ATOM 56 O HIS A 154 21.452 -1.901 21.947 1.00 24.09 O ATOM 57 CB HIS A 154 21.985 1.400 21.480 1.00 26.71 C ATOM 58 CG HIS A 154 21.523 2.784 21.785 1.00 29.18 C ATOM 59 ND1 HIS A 154 22.299 3.682 22.491 1.00 29.01 N ATOM 60 CD2 HIS A 154 20.324 3.393 21.585 1.00 28.72 C ATOM 61 CE1 HIS A 154 21.618 4.798 22.676 1.00 29.92 C ATOM 62 NE2 HIS A 154 20.418 4.650 22.139 1.00 30.31 N ATOM 63 H HIS A 154 22.794 1.751 23.848 1.00 0.00 H ATOM 64 N GLN A 155 23.505 -1.092 22.414 1.00 28.85 N ATOM 65 CA GLN A 155 24.157 -2.355 22.201 1.00 31.36 C ATOM 66 C GLN A 155 23.741 -3.407 23.216 1.00 30.53 C ATOM 67 O GLN A 155 23.558 -4.585 22.841 1.00 27.65 O ATOM 68 CB GLN A 155 25.662 -2.173 22.200 1.00 35.83 C ATOM 69 CG GLN A 155 26.153 -1.578 20.913 1.00 38.41 C ATOM 70 CD GLN A 155 27.578 -1.089 21.020 1.00 45.38 C ATOM 71 OE1 GLN A 155 27.896 -0.230 21.859 1.00 45.85 O ATOM 72 NE2 GLN A 155 28.453 -1.627 20.166 1.00 47.93 N ATOM 73 HE22 GLN A 155 28.138 -2.344 19.481 1.00 0.00 H ATOM 74 HE21 GLN A 155 29.449 -1.329 20.186 1.00 0.00 H ATOM 75 H GLN A 155 24.073 -0.259 22.669 1.00 0.00 H ATOM 76 N LEU A 156 23.573 -2.998 24.485 1.00 27.91 N ATOM 77 CA LEU A 156 23.130 -3.948 25.509 1.00 28.59 C ATOM 78 C LEU A 156 21.770 -4.490 25.129 1.00 25.42 C ATOM 79 O LEU A 156 21.525 -5.683 25.231 1.00 25.12 O ATOM 80 CB LEU A 156 23.064 -3.324 26.904 1.00 28.83 C ATOM 81 CG LEU A 156 24.403 -2.821 27.492 1.00 32.35 C ATOM 82 CD1 LEU A 156 24.175 -2.182 28.846 1.00 33.34 C ATOM 83 CD2 LEU A 156 25.405 -3.946 27.599 1.00 32.94 C ATOM 84 H LEU A 156 23.757 -2.007 24.740 1.00 0.00 H ATOM 85 N ALA A 157 20.908 -3.612 24.645 1.00 24.89 N ATOM 86 CA ALA A 157 19.536 -3.997 24.298 1.00 23.87 C ATOM 87 C ALA A 157 19.522 -4.950 23.111 1.00 22.71 C ATOM 88 O ALA A 157 18.825 -5.956 23.126 1.00 23.51 O ATOM 89 CB ALA A 157 18.709 -2.749 24.007 1.00 24.85 C ATOM 90 H ALA A 157 21.210 -2.626 24.507 1.00 0.00 H ATOM 91 N ALA A 158 20.337 -4.632 22.101 1.00 24.72 N ATOM 92 CA ALA A 158 20.545 -5.448 20.893 1.00 25.04 C ATOM 93 C ALA A 158 21.028 -6.860 21.205 1.00 25.86 C ATOM 94 O ALA A 158 20.599 -7.810 20.566 1.00 25.19 O ATOM 95 CB ALA A 158 21.583 -4.774 19.974 1.00 25.79 C ATOM 96 H ALA A 158 20.865 -3.739 22.174 1.00 0.00 H ATOM 97 N GLN A 159 21.946 -6.964 22.161 1.00 27.92 N ATOM 98 CA GLN A 159 22.528 -8.256 22.606 1.00 27.95 C ATOM 99 C GLN A 159 21.637 -9.045 23.574 1.00 27.80 C ATOM 100 O GLN A 159 21.869 -10.240 23.773 1.00 26.82 O ATOM 101 CB GLN A 159 23.885 -8.041 23.288 1.00 30.40 C ATOM 102 CG GLN A 159 24.943 -7.462 22.378 1.00 35.60 C ATOM 103 H GLN A 159 22.275 -6.092 22.623 1.00 0.00 H ATOM 104 N GLY A 160 20.603 -8.400 24.144 1.00 26.52 N ATOM 105 CA GLY A 160 19.727 -9.052 25.114 1.00 27.41 C ATOM 106 C GLY A 160 20.363 -9.231 26.490 1.00 28.49 C ATOM 107 O GLY A 160 20.022 -10.201 27.215 1.00 27.61 O ATOM 108 H GLY A 160 20.422 -7.409 23.887 1.00 0.00 H ATOM 109 N GLU A 161 21.266 -8.297 26.857 1.00 29.23 N ATOM 110 CA GLU A 161 21.967 -8.300 28.159 1.00 29.13 C ATOM 111 C GLU A 161 21.121 -7.623 29.244 1.00 27.59 C ATOM 112 O GLU A 161 21.406 -6.516 29.661 1.00 29.40 O ATOM 113 CB GLU A 161 23.318 -7.568 28.052 1.00 28.43 C ATOM 114 CG GLU A 161 24.387 -8.337 27.315 1.00 28.88 C ATOM 115 CD GLU A 161 25.162 -9.255 28.225 1.00 28.37 C ATOM 116 OE1 GLU A 161 24.966 -9.180 29.452 1.00 29.26 O ATOM 117 OE2 GLU A 161 25.978 -10.037 27.710 1.00 27.77 O ATOM 118 H GLU A 161 21.481 -7.532 26.186 1.00 0.00 H ATOM 119 N MET A 162 20.095 -8.312 29.702 1.00 29.67 N ATOM 120 CA MET A 162 19.115 -7.759 30.611 1.00 34.18 C ATOM 121 C MET A 162 19.744 -7.205 31.879 1.00 33.75 C ATOM 122 O MET A 162 19.332 -6.156 32.370 1.00 31.51 O ATOM 123 CB MET A 162 18.115 -8.843 30.988 1.00 40.27 C ATOM 124 CG MET A 162 16.903 -8.339 31.767 1.00 48.12 C ATOM 125 SD MET A 162 15.689 -7.617 30.668 1.00 53.15 S ATOM 126 CE MET A 162 15.202 -9.082 29.744 1.00 49.31 C ATOM 127 H MET A 162 19.985 -9.300 29.395 1.00 0.00 H ATOM 128 N LEU A 163 20.748 -7.909 32.423 1.00 35.59 N ATOM 129 CA LEU A 163 21.331 -7.480 33.705 1.00 34.79 C ATOM 130 C LEU A 163 22.046 -6.136 33.631 1.00 33.03 C ATOM 131 O LEU A 163 21.727 -5.225 34.372 1.00 33.55 O ATOM 132 CB LEU A 163 22.270 -8.561 34.291 1.00 35.86 C ATOM 133 CG LEU A 163 22.754 -8.227 35.721 1.00 36.61 C ATOM 134 CD1 LEU A 163 21.587 -8.070 36.678 1.00 36.01 C ATOM 135 CD2 LEU A 163 23.703 -9.301 36.226 1.00 40.92 C ATOM 136 H LEU A 163 21.113 -8.755 31.941 1.00 0.00 H ATOM 137 N TYR A 164 23.009 -6.008 32.738 1.00 31.64 N ATOM 138 CA TYR A 164 23.715 -4.762 32.581 1.00 35.53 C ATOM 139 C TYR A 164 22.767 -3.678 32.122 1.00 35.04 C ATOM 140 O TYR A 164 22.910 -2.542 32.503 1.00 30.99 O ATOM 141 CB TYR A 164 24.847 -4.876 31.567 1.00 39.37 C ATOM 142 CG TYR A 164 26.037 -5.684 32.026 1.00 46.28 C ATOM 143 CD1 TYR A 164 27.247 -5.057 32.345 1.00 50.21 C ATOM 144 CD2 TYR A 164 25.968 -7.077 32.129 1.00 49.33 C ATOM 145 CE1 TYR A 164 28.353 -5.803 32.764 1.00 53.06 C ATOM 146 CE2 TYR A 164 27.060 -7.835 32.542 1.00 52.72 C ATOM 147 CZ TYR A 164 28.252 -7.201 32.852 1.00 53.62 C ATOM 148 OH TYR A 164 29.339 -7.941 33.257 1.00 53.76 O ATOM 149 HH TYR A 164 30.101 -7.335 33.437 1.00 0.00 H ATOM 150 H TYR A 164 23.262 -6.819 32.138 1.00 0.00 H ATOM 151 N LEU A 165 21.798 -4.047 31.290 1.00 34.90 N ATOM 152 CA LEU A 165 20.870 -3.077 30.760 1.00 36.77 C ATOM 153 C LEU A 165 20.067 -2.494 31.893 1.00 38.35 C ATOM 154 O LEU A 165 19.895 -1.280 31.966 1.00 36.63 O ATOM 155 CB LEU A 165 19.932 -3.723 29.731 1.00 36.78 C ATOM 156 CG LEU A 165 18.876 -2.817 29.066 1.00 36.80 C ATOM 157 CD1 LEU A 165 19.486 -1.557 28.452 1.00 35.44 C ATOM 158 CD2 LEU A 165 18.130 -3.620 28.009 1.00 38.94 C ATOM 159 H LEU A 165 21.708 -5.047 31.018 1.00 0.00 H ATOM 160 N ALA A 166 19.581 -3.361 32.775 1.00 39.85 N ATOM 161 CA ALA A 166 18.804 -2.907 33.942 1.00 45.10 C ATOM 162 C ALA A 166 19.620 -2.003 34.881 1.00 46.49 C ATOM 163 O ALA A 166 19.069 -1.097 35.517 1.00 48.91 O ATOM 164 CB ALA A 166 18.252 -4.096 34.700 1.00 46.60 C ATOM 165 H ALA A 166 19.752 -4.378 32.639 1.00 0.00 H ATOM 166 N THR A 167 20.925 -2.245 34.946 1.00 47.11 N ATOM 167 CA THR A 167 21.825 -1.485 35.812 1.00 48.44 C ATOM 168 C THR A 167 22.087 -0.095 35.240 1.00 50.27 C ATOM 169 O THR A 167 21.974 0.915 35.939 1.00 48.80 O ATOM 170 CB THR A 167 23.176 -2.224 35.989 1.00 47.97 C ATOM 171 OG1 THR A 167 22.945 -3.527 36.551 1.00 44.13 O ATOM 172 CG2 THR A 167 24.114 -1.449 36.895 1.00 48.02 C ATOM 173 HG1 THR A 167 22.362 -4.048 35.944 1.00 0.00 H ATOM 174 H THR A 167 21.322 -3.005 34.358 1.00 0.00 H ATOM 175 N ARG A 168 22.436 -0.063 33.961 1.00 49.02 N ATOM 176 CA ARG A 168 22.682 1.179 33.252 1.00 48.87 C ATOM 177 C ARG A 168 21.469 2.153 33.307 1.00 49.93 C ATOM 178 O ARG A 168 21.662 3.383 33.340 1.00 46.77 O ATOM 179 CB ARG A 168 23.056 0.863 31.815 1.00 50.39 C ATOM 180 CG ARG A 168 23.765 1.985 31.113 1.00 51.05 C ATOM 181 CD ARG A 168 25.209 2.105 31.543 1.00 51.70 C ATOM 182 NE ARG A 168 26.012 0.953 31.137 1.00 52.14 N ATOM 183 CZ ARG A 168 26.577 0.783 29.934 1.00 54.22 C ATOM 184 NH1 ARG A 168 27.307 -0.311 29.707 1.00 54.64 N ATOM 185 NH2 ARG A 168 26.438 1.686 28.959 1.00 52.26 N ATOM 186 HE ARG A 168 26.157 0.202 31.841 1.00 0.00 H ATOM 187 HH12 ARG A 168 27.751 -0.456 28.778 1.00 0.00 H ATOM 188 HH11 ARG A 168 27.431 -1.018 30.459 1.00 0.00 H ATOM 189 HH22 ARG A 168 26.888 1.527 28.035 1.00 0.00 H ATOM 190 HH21 ARG A 168 25.880 2.548 29.124 1.00 0.00 H ATOM 191 H ARG A 168 22.537 -0.961 33.447 1.00 0.00 H ATOM 192 N ILE A 169 20.246 1.596 33.345 1.00 48.01 N ATOM 193 CA ILE A 169 18.998 2.367 33.529 1.00 52.19 C ATOM 194 C ILE A 169 18.849 2.961 34.944 1.00 54.65 C ATOM 195 O ILE A 169 18.279 4.043 35.100 1.00 56.14 O ATOM 196 CB ILE A 169 17.732 1.498 33.257 1.00 52.20 C ATOM 197 CG1 ILE A 169 17.687 0.986 31.810 1.00 54.84 C ATOM 198 CG2 ILE A 169 16.447 2.260 33.586 1.00 53.16 C ATOM 199 CD1 ILE A 169 17.652 2.057 30.749 1.00 54.84 C ATOM 200 H ILE A 169 20.174 0.564 33.239 1.00 0.00 H ATOM 201 N GLU A 170 19.311 2.244 35.978 1.00 60.24 N ATOM 202 CA GLU A 170 19.293 2.778 37.361 1.00 56.82 C ATOM 203 C GLU A 170 20.351 3.882 37.499 1.00 58.76 C ATOM 204 O GLU A 170 20.066 4.946 38.038 1.00 55.95 O ATOM 205 CB GLU A 170 19.538 1.678 38.399 1.00 57.88 C ATOM 206 H GLU A 170 19.691 1.291 35.806 1.00 0.00 H ATOM 207 N GLN A 171 21.560 3.624 36.985 1.00 60.74 N ATOM 208 CA GLN A 171 22.648 4.621 36.993 1.00 65.70 C ATOM 209 C GLN A 171 22.208 5.982 36.403 1.00 68.09 C ATOM 210 O GLN A 171 22.547 7.045 36.963 1.00 69.26 O ATOM 211 CB GLN A 171 23.906 4.101 36.246 1.00 66.00 C ATOM 212 CG GLN A 171 24.686 2.999 36.960 1.00 64.25 C ATOM 213 H GLN A 171 21.738 2.689 36.566 1.00 0.00 H ATOM 214 N GLU A 172 21.444 5.952 35.301 1.00 66.36 N ATOM 215 CA GLU A 172 21.067 7.189 34.582 1.00 63.29 C ATOM 216 C GLU A 172 19.673 7.078 33.945 1.00 58.76 C ATOM 217 O GLU A 172 19.274 5.988 33.549 1.00 61.71 O ATOM 218 CB GLU A 172 22.126 7.468 33.509 1.00 65.20 C ATOM 219 CG GLU A 172 22.544 8.925 33.398 1.00 66.38 C ATOM 220 CD GLU A 172 23.992 9.099 32.940 1.00 65.94 C ATOM 221 OE1 GLU A 172 24.264 10.078 32.212 1.00 59.80 O ATOM 222 OE2 GLU A 172 24.863 8.279 33.323 1.00 66.25 O ATOM 223 H GLU A 172 21.108 5.035 34.943 1.00 0.00 H ATOM 224 N ASN A 173 18.929 8.189 33.846 1.00 52.55 N ATOM 225 CA ASN A 173 17.664 8.168 33.078 1.00 50.93 C ATOM 226 C ASN A 173 17.957 8.203 31.555 1.00 46.86 C ATOM 227 O ASN A 173 17.982 9.277 30.916 1.00 46.37 O ATOM 228 CB ASN A 173 16.717 9.296 33.463 1.00 53.57 C ATOM 229 CG ASN A 173 15.397 9.237 32.681 1.00 61.18 C ATOM 230 OD1 ASN A 173 14.963 8.162 32.229 1.00 61.40 O ATOM 231 ND2 ASN A 173 14.758 10.399 32.509 1.00 64.98 N ATOM 232 HD22 ASN A 173 15.156 11.275 32.904 1.00 0.00 H ATOM 233 HD21 ASN A 173 13.863 10.427 31.980 1.00 0.00 H ATOM 234 H ASN A 173 19.241 9.066 34.309 1.00 0.00 H ATOM 235 N VAL A 174 18.204 7.020 31.001 1.00 42.57 N ATOM 236 CA VAL A 174 18.611 6.879 29.606 1.00 40.69 C ATOM 237 C VAL A 174 17.728 5.906 28.838 1.00 34.81 C ATOM 238 O VAL A 174 18.107 5.477 27.766 1.00 34.87 O ATOM 239 CB VAL A 174 20.110 6.449 29.463 1.00 40.28 C ATOM 240 CG1 VAL A 174 21.048 7.580 29.888 1.00 41.72 C ATOM 241 CG2 VAL A 174 20.392 5.173 30.250 1.00 41.93 C ATOM 242 H VAL A 174 18.104 6.164 31.583 1.00 0.00 H ATOM 243 N ILE A 175 16.548 5.582 29.356 1.00 31.32 N ATOM 244 CA ILE A 175 15.704 4.609 28.701 1.00 31.21 C ATOM 245 C ILE A 175 15.254 5.030 27.266 1.00 30.85 C ATOM 246 O ILE A 175 15.148 4.184 26.378 1.00 30.83 O ATOM 247 CB ILE A 175 14.500 4.177 29.570 1.00 33.17 C ATOM 248 CG1 ILE A 175 13.887 2.884 29.008 1.00 36.46 C ATOM 249 CG2 ILE A 175 13.469 5.284 29.693 1.00 33.93 C ATOM 250 CD1 ILE A 175 12.900 2.206 29.931 1.00 37.77 C ATOM 251 H ILE A 175 16.230 6.031 30.238 1.00 0.00 H ATOM 252 N ASN A 176 15.034 6.321 27.035 1.00 30.84 N ATOM 253 CA ASN A 176 14.613 6.793 25.703 1.00 28.72 C ATOM 254 C ASN A 176 15.686 7.621 25.021 1.00 29.92 C ATOM 255 O ASN A 176 15.386 8.348 24.072 1.00 30.36 O ATOM 256 CB ASN A 176 13.314 7.573 25.809 1.00 29.25 C ATOM 257 CG ASN A 176 12.140 6.693 26.139 1.00 29.37 C ATOM 258 OD1 ASN A 176 11.923 5.665 25.524 1.00 31.54 O ATOM 259 ND2 ASN A 176 11.359 7.101 27.130 1.00 30.63 N ATOM 260 HD22 ASN A 176 11.576 7.985 27.633 1.00 0.00 H ATOM 261 HD21 ASN A 176 10.530 6.537 27.404 1.00 0.00 H ATOM 262 H ASN A 176 15.161 7.008 27.805 1.00 0.00 H ATOM 263 N HIS A 177 16.932 7.487 25.484 1.00 28.04 N ATOM 264 CA HIS A 177 18.065 8.202 24.898 1.00 29.44 C ATOM 265 C HIS A 177 18.338 7.700 23.494 1.00 30.53 C ATOM 266 O HIS A 177 18.540 6.509 23.260 1.00 26.57 O ATOM 267 CB HIS A 177 19.347 8.085 25.749 1.00 32.10 C ATOM 268 CG HIS A 177 19.470 9.150 26.791 1.00 35.25 C ATOM 269 ND1 HIS A 177 20.633 9.861 26.997 1.00 37.83 N ATOM 270 CD2 HIS A 177 18.564 9.641 27.674 1.00 37.92 C ATOM 271 CE1 HIS A 177 20.445 10.726 27.984 1.00 39.70 C ATOM 272 NE2 HIS A 177 19.200 10.609 28.413 1.00 39.77 N ATOM 273 H HIS A 177 17.102 6.852 26.290 1.00 0.00 H ATOM 274 N THR A 178 18.351 8.643 22.559 1.00 31.54 N ATOM 275 CA THR A 178 18.473 8.343 21.148 1.00 33.21 C ATOM 276 C THR A 178 19.939 8.406 20.784 1.00 34.40 C ATOM 277 O THR A 178 20.677 9.231 21.305 1.00 38.47 O ATOM 278 CB THR A 178 17.654 9.361 20.327 1.00 34.14 C ATOM 279 OG1 THR A 178 18.061 10.687 20.695 1.00 37.33 O ATOM 280 CG2 THR A 178 16.143 9.222 20.643 1.00 33.63 C ATOM 281 HG1 THR A 178 17.897 10.825 21.661 1.00 0.00 H ATOM 282 H THR A 178 18.270 9.637 22.852 1.00 0.00 H ATOM 283 N ASP A 179 20.378 7.499 19.927 1.00 34.96 N ATOM 284 CA ASP A 179 21.737 7.567 19.349 1.00 31.99 C ATOM 285 C ASP A 179 21.813 8.597 18.188 1.00 30.27 C ATOM 286 O ASP A 179 20.866 9.376 17.966 1.00 28.57 O ATOM 287 CB ASP A 179 22.208 6.154 18.932 1.00 29.66 C ATOM 288 CG ASP A 179 21.476 5.586 17.677 1.00 28.72 C ATOM 289 OD1 ASP A 179 20.714 6.283 16.977 1.00 29.61 O ATOM 290 OD2 ASP A 179 21.665 4.384 17.421 1.00 28.92 O ATOM 291 H ASP A 179 19.750 6.717 19.652 1.00 0.00 H ATOM 292 N GLU A 180 22.934 8.592 17.457 1.00 30.87 N ATOM 293 CA GLU A 180 23.169 9.516 16.305 1.00 31.52 C ATOM 294 C GLU A 180 22.081 9.510 15.207 1.00 33.35 C ATOM 295 O GLU A 180 21.870 10.531 14.483 1.00 32.04 O ATOM 296 CB GLU A 180 24.526 9.199 15.654 1.00 31.27 C ATOM 297 H GLU A 180 23.680 7.910 17.703 1.00 0.00 H ATOM 298 N GLU A 181 21.413 8.362 15.063 1.00 31.62 N ATOM 299 CA GLU A 181 20.415 8.163 14.019 1.00 33.50 C ATOM 300 C GLU A 181 18.972 8.239 14.538 1.00 30.59 C ATOM 301 O GLU A 181 18.012 7.887 13.804 1.00 28.56 O ATOM 302 CB GLU A 181 20.644 6.801 13.373 1.00 37.53 C ATOM 303 CG GLU A 181 21.983 6.665 12.646 1.00 42.41 C ATOM 304 CD GLU A 181 21.893 7.045 11.178 1.00 46.56 C ATOM 305 OE1 GLU A 181 20.973 6.545 10.476 1.00 51.03 O ATOM 306 OE2 GLU A 181 22.743 7.840 10.724 1.00 50.54 O ATOM 307 H GLU A 181 21.612 7.581 15.720 1.00 0.00 H ATOM 308 N GLY A 182 18.827 8.670 15.798 1.00 25.50 N ATOM 309 CA GLY A 182 17.514 8.812 16.446 1.00 26.92 C ATOM 310 C GLY A 182 16.936 7.526 16.988 1.00 23.06 C ATOM 311 O GLY A 182 15.768 7.518 17.426 1.00 25.73 O ATOM 312 H GLY A 182 19.679 8.915 16.341 1.00 0.00 H ATOM 313 N PHE A 183 17.732 6.453 16.949 1.00 24.80 N ATOM 314 CA PHE A 183 17.303 5.121 17.428 1.00 24.28 C ATOM 315 C PHE A 183 17.322 5.004 18.966 1.00 23.31 C ATOM 316 O PHE A 183 18.301 5.329 19.618 1.00 22.42 O ATOM 317 CB PHE A 183 18.167 4.014 16.816 1.00 25.63 C ATOM 318 CG PHE A 183 17.826 3.686 15.384 1.00 27.17 C ATOM 319 CD1 PHE A 183 17.515 4.691 14.466 1.00 28.51 C ATOM 320 CD2 PHE A 183 17.834 2.362 14.948 1.00 27.95 C ATOM 321 CE1 PHE A 183 17.215 4.392 13.135 1.00 30.77 C ATOM 322 CE2 PHE A 183 17.532 2.056 13.622 1.00 29.86 C ATOM 323 CZ PHE A 183 17.232 3.067 12.708 1.00 29.25 C ATOM 324 H PHE A 183 18.693 6.559 16.566 1.00 0.00 H ATOM 325 N THR A 184 16.213 4.529 19.528 1.00 22.70 N ATOM 326 CA THR A 184 16.102 4.293 20.951 1.00 20.55 C ATOM 327 C THR A 184 16.592 2.859 21.255 1.00 22.36 C ATOM 328 O THR A 184 16.728 2.042 20.342 1.00 19.77 O ATOM 329 CB THR A 184 14.648 4.409 21.340 1.00 19.93 C ATOM 330 OG1 THR A 184 13.921 3.535 20.498 1.00 17.88 O ATOM 331 CG2 THR A 184 14.151 5.798 21.053 1.00 21.26 C ATOM 332 HG1 THR A 184 12.959 3.584 20.725 1.00 0.00 H ATOM 333 H THR A 184 15.395 4.319 18.921 1.00 0.00 H ATOM 334 N PRO A 185 16.885 2.560 22.544 1.00 24.49 N ATOM 335 CA PRO A 185 17.247 1.179 22.899 1.00 23.05 C ATOM 336 C PRO A 185 16.190 0.198 22.427 1.00 20.49 C ATOM 337 O PRO A 185 16.531 -0.856 21.929 1.00 19.43 O ATOM 338 CB PRO A 185 17.336 1.228 24.436 1.00 23.78 C ATOM 339 CG PRO A 185 17.852 2.630 24.691 1.00 25.71 C ATOM 340 CD PRO A 185 17.181 3.501 23.649 1.00 24.87 C ATOM 341 N LEU A 186 14.909 0.561 22.599 1.00 18.79 N ATOM 342 CA LEU A 186 13.806 -0.223 22.096 1.00 18.81 C ATOM 343 C LEU A 186 13.879 -0.565 20.619 1.00 17.90 C ATOM 344 O LEU A 186 13.593 -1.710 20.235 1.00 19.40 O ATOM 345 CB LEU A 186 12.471 0.494 22.386 1.00 19.69 C ATOM 346 CG LEU A 186 11.195 -0.278 22.043 1.00 21.10 C ATOM 347 CD1 LEU A 186 10.968 -1.511 22.897 1.00 22.78 C ATOM 348 CD2 LEU A 186 10.008 0.665 22.174 1.00 23.47 C ATOM 349 H LEU A 186 14.703 1.441 23.114 1.00 0.00 H ATOM 350 N MET A 187 14.217 0.415 19.781 1.00 18.07 N ATOM 351 CA MET A 187 14.374 0.160 18.347 1.00 19.62 C ATOM 352 C MET A 187 15.517 -0.841 18.128 1.00 18.77 C ATOM 353 O MET A 187 15.398 -1.721 17.281 1.00 16.71 O ATOM 354 CB MET A 187 14.620 1.454 17.556 1.00 20.28 C ATOM 355 CG MET A 187 13.350 2.302 17.395 1.00 20.64 C ATOM 356 SD MET A 187 13.712 4.042 16.935 1.00 23.72 S ATOM 357 CE MET A 187 14.356 3.821 15.309 1.00 24.87 C ATOM 358 H MET A 187 14.372 1.375 20.151 1.00 0.00 H ATOM 359 N TRP A 188 16.622 -0.695 18.854 1.00 21.00 N ATOM 360 CA TRP A 188 17.722 -1.674 18.691 1.00 21.07 C ATOM 361 C TRP A 188 17.288 -3.100 19.071 1.00 20.22 C ATOM 362 O TRP A 188 17.669 -4.111 18.414 1.00 19.05 O ATOM 363 CB TRP A 188 18.949 -1.302 19.492 1.00 21.88 C ATOM 364 CG TRP A 188 19.815 -0.259 18.870 1.00 21.36 C ATOM 365 CD1 TRP A 188 19.552 1.058 18.763 1.00 22.94 C ATOM 366 CD2 TRP A 188 21.094 -0.463 18.277 1.00 22.89 C ATOM 367 NE1 TRP A 188 20.596 1.702 18.167 1.00 22.81 N ATOM 368 CE2 TRP A 188 21.557 0.792 17.850 1.00 22.70 C ATOM 369 CE3 TRP A 188 21.916 -1.587 18.100 1.00 25.33 C ATOM 370 CZ2 TRP A 188 22.808 0.966 17.224 1.00 26.69 C ATOM 371 CZ3 TRP A 188 23.169 -1.417 17.466 1.00 27.70 C ATOM 372 CH2 TRP A 188 23.590 -0.145 17.049 1.00 26.77 C ATOM 373 HE1 TRP A 188 20.649 2.724 17.984 1.00 0.00 H ATOM 374 H TRP A 188 16.712 0.094 19.526 1.00 0.00 H ATOM 375 N ALA A 189 16.497 -3.189 20.136 1.00 20.06 N ATOM 376 CA ALA A 189 16.023 -4.476 20.625 1.00 19.64 C ATOM 377 C ALA A 189 15.048 -5.096 19.652 1.00 20.05 C ATOM 378 O ALA A 189 15.122 -6.315 19.368 1.00 19.92 O ATOM 379 CB ALA A 189 15.380 -4.332 22.003 1.00 18.61 C ATOM 380 H ALA A 189 16.211 -2.320 20.631 1.00 0.00 H ATOM 381 N ALA A 190 14.112 -4.267 19.164 1.00 20.97 N ATOM 382 CA ALA A 190 13.155 -4.700 18.164 1.00 19.79 C ATOM 383 C ALA A 190 13.881 -5.214 16.927 1.00 19.74 C ATOM 384 O ALA A 190 13.543 -6.273 16.384 1.00 19.41 O ATOM 385 CB ALA A 190 12.187 -3.555 17.803 1.00 20.31 C ATOM 386 H ALA A 190 14.072 -3.288 19.512 1.00 0.00 H ATOM 387 N ALA A 191 14.952 -4.511 16.516 1.00 18.00 N ATOM 388 CA ALA A 191 15.643 -4.868 15.255 1.00 19.89 C ATOM 389 C ALA A 191 16.397 -6.188 15.317 1.00 21.62 C ATOM 390 O ALA A 191 16.677 -6.799 14.273 1.00 19.72 O ATOM 391 CB ALA A 191 16.603 -3.771 14.879 1.00 19.64 C ATOM 392 H ALA A 191 15.297 -3.713 17.087 1.00 0.00 H ATOM 393 N HIS A 192 16.772 -6.589 16.539 1.00 23.01 N ATOM 394 CA HIS A 192 17.566 -7.795 16.754 1.00 22.82 C ATOM 395 C HIS A 192 16.722 -8.865 17.424 1.00 22.61 C ATOM 396 O HIS A 192 17.258 -9.823 17.923 1.00 20.72 O ATOM 397 CB HIS A 192 18.795 -7.479 17.596 1.00 26.86 C ATOM 398 CG HIS A 192 19.805 -6.646 16.876 1.00 27.99 C ATOM 399 ND1 HIS A 192 19.788 -5.267 16.907 1.00 28.72 N ATOM 400 CD2 HIS A 192 20.831 -6.993 16.073 1.00 28.12 C ATOM 401 CE1 HIS A 192 20.777 -4.807 16.162 1.00 30.05 C ATOM 402 NE2 HIS A 192 21.421 -5.833 15.646 1.00 28.82 N ATOM 403 H HIS A 192 16.488 -6.022 17.363 1.00 0.00 H ATOM 404 N GLY A 193 15.399 -8.671 17.472 1.00 21.02 N ATOM 405 CA GLY A 193 14.481 -9.717 17.929 1.00 21.74 C ATOM 406 C GLY A 193 14.574 -10.168 19.384 1.00 23.58 C ATOM 407 O GLY A 193 14.328 -11.365 19.714 1.00 22.76 O ATOM 408 H GLY A 193 15.012 -7.752 17.177 1.00 0.00 H ATOM 409 N GLN A 194 14.895 -9.223 20.269 1.00 23.61 N ATOM 410 CA GLN A 194 15.096 -9.480 21.700 1.00 23.27 C ATOM 411 C GLN A 194 13.765 -9.254 22.438 1.00 24.61 C ATOM 412 O GLN A 194 13.510 -8.170 22.957 1.00 24.11 O ATOM 413 CB GLN A 194 16.164 -8.541 22.237 1.00 24.40 C ATOM 414 CG GLN A 194 17.516 -8.721 21.546 1.00 25.25 C ATOM 415 CD GLN A 194 18.130 -10.043 21.911 1.00 27.33 C ATOM 416 OE1 GLN A 194 17.663 -10.719 22.802 1.00 25.21 O ATOM 417 NE2 GLN A 194 19.201 -10.393 21.260 1.00 30.24 N ATOM 418 HE22 GLN A 194 19.570 -9.785 20.501 1.00 0.00 H ATOM 419 HE21 GLN A 194 19.688 -11.281 21.498 1.00 0.00 H ATOM 420 H GLN A 194 15.009 -8.248 19.925 1.00 0.00 H ATOM 421 N ILE A 195 12.916 -10.280 22.431 1.00 25.84 N ATOM 422 CA ILE A 195 11.541 -10.173 22.933 1.00 25.87 C ATOM 423 C ILE A 195 11.554 -9.733 24.392 1.00 26.44 C ATOM 424 O ILE A 195 10.795 -8.832 24.793 1.00 23.54 O ATOM 425 CB ILE A 195 10.762 -11.515 22.781 1.00 25.77 C ATOM 426 CG1 ILE A 195 10.461 -11.827 21.304 1.00 28.12 C ATOM 427 CG2 ILE A 195 9.469 -11.487 23.598 1.00 25.37 C ATOM 428 CD1 ILE A 195 10.134 -13.285 20.979 1.00 28.14 C ATOM 429 H ILE A 195 13.240 -11.194 22.055 1.00 0.00 H ATOM 430 N ALA A 196 12.390 -10.388 25.201 1.00 26.07 N ATOM 431 CA ALA A 196 12.412 -10.140 26.635 1.00 26.78 C ATOM 432 C ALA A 196 12.847 -8.697 26.949 1.00 25.16 C ATOM 433 O ALA A 196 12.247 -8.036 27.758 1.00 26.03 O ATOM 434 CB ALA A 196 13.310 -11.153 27.347 1.00 27.13 C ATOM 435 H ALA A 196 13.041 -11.092 24.797 1.00 0.00 H ATOM 436 N VAL A 197 13.868 -8.221 26.254 1.00 23.82 N ATOM 437 CA VAL A 197 14.288 -6.851 26.383 1.00 22.74 C ATOM 438 C VAL A 197 13.199 -5.829 25.959 1.00 22.70 C ATOM 439 O VAL A 197 13.045 -4.787 26.608 1.00 22.34 O ATOM 440 CB VAL A 197 15.564 -6.596 25.579 1.00 22.85 C ATOM 441 CG1 VAL A 197 15.859 -5.118 25.497 1.00 22.65 C ATOM 442 CG2 VAL A 197 16.711 -7.340 26.214 1.00 23.69 C ATOM 443 H VAL A 197 14.377 -8.850 25.601 1.00 0.00 H ATOM 444 N VAL A 198 12.492 -6.125 24.872 1.00 22.63 N ATOM 445 CA VAL A 198 11.398 -5.268 24.418 1.00 22.68 C ATOM 446 C VAL A 198 10.357 -5.180 25.546 1.00 24.45 C ATOM 447 O VAL A 198 9.976 -4.075 25.951 1.00 24.85 O ATOM 448 CB VAL A 198 10.776 -5.765 23.080 1.00 20.54 C ATOM 449 CG1 VAL A 198 9.506 -5.019 22.746 1.00 19.76 C ATOM 450 CG2 VAL A 198 11.735 -5.510 21.932 1.00 19.43 C ATOM 451 H VAL A 198 12.722 -6.984 24.334 1.00 0.00 H ATOM 452 N GLU A 199 9.964 -6.340 26.078 1.00 24.93 N ATOM 453 CA GLU A 199 8.990 -6.381 27.201 1.00 28.25 C ATOM 454 C GLU A 199 9.482 -5.545 28.352 1.00 26.02 C ATOM 455 O GLU A 199 8.778 -4.690 28.845 1.00 26.85 O ATOM 456 CB GLU A 199 8.758 -7.817 27.702 1.00 30.24 C ATOM 457 CG GLU A 199 7.641 -7.885 28.756 1.00 33.87 C ATOM 458 CD GLU A 199 7.268 -9.300 29.116 1.00 37.92 C ATOM 459 OE1 GLU A 199 8.156 -10.063 29.542 1.00 41.17 O ATOM 460 OE2 GLU A 199 6.089 -9.645 28.972 1.00 42.70 O ATOM 461 H GLU A 199 10.346 -7.231 25.700 1.00 0.00 H ATOM 462 N PHE A 200 10.717 -5.795 28.750 1.00 26.31 N ATOM 463 CA PHE A 200 11.347 -5.061 29.862 1.00 27.13 C ATOM 464 C PHE A 200 11.397 -3.549 29.631 1.00 26.76 C ATOM 465 O PHE A 200 11.043 -2.781 30.517 1.00 28.42 O ATOM 466 CB PHE A 200 12.758 -5.611 30.146 1.00 29.51 C ATOM 467 CG PHE A 200 13.614 -4.725 31.035 1.00 31.43 C ATOM 468 CD1 PHE A 200 13.477 -4.757 32.430 1.00 34.62 C ATOM 469 CD2 PHE A 200 14.589 -3.897 30.481 1.00 34.35 C ATOM 470 CE1 PHE A 200 14.265 -3.948 33.236 1.00 32.39 C ATOM 471 CE2 PHE A 200 15.370 -3.084 31.280 1.00 32.39 C ATOM 472 CZ PHE A 200 15.212 -3.110 32.660 1.00 35.04 C ATOM 473 H PHE A 200 11.262 -6.534 28.262 1.00 0.00 H ATOM 474 N LEU A 201 11.830 -3.112 28.445 1.00 24.61 N ATOM 475 CA LEU A 201 11.881 -1.672 28.158 1.00 23.08 C ATOM 476 C LEU A 201 10.505 -1.008 28.169 1.00 24.32 C ATOM 477 O LEU A 201 10.362 0.068 28.756 1.00 24.93 O ATOM 478 CB LEU A 201 12.555 -1.415 26.830 1.00 23.67 C ATOM 479 CG LEU A 201 14.050 -1.723 26.797 1.00 22.72 C ATOM 480 CD1 LEU A 201 14.541 -1.762 25.357 1.00 25.23 C ATOM 481 CD2 LEU A 201 14.858 -0.760 27.653 1.00 23.91 C ATOM 482 H LEU A 201 12.133 -3.795 27.721 1.00 0.00 H ATOM 483 N LEU A 202 9.532 -1.630 27.514 1.00 23.27 N ATOM 484 CA LEU A 202 8.129 -1.127 27.496 1.00 24.68 C ATOM 485 C LEU A 202 7.539 -1.050 28.903 1.00 28.35 C ATOM 486 O LEU A 202 6.855 -0.069 29.244 1.00 29.04 O ATOM 487 CB LEU A 202 7.208 -1.981 26.635 1.00 24.51 C ATOM 488 CG LEU A 202 7.447 -2.000 25.110 1.00 23.75 C ATOM 489 CD1 LEU A 202 6.695 -3.121 24.416 1.00 22.87 C ATOM 490 CD2 LEU A 202 7.122 -0.650 24.474 1.00 23.80 C ATOM 491 H LEU A 202 9.757 -2.502 26.993 1.00 0.00 H ATOM 492 N GLN A 203 7.786 -2.069 29.717 1.00 28.59 N ATOM 493 CA GLN A 203 7.373 -2.020 31.151 1.00 32.17 C ATOM 494 C GLN A 203 7.992 -0.895 31.953 1.00 31.26 C ATOM 495 O GLN A 203 7.387 -0.418 32.884 1.00 35.86 O ATOM 496 CB GLN A 203 7.676 -3.328 31.831 1.00 33.55 C ATOM 497 CG GLN A 203 6.641 -4.367 31.529 1.00 37.96 C ATOM 498 CD GLN A 203 6.749 -5.553 32.457 1.00 44.79 C ATOM 499 OE1 GLN A 203 7.122 -5.418 33.640 1.00 47.44 O ATOM 500 NE2 GLN A 203 6.426 -6.725 31.937 1.00 48.87 N ATOM 501 HE22 GLN A 203 6.120 -6.787 30.945 1.00 0.00 H ATOM 502 HE21 GLN A 203 6.477 -7.585 32.520 1.00 0.00 H ATOM 503 H GLN A 203 8.273 -2.912 29.351 1.00 0.00 H ATOM 504 N ASN A 204 9.195 -0.469 31.577 1.00 30.69 N ATOM 505 CA ASN A 204 9.909 0.573 32.280 1.00 31.38 C ATOM 506 C ASN A 204 9.817 1.943 31.618 1.00 28.06 C ATOM 507 O ASN A 204 10.593 2.825 31.919 1.00 30.34 O ATOM 508 CB ASN A 204 11.358 0.145 32.478 1.00 33.27 C ATOM 509 CG ASN A 204 11.490 -0.883 33.578 1.00 37.47 C ATOM 510 OD1 ASN A 204 11.363 -0.550 34.762 1.00 38.70 O ATOM 511 ND2 ASN A 204 11.697 -2.151 33.203 1.00 40.01 N ATOM 512 HD22 ASN A 204 11.798 -2.385 32.195 1.00 0.00 H ATOM 513 HD21 ASN A 204 11.757 -2.902 33.920 1.00 0.00 H ATOM 514 H ASN A 204 9.640 -0.903 30.743 1.00 0.00 H ATOM 515 N GLY A 205 8.844 2.104 30.736 1.00 27.32 N ATOM 516 CA GLY A 205 8.481 3.419 30.209 1.00 27.20 C ATOM 517 C GLY A 205 9.104 3.778 28.873 1.00 27.98 C ATOM 518 O GLY A 205 9.081 4.947 28.477 1.00 27.31 O ATOM 519 H GLY A 205 8.320 1.268 30.407 1.00 0.00 H ATOM 520 N ALA A 206 9.658 2.796 28.148 1.00 25.94 N ATOM 521 CA ALA A 206 10.247 3.135 26.829 1.00 26.85 C ATOM 522 C ALA A 206 9.091 3.486 25.887 1.00 26.08 C ATOM 523 O ALA A 206 8.052 2.813 25.875 1.00 26.76 O ATOM 524 CB ALA A 206 11.091 2.005 26.274 1.00 25.83 C ATOM 525 H ALA A 206 9.675 1.818 28.502 1.00 0.00 H ATOM 526 N ASP A 207 9.273 4.567 25.130 1.00 27.36 N ATOM 527 CA ASP A 207 8.225 5.109 24.271 1.00 25.93 C ATOM 528 C ASP A 207 8.319 4.476 22.862 1.00 23.85 C ATOM 529 O ASP A 207 9.306 4.697 22.165 1.00 23.74 O ATOM 530 CB ASP A 207 8.376 6.617 24.202 1.00 27.03 C ATOM 531 CG ASP A 207 7.291 7.285 23.362 1.00 27.33 C ATOM 532 OD1 ASP A 207 6.452 6.590 22.762 1.00 27.04 O ATOM 533 OD2 ASP A 207 7.299 8.522 23.300 1.00 31.32 O ATOM 534 H ASP A 207 10.197 5.043 25.152 1.00 0.00 H ATOM 535 N PRO A 208 7.323 3.645 22.483 1.00 24.21 N ATOM 536 CA PRO A 208 7.428 2.926 21.227 1.00 25.19 C ATOM 537 C PRO A 208 7.067 3.777 20.000 1.00 26.00 C ATOM 538 O PRO A 208 7.224 3.314 18.879 1.00 26.10 O ATOM 539 CB PRO A 208 6.433 1.763 21.410 1.00 26.91 C ATOM 540 CG PRO A 208 5.360 2.334 22.333 1.00 27.14 C ATOM 541 CD PRO A 208 6.034 3.390 23.165 1.00 26.81 C ATOM 542 N GLN A 209 6.590 5.013 20.210 1.00 27.41 N ATOM 543 CA GLN A 209 6.201 5.884 19.112 1.00 27.70 C ATOM 544 C GLN A 209 7.314 6.776 18.623 1.00 26.97 C ATOM 545 O GLN A 209 7.150 7.445 17.603 1.00 29.06 O ATOM 546 CB GLN A 209 5.015 6.734 19.535 1.00 31.53 C ATOM 547 CG GLN A 209 3.785 5.882 19.820 1.00 38.00 C ATOM 548 CD GLN A 209 2.460 6.617 19.629 1.00 44.27 C ATOM 549 OE1 GLN A 209 1.399 5.990 19.569 1.00 52.30 O ATOM 550 NE2 GLN A 209 2.513 7.949 19.530 1.00 49.42 N ATOM 551 HE22 GLN A 209 3.429 8.439 19.586 1.00 0.00 H ATOM 552 HE21 GLN A 209 1.638 8.496 19.397 1.00 0.00 H ATOM 553 H GLN A 209 6.496 5.359 21.186 1.00 0.00 H ATOM 554 N LEU A 210 8.439 6.796 19.326 1.00 25.64 N ATOM 555 CA LEU A 210 9.603 7.621 18.924 1.00 26.05 C ATOM 556 C LEU A 210 10.188 7.076 17.665 1.00 26.28 C ATOM 557 O LEU A 210 10.289 5.853 17.505 1.00 24.91 O ATOM 558 CB LEU A 210 10.686 7.655 20.024 1.00 27.49 C ATOM 559 CG LEU A 210 10.256 8.280 21.365 1.00 28.22 C ATOM 560 CD1 LEU A 210 11.403 8.263 22.348 1.00 30.26 C ATOM 561 CD2 LEU A 210 9.707 9.681 21.157 1.00 27.82 C ATOM 562 H LEU A 210 8.506 6.215 20.186 1.00 0.00 H ATOM 563 N LEU A 211 10.603 7.962 16.760 1.00 24.70 N ATOM 564 CA LEU A 211 11.017 7.518 15.449 1.00 24.01 C ATOM 565 C LEU A 211 12.438 7.889 15.213 1.00 21.77 C ATOM 566 O LEU A 211 12.937 8.809 15.829 1.00 20.88 O ATOM 567 CB LEU A 211 10.147 8.175 14.352 1.00 25.93 C ATOM 568 CG LEU A 211 8.632 8.056 14.453 1.00 27.80 C ATOM 569 CD1 LEU A 211 8.002 8.810 13.322 1.00 28.08 C ATOM 570 CD2 LEU A 211 8.183 6.605 14.415 1.00 29.54 C ATOM 571 H LEU A 211 10.629 8.974 16.998 1.00 0.00 H ATOM 572 N GLY A 212 13.075 7.176 14.322 1.00 20.94 N ATOM 573 CA GLY A 212 14.463 7.485 13.913 1.00 22.57 C ATOM 574 C GLY A 212 14.522 8.720 13.024 1.00 24.93 C ATOM 575 O GLY A 212 13.505 9.326 12.718 1.00 23.46 O ATOM 576 H GLY A 212 12.591 6.365 13.886 1.00 0.00 H ATOM 577 N LYS A 213 15.749 9.069 12.648 1.00 27.48 N ATOM 578 CA LYS A 213 16.093 10.227 11.810 1.00 34.11 C ATOM 579 C LYS A 213 15.340 10.213 10.468 1.00 32.76 C ATOM 580 O LYS A 213 14.824 11.267 10.006 1.00 34.28 O ATOM 581 CB LYS A 213 17.611 10.135 11.575 1.00 37.67 C ATOM 582 CG LYS A 213 18.247 11.155 10.670 1.00 42.99 C ATOM 583 CD LYS A 213 19.694 10.752 10.426 1.00 44.92 C ATOM 584 CE LYS A 213 20.351 11.710 9.458 1.00 46.52 C ATOM 585 NZ LYS A 213 21.785 11.887 9.807 1.00 47.54 N ATOM 586 HZ1 LYS A 213 21.861 12.270 10.771 1.00 0.00 H ATOM 587 HZ2 LYS A 213 22.268 10.967 9.759 1.00 0.00 H ATOM 588 HZ3 LYS A 213 22.225 12.547 9.135 1.00 0.00 H ATOM 589 H LYS A 213 16.534 8.470 12.975 1.00 0.00 H ATOM 590 N GLY A 214 15.276 9.020 9.866 1.00 29.75 N ATOM 591 CA GLY A 214 14.464 8.778 8.679 1.00 30.54 C ATOM 592 C GLY A 214 13.050 8.256 8.949 1.00 29.79 C ATOM 593 O GLY A 214 12.470 7.637 8.082 1.00 27.97 O ATOM 594 H GLY A 214 15.828 8.232 10.261 1.00 0.00 H ATOM 595 N ARG A 215 12.511 8.546 10.141 1.00 28.59 N ATOM 596 CA ARG A 215 11.178 8.097 10.604 1.00 28.87 C ATOM 597 C ARG A 215 11.047 6.536 10.678 1.00 24.75 C ATOM 598 O ARG A 215 9.932 5.982 10.572 1.00 22.13 O ATOM 599 CB ARG A 215 10.033 8.738 9.771 1.00 32.07 C ATOM 600 CG ARG A 215 9.863 10.267 9.923 1.00 35.01 C ATOM 601 CD ARG A 215 8.448 10.736 9.519 1.00 35.93 C ATOM 602 H ARG A 215 13.072 9.132 10.791 1.00 0.00 H ATOM 603 N GLU A 216 12.183 5.858 10.881 1.00 23.02 N ATOM 604 CA GLU A 216 12.214 4.416 11.175 1.00 22.59 C ATOM 605 C GLU A 216 11.507 4.207 12.486 1.00 23.11 C ATOM 606 O GLU A 216 11.715 4.989 13.412 1.00 24.25 O ATOM 607 CB GLU A 216 13.632 3.901 11.383 1.00 23.89 C ATOM 608 CG GLU A 216 14.591 4.037 10.206 1.00 26.45 C ATOM 609 CD GLU A 216 15.345 5.368 10.136 1.00 28.78 C ATOM 610 OE1 GLU A 216 14.916 6.369 10.762 1.00 27.97 O ATOM 611 OE2 GLU A 216 16.373 5.414 9.412 1.00 31.43 O ATOM 612 H GLU A 216 13.085 6.373 10.829 1.00 0.00 H ATOM 613 N SER A 217 10.708 3.160 12.573 1.00 21.33 N ATOM 614 CA SER A 217 9.996 2.820 13.767 1.00 20.09 C ATOM 615 C SER A 217 10.428 1.434 14.252 1.00 19.66 C ATOM 616 O SER A 217 10.869 0.574 13.464 1.00 20.67 O ATOM 617 CB SER A 217 8.483 2.801 13.505 1.00 17.57 C ATOM 618 OG SER A 217 8.187 1.828 12.512 1.00 19.28 O ATOM 619 HG SER A 217 7.212 1.816 12.344 1.00 0.00 H ATOM 620 H SER A 217 10.590 2.554 11.736 1.00 0.00 H ATOM 621 N ALA A 218 10.272 1.222 15.551 1.00 19.83 N ATOM 622 CA ALA A 218 10.450 -0.086 16.168 1.00 19.83 C ATOM 623 C ALA A 218 9.544 -1.086 15.476 1.00 18.64 C ATOM 624 O ALA A 218 9.963 -2.206 15.176 1.00 17.02 O ATOM 625 CB ALA A 218 10.137 -0.015 17.670 1.00 21.34 C ATOM 626 H ALA A 218 10.011 2.026 16.157 1.00 0.00 H ATOM 627 N LEU A 219 8.297 -0.679 15.219 1.00 18.58 N ATOM 628 CA LEU A 219 7.362 -1.533 14.516 1.00 19.06 C ATOM 629 C LEU A 219 7.908 -1.985 13.140 1.00 18.87 C ATOM 630 O LEU A 219 7.922 -3.166 12.843 1.00 18.69 O ATOM 631 CB LEU A 219 6.005 -0.873 14.354 1.00 19.96 C ATOM 632 CG LEU A 219 4.959 -1.765 13.671 1.00 22.10 C ATOM 633 CD1 LEU A 219 4.757 -3.098 14.382 1.00 22.55 C ATOM 634 CD2 LEU A 219 3.629 -0.998 13.552 1.00 24.00 C ATOM 635 H LEU A 219 7.993 0.266 15.529 1.00 0.00 H ATOM 636 N SER A 220 8.365 -1.048 12.318 1.00 18.45 N ATOM 637 CA SER A 220 8.877 -1.386 10.994 1.00 18.73 C ATOM 638 C SER A 220 10.133 -2.293 11.079 1.00 17.68 C ATOM 639 O SER A 220 10.284 -3.252 10.285 1.00 17.34 O ATOM 640 CB SER A 220 9.171 -0.115 10.184 1.00 19.39 C ATOM 641 OG SER A 220 10.211 0.648 10.777 1.00 20.44 O ATOM 642 HG SER A 220 9.943 0.913 11.693 1.00 0.00 H ATOM 643 H SER A 220 8.358 -0.054 12.624 1.00 0.00 H ATOM 644 N LEU A 221 11.008 -2.000 12.038 1.00 16.83 N ATOM 645 CA LEU A 221 12.239 -2.800 12.212 1.00 17.13 C ATOM 646 C LEU A 221 11.840 -4.243 12.501 1.00 17.79 C ATOM 647 O LEU A 221 12.386 -5.157 11.902 1.00 19.65 O ATOM 648 CB LEU A 221 13.125 -2.248 13.325 1.00 17.74 C ATOM 649 CG LEU A 221 13.794 -0.948 12.896 1.00 18.17 C ATOM 650 CD1 LEU A 221 14.205 -0.131 14.094 1.00 18.32 C ATOM 651 CD2 LEU A 221 14.986 -1.228 12.011 1.00 18.30 C ATOM 652 H LEU A 221 10.823 -1.198 12.673 1.00 0.00 H ATOM 653 N ALA A 222 10.889 -4.435 13.414 1.00 16.94 N ATOM 654 CA ALA A 222 10.452 -5.760 13.806 1.00 17.13 C ATOM 655 C ALA A 222 9.763 -6.451 12.622 1.00 17.33 C ATOM 656 O ALA A 222 9.927 -7.681 12.385 1.00 16.58 O ATOM 657 CB ALA A 222 9.520 -5.667 15.042 1.00 17.37 C ATOM 658 H ALA A 222 10.446 -3.607 13.860 1.00 0.00 H ATOM 659 N CYS A 223 8.929 -5.693 11.917 1.00 18.66 N ATOM 660 CA CYS A 223 8.176 -6.233 10.778 1.00 17.73 C ATOM 661 C CYS A 223 9.131 -6.698 9.679 1.00 17.96 C ATOM 662 O CYS A 223 8.871 -7.684 9.008 1.00 18.09 O ATOM 663 CB CYS A 223 7.293 -5.184 10.181 1.00 16.94 C ATOM 664 SG CYS A 223 5.749 -4.971 11.117 1.00 19.07 S ATOM 665 H CYS A 223 8.807 -4.694 12.178 1.00 0.00 H ATOM 666 N SER A 224 10.171 -5.918 9.454 1.00 19.15 N ATOM 667 CA SER A 224 11.107 -6.210 8.364 1.00 20.51 C ATOM 668 C SER A 224 11.808 -7.548 8.534 1.00 21.11 C ATOM 669 O SER A 224 12.165 -8.164 7.563 1.00 21.87 O ATOM 670 CB SER A 224 12.129 -5.103 8.184 1.00 21.22 C ATOM 671 OG SER A 224 13.139 -5.153 9.157 1.00 23.83 O ATOM 672 HG SER A 224 12.735 -5.057 10.056 1.00 0.00 H ATOM 673 H SER A 224 10.329 -5.086 10.057 1.00 0.00 H ATOM 674 N LYS A 225 11.996 -7.981 9.769 1.00 23.50 N ATOM 675 CA LYS A 225 12.690 -9.242 10.062 1.00 23.97 C ATOM 676 C LYS A 225 11.741 -10.376 10.447 1.00 24.45 C ATOM 677 O LYS A 225 12.198 -11.470 10.730 1.00 24.60 O ATOM 678 CB LYS A 225 13.656 -9.034 11.208 1.00 27.30 C ATOM 679 CG LYS A 225 14.685 -7.948 10.988 1.00 29.48 C ATOM 680 CD LYS A 225 15.721 -8.332 9.957 1.00 34.41 C ATOM 681 CE LYS A 225 16.852 -7.300 9.987 1.00 36.79 C ATOM 682 NZ LYS A 225 18.112 -7.782 9.363 1.00 42.38 N ATOM 683 HZ1 LYS A 225 18.447 -8.627 9.869 1.00 0.00 H ATOM 684 HZ2 LYS A 225 17.935 -8.021 8.367 1.00 0.00 H ATOM 685 HZ3 LYS A 225 18.833 -7.034 9.418 1.00 0.00 H ATOM 686 H LYS A 225 11.640 -7.409 10.561 1.00 0.00 H ATOM 687 N GLY A 226 10.435 -10.088 10.524 1.00 23.44 N ATOM 688 CA GLY A 226 9.425 -11.058 10.878 1.00 23.28 C ATOM 689 C GLY A 226 9.410 -11.494 12.324 1.00 22.33 C ATOM 690 O GLY A 226 9.141 -12.665 12.611 1.00 24.01 O ATOM 691 H GLY A 226 10.132 -9.115 10.318 1.00 0.00 H ATOM 692 N TYR A 227 9.672 -10.570 13.241 1.00 23.02 N ATOM 693 CA TYR A 227 9.635 -10.853 14.673 1.00 22.79 C ATOM 694 C TYR A 227 8.199 -10.639 15.203 1.00 22.89 C ATOM 695 O TYR A 227 7.904 -9.652 15.876 1.00 23.01 O ATOM 696 CB TYR A 227 10.601 -9.932 15.444 1.00 23.52 C ATOM 697 CG TYR A 227 12.042 -10.152 15.104 1.00 23.61 C ATOM 698 CD1 TYR A 227 12.595 -11.427 15.078 1.00 27.23 C ATOM 699 CD2 TYR A 227 12.856 -9.091 14.810 1.00 24.00 C ATOM 700 CE1 TYR A 227 13.945 -11.617 14.762 1.00 26.00 C ATOM 701 CE2 TYR A 227 14.178 -9.275 14.485 1.00 23.75 C ATOM 702 CZ TYR A 227 14.706 -10.538 14.453 1.00 26.10 C ATOM 703 OH TYR A 227 16.032 -10.671 14.128 1.00 27.14 O ATOM 704 HH TYR A 227 16.187 -10.303 13.222 1.00 0.00 H ATOM 705 H TYR A 227 9.913 -9.608 12.927 1.00 0.00 H ATOM 706 N THR A 228 7.333 -11.580 14.864 1.00 24.55 N ATOM 707 CA THR A 228 5.908 -11.530 15.203 1.00 24.66 C ATOM 708 C THR A 228 5.539 -11.182 16.652 1.00 24.20 C ATOM 709 O THR A 228 4.638 -10.330 16.913 1.00 23.20 O ATOM 710 CB THR A 228 5.310 -12.903 14.854 1.00 26.71 C ATOM 711 OG1 THR A 228 5.760 -13.288 13.533 1.00 27.69 O ATOM 712 CG2 THR A 228 3.806 -12.861 14.886 1.00 29.83 C ATOM 713 HG1 THR A 228 5.379 -14.172 13.300 1.00 0.00 H ATOM 714 H THR A 228 7.682 -12.400 14.328 1.00 0.00 H ATOM 715 N ASP A 229 6.203 -11.839 17.601 1.00 26.00 N ATOM 716 CA ASP A 229 5.936 -11.617 19.028 1.00 26.76 C ATOM 717 C ASP A 229 6.186 -10.153 19.423 1.00 24.98 C ATOM 718 O ASP A 229 5.400 -9.551 20.154 1.00 23.79 O ATOM 719 CB ASP A 229 6.761 -12.560 19.896 1.00 30.28 C ATOM 720 CG ASP A 229 6.396 -14.043 19.682 1.00 35.78 C ATOM 721 OD1 ASP A 229 5.218 -14.425 19.833 1.00 38.70 O ATOM 722 OD2 ASP A 229 7.294 -14.830 19.354 1.00 38.27 O ATOM 723 H ASP A 229 6.931 -12.528 17.324 1.00 0.00 H ATOM 724 N ILE A 230 7.270 -9.574 18.916 1.00 22.65 N ATOM 725 CA ILE A 230 7.563 -8.138 19.114 1.00 21.59 C ATOM 726 C ILE A 230 6.536 -7.237 18.379 1.00 21.38 C ATOM 727 O ILE A 230 6.064 -6.227 18.930 1.00 20.41 O ATOM 728 CB ILE A 230 9.010 -7.839 18.671 1.00 22.22 C ATOM 729 CG1 ILE A 230 9.961 -8.502 19.679 1.00 21.58 C ATOM 730 CG2 ILE A 230 9.297 -6.345 18.618 1.00 23.98 C ATOM 731 CD1 ILE A 230 11.389 -8.584 19.213 1.00 20.35 C ATOM 732 H ILE A 230 7.935 -10.150 18.361 1.00 0.00 H ATOM 733 N VAL A 231 6.161 -7.612 17.161 1.00 20.99 N ATOM 734 CA VAL A 231 5.147 -6.855 16.454 1.00 22.10 C ATOM 735 C VAL A 231 3.866 -6.797 17.337 1.00 23.80 C ATOM 736 O VAL A 231 3.290 -5.711 17.526 1.00 22.69 O ATOM 737 CB VAL A 231 4.842 -7.432 15.048 1.00 22.45 C ATOM 738 CG1 VAL A 231 3.658 -6.718 14.415 1.00 22.79 C ATOM 739 CG2 VAL A 231 6.075 -7.268 14.122 1.00 22.21 C ATOM 740 H VAL A 231 6.594 -8.446 16.716 1.00 0.00 H ATOM 741 N LYS A 232 3.452 -7.943 17.869 1.00 25.92 N ATOM 742 CA LYS A 232 2.216 -7.996 18.695 1.00 27.72 C ATOM 743 C LYS A 232 2.328 -7.061 19.891 1.00 27.12 C ATOM 744 O LYS A 232 1.390 -6.325 20.173 1.00 29.31 O ATOM 745 CB LYS A 232 1.916 -9.412 19.169 1.00 29.15 C ATOM 746 CG LYS A 232 0.685 -9.478 20.076 1.00 32.81 C ATOM 747 CD LYS A 232 0.088 -10.866 20.122 1.00 35.44 C ATOM 748 CE LYS A 232 -1.195 -10.889 20.965 1.00 35.41 C ATOM 749 H LYS A 232 3.999 -8.813 17.706 1.00 0.00 H ATOM 750 N MET A 233 3.491 -7.080 20.581 1.00 27.46 N ATOM 751 CA MET A 233 3.703 -6.238 21.777 1.00 29.62 C ATOM 752 C MET A 233 3.562 -4.754 21.455 1.00 27.48 C ATOM 753 O MET A 233 2.855 -4.044 22.140 1.00 25.86 O ATOM 754 CB MET A 233 5.067 -6.483 22.418 1.00 31.65 C ATOM 755 CG MET A 233 5.168 -7.764 23.230 1.00 35.87 C ATOM 756 SD MET A 233 6.744 -7.890 24.130 1.00 42.44 S ATOM 757 CE MET A 233 7.874 -8.371 22.862 1.00 40.36 C ATOM 758 H MET A 233 4.258 -7.705 20.261 1.00 0.00 H ATOM 759 N LEU A 234 4.208 -4.317 20.373 1.00 25.80 N ATOM 760 CA LEU A 234 4.163 -2.910 19.945 1.00 24.50 C ATOM 761 C LEU A 234 2.738 -2.479 19.506 1.00 25.97 C ATOM 762 O LEU A 234 2.291 -1.397 19.852 1.00 28.55 O ATOM 763 CB LEU A 234 5.196 -2.664 18.815 1.00 26.03 C ATOM 764 CG LEU A 234 6.683 -2.904 19.239 1.00 24.22 C ATOM 765 CD1 LEU A 234 7.689 -2.972 18.074 1.00 24.06 C ATOM 766 CD2 LEU A 234 7.082 -1.828 20.216 1.00 23.97 C ATOM 767 H LEU A 234 4.763 -4.995 19.812 1.00 0.00 H ATOM 768 N LEU A 235 2.067 -3.316 18.728 1.00 27.15 N ATOM 769 CA LEU A 235 0.698 -3.064 18.289 1.00 28.72 C ATOM 770 C LEU A 235 -0.223 -2.878 19.503 1.00 31.19 C ATOM 771 O LEU A 235 -1.083 -1.978 19.504 1.00 31.72 O ATOM 772 CB LEU A 235 0.183 -4.221 17.413 1.00 29.36 C ATOM 773 CG LEU A 235 0.715 -4.272 15.983 1.00 28.87 C ATOM 774 CD1 LEU A 235 0.283 -5.543 15.283 1.00 29.25 C ATOM 775 CD2 LEU A 235 0.300 -3.031 15.199 1.00 30.04 C ATOM 776 H LEU A 235 2.536 -4.190 18.417 1.00 0.00 H ATOM 777 N ASP A 236 -0.019 -3.698 20.526 1.00 33.78 N ATOM 778 CA ASP A 236 -0.801 -3.612 21.788 1.00 37.09 C ATOM 779 C ASP A 236 -0.539 -2.300 22.533 1.00 38.45 C ATOM 780 O ASP A 236 -1.375 -1.867 23.313 1.00 39.79 O ATOM 781 CB ASP A 236 -0.548 -4.839 22.697 1.00 38.14 C ATOM 782 CG ASP A 236 -1.176 -6.146 22.141 1.00 40.22 C ATOM 783 OD1 ASP A 236 -2.113 -6.072 21.317 1.00 41.35 O ATOM 784 OD2 ASP A 236 -0.734 -7.260 22.524 1.00 40.53 O ATOM 785 H ASP A 236 0.716 -4.429 20.442 1.00 0.00 H ATOM 786 N CYS A 237 0.586 -1.642 22.249 1.00 34.58 N ATOM 787 CA CYS A 237 0.833 -0.258 22.710 1.00 37.72 C ATOM 788 C CYS A 237 0.095 0.817 21.899 1.00 37.54 C ATOM 789 O CYS A 237 0.193 1.994 22.226 1.00 41.32 O ATOM 790 CB CYS A 237 2.329 0.071 22.676 1.00 38.74 C ATOM 791 SG CYS A 237 3.302 -0.961 23.774 1.00 41.51 S ATOM 792 H CYS A 237 1.316 -2.119 21.683 1.00 0.00 H ATOM 793 N GLY A 238 -0.611 0.422 20.840 1.00 36.06 N ATOM 794 CA GLY A 238 -1.373 1.354 20.018 1.00 34.07 C ATOM 795 C GLY A 238 -0.564 2.302 19.134 1.00 31.99 C ATOM 796 O GLY A 238 -0.951 3.443 18.929 1.00 32.50 O ATOM 797 H GLY A 238 -0.619 -0.588 20.591 1.00 0.00 H ATOM 798 N VAL A 239 0.564 1.839 18.601 1.00 30.04 N ATOM 799 CA VAL A 239 1.328 2.653 17.671 1.00 28.29 C ATOM 800 C VAL A 239 0.619 2.771 16.338 1.00 26.19 C ATOM 801 O VAL A 239 -0.244 1.962 16.042 1.00 28.64 O ATOM 802 CB VAL A 239 2.758 2.071 17.435 1.00 26.09 C ATOM 803 CG1 VAL A 239 3.528 2.082 18.743 1.00 29.12 C ATOM 804 CG2 VAL A 239 2.690 0.664 16.865 1.00 27.04 C ATOM 805 H VAL A 239 0.901 0.888 18.852 1.00 0.00 H ATOM 806 N ASP A 240 0.996 3.782 15.542 1.00 25.89 N ATOM 807 CA ASP A 240 0.438 3.948 14.180 1.00 26.18 C ATOM 808 C ASP A 240 0.970 2.824 13.296 1.00 27.39 C ATOM 809 O ASP A 240 2.199 2.552 13.248 1.00 30.40 O ATOM 810 CB ASP A 240 0.778 5.310 13.558 1.00 27.30 C ATOM 811 CG ASP A 240 -0.082 5.639 12.274 1.00 26.36 C ATOM 812 OD1 ASP A 240 -0.872 4.789 11.811 1.00 25.39 O ATOM 813 OD2 ASP A 240 0.045 6.762 11.740 1.00 26.00 O ATOM 814 H ASP A 240 1.698 4.467 15.890 1.00 0.00 H ATOM 815 N VAL A 241 0.060 2.138 12.626 1.00 23.69 N ATOM 816 CA VAL A 241 0.448 1.034 11.756 1.00 24.32 C ATOM 817 C VAL A 241 0.633 1.428 10.276 1.00 22.99 C ATOM 818 O VAL A 241 1.097 0.621 9.513 1.00 24.51 O ATOM 819 CB VAL A 241 -0.537 -0.180 11.839 1.00 24.70 C ATOM 820 CG1 VAL A 241 -0.688 -0.659 13.254 1.00 27.58 C ATOM 821 CG2 VAL A 241 -1.893 0.155 11.247 1.00 26.07 C ATOM 822 H VAL A 241 -0.945 2.389 12.721 1.00 0.00 H ATOM 823 N ASN A 242 0.242 2.649 9.882 1.00 21.62 N ATOM 824 CA ASN A 242 0.229 3.040 8.500 1.00 23.19 C ATOM 825 C ASN A 242 1.196 4.148 8.121 1.00 22.70 C ATOM 826 O ASN A 242 1.066 4.709 7.025 1.00 25.02 O ATOM 827 CB ASN A 242 -1.198 3.457 8.090 1.00 22.94 C ATOM 828 CG ASN A 242 -2.109 2.273 7.871 1.00 23.94 C ATOM 829 OD1 ASN A 242 -1.812 1.373 7.081 1.00 23.61 O ATOM 830 ND2 ASN A 242 -3.226 2.254 8.588 1.00 22.46 N ATOM 831 HD22 ASN A 242 -3.437 3.034 9.243 1.00 0.00 H ATOM 832 HD21 ASN A 242 -3.890 1.459 8.495 1.00 0.00 H ATOM 833 H ASN A 242 -0.062 3.336 10.601 1.00 0.00 H ATOM 834 N GLU A 243 2.165 4.448 8.976 1.00 23.57 N ATOM 835 CA GLU A 243 3.033 5.590 8.715 1.00 25.04 C ATOM 836 C GLU A 243 4.218 5.181 7.845 1.00 23.70 C ATOM 837 O GLU A 243 4.691 4.052 7.912 1.00 23.80 O ATOM 838 CB GLU A 243 3.474 6.280 10.012 1.00 26.51 C ATOM 839 CG GLU A 243 4.569 5.566 10.771 1.00 27.22 C ATOM 840 CD GLU A 243 4.754 6.074 12.201 1.00 29.47 C ATOM 841 OE1 GLU A 243 4.383 7.227 12.528 1.00 31.73 O ATOM 842 OE2 GLU A 243 5.279 5.295 13.006 1.00 27.92 O ATOM 843 H GLU A 243 2.305 3.871 9.830 1.00 0.00 H ATOM 844 N TYR A 244 4.637 6.113 7.004 1.00 22.24 N ATOM 845 CA TYR A 244 5.732 5.956 6.046 1.00 22.93 C ATOM 846 C TYR A 244 6.975 6.539 6.627 1.00 21.84 C ATOM 847 O TYR A 244 6.890 7.544 7.328 1.00 20.28 O ATOM 848 CB TYR A 244 5.490 6.781 4.783 1.00 23.71 C ATOM 849 CG TYR A 244 4.439 6.323 3.840 1.00 24.01 C ATOM 850 CD1 TYR A 244 4.769 5.582 2.703 1.00 24.38 C ATOM 851 CD2 TYR A 244 3.124 6.700 4.024 1.00 24.02 C ATOM 852 CE1 TYR A 244 3.795 5.196 1.811 1.00 24.50 C ATOM 853 CE2 TYR A 244 2.156 6.313 3.139 1.00 25.29 C ATOM 854 CZ TYR A 244 2.498 5.577 2.046 1.00 24.68 C ATOM 855 OH TYR A 244 1.527 5.223 1.188 1.00 26.86 O ATOM 856 HH TYR A 244 1.919 4.695 0.447 1.00 0.00 H ATOM 857 H TYR A 244 4.149 7.031 7.026 1.00 0.00 H ATOM 858 N ASP A 245 8.130 5.943 6.312 1.00 21.30 N ATOM 859 CA ASP A 245 9.417 6.573 6.577 1.00 20.97 C ATOM 860 C ASP A 245 9.918 7.285 5.306 1.00 22.09 C ATOM 861 O ASP A 245 9.248 7.345 4.302 1.00 20.79 O ATOM 862 CB ASP A 245 10.439 5.541 7.128 1.00 19.61 C ATOM 863 CG ASP A 245 10.682 4.388 6.194 1.00 19.38 C ATOM 864 OD1 ASP A 245 10.959 3.292 6.721 1.00 20.08 O ATOM 865 OD2 ASP A 245 10.633 4.565 4.944 1.00 18.76 O ATOM 866 H ASP A 245 8.109 5.004 5.866 1.00 0.00 H ATOM 867 N TRP A 246 11.072 7.881 5.406 1.00 25.91 N ATOM 868 CA TRP A 246 11.674 8.592 4.296 1.00 29.67 C ATOM 869 C TRP A 246 12.023 7.725 3.105 1.00 32.71 C ATOM 870 O TRP A 246 12.126 8.230 1.983 1.00 35.55 O ATOM 871 CB TRP A 246 12.948 9.240 4.773 1.00 30.86 C ATOM 872 CG TRP A 246 12.743 10.441 5.542 1.00 30.43 C ATOM 873 CD1 TRP A 246 11.579 10.898 6.116 1.00 29.70 C ATOM 874 CD2 TRP A 246 13.745 11.390 5.847 1.00 33.78 C ATOM 875 NE1 TRP A 246 11.810 12.088 6.751 1.00 29.63 N ATOM 876 CE2 TRP A 246 13.133 12.415 6.606 1.00 32.89 C ATOM 877 CE3 TRP A 246 15.111 11.486 5.540 1.00 35.53 C ATOM 878 CZ2 TRP A 246 13.847 13.523 7.080 1.00 35.81 C ATOM 879 CZ3 TRP A 246 15.829 12.599 6.012 1.00 39.05 C ATOM 880 CH2 TRP A 246 15.183 13.604 6.771 1.00 36.67 C ATOM 881 HE1 TRP A 246 11.099 12.651 7.260 1.00 0.00 H ATOM 882 H TRP A 246 11.579 7.845 6.314 1.00 0.00 H ATOM 883 N ASN A 247 12.268 6.443 3.323 1.00 34.27 N ATOM 884 CA ASN A 247 12.515 5.557 2.199 1.00 36.81 C ATOM 885 C ASN A 247 11.231 4.975 1.671 1.00 34.57 C ATOM 886 O ASN A 247 11.232 3.953 1.015 1.00 41.86 O ATOM 887 CB ASN A 247 13.531 4.498 2.575 1.00 41.80 C ATOM 888 CG ASN A 247 14.934 5.043 2.551 1.00 47.48 C ATOM 889 OD1 ASN A 247 15.215 6.047 1.885 1.00 51.02 O ATOM 890 ND2 ASN A 247 15.821 4.403 3.274 1.00 52.23 N ATOM 891 HD22 ASN A 247 15.540 3.563 3.818 1.00 0.00 H ATOM 892 HD21 ASN A 247 16.806 4.736 3.303 1.00 0.00 H ATOM 893 H ASN A 247 12.284 6.072 4.294 1.00 0.00 H ATOM 894 N GLY A 248 10.131 5.660 1.947 1.00 30.83 N ATOM 895 CA GLY A 248 8.816 5.231 1.502 1.00 30.67 C ATOM 896 C GLY A 248 8.379 3.838 1.899 1.00 29.60 C ATOM 897 O GLY A 248 7.585 3.218 1.162 1.00 33.98 O ATOM 898 H GLY A 248 10.212 6.536 2.502 1.00 0.00 H ATOM 899 N GLY A 249 8.864 3.334 3.039 1.00 26.28 N ATOM 900 CA GLY A 249 8.432 2.029 3.558 1.00 23.06 C ATOM 901 C GLY A 249 7.365 2.195 4.656 1.00 21.95 C ATOM 902 O GLY A 249 7.375 3.174 5.382 1.00 21.16 O ATOM 903 H GLY A 249 9.568 3.882 3.574 1.00 0.00 H ATOM 904 N THR A 250 6.462 1.230 4.772 1.00 20.11 N ATOM 905 CA THR A 250 5.515 1.160 5.893 1.00 19.57 C ATOM 906 C THR A 250 5.703 -0.212 6.533 1.00 19.34 C ATOM 907 O THR A 250 6.272 -1.114 5.899 1.00 20.33 O ATOM 908 CB THR A 250 4.048 1.226 5.399 1.00 18.33 C ATOM 909 OG1 THR A 250 3.846 0.151 4.465 1.00 18.58 O ATOM 910 CG2 THR A 250 3.715 2.546 4.727 1.00 20.41 C ATOM 911 HG1 THR A 250 2.913 0.173 4.135 1.00 0.00 H ATOM 912 H THR A 250 6.423 0.493 4.039 1.00 0.00 H ATOM 913 N PRO A 251 5.207 -0.418 7.779 1.00 20.06 N ATOM 914 CA PRO A 251 5.329 -1.757 8.388 1.00 20.22 C ATOM 915 C PRO A 251 4.881 -2.896 7.451 1.00 19.82 C ATOM 916 O PRO A 251 5.523 -3.925 7.409 1.00 19.37 O ATOM 917 CB PRO A 251 4.392 -1.659 9.616 1.00 19.06 C ATOM 918 CG PRO A 251 4.491 -0.224 9.998 1.00 19.90 C ATOM 919 CD PRO A 251 4.626 0.569 8.711 1.00 19.67 C ATOM 920 N LEU A 252 3.756 -2.698 6.746 1.00 19.70 N ATOM 921 CA LEU A 252 3.174 -3.723 5.876 1.00 18.91 C ATOM 922 C LEU A 252 4.081 -3.995 4.678 1.00 18.59 C ATOM 923 O LEU A 252 4.327 -5.133 4.327 1.00 17.47 O ATOM 924 CB LEU A 252 1.783 -3.280 5.423 1.00 20.70 C ATOM 925 CG LEU A 252 0.956 -4.286 4.587 1.00 22.26 C ATOM 926 CD1 LEU A 252 0.871 -5.659 5.235 1.00 22.42 C ATOM 927 CD2 LEU A 252 -0.457 -3.736 4.289 1.00 22.29 C ATOM 928 H LEU A 252 3.277 -1.778 6.821 1.00 0.00 H ATOM 929 N LEU A 253 4.605 -2.951 4.067 1.00 18.05 N ATOM 930 CA LEU A 253 5.531 -3.134 2.927 1.00 19.27 C ATOM 931 C LEU A 253 6.775 -3.899 3.352 1.00 18.63 C ATOM 932 O LEU A 253 7.299 -4.760 2.586 1.00 18.67 O ATOM 933 CB LEU A 253 5.890 -1.794 2.296 1.00 19.58 C ATOM 934 CG LEU A 253 4.771 -1.167 1.437 1.00 20.35 C ATOM 935 CD1 LEU A 253 5.067 0.266 1.061 1.00 22.92 C ATOM 936 CD2 LEU A 253 4.450 -1.987 0.205 1.00 20.72 C ATOM 937 H LEU A 253 4.366 -1.991 4.389 1.00 0.00 H ATOM 938 N TYR A 254 7.269 -3.614 4.557 1.00 19.39 N ATOM 939 CA TYR A 254 8.468 -4.326 5.087 1.00 19.34 C ATOM 940 C TYR A 254 8.154 -5.793 5.399 1.00 18.72 C ATOM 941 O TYR A 254 8.962 -6.683 5.089 1.00 18.73 O ATOM 942 CB TYR A 254 9.085 -3.599 6.315 1.00 19.88 C ATOM 943 CG TYR A 254 9.713 -2.290 5.975 1.00 20.57 C ATOM 944 CD1 TYR A 254 9.271 -1.094 6.537 1.00 21.18 C ATOM 945 CD2 TYR A 254 10.777 -2.238 5.086 1.00 21.16 C ATOM 946 CE1 TYR A 254 9.885 0.105 6.231 1.00 22.09 C ATOM 947 CE2 TYR A 254 11.378 -1.036 4.754 1.00 21.73 C ATOM 948 CZ TYR A 254 10.948 0.121 5.313 1.00 22.21 C ATOM 949 OH TYR A 254 11.601 1.292 4.917 1.00 22.07 O ATOM 950 HH TYR A 254 11.203 2.066 5.389 1.00 0.00 H ATOM 951 H TYR A 254 6.811 -2.883 5.137 1.00 0.00 H ATOM 952 N ALA A 255 6.966 -6.068 5.952 1.00 17.27 N ATOM 953 CA ALA A 255 6.555 -7.423 6.182 1.00 17.58 C ATOM 954 C ALA A 255 6.441 -8.202 4.853 1.00 18.11 C ATOM 955 O ALA A 255 6.871 -9.406 4.768 1.00 18.98 O ATOM 956 CB ALA A 255 5.202 -7.447 6.942 1.00 17.65 C ATOM 957 H ALA A 255 6.332 -5.288 6.219 1.00 0.00 H ATOM 958 N VAL A 256 5.861 -7.542 3.835 1.00 19.96 N ATOM 959 CA VAL A 256 5.634 -8.158 2.544 1.00 20.27 C ATOM 960 C VAL A 256 6.996 -8.339 1.891 1.00 22.65 C ATOM 961 O VAL A 256 7.295 -9.392 1.365 1.00 20.60 O ATOM 962 CB VAL A 256 4.754 -7.296 1.643 1.00 19.72 C ATOM 963 CG1 VAL A 256 4.856 -7.751 0.194 1.00 20.58 C ATOM 964 CG2 VAL A 256 3.270 -7.354 2.131 1.00 19.46 C ATOM 965 H VAL A 256 5.565 -6.555 3.980 1.00 0.00 H ATOM 966 N HIS A 257 7.827 -7.299 1.957 1.00 22.83 N ATOM 967 CA HIS A 257 9.172 -7.417 1.349 1.00 25.38 C ATOM 968 C HIS A 257 9.978 -8.604 1.863 1.00 25.95 C ATOM 969 O HIS A 257 10.766 -9.189 1.110 1.00 26.12 O ATOM 970 CB HIS A 257 9.960 -6.118 1.537 1.00 25.88 C ATOM 971 CG HIS A 257 11.311 -6.142 0.892 1.00 28.27 C ATOM 972 ND1 HIS A 257 11.492 -5.892 -0.449 1.00 29.92 N ATOM 973 CD2 HIS A 257 12.538 -6.417 1.395 1.00 31.29 C ATOM 974 CE1 HIS A 257 12.775 -6.010 -0.752 1.00 31.67 C ATOM 975 NE2 HIS A 257 13.435 -6.314 0.351 1.00 32.21 N ATOM 976 H HIS A 257 7.535 -6.419 2.428 1.00 0.00 H ATOM 977 N GLY A 258 9.805 -8.951 3.138 1.00 25.24 N ATOM 978 CA GLY A 258 10.550 -10.028 3.775 1.00 25.20 C ATOM 979 C GLY A 258 9.827 -11.344 3.792 1.00 24.46 C ATOM 980 O GLY A 258 10.277 -12.301 4.426 1.00 22.67 O ATOM 981 H GLY A 258 9.106 -8.429 3.704 1.00 0.00 H ATOM 982 N ASN A 259 8.673 -11.386 3.131 1.00 24.69 N ATOM 983 CA ASN A 259 7.854 -12.589 3.078 1.00 25.30 C ATOM 984 C ASN A 259 7.524 -13.110 4.482 1.00 25.26 C ATOM 985 O ASN A 259 7.694 -14.294 4.799 1.00 26.00 O ATOM 986 CB ASN A 259 8.588 -13.650 2.213 1.00 27.26 C ATOM 987 CG ASN A 259 7.692 -14.784 1.783 1.00 30.18 C ATOM 988 OD1 ASN A 259 6.443 -14.737 1.882 1.00 27.93 O ATOM 989 ND2 ASN A 259 8.318 -15.820 1.289 1.00 34.17 N ATOM 990 HD22 ASN A 259 9.356 -15.818 1.225 1.00 0.00 H ATOM 991 HD21 ASN A 259 7.778 -16.646 0.960 1.00 0.00 H ATOM 992 H ASN A 259 8.345 -10.532 2.636 1.00 0.00 H ATOM 993 N HIS A 260 7.002 -12.202 5.314 1.00 23.82 N ATOM 994 CA HIS A 260 6.671 -12.465 6.698 1.00 21.46 C ATOM 995 C HIS A 260 5.154 -12.566 6.876 1.00 22.15 C ATOM 996 O HIS A 260 4.518 -11.633 7.304 1.00 22.64 O ATOM 997 CB HIS A 260 7.273 -11.369 7.608 1.00 22.45 C ATOM 998 CG HIS A 260 8.777 -11.317 7.544 1.00 22.28 C ATOM 999 ND1 HIS A 260 9.555 -12.437 7.753 1.00 24.02 N ATOM 1000 CD2 HIS A 260 9.638 -10.304 7.275 1.00 23.80 C ATOM 1001 CE1 HIS A 260 10.836 -12.115 7.625 1.00 24.28 C ATOM 1002 NE2 HIS A 260 10.913 -10.820 7.353 1.00 23.58 N ATOM 1003 H HIS A 260 6.823 -11.247 4.943 1.00 0.00 H ATOM 1004 N VAL A 261 4.613 -13.740 6.592 1.00 23.36 N ATOM 1005 CA VAL A 261 3.166 -13.904 6.420 1.00 26.00 C ATOM 1006 C VAL A 261 2.382 -13.643 7.685 1.00 24.25 C ATOM 1007 O VAL A 261 1.331 -12.991 7.670 1.00 21.81 O ATOM 1008 CB VAL A 261 2.819 -15.359 5.953 1.00 28.26 C ATOM 1009 CG1 VAL A 261 1.364 -15.449 5.548 1.00 30.78 C ATOM 1010 CG2 VAL A 261 3.709 -15.800 4.814 1.00 31.28 C ATOM 1011 H VAL A 261 5.232 -14.570 6.488 1.00 0.00 H ATOM 1012 N LYS A 262 2.883 -14.162 8.810 1.00 25.42 N ATOM 1013 CA LYS A 262 2.198 -13.963 10.103 1.00 25.47 C ATOM 1014 C LYS A 262 2.217 -12.505 10.481 1.00 23.10 C ATOM 1015 O LYS A 262 1.225 -11.998 11.001 1.00 22.28 O ATOM 1016 CB LYS A 262 2.809 -14.827 11.225 1.00 26.95 C ATOM 1017 CG LYS A 262 2.725 -16.330 10.955 1.00 30.31 C ATOM 1018 CD LYS A 262 1.283 -16.848 10.852 1.00 33.43 C ATOM 1019 H LYS A 262 3.765 -14.712 8.774 1.00 0.00 H ATOM 1020 N CYS A 263 3.333 -11.814 10.206 1.00 22.82 N ATOM 1021 CA CYS A 263 3.381 -10.338 10.440 1.00 21.21 C ATOM 1022 C CYS A 263 2.389 -9.579 9.559 1.00 19.51 C ATOM 1023 O CYS A 263 1.700 -8.664 10.045 1.00 23.34 O ATOM 1024 CB CYS A 263 4.832 -9.768 10.262 1.00 21.70 C ATOM 1025 SG CYS A 263 5.910 -10.167 11.648 1.00 24.92 S ATOM 1026 H CYS A 263 4.168 -12.306 9.829 1.00 0.00 H ATOM 1027 N VAL A 264 2.271 -9.965 8.289 1.00 19.39 N ATOM 1028 CA VAL A 264 1.307 -9.340 7.343 1.00 18.51 C ATOM 1029 C VAL A 264 -0.110 -9.519 7.926 1.00 19.95 C ATOM 1030 O VAL A 264 -0.854 -8.587 8.019 1.00 18.13 O ATOM 1031 CB VAL A 264 1.379 -9.991 5.969 1.00 19.01 C ATOM 1032 CG1 VAL A 264 0.287 -9.511 5.057 1.00 19.63 C ATOM 1033 CG2 VAL A 264 2.768 -9.697 5.308 1.00 19.33 C ATOM 1034 H VAL A 264 2.878 -10.736 7.944 1.00 0.00 H ATOM 1035 N LYS A 265 -0.420 -10.730 8.334 1.00 20.07 N ATOM 1036 CA LYS A 265 -1.786 -11.034 8.852 1.00 22.86 C ATOM 1037 C LYS A 265 -2.109 -10.188 10.041 1.00 21.72 C ATOM 1038 O LYS A 265 -3.205 -9.598 10.147 1.00 23.23 O ATOM 1039 CB LYS A 265 -1.888 -12.530 9.181 1.00 26.51 C ATOM 1040 CG LYS A 265 -3.296 -13.028 9.474 1.00 29.32 C ATOM 1041 CD LYS A 265 -3.296 -14.559 9.596 1.00 32.84 C ATOM 1042 H LYS A 265 0.295 -11.484 8.295 1.00 0.00 H ATOM 1043 N MET A 266 -1.160 -10.093 10.952 1.00 21.65 N ATOM 1044 CA MET A 266 -1.326 -9.347 12.191 1.00 23.96 C ATOM 1045 C MET A 266 -1.478 -7.888 11.929 1.00 21.13 C ATOM 1046 O MET A 266 -2.324 -7.251 12.517 1.00 21.67 O ATOM 1047 CB MET A 266 -0.131 -9.588 13.093 1.00 26.59 C ATOM 1048 CG MET A 266 -0.181 -8.944 14.465 1.00 31.61 C ATOM 1049 SD MET A 266 1.119 -9.560 15.575 1.00 38.17 S ATOM 1050 CE MET A 266 0.921 -11.327 15.425 1.00 37.98 C ATOM 1051 H MET A 266 -0.253 -10.572 10.778 1.00 0.00 H ATOM 1052 N LEU A 267 -0.649 -7.339 11.054 1.00 18.94 N ATOM 1053 CA LEU A 267 -0.814 -5.932 10.688 1.00 18.60 C ATOM 1054 C LEU A 267 -2.225 -5.585 10.103 1.00 19.84 C ATOM 1055 O LEU A 267 -2.800 -4.573 10.472 1.00 20.24 O ATOM 1056 CB LEU A 267 0.242 -5.530 9.688 1.00 18.63 C ATOM 1057 CG LEU A 267 1.624 -5.462 10.306 1.00 17.85 C ATOM 1058 CD1 LEU A 267 2.680 -5.525 9.179 1.00 19.38 C ATOM 1059 CD2 LEU A 267 1.781 -4.207 11.120 1.00 17.87 C ATOM 1060 H LEU A 267 0.114 -7.904 10.630 1.00 0.00 H ATOM 1061 N LEU A 268 -2.713 -6.418 9.174 1.00 20.47 N ATOM 1062 CA LEU A 268 -4.015 -6.228 8.537 1.00 21.04 C ATOM 1063 C LEU A 268 -5.130 -6.286 9.586 1.00 22.09 C ATOM 1064 O LEU A 268 -6.057 -5.497 9.538 1.00 24.34 O ATOM 1065 CB LEU A 268 -4.252 -7.307 7.471 1.00 21.26 C ATOM 1066 CG LEU A 268 -3.327 -7.236 6.239 1.00 21.99 C ATOM 1067 CD1 LEU A 268 -3.508 -8.472 5.382 1.00 23.30 C ATOM 1068 CD2 LEU A 268 -3.561 -5.949 5.451 1.00 22.34 C ATOM 1069 H LEU A 268 -2.139 -7.238 8.893 1.00 0.00 H ATOM 1070 N GLU A 269 -5.016 -7.205 10.528 1.00 23.77 N ATOM 1071 CA GLU A 269 -6.030 -7.328 11.609 1.00 26.69 C ATOM 1072 C GLU A 269 -6.037 -6.083 12.538 1.00 28.23 C ATOM 1073 O GLU A 269 -7.084 -5.776 13.164 1.00 25.33 O ATOM 1074 CB GLU A 269 -5.810 -8.616 12.430 1.00 30.23 C ATOM 1075 CG GLU A 269 -6.108 -9.909 11.661 1.00 33.41 C ATOM 1076 CD GLU A 269 -5.574 -11.168 12.356 1.00 39.34 C ATOM 1077 OE1 GLU A 269 -4.840 -11.040 13.374 1.00 42.91 O ATOM 1078 OE2 GLU A 269 -5.867 -12.292 11.884 1.00 40.96 O ATOM 1079 H GLU A 269 -4.203 -7.854 10.513 1.00 0.00 H ATOM 1080 N SER A 270 -4.894 -5.379 12.607 1.00 25.02 N ATOM 1081 CA SER A 270 -4.742 -4.145 13.409 1.00 27.09 C ATOM 1082 C SER A 270 -4.967 -2.862 12.624 1.00 24.54 C ATOM 1083 O SER A 270 -4.752 -1.776 13.139 1.00 27.85 O ATOM 1084 CB SER A 270 -3.374 -4.090 14.062 1.00 28.10 C ATOM 1085 OG SER A 270 -3.233 -5.099 15.046 1.00 32.77 O ATOM 1086 HG SER A 270 -3.346 -5.988 14.624 1.00 0.00 H ATOM 1087 H SER A 270 -4.073 -5.720 12.068 1.00 0.00 H ATOM 1088 N GLY A 271 -5.422 -2.981 11.395 1.00 22.31 N ATOM 1089 CA GLY A 271 -5.823 -1.837 10.612 1.00 21.50 C ATOM 1090 C GLY A 271 -4.851 -1.345 9.570 1.00 19.24 C ATOM 1091 O GLY A 271 -5.086 -0.294 8.971 1.00 20.11 O ATOM 1092 H GLY A 271 -5.495 -3.929 10.975 1.00 0.00 H ATOM 1093 N ALA A 272 -3.787 -2.099 9.284 1.00 19.82 N ATOM 1094 CA ALA A 272 -2.934 -1.730 8.190 1.00 19.98 C ATOM 1095 C ALA A 272 -3.678 -1.850 6.821 1.00 20.28 C ATOM 1096 O ALA A 272 -4.326 -2.857 6.514 1.00 20.76 O ATOM 1097 CB ALA A 272 -1.659 -2.542 8.188 1.00 20.31 C ATOM 1098 H ALA A 272 -3.578 -2.947 9.849 1.00 0.00 H ATOM 1099 N ASP A 273 -3.599 -0.789 6.024 1.00 21.32 N ATOM 1100 CA ASP A 273 -4.306 -0.715 4.770 1.00 21.92 C ATOM 1101 C ASP A 273 -3.393 -1.144 3.627 1.00 20.66 C ATOM 1102 O ASP A 273 -2.428 -0.457 3.304 1.00 19.29 O ATOM 1103 CB ASP A 273 -4.821 0.715 4.611 1.00 22.83 C ATOM 1104 CG ASP A 273 -5.583 0.956 3.341 1.00 24.83 C ATOM 1105 OD1 ASP A 273 -5.709 0.058 2.463 1.00 24.05 O ATOM 1106 OD2 ASP A 273 -6.076 2.120 3.237 1.00 23.97 O ATOM 1107 H ASP A 273 -3.007 0.015 6.315 1.00 0.00 H ATOM 1108 N PRO A 274 -3.727 -2.269 2.959 1.00 21.35 N ATOM 1109 CA PRO A 274 -2.900 -2.815 1.829 1.00 22.49 C ATOM 1110 C PRO A 274 -3.015 -2.091 0.483 1.00 22.43 C ATOM 1111 O PRO A 274 -2.316 -2.465 -0.489 1.00 22.71 O ATOM 1112 CB PRO A 274 -3.394 -4.265 1.703 1.00 22.97 C ATOM 1113 CG PRO A 274 -4.811 -4.212 2.188 1.00 21.41 C ATOM 1114 CD PRO A 274 -4.954 -3.069 3.181 1.00 21.86 C ATOM 1115 N THR A 275 -3.863 -1.055 0.437 1.00 23.37 N ATOM 1116 CA THR A 275 -4.102 -0.292 -0.763 1.00 25.50 C ATOM 1117 C THR A 275 -3.383 1.031 -0.781 1.00 26.00 C ATOM 1118 O THR A 275 -3.411 1.687 -1.784 1.00 27.24 O ATOM 1119 CB THR A 275 -5.608 -0.018 -0.957 1.00 26.69 C ATOM 1120 OG1 THR A 275 -6.074 0.949 0.008 1.00 26.08 O ATOM 1121 CG2 THR A 275 -6.398 -1.344 -0.886 1.00 28.04 C ATOM 1122 HG1 THR A 275 -5.925 0.599 0.922 1.00 0.00 H ATOM 1123 H THR A 275 -4.371 -0.789 1.305 1.00 0.00 H ATOM 1124 N ILE A 276 -2.718 1.429 0.305 1.00 23.58 N ATOM 1125 CA ILE A 276 -2.003 2.712 0.287 1.00 24.34 C ATOM 1126 C ILE A 276 -0.787 2.501 -0.595 1.00 23.37 C ATOM 1127 O ILE A 276 -0.193 1.431 -0.574 1.00 21.01 O ATOM 1128 CB ILE A 276 -1.569 3.122 1.698 1.00 26.09 C ATOM 1129 CG1 ILE A 276 -2.772 3.516 2.550 1.00 26.52 C ATOM 1130 CG2 ILE A 276 -0.574 4.249 1.689 1.00 27.61 C ATOM 1131 CD1 ILE A 276 -2.467 3.405 4.018 1.00 28.84 C ATOM 1132 H ILE A 276 -2.706 0.835 1.159 1.00 0.00 H ATOM 1133 N GLU A 277 -0.433 3.529 -1.360 1.00 26.66 N ATOM 1134 CA GLU A 277 0.602 3.425 -2.381 1.00 26.78 C ATOM 1135 C GLU A 277 1.884 4.157 -2.056 1.00 26.38 C ATOM 1136 O GLU A 277 1.893 5.155 -1.359 1.00 27.45 O ATOM 1137 CB GLU A 277 0.075 3.985 -3.684 1.00 28.34 C ATOM 1138 CG GLU A 277 -1.045 3.214 -4.298 1.00 31.88 C ATOM 1139 CD GLU A 277 -1.648 3.976 -5.470 1.00 35.07 C ATOM 1140 OE1 GLU A 277 -1.019 4.951 -5.971 1.00 37.04 O ATOM 1141 OE2 GLU A 277 -2.745 3.602 -5.886 1.00 37.32 O ATOM 1142 H GLU A 277 -0.913 4.442 -1.225 1.00 0.00 H ATOM 1143 N THR A 278 2.976 3.637 -2.588 1.00 27.33 N ATOM 1144 CA THR A 278 4.231 4.371 -2.592 1.00 31.03 C ATOM 1145 C THR A 278 4.179 5.554 -3.593 1.00 31.60 C ATOM 1146 O THR A 278 3.252 5.676 -4.438 1.00 28.67 O ATOM 1147 CB THR A 278 5.405 3.481 -3.038 1.00 29.89 C ATOM 1148 OG1 THR A 278 5.215 3.092 -4.412 1.00 31.91 O ATOM 1149 CG2 THR A 278 5.532 2.247 -2.141 1.00 31.35 C ATOM 1150 HG1 THR A 278 4.367 2.589 -4.497 1.00 0.00 H ATOM 1151 H THR A 278 2.937 2.688 -3.011 1.00 0.00 H ATOM 1152 N ASP A 279 5.215 6.389 -3.552 1.00 34.43 N ATOM 1153 CA ASP A 279 5.296 7.495 -4.506 1.00 34.31 C ATOM 1154 C ASP A 279 5.375 6.964 -5.941 1.00 35.02 C ATOM 1155 O ASP A 279 5.054 7.679 -6.863 1.00 35.09 O ATOM 1156 CB ASP A 279 6.481 8.418 -4.222 1.00 34.20 C ATOM 1157 CG ASP A 279 6.793 9.345 -5.399 1.00 34.52 C ATOM 1158 OD1 ASP A 279 5.867 10.050 -5.872 1.00 35.24 O ATOM 1159 OD2 ASP A 279 7.959 9.342 -5.867 1.00 32.66 O ATOM 1160 H ASP A 279 5.965 6.255 -2.844 1.00 0.00 H ATOM 1161 N SER A 280 5.769 5.703 -6.105 1.00 36.17 N ATOM 1162 CA SER A 280 5.797 5.062 -7.409 1.00 39.76 C ATOM 1163 C SER A 280 4.443 4.526 -7.871 1.00 37.67 C ATOM 1164 O SER A 280 4.304 4.125 -9.001 1.00 39.26 O ATOM 1165 CB SER A 280 6.783 3.907 -7.395 1.00 43.58 C ATOM 1166 OG SER A 280 7.004 3.463 -8.711 1.00 50.16 O ATOM 1167 HG SER A 280 6.147 3.161 -9.105 1.00 0.00 H ATOM 1168 H SER A 280 6.067 5.158 -5.271 1.00 0.00 H ATOM 1169 N GLY A 281 3.467 4.484 -6.991 1.00 32.69 N ATOM 1170 CA GLY A 281 2.108 4.059 -7.350 1.00 31.69 C ATOM 1171 C GLY A 281 1.756 2.612 -7.037 1.00 31.97 C ATOM 1172 O GLY A 281 0.621 2.170 -7.305 1.00 36.88 O ATOM 1173 H GLY A 281 3.664 4.761 -6.008 1.00 0.00 H ATOM 1174 N TYR A 282 2.677 1.865 -6.439 1.00 28.11 N ATOM 1175 CA TYR A 282 2.377 0.475 -6.105 1.00 26.74 C ATOM 1176 C TYR A 282 1.988 0.301 -4.634 1.00 23.72 C ATOM 1177 O TYR A 282 2.408 1.072 -3.759 1.00 20.69 O ATOM 1178 CB TYR A 282 3.535 -0.452 -6.502 1.00 27.37 C ATOM 1179 CG TYR A 282 4.769 -0.419 -5.626 1.00 26.89 C ATOM 1180 CD1 TYR A 282 4.813 -1.095 -4.421 1.00 26.22 C ATOM 1181 CD2 TYR A 282 5.937 0.216 -6.065 1.00 24.95 C ATOM 1182 CE1 TYR A 282 5.959 -1.104 -3.628 1.00 26.98 C ATOM 1183 CE2 TYR A 282 7.087 0.218 -5.281 1.00 26.72 C ATOM 1184 CZ TYR A 282 7.107 -0.440 -4.061 1.00 26.75 C ATOM 1185 OH TYR A 282 8.285 -0.446 -3.290 1.00 28.71 O ATOM 1186 HH TYR A 282 9.014 -0.872 -3.807 1.00 0.00 H ATOM 1187 H TYR A 282 3.608 2.268 -6.209 1.00 0.00 H ATOM 1188 N ASN A 283 1.156 -0.693 -4.369 1.00 22.78 N ATOM 1189 CA ASN A 283 0.702 -0.932 -3.039 1.00 21.95 C ATOM 1190 C ASN A 283 1.211 -2.290 -2.544 1.00 21.72 C ATOM 1191 O ASN A 283 2.045 -2.926 -3.227 1.00 22.22 O ATOM 1192 CB ASN A 283 -0.825 -0.763 -2.971 1.00 22.88 C ATOM 1193 CG ASN A 283 -1.569 -1.818 -3.740 1.00 24.28 C ATOM 1194 OD1 ASN A 283 -1.152 -2.960 -3.835 1.00 25.34 O ATOM 1195 ND2 ASN A 283 -2.686 -1.435 -4.284 1.00 27.12 N ATOM 1196 HD22 ASN A 283 -3.005 -0.451 -4.178 1.00 0.00 H ATOM 1197 HD21 ASN A 283 -3.260 -2.113 -4.825 1.00 0.00 H ATOM 1198 H ASN A 283 0.829 -1.308 -5.141 1.00 0.00 H ATOM 1199 N SER A 284 0.726 -2.757 -1.397 1.00 20.70 N ATOM 1200 CA SER A 284 1.288 -3.969 -0.777 1.00 20.85 C ATOM 1201 C SER A 284 0.939 -5.218 -1.587 1.00 21.86 C ATOM 1202 O SER A 284 1.757 -6.144 -1.703 1.00 22.29 O ATOM 1203 CB SER A 284 0.850 -4.093 0.681 1.00 20.98 C ATOM 1204 OG SER A 284 1.292 -2.983 1.483 1.00 20.43 O ATOM 1205 HG SER A 284 0.913 -2.143 1.120 1.00 0.00 H ATOM 1206 H SER A 284 -0.060 -2.260 -0.932 1.00 0.00 H ATOM 1207 N MET A 285 -0.276 -5.248 -2.148 1.00 24.83 N ATOM 1208 CA MET A 285 -0.678 -6.371 -3.009 1.00 25.03 C ATOM 1209 C MET A 285 0.238 -6.457 -4.228 1.00 25.24 C ATOM 1210 O MET A 285 0.745 -7.554 -4.599 1.00 26.57 O ATOM 1211 CB MET A 285 -2.147 -6.265 -3.429 1.00 25.44 C ATOM 1212 CG MET A 285 -2.638 -7.488 -4.201 1.00 26.47 C ATOM 1213 SD MET A 285 -2.557 -9.055 -3.292 1.00 26.50 S ATOM 1214 CE MET A 285 -2.560 -10.209 -4.661 1.00 27.85 C ATOM 1215 H MET A 285 -0.943 -4.469 -1.973 1.00 0.00 H ATOM 1216 N ASP A 286 0.465 -5.290 -4.840 1.00 25.41 N ATOM 1217 CA ASP A 286 1.338 -5.184 -6.016 1.00 25.46 C ATOM 1218 C ASP A 286 2.703 -5.741 -5.717 1.00 24.94 C ATOM 1219 O ASP A 286 3.255 -6.519 -6.513 1.00 24.90 O ATOM 1220 CB ASP A 286 1.465 -3.723 -6.489 1.00 27.02 C ATOM 1221 CG ASP A 286 0.116 -3.095 -6.877 1.00 29.84 C ATOM 1222 OD1 ASP A 286 -0.829 -3.817 -7.291 1.00 33.23 O ATOM 1223 OD2 ASP A 286 0.000 -1.859 -6.770 1.00 28.63 O ATOM 1224 H ASP A 286 0.009 -4.431 -4.472 1.00 0.00 H ATOM 1225 N LEU A 287 3.271 -5.329 -4.571 1.00 22.96 N ATOM 1226 CA LEU A 287 4.602 -5.758 -4.196 1.00 23.23 C ATOM 1227 C LEU A 287 4.686 -7.298 -3.989 1.00 25.44 C ATOM 1228 O LEU A 287 5.665 -7.956 -4.425 1.00 24.19 O ATOM 1229 CB LEU A 287 5.079 -4.991 -2.935 1.00 22.86 C ATOM 1230 CG LEU A 287 6.494 -5.305 -2.457 1.00 23.45 C ATOM 1231 CD1 LEU A 287 7.566 -4.955 -3.505 1.00 23.87 C ATOM 1232 CD2 LEU A 287 6.784 -4.571 -1.166 1.00 24.67 C ATOM 1233 H LEU A 287 2.745 -4.690 -3.942 1.00 0.00 H ATOM 1234 N ALA A 288 3.674 -7.870 -3.313 1.00 24.12 N ATOM 1235 CA ALA A 288 3.648 -9.299 -3.071 1.00 23.15 C ATOM 1236 C ALA A 288 3.578 -10.070 -4.386 1.00 24.44 C ATOM 1237 O ALA A 288 4.145 -11.175 -4.482 1.00 27.02 O ATOM 1238 CB ALA A 288 2.470 -9.674 -2.181 1.00 23.48 C ATOM 1239 H ALA A 288 2.897 -7.277 -2.958 1.00 0.00 H ATOM 1240 N VAL A 289 2.857 -9.509 -5.381 1.00 27.31 N ATOM 1241 CA VAL A 289 2.729 -10.121 -6.721 1.00 27.49 C ATOM 1242 C VAL A 289 4.095 -10.003 -7.412 1.00 29.61 C ATOM 1243 O VAL A 289 4.680 -10.999 -7.833 1.00 30.52 O ATOM 1244 CB VAL A 289 1.637 -9.457 -7.582 1.00 28.22 C ATOM 1245 CG1 VAL A 289 1.667 -9.992 -9.002 1.00 29.35 C ATOM 1246 CG2 VAL A 289 0.260 -9.679 -6.998 1.00 29.56 C ATOM 1247 H VAL A 289 2.371 -8.608 -5.197 1.00 0.00 H ATOM 1248 N ALA A 290 4.634 -8.792 -7.436 1.00 29.21 N ATOM 1249 CA ALA A 290 5.948 -8.539 -8.009 1.00 29.32 C ATOM 1250 C ALA A 290 7.031 -9.480 -7.486 1.00 29.20 C ATOM 1251 O ALA A 290 7.873 -9.940 -8.256 1.00 30.23 O ATOM 1252 CB ALA A 290 6.347 -7.092 -7.759 1.00 29.60 C ATOM 1253 H ALA A 290 4.100 -7.996 -7.032 1.00 0.00 H ATOM 1254 N LEU A 291 7.007 -9.783 -6.189 1.00 27.97 N ATOM 1255 CA LEU A 291 8.058 -10.571 -5.553 1.00 27.27 C ATOM 1256 C LEU A 291 7.792 -12.069 -5.560 1.00 28.79 C ATOM 1257 O LEU A 291 8.688 -12.861 -5.205 1.00 27.26 O ATOM 1258 CB LEU A 291 8.336 -10.084 -4.107 1.00 29.17 C ATOM 1259 CG LEU A 291 8.808 -8.617 -3.945 1.00 30.87 C ATOM 1260 CD1 LEU A 291 8.798 -8.227 -2.484 1.00 31.52 C ATOM 1261 CD2 LEU A 291 10.195 -8.413 -4.522 1.00 31.74 C ATOM 1262 H LEU A 291 6.212 -9.446 -5.610 1.00 0.00 H ATOM 1263 N GLY A 292 6.581 -12.458 -5.957 1.00 27.80 N ATOM 1264 CA GLY A 292 6.210 -13.858 -6.077 1.00 28.84 C ATOM 1265 C GLY A 292 5.921 -14.539 -4.764 1.00 28.72 C ATOM 1266 O GLY A 292 6.116 -15.763 -4.633 1.00 27.00 O ATOM 1267 H GLY A 292 5.874 -11.732 -6.190 1.00 0.00 H ATOM 1268 N TYR A 293 5.449 -13.760 -3.786 1.00 25.25 N ATOM 1269 CA TYR A 293 5.166 -14.287 -2.476 1.00 25.65 C ATOM 1270 C TYR A 293 3.693 -14.630 -2.385 1.00 24.07 C ATOM 1271 O TYR A 293 2.861 -13.821 -2.000 1.00 21.25 O ATOM 1272 CB TYR A 293 5.576 -13.298 -1.388 1.00 26.82 C ATOM 1273 CG TYR A 293 7.067 -13.035 -1.298 1.00 27.37 C ATOM 1274 CD1 TYR A 293 7.998 -13.946 -1.770 1.00 29.11 C ATOM 1275 CD2 TYR A 293 7.531 -11.855 -0.751 1.00 27.82 C ATOM 1276 CE1 TYR A 293 9.356 -13.689 -1.688 1.00 30.52 C ATOM 1277 CE2 TYR A 293 8.895 -11.585 -0.664 1.00 30.33 C ATOM 1278 CZ TYR A 293 9.798 -12.509 -1.127 1.00 31.88 C ATOM 1279 OH TYR A 293 11.163 -12.242 -1.048 1.00 33.16 O ATOM 1280 HH TYR A 293 11.670 -13.006 -1.423 1.00 0.00 H ATOM 1281 H TYR A 293 5.282 -12.751 -3.975 1.00 0.00 H ATOM 1282 N ARG A 294 3.388 -15.869 -2.749 1.00 23.66 N ATOM 1283 CA ARG A 294 2.014 -16.249 -2.983 1.00 24.62 C ATOM 1284 C ARG A 294 1.174 -16.359 -1.744 1.00 20.39 C ATOM 1285 O ARG A 294 -0.012 -15.953 -1.773 1.00 21.80 O ATOM 1286 CB ARG A 294 1.979 -17.547 -3.820 1.00 26.01 C ATOM 1287 CG ARG A 294 2.402 -17.293 -5.274 1.00 29.01 C ATOM 1288 CD ARG A 294 2.440 -18.555 -6.150 1.00 32.61 C ATOM 1289 NE ARG A 294 3.058 -18.337 -7.475 1.00 34.69 N ATOM 1290 CZ ARG A 294 2.448 -17.766 -8.530 1.00 39.32 C ATOM 1291 NH1 ARG A 294 3.097 -17.637 -9.680 1.00 43.82 N ATOM 1292 NH2 ARG A 294 1.195 -17.326 -8.460 1.00 40.27 N ATOM 1293 HE ARG A 294 4.042 -18.650 -7.602 1.00 0.00 H ATOM 1294 HH12 ARG A 294 2.627 -17.196 -10.496 1.00 0.00 H ATOM 1295 HH11 ARG A 294 4.076 -17.977 -9.766 1.00 0.00 H ATOM 1296 HH22 ARG A 294 0.750 -16.889 -9.292 1.00 0.00 H ATOM 1297 HH21 ARG A 294 0.660 -17.419 -7.573 1.00 0.00 H ATOM 1298 H ARG A 294 4.145 -16.573 -2.867 1.00 0.00 H ATOM 1299 N SER A 295 1.721 -16.918 -0.665 1.00 20.76 N ATOM 1300 CA SER A 295 0.959 -17.025 0.626 1.00 22.01 C ATOM 1301 C SER A 295 0.605 -15.596 1.130 1.00 21.24 C ATOM 1302 O SER A 295 -0.528 -15.310 1.559 1.00 19.46 O ATOM 1303 CB SER A 295 1.761 -17.760 1.694 1.00 23.94 C ATOM 1304 OG SER A 295 1.976 -19.134 1.402 1.00 26.02 O ATOM 1305 HG SER A 295 2.500 -19.547 2.133 1.00 0.00 H ATOM 1306 H SER A 295 2.692 -17.287 -0.717 1.00 0.00 H ATOM 1307 N VAL A 296 1.561 -14.687 1.013 1.00 20.15 N ATOM 1308 CA VAL A 296 1.321 -13.272 1.350 1.00 22.95 C ATOM 1309 C VAL A 296 0.227 -12.629 0.455 1.00 24.64 C ATOM 1310 O VAL A 296 -0.654 -11.932 0.962 1.00 22.40 O ATOM 1311 CB VAL A 296 2.627 -12.454 1.259 1.00 22.20 C ATOM 1312 CG1 VAL A 296 2.372 -10.964 1.420 1.00 23.52 C ATOM 1313 CG2 VAL A 296 3.617 -12.933 2.313 1.00 22.64 C ATOM 1314 H VAL A 296 2.501 -14.978 0.676 1.00 0.00 H ATOM 1315 N GLN A 297 0.314 -12.846 -0.864 1.00 23.73 N ATOM 1316 CA GLN A 297 -0.673 -12.291 -1.807 1.00 23.41 C ATOM 1317 C GLN A 297 -2.059 -12.757 -1.357 1.00 23.21 C ATOM 1318 O GLN A 297 -3.008 -11.971 -1.304 1.00 22.87 O ATOM 1319 CB GLN A 297 -0.431 -12.761 -3.236 1.00 23.92 C ATOM 1320 CG GLN A 297 0.852 -12.265 -3.918 1.00 24.27 C ATOM 1321 CD GLN A 297 1.177 -13.071 -5.159 1.00 23.02 C ATOM 1322 OE1 GLN A 297 2.359 -13.421 -5.445 1.00 20.73 O ATOM 1323 NE2 GLN A 297 0.137 -13.386 -5.910 1.00 21.34 N ATOM 1324 HE22 GLN A 297 -0.817 -13.076 -5.634 1.00 0.00 H ATOM 1325 HE21 GLN A 297 0.272 -13.944 -6.777 1.00 0.00 H ATOM 1326 H GLN A 297 1.098 -13.421 -1.232 1.00 0.00 H ATOM 1327 N GLN A 298 -2.150 -14.021 -0.987 1.00 21.96 N ATOM 1328 CA GLN A 298 -3.445 -14.595 -0.620 1.00 23.71 C ATOM 1329 C GLN A 298 -4.047 -14.051 0.695 1.00 23.60 C ATOM 1330 O GLN A 298 -5.275 -13.839 0.798 1.00 21.27 O ATOM 1331 CB GLN A 298 -3.340 -16.132 -0.643 1.00 26.87 C ATOM 1332 CG GLN A 298 -4.549 -16.868 -0.073 1.00 28.45 C ATOM 1333 CD GLN A 298 -5.897 -16.608 -0.781 1.00 32.51 C ATOM 1334 OE1 GLN A 298 -5.989 -16.066 -1.917 1.00 34.36 O ATOM 1335 NE2 GLN A 298 -6.968 -17.011 -0.095 1.00 32.57 N ATOM 1336 HE22 GLN A 298 -6.851 -17.454 0.839 1.00 0.00 H ATOM 1337 HE21 GLN A 298 -7.920 -16.882 -0.494 1.00 0.00 H ATOM 1338 H GLN A 298 -1.295 -14.613 -0.956 1.00 0.00 H ATOM 1339 N VAL A 299 -3.197 -13.805 1.676 1.00 23.18 N ATOM 1340 CA VAL A 299 -3.619 -13.155 2.942 1.00 22.07 C ATOM 1341 C VAL A 299 -4.183 -11.765 2.657 1.00 21.52 C ATOM 1342 O VAL A 299 -5.247 -11.342 3.206 1.00 21.12 O ATOM 1343 CB VAL A 299 -2.416 -13.101 3.923 1.00 22.00 C ATOM 1344 CG1 VAL A 299 -2.722 -12.211 5.139 1.00 21.50 C ATOM 1345 CG2 VAL A 299 -2.074 -14.535 4.345 1.00 21.93 C ATOM 1346 H VAL A 299 -2.200 -14.076 1.557 1.00 0.00 H ATOM 1347 N ILE A 300 -3.490 -11.041 1.791 1.00 21.29 N ATOM 1348 CA ILE A 300 -3.898 -9.703 1.456 1.00 22.06 C ATOM 1349 C ILE A 300 -5.206 -9.704 0.662 1.00 22.79 C ATOM 1350 O ILE A 300 -6.140 -8.943 0.985 1.00 21.58 O ATOM 1351 CB ILE A 300 -2.815 -8.966 0.682 1.00 22.09 C ATOM 1352 CG1 ILE A 300 -1.595 -8.697 1.589 1.00 22.96 C ATOM 1353 CG2 ILE A 300 -3.377 -7.631 0.178 1.00 23.84 C ATOM 1354 CD1 ILE A 300 -0.385 -8.086 0.868 1.00 24.32 C ATOM 1355 H ILE A 300 -2.640 -11.445 1.348 1.00 0.00 H ATOM 1356 N GLU A 301 -5.272 -10.533 -0.380 1.00 25.66 N ATOM 1357 CA GLU A 301 -6.494 -10.639 -1.183 1.00 28.45 C ATOM 1358 C GLU A 301 -7.666 -11.087 -0.340 1.00 27.63 C ATOM 1359 O GLU A 301 -8.753 -10.516 -0.434 1.00 26.32 O ATOM 1360 CB GLU A 301 -6.335 -11.633 -2.310 1.00 32.14 C ATOM 1361 CG GLU A 301 -5.478 -11.151 -3.465 1.00 37.58 C ATOM 1362 CD GLU A 301 -5.721 -11.958 -4.751 1.00 43.12 C ATOM 1363 OE1 GLU A 301 -4.827 -11.936 -5.632 1.00 47.78 O ATOM 1364 OE2 GLU A 301 -6.797 -12.622 -4.862 1.00 45.62 O ATOM 1365 H GLU A 301 -4.445 -11.113 -0.627 1.00 0.00 H ATOM 1366 N SER A 302 -7.449 -12.099 0.491 1.00 26.47 N ATOM 1367 CA SER A 302 -8.501 -12.593 1.351 1.00 28.61 C ATOM 1368 C SER A 302 -9.071 -11.502 2.264 1.00 28.64 C ATOM 1369 O SER A 302 -10.295 -11.379 2.426 1.00 26.38 O ATOM 1370 CB SER A 302 -8.008 -13.764 2.180 1.00 29.60 C ATOM 1371 OG SER A 302 -8.993 -14.080 3.121 1.00 33.00 O ATOM 1372 HG SER A 302 -9.156 -13.296 3.703 1.00 0.00 H ATOM 1373 H SER A 302 -6.509 -12.543 0.524 1.00 0.00 H ATOM 1374 N HIS A 303 -8.185 -10.707 2.844 1.00 24.70 N ATOM 1375 CA HIS A 303 -8.569 -9.537 3.597 1.00 25.33 C ATOM 1376 C HIS A 303 -9.415 -8.517 2.789 1.00 25.92 C ATOM 1377 O HIS A 303 -10.482 -8.082 3.234 1.00 27.34 O ATOM 1378 CB HIS A 303 -7.301 -8.865 4.093 1.00 25.25 C ATOM 1379 CG HIS A 303 -7.539 -7.608 4.839 1.00 25.37 C ATOM 1380 ND1 HIS A 303 -7.838 -7.584 6.191 1.00 26.66 N ATOM 1381 CD2 HIS A 303 -7.505 -6.322 4.437 1.00 26.21 C ATOM 1382 CE1 HIS A 303 -7.987 -6.332 6.582 1.00 25.73 C ATOM 1383 NE2 HIS A 303 -7.783 -5.549 5.536 1.00 27.02 N ATOM 1384 H HIS A 303 -7.174 -10.934 2.754 1.00 0.00 H ATOM 1385 N LEU A 304 -8.935 -8.138 1.619 1.00 25.72 N ATOM 1386 CA LEU A 304 -9.685 -7.241 0.778 1.00 27.57 C ATOM 1387 C LEU A 304 -11.075 -7.833 0.453 1.00 28.46 C ATOM 1388 O LEU A 304 -12.092 -7.114 0.506 1.00 31.15 O ATOM 1389 CB LEU A 304 -8.930 -6.963 -0.503 1.00 28.65 C ATOM 1390 CG LEU A 304 -7.688 -6.090 -0.388 1.00 32.53 C ATOM 1391 CD1 LEU A 304 -6.846 -6.237 -1.663 1.00 34.20 C ATOM 1392 CD2 LEU A 304 -8.032 -4.618 -0.126 1.00 32.95 C ATOM 1393 H LEU A 304 -8.009 -8.490 1.302 1.00 0.00 H ATOM 1394 N LEU A 305 -11.117 -9.119 0.106 1.00 26.91 N ATOM 1395 CA LEU A 305 -12.381 -9.752 -0.311 1.00 28.23 C ATOM 1396 C LEU A 305 -13.377 -9.698 0.849 1.00 31.71 C ATOM 1397 O LEU A 305 -14.563 -9.333 0.674 1.00 29.74 O ATOM 1398 CB LEU A 305 -12.136 -11.197 -0.797 1.00 30.00 C ATOM 1399 CG LEU A 305 -13.324 -12.021 -1.344 1.00 31.73 C ATOM 1400 H LEU A 305 -10.245 -9.685 0.130 1.00 0.00 H ATOM 1401 N LYS A 306 -12.900 -10.019 2.043 1.00 32.98 N ATOM 1402 CA LYS A 306 -13.801 -10.067 3.214 1.00 34.62 C ATOM 1403 C LYS A 306 -14.310 -8.684 3.597 1.00 37.10 C ATOM 1404 O LYS A 306 -15.455 -8.551 4.054 1.00 38.38 O ATOM 1405 CB LYS A 306 -13.144 -10.794 4.395 1.00 34.81 C ATOM 1406 CG LYS A 306 -12.912 -12.281 4.106 1.00 36.21 C ATOM 1407 CD LYS A 306 -12.383 -13.079 5.300 1.00 38.31 C ATOM 1408 CE LYS A 306 -11.647 -14.340 4.850 1.00 38.85 C ATOM 1409 H LYS A 306 -11.890 -10.238 2.156 1.00 0.00 H ATOM 1410 N LEU A 307 -13.504 -7.661 3.374 1.00 36.71 N ATOM 1411 CA LEU A 307 -14.004 -6.298 3.513 1.00 40.37 C ATOM 1412 C LEU A 307 -15.149 -6.057 2.554 1.00 44.76 C ATOM 1413 O LEU A 307 -16.192 -5.566 2.956 1.00 53.82 O ATOM 1414 CB LEU A 307 -12.914 -5.266 3.283 1.00 41.11 C ATOM 1415 CG LEU A 307 -12.041 -5.082 4.520 1.00 44.24 C ATOM 1416 CD1 LEU A 307 -10.788 -4.284 4.182 1.00 44.96 C ATOM 1417 CD2 LEU A 307 -12.842 -4.440 5.658 1.00 45.88 C ATOM 1418 H LEU A 307 -12.515 -7.827 3.100 1.00 0.00 H ATOM 1419 N LEU A 308 -14.986 -6.430 1.297 1.00 45.27 N ATOM 1420 CA LEU A 308 -16.055 -6.203 0.312 1.00 47.60 C ATOM 1421 C LEU A 308 -17.298 -7.081 0.556 1.00 49.90 C ATOM 1422 O LEU A 308 -18.420 -6.626 0.340 1.00 48.36 O ATOM 1423 CB LEU A 308 -15.525 -6.400 -1.086 1.00 48.15 C ATOM 1424 CG LEU A 308 -14.504 -5.328 -1.450 1.00 48.76 C ATOM 1425 CD1 LEU A 308 -13.675 -5.818 -2.631 1.00 51.77 C ATOM 1426 CD2 LEU A 308 -15.171 -3.978 -1.734 1.00 50.23 C ATOM 1427 H LEU A 308 -14.099 -6.886 1.003 1.00 0.00 H ATOM 1428 N GLN A 309 -17.095 -8.314 1.026 1.00 51.67 N ATOM 1429 CA GLN A 309 -18.205 -9.203 1.385 1.00 55.66 C ATOM 1430 C GLN A 309 -18.801 -8.920 2.786 1.00 59.84 C ATOM 1431 O GLN A 309 -19.760 -9.586 3.187 1.00 61.39 O ATOM 1432 CB GLN A 309 -17.751 -10.664 1.302 1.00 56.50 C ATOM 1433 CG GLN A 309 -17.283 -11.073 -0.087 1.00 58.60 C ATOM 1434 CD GLN A 309 -16.598 -12.434 -0.115 1.00 61.78 C ATOM 1435 OE1 GLN A 309 -15.920 -12.824 0.836 1.00 64.04 O ATOM 1436 NE2 GLN A 309 -16.771 -13.161 -1.219 1.00 61.72 N ATOM 1437 HE22 GLN A 309 -17.352 -12.792 -1.999 1.00 0.00 H ATOM 1438 HE21 GLN A 309 -16.325 -14.097 -1.301 1.00 0.00 H ATOM 1439 H GLN A 309 -16.119 -8.655 1.141 1.00 0.00 H ATOM 1440 N ASN A 310 -18.244 -7.936 3.510 1.00 62.27 N ATOM 1441 CA ASN A 310 -18.658 -7.594 4.891 1.00 63.97 C ATOM 1442 C ASN A 310 -18.487 -8.771 5.873 1.00 61.73 C ATOM 1443 O ASN A 310 -19.421 -9.527 6.136 1.00 59.13 O ATOM 1444 CB ASN A 310 -20.101 -7.036 4.927 1.00 63.99 C ATOM 1445 H ASN A 310 -17.478 -7.382 3.077 1.00 0.00 H TER 1446 ASN A 310 HETATM 1447 O HOH 1 15.587 8.379 28.907 1.00 36.04 O HETATM 1448 O HOH 2 14.026 2.602 24.409 1.00 19.92 O HETATM 1449 O HOH 3 12.010 4.544 23.353 1.00 26.33 O HETATM 1450 O HOH 4 10.041 10.647 17.057 1.00 26.95 O HETATM 1451 O HOH 5 11.324 3.802 20.171 1.00 21.11 O HETATM 1452 O HOH 6 4.419 -15.730 0.493 1.00 21.23 O HETATM 1453 O HOH 7 6.806 1.473 16.566 1.00 18.67 O HETATM 1454 O HOH 8 0.027 -0.870 1.024 1.00 20.70 O HETATM 1455 O HOH 9 1.568 0.308 3.182 1.00 22.54 O HETATM 1456 O HOH 10 13.858 -11.031 6.925 1.00 31.23 O HETATM 1457 O HOH 11 1.726 -0.655 7.214 1.00 20.52 O HETATM 1458 O HOH 12 9.184 9.937 25.180 1.00 31.60 O HETATM 1459 O HOH 13 -2.697 2.547 13.626 1.00 36.54 O HETATM 1460 O HOH 14 11.716 -6.678 4.888 1.00 24.71 O HETATM 1461 O HOH 15 12.537 -13.011 18.235 1.00 33.22 O HETATM 1462 O HOH 16 19.002 11.874 18.645 1.00 29.99 O HETATM 1463 O HOH 17 -3.895 1.390 -4.406 1.00 29.77 O HETATM 1464 O HOH 18 4.199 -20.026 2.954 1.00 31.47 O HETATM 1465 O HOH 19 9.717 3.362 17.390 1.00 26.27 O HETATM 1466 O HOH 20 -6.211 -12.225 5.452 1.00 27.87 O HETATM 1467 O HOH 21 5.453 -18.237 -2.708 1.00 29.49 O HETATM 1468 O HOH 22 4.230 -18.434 -0.648 1.00 30.26 O HETATM 1469 O HOH 23 5.718 9.878 21.735 1.00 34.10 O HETATM 1470 O HOH 24 17.968 -9.300 13.034 1.00 36.69 O HETATM 1471 O HOH 25 20.806 -12.732 24.938 1.00 40.49 O HETATM 1472 O HOH 26 13.577 9.075 18.449 1.00 33.76 O HETATM 1473 O HOH 27 26.791 11.419 30.771 1.00 27.19 O HETATM 1474 O HOH 28 14.608 -12.668 9.770 1.00 34.29 O HETATM 1475 O HOH 29 15.911 -10.270 24.904 1.00 26.17 O HETATM 1476 O HOH 30 21.793 -10.949 31.873 1.00 29.22 O HETATM 1477 O HOH 31 16.501 5.427 31.994 1.00 38.98 O HETATM 1478 O HOH 32 24.825 4.311 26.363 1.00 37.77 O HETATM 1479 O HOH 33 17.940 11.483 23.437 1.00 39.09 O HETATM 1480 O HOH 34 6.371 2.081 27.846 1.00 35.44 O HETATM 1481 O HOH 35 4.895 2.973 14.531 1.00 39.15 O HETATM 1482 O HOH 36 -0.230 0.320 5.149 1.00 33.97 O HETATM 1483 O HOH 37 -6.616 -3.447 7.710 1.00 31.51 O HETATM 1484 O HOH 38 1.068 6.955 -5.468 1.00 37.27 O HETATM 1485 O HOH 39 -0.732 5.057 11.100 1.00 13.25 O HETATM 1486 O HOH 40 -8.469 -15.227 -2.855 1.00 37.27 O HETATM 1487 O HOH 41 -3.051 -7.481 15.313 1.00 41.62 O HETATM 1488 O HOH 42 -5.563 4.508 5.026 1.00 35.15 O HETATM 1489 O HOH 43 -1.825 0.462 -7.300 1.00 43.22 O HETATM 1490 O HOH 44 9.896 -11.948 17.812 1.00 33.90 O HETATM 1491 O HOH 45 -4.005 -14.999 -3.978 1.00 30.81 O HETATM 1492 O HOH 46 3.293 8.779 7.356 1.00 36.45 O HETATM 1493 O HOH 47 -0.961 -6.419 -8.708 1.00 40.86 O HETATM 1494 O HOH 48 1.548 -7.373 24.266 1.00 38.45 O HETATM 1495 O HOH 49 4.130 6.646 23.908 1.00 45.01 O HETATM 1496 O HOH 50 6.201 2.869 11.233 1.00 31.14 O HETATM 1497 O HOH 51 27.232 9.243 31.993 1.00 40.50 O HETATM 1498 O HOH 52 14.820 0.805 -5.010 1.00 33.74 O HETATM 1499 O HOH 53 13.663 1.392 3.165 1.00 35.75 O HETATM 1500 N HIS A 54 26.639 -2.231 12.754 1.00 0.24 N HETATM 1501 CA HIS A 54 25.880 -1.124 12.086 1.00 0.06 C HETATM 1502 C HIS A 54 24.675 -0.706 12.938 1.00 0.23 C HETATM 1503 O HIS A 54 24.144 -1.502 13.752 1.00 -0.39 O HETATM 1504 N HIS A 54 24.238 0.540 12.772 1.00 -0.26 N HETATM 1505 CA HIS A 54 22.883 0.879 13.198 1.00 0.16 C HETATM 1506 C HIS A 54 22.002 -0.121 12.452 1.00 0.21 C HETATM 1507 O HIS A 54 22.282 -0.450 11.278 1.00 -0.39 O HETATM 1508 N HIS A 54 20.968 -0.661 13.125 1.00 -0.25 N HETATM 1509 CA HIS A 54 20.094 -1.470 12.291 1.00 0.13 C HETATM 1510 C HIS A 54 19.514 -0.606 11.131 1.00 0.20 C HETATM 1511 O HIS A 54 19.351 0.610 11.269 1.00 -0.39 O HETATM 1512 N HIS A 54 19.283 -1.213 9.984 1.00 -0.26 N HETATM 1513 CA HIS A 54 18.750 -0.467 8.850 1.00 0.13 C HETATM 1514 C HIS A 54 17.614 -1.222 8.257 1.00 0.20 C HETATM 1515 O HIS A 54 17.464 -2.409 8.459 1.00 -0.39 O HETATM 1516 N HIS A 54 16.774 -0.515 7.549 1.00 -0.26 N HETATM 1517 CA HIS A 54 15.643 -1.137 6.905 1.00 0.13 C HETATM 1518 C HIS A 54 16.104 -1.464 5.498 1.00 0.21 C HETATM 1519 O HIS A 54 16.936 -0.783 4.966 1.00 -0.39 O HETATM 1520 N HIS A 54 15.585 -2.530 4.911 1.00 -0.25 N HETATM 1521 CA HIS A 54 15.891 -2.806 3.495 1.00 0.13 C HETATM 1522 C HIS A 54 15.370 -1.748 2.516 1.00 0.20 C HETATM 1523 O HIS A 54 14.316 -1.133 2.738 1.00 -0.39 O HETATM 1524 N HIS A 54 16.120 -1.533 1.438 1.00 -0.26 N HETATM 1525 CA HIS A 54 15.694 -0.697 0.325 1.00 0.16 C HETATM 1526 C HIS A 54 14.521 -1.350 -0.395 1.00 0.21 C HETATM 1527 O HIS A 54 14.612 -2.510 -0.827 1.00 -0.39 O HETATM 1528 N HIS A 54 13.404 -0.641 -0.518 1.00 -0.26 N HETATM 1529 CA HIS A 54 12.272 -1.181 -1.290 1.00 0.13 C HETATM 1530 C HIS A 54 12.349 -0.777 -2.791 1.00 0.21 C HETATM 1531 O HIS A 54 13.026 0.218 -3.143 1.00 -0.39 O HETATM 1532 N HIS A 54 11.658 -1.526 -3.680 1.00 -0.25 N HETATM 1533 CA HIS A 54 11.640 -1.113 -5.094 1.00 0.13 C HETATM 1534 C HIS A 54 11.182 0.335 -5.326 1.00 0.20 C HETATM 1535 O HIS A 54 10.212 0.802 -4.673 1.00 -0.39 O HETATM 1536 N HIS A 54 11.875 1.051 -6.223 1.00 -0.26 N HETATM 1537 CA HIS A 54 11.387 2.362 -6.683 1.00 0.13 C HETATM 1538 C HIS A 54 10.332 2.190 -7.806 1.00 0.20 C HETATM 1539 O HIS A 54 9.727 3.171 -8.255 1.00 -0.39 O HETATM 1540 N HIS A 54 10.087 0.953 -8.244 1.00 -0.26 N HETATM 1541 CA HIS A 54 9.034 0.686 -9.216 1.00 0.13 C HETATM 1542 C HIS A 54 8.871 -0.820 -9.389 1.00 0.20 C HETATM 1543 O HIS A 54 9.843 -1.564 -9.319 1.00 -0.39 O HETATM 1544 N HIS A 54 7.627 -1.263 -9.573 1.00 -0.26 N HETATM 1545 CA HIS A 54 7.333 -2.629 -10.060 1.00 0.13 C HETATM 1546 C HIS A 54 6.334 -2.568 -11.234 1.00 0.20 C HETATM 1547 O HIS A 54 5.609 -1.583 -11.373 1.00 -0.39 O HETATM 1548 N HIS A 54 6.290 -3.621 -12.079 1.00 -0.27 N HETATM 1549 CA HIS A 54 5.316 -3.607 -13.187 1.00 0.03 C HETATM 1550 CB HIS A 54 5.732 -4.810 -14.035 1.00 -0.03 C HETATM 1551 CG HIS A 54 6.394 -5.743 -13.078 1.00 -0.03 C HETATM 1552 CD HIS A 54 7.062 -4.881 -12.038 1.00 0.03 C HETATM 1553 H103 HIS A 54 7.000 -5.347 -11.043 1.00 0.05 H HETATM 1554 H104 HIS A 54 8.117 -4.703 -12.294 1.00 0.05 H HETATM 1555 H101 HIS A 54 7.142 -6.357 -13.601 1.00 0.03 H HETATM 1556 H102 HIS A 54 5.647 -6.398 -12.606 1.00 0.03 H HETATM 1557 H99 HIS A 54 6.434 -4.503 -14.824 1.00 0.03 H HETATM 1558 H100 HIS A 54 4.851 -5.285 -14.492 1.00 0.03 H HETATM 1559 H97 HIS A 54 5.389 -2.674 -13.764 1.00 0.05 H HETATM 1560 H98 HIS A 54 4.289 -3.726 -12.811 1.00 0.05 H HETATM 1561 CB HIS A 54 6.802 -3.557 -8.940 1.00 -0.01 C HETATM 1562 CG1 HIS A 54 7.917 -3.870 -7.951 1.00 -0.06 C HETATM 1563 H91 HIS A 54 7.531 -4.529 -7.160 1.00 0.02 H HETATM 1564 H92 HIS A 54 8.283 -2.934 -7.503 1.00 0.02 H HETATM 1565 H93 HIS A 54 8.743 -4.372 -8.476 1.00 0.02 H HETATM 1566 CG2 HIS A 54 5.581 -2.968 -8.236 1.00 -0.06 C HETATM 1567 H94 HIS A 54 4.798 -2.755 -8.978 1.00 0.02 H HETATM 1568 H95 HIS A 54 5.866 -2.036 -7.725 1.00 0.02 H HETATM 1569 H96 HIS A 54 5.200 -3.689 -7.498 1.00 0.02 H HETATM 1570 H90 HIS A 54 6.490 -4.502 -9.408 1.00 0.03 H HETATM 1571 H89 HIS A 54 8.273 -3.061 -10.433 1.00 0.08 H HETATM 1572 H88 HIS A 54 6.863 -0.649 -9.374 1.00 0.19 H HETATM 1573 CB HIS A 54 9.344 1.360 -10.576 1.00 -0.02 C HETATM 1574 H85 HIS A 54 8.534 1.141 -11.287 1.00 0.03 H HETATM 1575 H86 HIS A 54 10.293 0.969 -10.971 1.00 0.03 H HETATM 1576 H87 HIS A 54 9.425 2.448 -10.436 1.00 0.03 H HETATM 1577 H84 HIS A 54 8.090 1.100 -8.832 1.00 0.08 H HETATM 1578 H83 HIS A 54 10.638 0.193 -7.898 1.00 0.19 H HETATM 1579 CB HIS A 54 12.542 3.301 -7.102 1.00 -0.01 C HETATM 1580 CG HIS A 54 13.185 4.056 -5.930 1.00 -0.05 C HETATM 1581 CD HIS A 54 13.759 5.425 -6.328 1.00 -0.07 C HETATM 1582 H80 HIS A 54 14.202 5.908 -5.444 1.00 0.02 H HETATM 1583 H81 HIS A 54 12.953 6.059 -6.727 1.00 0.02 H HETATM 1584 H82 HIS A 54 14.533 5.288 -7.098 1.00 0.02 H HETATM 1585 H78 HIS A 54 14.001 3.440 -5.524 1.00 0.03 H HETATM 1586 H79 HIS A 54 12.421 4.210 -5.154 1.00 0.03 H HETATM 1587 H76 HIS A 54 12.147 4.040 -7.815 1.00 0.03 H HETATM 1588 H77 HIS A 54 13.319 2.697 -7.593 1.00 0.03 H HETATM 1589 H75 HIS A 54 10.880 2.838 -5.831 1.00 0.08 H HETATM 1590 H74 HIS A 54 12.735 0.690 -6.585 1.00 0.19 H HETATM 1591 CB HIS A 54 10.637 -2.104 -5.737 1.00 -0.01 C HETATM 1592 CG HIS A 54 10.759 -3.327 -4.890 1.00 -0.03 C HETATM 1593 CD HIS A 54 10.954 -2.813 -3.472 1.00 0.04 C HETATM 1594 H72 HIS A 54 9.987 -2.659 -2.971 1.00 0.05 H HETATM 1595 H73 HIS A 54 11.567 -3.508 -2.880 1.00 0.05 H HETATM 1596 H70 HIS A 54 11.624 -3.929 -5.204 1.00 0.03 H HETATM 1597 H71 HIS A 54 9.845 -3.935 -4.957 1.00 0.03 H HETATM 1598 H68 HIS A 54 10.912 -2.320 -6.780 1.00 0.03 H HETATM 1599 H69 HIS A 54 9.613 -1.704 -5.703 1.00 0.03 H HETATM 1600 H67 HIS A 54 12.642 -1.236 -5.531 1.00 0.08 H HETATM 1601 CB HIS A 54 10.939 -0.706 -0.701 1.00 -0.01 C HETATM 1602 CG HIS A 54 10.695 -1.086 0.771 1.00 -0.04 C HETATM 1603 CD1 HIS A 54 9.505 -0.301 1.303 1.00 -0.06 C HETATM 1604 H61 HIS A 54 9.329 -0.571 2.355 1.00 0.02 H HETATM 1605 H62 HIS A 54 8.612 -0.541 0.708 1.00 0.02 H HETATM 1606 H63 HIS A 54 9.715 0.776 1.231 1.00 0.02 H HETATM 1607 CD2 HIS A 54 10.460 -2.583 0.913 1.00 -0.06 C HETATM 1608 H64 HIS A 54 11.331 -3.130 0.523 1.00 0.02 H HETATM 1609 H65 HIS A 54 9.563 -2.869 0.344 1.00 0.02 H HETATM 1610 H66 HIS A 54 10.316 -2.833 1.975 1.00 0.02 H HETATM 1611 H60 HIS A 54 11.586 -0.817 1.357 1.00 0.03 H HETATM 1612 H58 HIS A 54 10.128 -1.141 -1.303 1.00 0.03 H HETATM 1613 H59 HIS A 54 10.905 0.391 -0.778 1.00 0.03 H HETATM 1614 H57 HIS A 54 12.310 -2.279 -1.226 1.00 0.08 H HETATM 1615 H56 HIS A 54 13.332 0.258 -0.087 1.00 0.19 H HETATM 1616 CB HIS A 54 16.877 -0.508 -0.651 1.00 0.09 C HETATM 1617 OG1 HIS A 54 17.929 0.132 0.062 1.00 -0.39 O HETATM 1618 H52 HIS A 54 18.671 0.260 -0.518 1.00 0.21 H HETATM 1619 CG2 HIS A 54 16.498 0.352 -1.816 1.00 -0.03 C HETATM 1620 H53 HIS A 54 17.363 0.463 -2.486 1.00 0.03 H HETATM 1621 H54 HIS A 54 16.185 1.342 -1.454 1.00 0.03 H HETATM 1622 H55 HIS A 54 15.668 -0.118 -2.364 1.00 0.03 H HETATM 1623 H51 HIS A 54 17.211 -1.490 -1.017 1.00 0.06 H HETATM 1624 H50 HIS A 54 15.380 0.285 0.708 1.00 0.08 H HETATM 1625 H49 HIS A 54 17.020 -1.967 1.390 1.00 0.19 H HETATM 1626 CB HIS A 54 15.177 -4.122 3.244 1.00 -0.01 C HETATM 1627 CG HIS A 54 14.079 -4.176 4.274 1.00 -0.03 C HETATM 1628 CD HIS A 54 14.616 -3.482 5.479 1.00 0.04 C HETATM 1629 H47 HIS A 54 13.816 -2.956 6.021 1.00 0.05 H HETATM 1630 H48 HIS A 54 15.111 -4.193 6.156 1.00 0.05 H HETATM 1631 H45 HIS A 54 13.829 -5.220 4.513 1.00 0.03 H HETATM 1632 H46 HIS A 54 13.181 -3.660 3.904 1.00 0.03 H HETATM 1633 H43 HIS A 54 15.869 -4.967 3.373 1.00 0.03 H HETATM 1634 H44 HIS A 54 14.755 -4.145 2.228 1.00 0.03 H HETATM 1635 H42 HIS A 54 16.977 -2.912 3.357 1.00 0.08 H HETATM 1636 CB HIS A 54 14.455 -0.191 6.901 1.00 -0.01 C HETATM 1637 CG HIS A 54 13.858 0.017 8.290 1.00 -0.04 C HETATM 1638 CD1 HIS A 54 13.022 1.259 8.349 1.00 -0.06 C HETATM 1639 H36 HIS A 54 12.610 1.376 9.362 1.00 0.02 H HETATM 1640 H37 HIS A 54 12.198 1.181 7.625 1.00 0.02 H HETATM 1641 H38 HIS A 54 13.645 2.132 8.104 1.00 0.02 H HETATM 1642 CD2 HIS A 54 13.037 -1.183 8.698 1.00 -0.06 C HETATM 1643 H39 HIS A 54 13.661 -2.087 8.651 1.00 0.02 H HETATM 1644 H40 HIS A 54 12.182 -1.292 8.015 1.00 0.02 H HETATM 1645 H41 HIS A 54 12.670 -1.044 9.726 1.00 0.02 H HETATM 1646 H35 HIS A 54 14.687 0.128 9.004 1.00 0.03 H HETATM 1647 H33 HIS A 54 13.677 -0.607 6.243 1.00 0.03 H HETATM 1648 H34 HIS A 54 14.783 0.783 6.510 1.00 0.03 H HETATM 1649 H32 HIS A 54 15.364 -2.061 7.433 1.00 0.08 H HETATM 1650 H31 HIS A 54 16.917 0.470 7.452 1.00 0.19 H HETATM 1651 CB HIS A 54 19.828 -0.094 7.801 1.00 -0.01 C HETATM 1652 CG HIS A 54 20.537 -1.247 7.101 1.00 -0.05 C HETATM 1653 CD HIS A 54 21.971 -0.867 6.697 1.00 -0.07 C HETATM 1654 H28 HIS A 54 22.449 -1.722 6.196 1.00 0.02 H HETATM 1655 H29 HIS A 54 22.546 -0.600 7.596 1.00 0.02 H HETATM 1656 H30 HIS A 54 21.943 -0.008 6.010 1.00 0.02 H HETATM 1657 H26 HIS A 54 19.971 -1.518 6.197 1.00 0.03 H HETATM 1658 H27 HIS A 54 20.575 -2.110 7.783 1.00 0.03 H HETATM 1659 H24 HIS A 54 20.595 0.507 8.312 1.00 0.03 H HETATM 1660 H25 HIS A 54 19.341 0.516 7.026 1.00 0.03 H HETATM 1661 H23 HIS A 54 18.349 0.480 9.241 1.00 0.08 H HETATM 1662 H22 HIS A 54 19.474 -2.190 9.891 1.00 0.19 H HETATM 1663 CB HIS A 54 19.022 -1.984 13.261 1.00 -0.01 C HETATM 1664 CG HIS A 54 19.255 -1.324 14.560 1.00 -0.03 C HETATM 1665 CD HIS A 54 20.580 -0.635 14.544 1.00 0.04 C HETATM 1666 H20 HIS A 54 20.489 0.399 14.907 1.00 0.05 H HETATM 1667 H21 HIS A 54 21.312 -1.177 15.161 1.00 0.05 H HETATM 1668 H18 HIS A 54 19.245 -2.078 15.361 1.00 0.03 H HETATM 1669 H19 HIS A 54 18.461 -0.585 14.742 1.00 0.03 H HETATM 1670 H16 HIS A 54 19.107 -3.075 13.372 1.00 0.03 H HETATM 1671 H17 HIS A 54 18.020 -1.730 12.884 1.00 0.03 H HETATM 1672 H15 HIS A 54 20.646 -2.318 11.859 1.00 0.08 H HETATM 1673 CB HIS A 54 22.477 2.320 12.843 1.00 0.09 C HETATM 1674 OG1 HIS A 54 23.524 3.206 13.235 1.00 -0.39 O HETATM 1675 H11 HIS A 54 23.280 4.098 13.019 1.00 0.21 H HETATM 1676 CG2 HIS A 54 21.170 2.732 13.572 1.00 -0.03 C HETATM 1677 H12 HIS A 54 20.907 3.764 13.298 1.00 0.03 H HETATM 1678 H13 HIS A 54 21.321 2.668 14.660 1.00 0.03 H HETATM 1679 H14 HIS A 54 20.355 2.055 13.275 1.00 0.03 H HETATM 1680 H10 HIS A 54 22.321 2.392 11.757 1.00 0.06 H HETATM 1681 H9 HIS A 54 22.786 0.743 14.285 1.00 0.08 H HETATM 1682 H8 HIS A 54 24.829 1.234 12.361 1.00 0.19 H HETATM 1683 CB HIS A 54 25.410 -1.565 10.678 1.00 -0.00 C HETATM 1684 H5 HIS A 54 24.856 -0.743 10.202 1.00 0.03 H HETATM 1685 H6 HIS A 54 24.755 -2.444 10.769 1.00 0.03 H HETATM 1686 H7 HIS A 54 26.285 -1.821 10.063 1.00 0.03 H HETATM 1687 H4 HIS A 54 26.549 -0.258 11.977 1.00 0.11 H HETATM 1688 H1 HIS A 54 27.426 -2.492 12.181 1.00 0.20 H HETATM 1689 H2 HIS A 54 26.033 -3.027 12.876 1.00 0.20 H HETATM 1690 H3 HIS A 54 26.968 -1.918 13.654 1.00 0.20 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1500 1501 1688 1689 1690 CONECT 1501 1500 1502 1683 1687 CONECT 1502 1501 1503 1504 CONECT 1503 1502 CONECT 1504 1502 1505 1682 CONECT 1505 1504 1506 1673 1681 CONECT 1506 1505 1507 1508 CONECT 1507 1506 CONECT 1508 1506 1509 1665 CONECT 1509 1508 1510 1663 1672 CONECT 1510 1509 1511 1512 CONECT 1511 1510 CONECT 1512 1510 1513 1662 CONECT 1513 1512 1514 1651 1661 CONECT 1514 1513 1515 1516 CONECT 1515 1514 CONECT 1516 1514 1517 1650 CONECT 1517 1516 1518 1636 1649 CONECT 1518 1517 1519 1520 CONECT 1519 1518 CONECT 1520 1518 1521 1628 CONECT 1521 1520 1522 1626 1635 CONECT 1522 1521 1523 1524 CONECT 1523 1522 CONECT 1524 1522 1525 1625 CONECT 1525 1524 1526 1616 1624 CONECT 1526 1525 1527 1528 CONECT 1527 1526 CONECT 1528 1526 1529 1615 CONECT 1529 1528 1530 1601 1614 CONECT 1530 1529 1531 1532 CONECT 1531 1530 CONECT 1532 1530 1533 1593 CONECT 1533 1532 1534 1591 1600 CONECT 1534 1533 1535 1536 CONECT 1535 1534 CONECT 1536 1534 1537 1590 CONECT 1537 1536 1538 1579 1589 CONECT 1538 1537 1539 1540 CONECT 1539 1538 CONECT 1540 1538 1541 1578 CONECT 1541 1540 1542 1573 1577 CONECT 1542 1541 1543 1544 CONECT 1543 1542 CONECT 1544 1542 1545 1572 CONECT 1545 1544 1546 1561 1571 CONECT 1546 1545 1547 1548 CONECT 1547 1546 CONECT 1548 1546 1549 1552 CONECT 1549 1548 1550 1559 1560 CONECT 1550 1549 1551 1557 1558 CONECT 1551 1550 1552 1555 1556 CONECT 1552 1548 1551 1553 1554 CONECT 1553 1552 CONECT 1554 1552 CONECT 1555 1551 CONECT 1556 1551 CONECT 1557 1550 CONECT 1558 1550 CONECT 1559 1549 CONECT 1560 1549 CONECT 1561 1545 1562 1566 1570 CONECT 1562 1561 1563 1564 1565 CONECT 1563 1562 CONECT 1564 1562 CONECT 1565 1562 CONECT 1566 1561 1567 1568 1569 CONECT 1567 1566 CONECT 1568 1566 CONECT 1569 1566 CONECT 1570 1561 CONECT 1571 1545 CONECT 1572 1544 CONECT 1573 1541 1574 1575 1576 CONECT 1574 1573 CONECT 1575 1573 CONECT 1576 1573 CONECT 1577 1541 CONECT 1578 1540 CONECT 1579 1537 1580 1587 1588 CONECT 1580 1579 1581 1585 1586 CONECT 1581 1580 1582 1583 1584 CONECT 1582 1581 CONECT 1583 1581 CONECT 1584 1581 CONECT 1585 1580 CONECT 1586 1580 CONECT 1587 1579 CONECT 1588 1579 CONECT 1589 1537 CONECT 1590 1536 CONECT 1591 1533 1592 1598 1599 CONECT 1592 1591 1593 1596 1597 CONECT 1593 1532 1592 1594 1595 CONECT 1594 1593 CONECT 1595 1593 CONECT 1596 1592 CONECT 1597 1592 CONECT 1598 1591 CONECT 1599 1591 CONECT 1600 1533 CONECT 1601 1529 1602 1612 1613 CONECT 1602 1601 1603 1607 1611 CONECT 1603 1602 1604 1605 1606 CONECT 1604 1603 CONECT 1605 1603 CONECT 1606 1603 CONECT 1607 1602 1608 1609 1610 CONECT 1608 1607 CONECT 1609 1607 CONECT 1610 1607 CONECT 1611 1602 CONECT 1612 1601 CONECT 1613 1601 CONECT 1614 1529 CONECT 1615 1528 CONECT 1616 1525 1617 1619 1623 CONECT 1617 1616 1618 CONECT 1618 1617 CONECT 1619 1616 1620 1621 1622 CONECT 1620 1619 CONECT 1621 1619 CONECT 1622 1619 CONECT 1623 1616 CONECT 1624 1525 CONECT 1625 1524 CONECT 1626 1521 1627 1633 1634 CONECT 1627 1626 1628 1631 1632 CONECT 1628 1520 1627 1629 1630 CONECT 1629 1628 CONECT 1630 1628 CONECT 1631 1627 CONECT 1632 1627 CONECT 1633 1626 CONECT 1634 1626 CONECT 1635 1521 CONECT 1636 1517 1637 1647 1648 CONECT 1637 1636 1638 1642 1646 CONECT 1638 1637 1639 1640 1641 CONECT 1639 1638 CONECT 1640 1638 CONECT 1641 1638 CONECT 1642 1637 1643 1644 1645 CONECT 1643 1642 CONECT 1644 1642 CONECT 1645 1642 CONECT 1646 1637 CONECT 1647 1636 CONECT 1648 1636 CONECT 1649 1517 CONECT 1650 1516 CONECT 1651 1513 1652 1659 1660 CONECT 1652 1651 1653 1657 1658 CONECT 1653 1652 1654 1655 1656 CONECT 1654 1653 CONECT 1655 1653 CONECT 1656 1653 CONECT 1657 1652 CONECT 1658 1652 CONECT 1659 1651 CONECT 1660 1651 CONECT 1661 1513 CONECT 1662 1512 CONECT 1663 1509 1664 1670 1671 CONECT 1664 1663 1665 1668 1669 CONECT 1665 1508 1664 1666 1667 CONECT 1666 1665 CONECT 1667 1665 CONECT 1668 1664 CONECT 1669 1664 CONECT 1670 1663 CONECT 1671 1663 CONECT 1672 1509 CONECT 1673 1505 1674 1676 1680 CONECT 1674 1673 1675 CONECT 1675 1674 CONECT 1676 1673 1677 1678 1679 CONECT 1677 1676 CONECT 1678 1676 CONECT 1679 1676 CONECT 1680 1673 CONECT 1681 1505 CONECT 1682 1504 CONECT 1683 1501 1684 1685 1686 CONECT 1684 1683 CONECT 1685 1683 CONECT 1686 1683 CONECT 1687 1501 CONECT 1688 1500 CONECT 1689 1500 CONECT 1690 1500 MASTER 0 0 0 0 0 0 0 0 1689 1 195 13 END
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Entry Information
PDB ID
4lg6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ankyrin repeat family A protein 2, ANKRA2
Ligand Name
17-mer
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Kd=0.18uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Structure Vol. 23: pp. 700-712
Ligand Properties
Formula
C
6
0
H
1
0
4
N
1
3
O
1
4
Molecular Weight
1231.550
Exact Mass
1230.780
No. of atoms
191
No. of bonds
194
Polar Surface Area
382.14
LOGP Value
1.97 (
Computed with XLOGP3
)
1.10 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 11
No. of Hydrogen Bond Acceptors: 14
No. of Rotatable Bonds: 45
No. of Nitrogen and Oxygen Atoms: 27
No. of Rings: 4
Canonical SMILES
CCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCCC1)C(C)C)C)CCC)CC(C)C)[C@H](O)C)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C
InChI String
InChI=1S/C60H103N13O14/c1-13-20-39(51(78)62-36(10)50(77)67-46(34(7)8)59(86)70-25-15-16-26-70)63-53(80)43-22-17-27-71(43)58(85)42(31-33(5)6)66-56(83)47(37(11)74)68-55(82)45-24-18-28-72(45)57(84)41(30-32(3)4)65-52(79)40(21-14-2)64-54(81)44-23-19-29-73(44)60(87)48(38(12)75)69-49(76)35(9)61/h32-48,74-75H,13-31,61H2,1-12H3,(H,62,78)(H,63,80)(H,64,81)(H,65,79)(H,66,83)(H,67,77)(H,68,82)(H,69,76)/p+1/t35-,36-,37+,38+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-/m0/s1
Links to External Databases
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Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9H0W5
Q9H9E1
Entrez Gene ID
NCBI Entrez Gene ID:
83987
57763
ASD
Information of known allosteric effects of PDB entries
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