Browse entries in the PDBbind-CN Database
HEADER 4NMT_COMPLEX COMPND 4NMT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 87 GLY PRO ILE ARG LYS VAL LEU LEU LEU LYS GLU ASP HIS SEQRES 2 A 87 GLU GLY LEU GLY ILE SER ILE THR GLY GLY LYS GLU HIS SEQRES 3 A 87 GLY VAL PRO ILE LEU ILE SER GLU ILE HIS PRO GLY GLN SEQRES 4 A 87 PRO ALA ASP ARG CYS GLY GLY LEU HIS VAL GLY ASP ALA SEQRES 5 A 87 ILE LEU ALA VAL ASN GLY VAL ASN LEU ARG ASP THR LYS SEQRES 6 A 87 HIS LYS GLU ALA VAL THR ILE LEU SER GLN GLN ARG GLY SEQRES 7 A 87 GLU ILE GLU PHE GLU VAL VAL TYR VAL HET ARG A 200 135 ATOM 1 N GLY A 284 7.675 18.811 -1.970 1.00 9.16 N ATOM 2 CA GLY A 284 6.694 17.758 -2.146 1.00 8.72 C ATOM 3 C GLY A 284 5.293 18.299 -2.001 1.00 7.22 C ATOM 4 O GLY A 284 5.109 19.502 -1.802 1.00 8.28 O ATOM 5 HN3 GLY A 284 7.572 19.224 -1.021 1.00 0.00 H ATOM 6 HN2 GLY A 284 7.524 19.547 -2.689 1.00 0.00 H ATOM 7 HN1 GLY A 284 8.631 18.414 -2.074 1.00 0.00 H ATOM 8 N PRO A 285 4.292 17.416 -2.084 1.00 8.79 N ATOM 9 CA PRO A 285 2.898 17.849 -1.983 1.00 7.46 C ATOM 10 C PRO A 285 2.552 18.250 -0.558 1.00 9.09 C ATOM 11 O PRO A 285 3.075 17.669 0.389 1.00 8.59 O ATOM 12 CB PRO A 285 2.118 16.582 -2.359 1.00 9.44 C ATOM 13 CG PRO A 285 3.043 15.457 -1.987 1.00 10.21 C ATOM 14 CD PRO A 285 4.418 15.962 -2.294 1.00 11.26 C ATOM 15 N ILE A 286 1.685 19.234 -0.400 1.00 7.29 N ATOM 16 CA ILE A 286 1.130 19.514 0.910 1.00 7.71 C ATOM 17 C ILE A 286 0.214 18.352 1.296 1.00 8.68 C ATOM 18 O ILE A 286 -0.565 17.858 0.471 1.00 11.61 O ATOM 19 CB ILE A 286 0.402 20.855 0.924 1.00 9.11 C ATOM 20 CG1 ILE A 286 1.408 21.976 0.626 1.00 11.86 C ATOM 21 CG2 ILE A 286 -0.306 21.055 2.270 1.00 8.88 C ATOM 22 CD1 ILE A 286 0.787 23.340 0.473 1.00 15.68 C ATOM 23 H ILE A 286 1.400 19.810 -1.218 1.00 0.00 H ATOM 24 N ARG A 287 0.344 17.881 2.535 1.00 6.94 N ATOM 25 CA ARG A 287 -0.436 16.755 3.037 1.00 7.90 C ATOM 26 C ARG A 287 -1.210 17.158 4.283 1.00 9.04 C ATOM 27 O ARG A 287 -0.745 17.985 5.075 1.00 8.51 O ATOM 28 CB ARG A 287 0.482 15.596 3.431 1.00 7.89 C ATOM 29 CG ARG A 287 1.284 14.978 2.311 1.00 12.92 C ATOM 30 CD ARG A 287 2.767 15.010 2.599 1.00 10.76 C ATOM 31 NE ARG A 287 3.117 14.364 3.867 1.00 8.01 N ATOM 32 CZ ARG A 287 4.189 14.687 4.576 1.00 7.07 C ATOM 33 NH1 ARG A 287 5.010 15.631 4.142 1.00 7.75 N ATOM 34 NH2 ARG A 287 4.440 14.074 5.720 1.00 7.27 N ATOM 35 HE ARG A 287 2.493 13.615 4.228 1.00 0.00 H ATOM 36 HH12 ARG A 287 5.851 15.885 4.698 1.00 0.00 H ATOM 37 HH11 ARG A 287 4.813 16.119 3.245 1.00 0.00 H ATOM 38 HH22 ARG A 287 5.282 14.330 6.273 1.00 0.00 H ATOM 39 HH21 ARG A 287 3.795 13.335 6.067 1.00 0.00 H ATOM 40 H ARG A 287 1.030 18.335 3.171 1.00 0.00 H ATOM 41 N LYS A 288 -2.380 16.553 4.453 1.00 8.38 N ATOM 42 CA LYS A 288 -3.145 16.644 5.692 1.00 9.37 C ATOM 43 C LYS A 288 -2.955 15.322 6.421 1.00 9.95 C ATOM 44 O LYS A 288 -3.142 14.249 5.835 1.00 11.83 O ATOM 45 CB LYS A 288 -4.627 16.846 5.391 1.00 13.68 C ATOM 46 CG LYS A 288 -4.916 17.975 4.419 1.00 30.57 C ATOM 47 CD LYS A 288 -4.776 19.332 5.078 1.00 39.08 C ATOM 48 CE LYS A 288 -6.090 19.786 5.685 1.00 44.70 C ATOM 49 NZ LYS A 288 -5.931 21.095 6.378 1.00 49.02 N ATOM 50 HZ1 LYS A 288 -5.226 21.001 7.137 1.00 0.00 H ATOM 51 HZ2 LYS A 288 -5.613 21.811 5.695 1.00 0.00 H ATOM 52 HZ3 LYS A 288 -6.844 21.384 6.785 1.00 0.00 H ATOM 53 H LYS A 288 -2.768 15.990 3.669 1.00 0.00 H ATOM 54 N VAL A 289 -2.585 15.394 7.694 1.00 6.12 N ATOM 55 CA VAL A 289 -2.246 14.199 8.471 1.00 6.15 C ATOM 56 C VAL A 289 -2.963 14.236 9.811 1.00 7.02 C ATOM 57 O VAL A 289 -2.928 15.253 10.503 1.00 8.08 O ATOM 58 CB VAL A 289 -0.712 14.104 8.711 1.00 6.37 C ATOM 59 CG1 VAL A 289 -0.379 12.938 9.641 1.00 9.26 C ATOM 60 CG2 VAL A 289 0.017 13.963 7.380 1.00 9.26 C ATOM 61 H VAL A 289 -2.534 16.326 8.153 1.00 0.00 H ATOM 62 N LEU A 290 -3.609 13.135 10.184 1.00 5.74 N ATOM 63 CA LEU A 290 -4.301 13.043 11.466 1.00 5.97 C ATOM 64 C LEU A 290 -3.440 12.348 12.518 1.00 5.93 C ATOM 65 O LEU A 290 -2.845 11.296 12.255 1.00 6.05 O ATOM 66 CB LEU A 290 -5.595 12.253 11.279 1.00 6.42 C ATOM 67 CG LEU A 290 -6.431 12.030 12.531 1.00 5.90 C ATOM 68 CD1 LEU A 290 -6.973 13.362 13.031 1.00 9.35 C ATOM 69 CD2 LEU A 290 -7.570 11.074 12.205 1.00 10.16 C ATOM 70 H LEU A 290 -3.622 12.316 9.544 1.00 0.00 H ATOM 71 N LEU A 291 -3.379 12.938 13.707 1.00 4.08 N ATOM 72 CA LEU A 291 -2.644 12.371 14.830 1.00 4.59 C ATOM 73 C LEU A 291 -3.604 12.190 16.001 1.00 5.08 C ATOM 74 O LEU A 291 -4.431 13.064 16.271 1.00 6.20 O ATOM 75 CB LEU A 291 -1.473 13.286 15.208 1.00 6.24 C ATOM 76 CG LEU A 291 -0.596 12.911 16.406 1.00 5.18 C ATOM 77 CD1 LEU A 291 0.798 13.501 16.220 1.00 5.93 C ATOM 78 CD2 LEU A 291 -1.225 13.398 17.712 1.00 5.99 C ATOM 79 H LEU A 291 -3.876 13.841 13.842 1.00 0.00 H ATOM 80 N LEU A 292 -3.524 11.037 16.661 1.00 5.22 N ATOM 81 CA LEU A 292 -4.336 10.749 17.841 1.00 5.47 C ATOM 82 C LEU A 292 -3.427 10.685 19.058 1.00 5.38 C ATOM 83 O LEU A 292 -2.492 9.887 19.107 1.00 5.47 O ATOM 84 CB LEU A 292 -5.099 9.430 17.686 1.00 7.09 C ATOM 85 CG LEU A 292 -6.510 9.507 17.116 1.00 8.29 C ATOM 86 CD1 LEU A 292 -6.570 10.245 15.792 1.00 9.30 C ATOM 87 CD2 LEU A 292 -7.128 8.109 16.994 1.00 8.44 C ATOM 88 H LEU A 292 -2.858 10.313 16.324 1.00 0.00 H ATOM 89 N LYS A 293 -3.710 11.514 20.047 1.00 9.86 N ATOM 90 CA LYS A 293 -2.891 11.658 21.257 1.00 15.87 C ATOM 91 C LYS A 293 -3.783 11.510 22.470 1.00 11.32 C ATOM 92 O LYS A 293 -4.857 12.034 22.518 1.00 10.77 O ATOM 93 CB LYS A 293 -2.263 13.083 21.282 1.00 18.23 C ATOM 94 CG LYS A 293 -1.243 13.365 22.372 1.00 20.80 C ATOM 95 CD LYS A 293 -0.714 14.712 22.362 1.00 12.41 C ATOM 96 CE LYS A 293 -1.540 15.665 23.138 1.00 15.96 C ATOM 97 NZ LYS A 293 -1.665 15.183 24.454 1.00 11.79 N ATOM 98 HZ1 LYS A 293 -2.122 14.249 24.438 1.00 0.00 H ATOM 99 HZ2 LYS A 293 -0.721 15.101 24.883 1.00 0.00 H ATOM 100 HZ3 LYS A 293 -2.244 15.844 25.010 1.00 0.00 H ATOM 101 H LYS A 293 -4.565 12.100 19.963 1.00 0.00 H ATOM 102 N GLU A 294 -3.296 10.791 23.471 1.00 10.72 N ATOM 103 CA GLU A 294 -3.963 10.738 24.761 1.00 13.07 C ATOM 104 C GLU A 294 -3.416 11.854 25.663 1.00 9.32 C ATOM 105 O GLU A 294 -2.312 12.351 25.445 1.00 8.26 O ATOM 106 CB GLU A 294 -3.782 9.361 25.403 1.00 17.97 C ATOM 107 CG GLU A 294 -4.782 8.299 24.924 1.00 21.23 C ATOM 108 CD GLU A 294 -4.462 7.714 23.554 1.00 19.63 C ATOM 109 OE1 GLU A 294 -3.266 7.644 23.180 1.00 14.69 O ATOM 110 OE2 GLU A 294 -5.419 7.307 22.851 1.00 9.15 O ATOM 111 H GLU A 294 -2.417 10.253 23.330 1.00 0.00 H ATOM 112 N ASP A 295 -4.191 12.252 26.666 1.00 10.28 N ATOM 113 CA ASP A 295 -3.859 13.428 27.461 1.00 10.60 C ATOM 114 C ASP A 295 -2.587 13.299 28.305 1.00 9.31 C ATOM 115 O ASP A 295 -2.024 14.307 28.730 1.00 12.46 O ATOM 116 CB ASP A 295 -5.041 13.827 28.354 1.00 14.58 C ATOM 117 CG ASP A 295 -6.247 14.299 27.561 1.00 20.20 C ATOM 118 OD1 ASP A 295 -6.110 14.608 26.358 1.00 15.81 O ATOM 119 OD2 ASP A 295 -7.342 14.369 28.153 1.00 22.24 O ATOM 120 H ASP A 295 -5.052 11.713 26.889 1.00 0.00 H ATOM 121 N HIS A 296 -2.117 12.070 28.505 1.00 6.01 N ATOM 122 CA HIS A 296 -0.915 11.832 29.317 1.00 6.58 C ATOM 123 C HIS A 296 0.374 11.918 28.501 1.00 5.76 C ATOM 124 O HIS A 296 1.465 11.783 29.056 1.00 7.05 O ATOM 125 CB HIS A 296 -0.988 10.460 29.996 1.00 5.90 C ATOM 126 CG HIS A 296 -0.824 9.319 29.042 1.00 6.17 C ATOM 127 ND1 HIS A 296 -1.715 9.081 28.022 1.00 7.72 N ATOM 128 CD2 HIS A 296 0.146 8.380 28.932 1.00 9.04 C ATOM 129 CE1 HIS A 296 -1.312 8.023 27.332 1.00 9.69 C ATOM 130 NE2 HIS A 296 -0.190 7.582 27.863 1.00 8.86 N ATOM 131 H HIS A 296 -2.611 11.261 28.078 1.00 0.00 H ATOM 132 N GLU A 297 0.234 12.131 27.196 1.00 6.15 N ATOM 133 CA GLU A 297 1.361 12.102 26.264 1.00 7.66 C ATOM 134 C GLU A 297 1.615 13.462 25.644 1.00 5.49 C ATOM 135 O GLU A 297 0.718 14.308 25.581 1.00 6.10 O ATOM 136 CB GLU A 297 1.048 11.177 25.088 1.00 13.55 C ATOM 137 CG GLU A 297 0.524 9.824 25.440 1.00 13.66 C ATOM 138 CD GLU A 297 0.219 9.017 24.193 1.00 8.59 C ATOM 139 OE1 GLU A 297 -0.838 9.266 23.572 1.00 10.99 O ATOM 140 OE2 GLU A 297 1.065 8.176 23.863 1.00 13.33 O ATOM 141 H GLU A 297 -0.717 12.326 26.822 1.00 0.00 H ATOM 142 N GLY A 298 2.835 13.665 25.163 1.00 6.52 N ATOM 143 CA GLY A 298 3.104 14.758 24.248 1.00 6.98 C ATOM 144 C GLY A 298 2.845 14.313 22.812 1.00 6.18 C ATOM 145 O GLY A 298 2.301 13.224 22.555 1.00 6.16 O ATOM 146 H GLY A 298 3.609 13.031 25.446 1.00 0.00 H ATOM 147 N LEU A 299 3.229 15.148 21.861 1.00 5.03 N ATOM 148 CA LEU A 299 3.071 14.809 20.455 1.00 4.70 C ATOM 149 C LEU A 299 4.097 13.783 20.019 1.00 6.13 C ATOM 150 O LEU A 299 3.833 12.989 19.125 1.00 6.66 O ATOM 151 CB LEU A 299 3.215 16.058 19.592 1.00 4.87 C ATOM 152 CG LEU A 299 2.080 17.071 19.735 1.00 4.82 C ATOM 153 CD1 LEU A 299 2.442 18.397 19.098 1.00 8.04 C ATOM 154 CD2 LEU A 299 0.817 16.502 19.102 1.00 6.57 C ATOM 155 H LEU A 299 3.651 16.062 22.122 1.00 0.00 H ATOM 156 N GLY A 300 5.275 13.802 20.626 1.00 5.29 N ATOM 157 CA GLY A 300 6.314 12.869 20.221 1.00 6.48 C ATOM 158 C GLY A 300 7.124 13.398 19.053 1.00 6.29 C ATOM 159 O GLY A 300 7.559 12.638 18.183 1.00 6.12 O ATOM 160 H GLY A 300 5.456 14.483 21.391 1.00 0.00 H ATOM 161 N ILE A 301 7.345 14.709 19.067 1.00 6.95 N ATOM 162 CA ILE A 301 8.043 15.421 18.005 1.00 6.50 C ATOM 163 C ILE A 301 9.105 16.321 18.635 1.00 6.19 C ATOM 164 O ILE A 301 8.931 16.791 19.762 1.00 6.79 O ATOM 165 CB ILE A 301 7.053 16.324 17.208 1.00 3.43 C ATOM 166 CG1 ILE A 301 5.799 15.545 16.788 1.00 3.50 C ATOM 167 CG2 ILE A 301 7.725 16.939 15.988 1.00 4.24 C ATOM 168 CD1 ILE A 301 4.775 16.398 16.066 1.00 8.03 C ATOM 169 H ILE A 301 7.000 15.257 19.881 1.00 0.00 H ATOM 170 N SER A 302 10.213 16.545 17.931 1.00 4.81 N ATOM 171 CA SER A 302 11.063 17.677 18.237 1.00 3.76 C ATOM 172 C SER A 302 10.919 18.615 17.066 1.00 6.35 C ATOM 173 O SER A 302 10.909 18.182 15.906 1.00 6.05 O ATOM 174 CB SER A 302 12.514 17.262 18.395 1.00 7.68 C ATOM 175 OG SER A 302 12.635 16.387 19.495 1.00 7.70 O ATOM 176 HG SER A 302 13.582 16.117 19.598 1.00 0.00 H ATOM 177 H SER A 302 10.470 15.902 17.155 1.00 0.00 H ATOM 178 N ILE A 303 10.747 19.893 17.371 1.00 5.01 N ATOM 179 CA ILE A 303 10.680 20.913 16.335 1.00 4.58 C ATOM 180 C ILE A 303 11.817 21.907 16.452 1.00 4.43 C ATOM 181 O ILE A 303 12.339 22.182 17.554 1.00 5.79 O ATOM 182 CB ILE A 303 9.348 21.697 16.338 1.00 4.72 C ATOM 183 CG1 ILE A 303 9.098 22.369 17.688 1.00 6.74 C ATOM 184 CG2 ILE A 303 8.194 20.783 15.946 1.00 6.85 C ATOM 185 CD1 ILE A 303 8.041 23.465 17.651 1.00 7.40 C ATOM 186 H ILE A 303 10.658 20.172 18.369 1.00 0.00 H ATOM 187 N THR A 304 12.210 22.438 15.302 1.00 6.59 N ATOM 188 CA THR A 304 13.203 23.491 15.237 1.00 5.71 C ATOM 189 C THR A 304 12.717 24.573 14.273 1.00 6.87 C ATOM 190 O THR A 304 11.658 24.438 13.667 1.00 11.11 O ATOM 191 CB THR A 304 14.575 22.907 14.827 1.00 6.47 C ATOM 192 OG1 THR A 304 15.604 23.885 15.016 1.00 10.01 O ATOM 193 CG2 THR A 304 14.564 22.441 13.383 1.00 8.99 C ATOM 194 HG1 THR A 304 16.476 23.500 14.750 1.00 0.00 H ATOM 195 H THR A 304 11.791 22.087 14.417 1.00 0.00 H ATOM 196 N GLY A 305 13.473 25.650 14.143 1.00 6.97 N ATOM 197 CA GLY A 305 13.094 26.715 13.235 1.00 6.54 C ATOM 198 C GLY A 305 12.124 27.704 13.842 1.00 5.86 C ATOM 199 O GLY A 305 12.002 27.816 15.062 1.00 9.20 O ATOM 200 H GLY A 305 14.349 25.734 14.698 1.00 0.00 H ATOM 201 N GLY A 306 11.449 28.449 12.979 1.00 5.79 N ATOM 202 CA GLY A 306 10.539 29.493 13.414 1.00 5.85 C ATOM 203 C GLY A 306 10.811 30.817 12.719 1.00 8.05 C ATOM 204 O GLY A 306 11.916 31.068 12.250 1.00 7.32 O ATOM 205 H GLY A 306 11.575 28.281 11.960 1.00 0.00 H ATOM 206 N LYS A 307 9.818 31.684 12.696 1.00 7.21 N ATOM 207 CA LYS A 307 9.880 32.917 11.923 1.00 7.49 C ATOM 208 C LYS A 307 11.073 33.792 12.238 1.00 11.37 C ATOM 209 O LYS A 307 11.638 34.418 11.371 1.00 11.55 O ATOM 210 CB LYS A 307 8.596 33.714 12.144 1.00 13.18 C ATOM 211 CG LYS A 307 8.471 34.943 11.286 1.00 16.76 C ATOM 212 CD LYS A 307 8.482 34.620 9.822 1.00 31.75 C ATOM 213 CE LYS A 307 8.276 35.918 8.997 1.00 39.18 C ATOM 214 NZ LYS A 307 8.809 35.916 7.617 1.00 43.14 N ATOM 215 HZ1 LYS A 307 9.836 35.756 7.644 1.00 0.00 H ATOM 216 HZ2 LYS A 307 8.353 35.157 7.072 1.00 0.00 H ATOM 217 HZ3 LYS A 307 8.611 36.833 7.169 1.00 0.00 H ATOM 218 H LYS A 307 8.961 31.481 13.249 1.00 0.00 H ATOM 219 N GLU A 308 11.466 33.835 13.498 1.00 9.41 N ATOM 220 CA GLU A 308 12.588 34.685 13.890 1.00 9.03 C ATOM 221 C GLU A 308 13.912 34.213 13.279 1.00 11.87 C ATOM 222 O GLU A 308 14.891 34.971 13.232 1.00 14.26 O ATOM 223 CB GLU A 308 12.672 34.813 15.421 1.00 13.64 C ATOM 224 CG GLU A 308 13.195 33.593 16.160 1.00 12.69 C ATOM 225 CD GLU A 308 12.109 32.604 16.603 1.00 12.78 C ATOM 226 OE1 GLU A 308 11.197 32.285 15.817 1.00 9.17 O ATOM 227 OE2 GLU A 308 12.192 32.120 17.752 1.00 14.41 O ATOM 228 H GLU A 308 10.975 33.262 14.214 1.00 0.00 H ATOM 229 N HIS A 309 13.930 32.981 12.779 1.00 11.13 N ATOM 230 CA HIS A 309 15.100 32.406 12.127 1.00 11.02 C ATOM 231 C HIS A 309 14.949 32.330 10.620 1.00 10.05 C ATOM 232 O HIS A 309 15.813 31.801 9.925 1.00 13.32 O ATOM 233 CB HIS A 309 15.355 31.015 12.683 1.00 11.84 C ATOM 234 CG HIS A 309 15.493 31.004 14.161 1.00 9.82 C ATOM 235 ND1 HIS A 309 16.500 31.685 14.810 1.00 11.80 N ATOM 236 CD2 HIS A 309 14.723 30.456 15.128 1.00 11.45 C ATOM 237 CE1 HIS A 309 16.358 31.536 16.113 1.00 9.35 C ATOM 238 NE2 HIS A 309 15.286 30.793 16.334 1.00 12.57 N ATOM 239 H HIS A 309 13.070 32.401 12.857 1.00 0.00 H ATOM 240 N GLY A 310 13.830 32.841 10.132 1.00 9.33 N ATOM 241 CA GLY A 310 13.563 32.858 8.705 1.00 10.80 C ATOM 242 C GLY A 310 13.261 31.501 8.098 1.00 10.46 C ATOM 243 O GLY A 310 13.418 31.310 6.895 1.00 14.22 O ATOM 244 H GLY A 310 13.126 33.239 10.786 1.00 0.00 H ATOM 245 N VAL A 311 12.828 30.549 8.918 1.00 10.44 N ATOM 246 CA VAL A 311 12.462 29.244 8.393 1.00 13.99 C ATOM 247 C VAL A 311 11.192 28.743 9.060 1.00 11.68 C ATOM 248 O VAL A 311 10.824 29.205 10.133 1.00 10.32 O ATOM 249 CB VAL A 311 13.588 28.216 8.585 1.00 16.68 C ATOM 250 CG1 VAL A 311 14.822 28.617 7.776 1.00 20.77 C ATOM 251 CG2 VAL A 311 13.932 28.075 10.051 1.00 12.75 C ATOM 252 H VAL A 311 12.751 30.738 9.938 1.00 0.00 H ATOM 253 N PRO A 312 10.500 27.803 8.413 1.00 10.45 N ATOM 254 CA PRO A 312 9.275 27.263 9.006 1.00 8.31 C ATOM 255 C PRO A 312 9.549 26.467 10.276 1.00 9.06 C ATOM 256 O PRO A 312 10.697 26.192 10.652 1.00 8.18 O ATOM 257 CB PRO A 312 8.731 26.328 7.917 1.00 13.89 C ATOM 258 CG PRO A 312 9.892 26.046 7.021 1.00 18.81 C ATOM 259 CD PRO A 312 10.787 27.237 7.082 1.00 15.04 C ATOM 260 N ILE A 313 8.471 26.101 10.949 1.00 8.51 N ATOM 261 CA ILE A 313 8.553 25.123 12.014 1.00 7.27 C ATOM 262 C ILE A 313 8.826 23.769 11.369 1.00 7.56 C ATOM 263 O ILE A 313 8.013 23.274 10.573 1.00 7.28 O ATOM 264 CB ILE A 313 7.246 25.090 12.805 1.00 6.93 C ATOM 265 CG1 ILE A 313 6.947 26.476 13.393 1.00 6.48 C ATOM 266 CG2 ILE A 313 7.300 24.011 13.881 1.00 8.87 C ATOM 267 CD1 ILE A 313 8.038 27.018 14.337 1.00 8.25 C ATOM 268 H ILE A 313 7.551 26.522 10.710 1.00 0.00 H ATOM 269 N LEU A 314 9.977 23.181 11.686 1.00 5.22 N ATOM 270 CA LEU A 314 10.432 21.943 11.056 1.00 6.68 C ATOM 271 C LEU A 314 10.515 20.800 12.065 1.00 6.18 C ATOM 272 O LEU A 314 10.987 20.975 13.198 1.00 6.72 O ATOM 273 CB LEU A 314 11.807 22.151 10.425 1.00 8.49 C ATOM 274 CG LEU A 314 11.826 23.118 9.247 1.00 10.01 C ATOM 275 CD1 LEU A 314 13.258 23.600 9.000 1.00 16.24 C ATOM 276 CD2 LEU A 314 11.259 22.448 8.007 1.00 11.00 C ATOM 277 H LEU A 314 10.578 23.621 12.412 1.00 0.00 H ATOM 278 N ILE A 315 10.044 19.627 11.662 1.00 6.23 N ATOM 279 CA ILE A 315 10.216 18.434 12.487 1.00 6.67 C ATOM 280 C ILE A 315 11.646 17.942 12.370 1.00 6.87 C ATOM 281 O ILE A 315 12.118 17.633 11.276 1.00 8.93 O ATOM 282 CB ILE A 315 9.240 17.308 12.088 1.00 6.46 C ATOM 283 CG1 ILE A 315 7.800 17.807 12.222 1.00 7.59 C ATOM 284 CG2 ILE A 315 9.480 16.067 12.944 1.00 7.27 C ATOM 285 CD1 ILE A 315 6.750 16.757 11.890 1.00 7.10 C ATOM 286 H ILE A 315 9.548 19.556 10.751 1.00 0.00 H ATOM 287 N SER A 316 12.345 17.895 13.493 1.00 6.61 N ATOM 288 CA SER A 316 13.705 17.375 13.488 1.00 6.82 C ATOM 289 C SER A 316 13.819 15.984 14.092 1.00 7.26 C ATOM 290 O SER A 316 14.812 15.302 13.866 1.00 8.24 O ATOM 291 CB SER A 316 14.634 18.343 14.215 1.00 8.30 C ATOM 292 OG SER A 316 14.234 18.478 15.565 1.00 10.52 O ATOM 293 HG SER A 316 14.843 19.107 16.027 1.00 0.00 H ATOM 294 H SER A 316 11.922 18.231 14.382 1.00 0.00 H ATOM 295 N GLU A 317 12.813 15.556 14.852 1.00 5.69 N ATOM 296 CA GLU A 317 12.801 14.210 15.424 1.00 7.00 C ATOM 297 C GLU A 317 11.380 13.706 15.512 1.00 6.50 C ATOM 298 O GLU A 317 10.457 14.478 15.787 1.00 6.34 O ATOM 299 CB GLU A 317 13.393 14.169 16.834 1.00 8.92 C ATOM 300 CG GLU A 317 14.796 14.680 16.968 1.00 11.71 C ATOM 301 CD GLU A 317 15.358 14.403 18.345 1.00 17.98 C ATOM 302 OE1 GLU A 317 14.733 14.826 19.334 1.00 20.05 O ATOM 303 OE2 GLU A 317 16.408 13.736 18.444 1.00 20.02 O ATOM 304 H GLU A 317 12.015 16.195 15.044 1.00 0.00 H ATOM 305 N ILE A 318 11.213 12.414 15.261 1.00 7.55 N ATOM 306 CA ILE A 318 9.985 11.690 15.561 1.00 6.76 C ATOM 307 C ILE A 318 10.357 10.646 16.616 1.00 10.09 C ATOM 308 O ILE A 318 11.133 9.729 16.340 1.00 11.77 O ATOM 309 CB ILE A 318 9.436 11.015 14.302 1.00 7.28 C ATOM 310 CG1 ILE A 318 9.076 12.073 13.249 1.00 9.96 C ATOM 311 CG2 ILE A 318 8.234 10.143 14.633 1.00 9.80 C ATOM 312 CD1 ILE A 318 7.808 12.854 13.529 1.00 11.42 C ATOM 313 H ILE A 318 12.000 11.891 14.827 1.00 0.00 H ATOM 314 N HIS A 319 9.827 10.779 17.819 1.00 8.37 N ATOM 315 CA HIS A 319 10.261 9.898 18.887 1.00 8.12 C ATOM 316 C HIS A 319 9.533 8.566 18.801 1.00 6.89 C ATOM 317 O HIS A 319 8.311 8.529 18.759 1.00 6.77 O ATOM 318 CB HIS A 319 10.069 10.590 20.229 1.00 10.87 C ATOM 319 CG HIS A 319 10.644 11.972 20.265 1.00 14.08 C ATOM 320 ND1 HIS A 319 11.982 12.228 20.049 1.00 20.04 N ATOM 321 CD2 HIS A 319 10.058 13.174 20.471 1.00 17.07 C ATOM 322 CE1 HIS A 319 12.196 13.530 20.133 1.00 15.03 C ATOM 323 NE2 HIS A 319 11.044 14.125 20.388 1.00 10.65 N ATOM 324 H HIS A 319 9.107 11.507 17.998 1.00 0.00 H ATOM 325 N PRO A 320 10.295 7.463 18.748 1.00 8.35 N ATOM 326 CA PRO A 320 9.720 6.147 18.468 1.00 8.24 C ATOM 327 C PRO A 320 8.636 5.780 19.458 1.00 7.50 C ATOM 328 O PRO A 320 8.802 5.946 20.672 1.00 8.91 O ATOM 329 CB PRO A 320 10.926 5.197 18.572 1.00 11.14 C ATOM 330 CG PRO A 320 11.976 5.970 19.312 1.00 13.48 C ATOM 331 CD PRO A 320 11.745 7.408 18.986 1.00 13.08 C ATOM 332 N GLY A 321 7.519 5.298 18.927 1.00 7.40 N ATOM 333 CA GLY A 321 6.438 4.785 19.745 1.00 7.21 C ATOM 334 C GLY A 321 5.494 5.820 20.323 1.00 8.52 C ATOM 335 O GLY A 321 4.487 5.454 20.935 1.00 10.01 O ATOM 336 H GLY A 321 7.416 5.288 17.892 1.00 0.00 H ATOM 337 N GLN A 322 5.815 7.097 20.140 1.00 5.66 N ATOM 338 CA GLN A 322 4.943 8.175 20.615 1.00 4.03 C ATOM 339 C GLN A 322 3.936 8.584 19.523 1.00 5.72 C ATOM 340 O GLN A 322 3.954 8.024 18.428 1.00 6.00 O ATOM 341 CB GLN A 322 5.785 9.335 21.143 1.00 6.22 C ATOM 342 CG GLN A 322 6.608 8.917 22.356 1.00 7.30 C ATOM 343 CD GLN A 322 5.737 8.357 23.470 1.00 13.32 C ATOM 344 OE1 GLN A 322 4.817 9.023 23.942 1.00 13.24 O ATOM 345 NE2 GLN A 322 6.025 7.128 23.891 1.00 15.37 N ATOM 346 HE22 GLN A 322 6.813 6.603 23.462 1.00 0.00 H ATOM 347 HE21 GLN A 322 5.462 6.693 24.649 1.00 0.00 H ATOM 348 H GLN A 322 6.701 7.335 19.651 1.00 0.00 H ATOM 349 N PRO A 323 3.010 9.507 19.827 1.00 4.55 N ATOM 350 CA PRO A 323 1.882 9.667 18.894 1.00 6.08 C ATOM 351 C PRO A 323 2.235 10.025 17.447 1.00 4.52 C ATOM 352 O PRO A 323 1.580 9.508 16.539 1.00 5.50 O ATOM 353 CB PRO A 323 1.047 10.767 19.554 1.00 4.75 C ATOM 354 CG PRO A 323 1.273 10.514 21.027 1.00 6.13 C ATOM 355 CD PRO A 323 2.731 10.128 21.137 1.00 6.85 C ATOM 356 N ALA A 324 3.221 10.879 17.206 1.00 4.38 N ATOM 357 CA ALA A 324 3.549 11.226 15.820 1.00 6.42 C ATOM 358 C ALA A 324 4.059 10.004 15.064 1.00 5.39 C ATOM 359 O ALA A 324 3.685 9.765 13.922 1.00 7.00 O ATOM 360 CB ALA A 324 4.563 12.358 15.761 1.00 5.88 C ATOM 361 H ALA A 324 3.756 11.298 17.993 1.00 0.00 H ATOM 362 N ASP A 325 4.885 9.195 15.711 1.00 5.24 N ATOM 363 CA ASP A 325 5.367 7.974 15.083 1.00 5.62 C ATOM 364 C ASP A 325 4.186 7.053 14.770 1.00 5.01 C ATOM 365 O ASP A 325 4.072 6.519 13.662 1.00 6.65 O ATOM 366 CB ASP A 325 6.340 7.271 16.031 1.00 5.50 C ATOM 367 CG ASP A 325 7.017 6.077 15.399 1.00 7.68 C ATOM 368 OD1 ASP A 325 7.224 6.077 14.175 1.00 10.22 O ATOM 369 OD2 ASP A 325 7.343 5.130 16.145 1.00 11.03 O ATOM 370 H ASP A 325 5.191 9.435 16.676 1.00 0.00 H ATOM 371 N ARG A 326 3.312 6.858 15.754 1.00 4.27 N ATOM 372 CA ARG A 326 2.194 5.933 15.600 1.00 6.10 C ATOM 373 C ARG A 326 1.216 6.378 14.512 1.00 6.48 C ATOM 374 O ARG A 326 0.592 5.527 13.862 1.00 5.92 O ATOM 375 CB ARG A 326 1.441 5.778 16.928 1.00 7.60 C ATOM 376 CG ARG A 326 2.315 5.337 18.090 1.00 5.70 C ATOM 377 CD ARG A 326 1.510 4.808 19.286 1.00 8.22 C ATOM 378 NE ARG A 326 0.538 5.742 19.854 1.00 9.68 N ATOM 379 CZ ARG A 326 0.720 6.424 20.983 1.00 8.12 C ATOM 380 NH1 ARG A 326 -0.248 7.215 21.438 1.00 9.12 N ATOM 381 NH2 ARG A 326 1.864 6.329 21.648 1.00 8.75 N ATOM 382 HE ARG A 326 -0.356 5.883 19.341 1.00 0.00 H ATOM 383 HH12 ARG A 326 -0.111 7.750 22.319 1.00 0.00 H ATOM 384 HH11 ARG A 326 -1.142 7.298 20.912 1.00 0.00 H ATOM 385 HH22 ARG A 326 1.999 6.865 22.529 1.00 0.00 H ATOM 386 HH21 ARG A 326 2.626 5.719 21.288 1.00 0.00 H ATOM 387 H ARG A 326 3.428 7.374 16.649 1.00 0.00 H ATOM 388 N CYS A 327 1.071 7.690 14.299 1.00 6.18 N ATOM 389 CA CYS A 327 0.129 8.169 13.287 1.00 7.77 C ATOM 390 C CYS A 327 0.578 7.835 11.876 1.00 8.68 C ATOM 391 O CYS A 327 -0.252 7.738 10.982 1.00 8.50 O ATOM 392 CB CYS A 327 -0.189 9.673 13.419 1.00 8.75 C ATOM 393 SG CYS A 327 0.883 10.851 12.537 1.00 7.91 S ATOM 394 H CYS A 327 1.628 8.371 14.853 1.00 0.00 H ATOM 395 N GLY A 328 1.885 7.682 11.677 1.00 7.02 N ATOM 396 CA GLY A 328 2.421 7.182 10.415 1.00 8.16 C ATOM 397 C GLY A 328 2.706 8.178 9.295 1.00 7.73 C ATOM 398 O GLY A 328 3.401 7.848 8.331 1.00 9.28 O ATOM 399 H GLY A 328 2.544 7.926 12.444 1.00 0.00 H ATOM 400 N GLY A 329 2.161 9.383 9.417 1.00 7.52 N ATOM 401 CA GLY A 329 2.218 10.364 8.344 1.00 6.30 C ATOM 402 C GLY A 329 3.082 11.588 8.557 1.00 8.98 C ATOM 403 O GLY A 329 3.049 12.507 7.742 1.00 8.14 O ATOM 404 H GLY A 329 1.680 9.632 10.305 1.00 0.00 H ATOM 405 N LEU A 330 3.832 11.617 9.653 1.00 6.83 N ATOM 406 CA LEU A 330 4.691 12.755 9.978 1.00 5.12 C ATOM 407 C LEU A 330 6.123 12.279 9.986 1.00 8.03 C ATOM 408 O LEU A 330 6.426 11.229 10.557 1.00 11.68 O ATOM 409 CB LEU A 330 4.352 13.323 11.358 1.00 6.91 C ATOM 410 CG LEU A 330 2.980 13.964 11.509 1.00 6.16 C ATOM 411 CD1 LEU A 330 2.787 14.421 12.946 1.00 9.13 C ATOM 412 CD2 LEU A 330 2.817 15.133 10.552 1.00 9.71 C ATOM 413 H LEU A 330 3.807 10.804 10.301 1.00 0.00 H ATOM 414 N HIS A 331 7.017 13.076 9.409 1.00 6.53 N ATOM 415 CA HIS A 331 8.391 12.622 9.220 1.00 6.81 C ATOM 416 C HIS A 331 9.406 13.731 9.434 1.00 7.40 C ATOM 417 O HIS A 331 9.104 14.915 9.263 1.00 7.01 O ATOM 418 CB HIS A 331 8.546 12.023 7.831 1.00 9.86 C ATOM 419 CG HIS A 331 7.479 11.029 7.500 1.00 9.40 C ATOM 420 ND1 HIS A 331 7.395 9.804 8.120 1.00 13.91 N ATOM 421 CD2 HIS A 331 6.441 11.095 6.637 1.00 10.89 C ATOM 422 CE1 HIS A 331 6.351 9.145 7.642 1.00 13.18 C ATOM 423 NE2 HIS A 331 5.759 9.905 6.741 1.00 14.88 N ATOM 424 H HIS A 331 6.736 14.026 9.091 1.00 0.00 H ATOM 425 N VAL A 332 10.614 13.330 9.815 1.00 7.85 N ATOM 426 CA VAL A 332 11.695 14.285 9.946 1.00 6.98 C ATOM 427 C VAL A 332 11.868 15.043 8.628 1.00 9.60 C ATOM 428 O VAL A 332 11.881 14.451 7.540 1.00 8.80 O ATOM 429 CB VAL A 332 13.001 13.583 10.363 1.00 6.89 C ATOM 430 CG1 VAL A 332 14.165 14.549 10.283 1.00 9.82 C ATOM 431 CG2 VAL A 332 12.860 13.032 11.767 1.00 8.88 C ATOM 432 H VAL A 332 10.784 12.325 10.020 1.00 0.00 H ATOM 433 N GLY A 333 11.964 16.359 8.728 1.00 6.99 N ATOM 434 CA GLY A 333 12.105 17.208 7.559 1.00 6.50 C ATOM 435 C GLY A 333 10.802 17.866 7.146 1.00 6.98 C ATOM 436 O GLY A 333 10.813 18.817 6.366 1.00 9.02 O ATOM 437 H GLY A 333 11.938 16.797 9.671 1.00 0.00 H ATOM 438 N ASP A 334 9.675 17.346 7.633 1.00 5.61 N ATOM 439 CA ASP A 334 8.393 18.002 7.385 1.00 7.42 C ATOM 440 C ASP A 334 8.334 19.398 7.992 1.00 7.50 C ATOM 441 O ASP A 334 8.767 19.621 9.125 1.00 7.27 O ATOM 442 CB ASP A 334 7.239 17.175 7.958 1.00 7.16 C ATOM 443 CG ASP A 334 6.883 15.988 7.096 1.00 7.75 C ATOM 444 OD1 ASP A 334 7.260 15.952 5.895 1.00 9.30 O ATOM 445 OD2 ASP A 334 6.190 15.096 7.618 1.00 7.00 O ATOM 446 H ASP A 334 9.708 16.470 8.192 1.00 0.00 H ATOM 447 N ALA A 335 7.815 20.343 7.223 1.00 6.53 N ATOM 448 CA ALA A 335 7.460 21.642 7.764 1.00 4.80 C ATOM 449 C ALA A 335 6.027 21.550 8.232 1.00 7.97 C ATOM 450 O ALA A 335 5.173 21.006 7.524 1.00 7.19 O ATOM 451 CB ALA A 335 7.620 22.742 6.717 1.00 6.48 C ATOM 452 H ALA A 335 7.659 20.151 6.213 1.00 0.00 H ATOM 453 N ILE A 336 5.765 22.039 9.440 1.00 5.86 N ATOM 454 CA ILE A 336 4.395 22.092 9.942 1.00 7.02 C ATOM 455 C ILE A 336 3.774 23.434 9.549 1.00 8.01 C ATOM 456 O ILE A 336 4.121 24.485 10.094 1.00 7.69 O ATOM 457 CB ILE A 336 4.300 21.882 11.468 1.00 5.14 C ATOM 458 CG1 ILE A 336 5.039 20.606 11.894 1.00 5.37 C ATOM 459 CG2 ILE A 336 2.835 21.818 11.855 1.00 8.86 C ATOM 460 CD1 ILE A 336 5.128 20.430 13.417 1.00 8.04 C ATOM 461 H ILE A 336 6.544 22.388 10.034 1.00 0.00 H ATOM 462 N LEU A 337 2.881 23.388 8.570 1.00 6.94 N ATOM 463 CA LEU A 337 2.266 24.592 8.030 1.00 6.46 C ATOM 464 C LEU A 337 1.097 25.057 8.871 1.00 6.71 C ATOM 465 O LEU A 337 0.840 26.252 8.970 1.00 8.40 O ATOM 466 CB LEU A 337 1.794 24.367 6.587 1.00 6.91 C ATOM 467 CG LEU A 337 2.842 23.802 5.632 1.00 7.91 C ATOM 468 CD1 LEU A 337 2.204 23.538 4.274 1.00 12.15 C ATOM 469 CD2 LEU A 337 4.010 24.756 5.514 1.00 11.27 C ATOM 470 H LEU A 337 2.612 22.464 8.176 1.00 0.00 H ATOM 471 N ALA A 338 0.376 24.112 9.466 1.00 6.32 N ATOM 472 CA ALA A 338 -0.783 24.455 10.274 1.00 7.02 C ATOM 473 C ALA A 338 -1.134 23.283 11.178 1.00 7.24 C ATOM 474 O ALA A 338 -0.783 22.132 10.891 1.00 7.06 O ATOM 475 CB ALA A 338 -1.971 24.816 9.376 1.00 7.44 C ATOM 476 H ALA A 338 0.645 23.114 9.352 1.00 0.00 H ATOM 477 N VAL A 339 -1.789 23.580 12.291 1.00 6.89 N ATOM 478 CA VAL A 339 -2.310 22.525 13.142 1.00 6.59 C ATOM 479 C VAL A 339 -3.714 22.918 13.545 1.00 7.36 C ATOM 480 O VAL A 339 -3.947 24.029 14.008 1.00 7.85 O ATOM 481 CB VAL A 339 -1.406 22.266 14.365 1.00 4.75 C ATOM 482 CG1 VAL A 339 -1.316 23.498 15.263 1.00 6.82 C ATOM 483 CG2 VAL A 339 -1.889 21.045 15.140 1.00 8.05 C ATOM 484 H VAL A 339 -1.931 24.575 12.557 1.00 0.00 H ATOM 485 N ASN A 340 -4.659 22.008 13.346 1.00 7.51 N ATOM 486 CA ASN A 340 -6.051 22.303 13.646 1.00 8.11 C ATOM 487 C ASN A 340 -6.507 23.650 13.084 1.00 10.34 C ATOM 488 O ASN A 340 -7.231 24.391 13.747 1.00 11.55 O ATOM 489 CB ASN A 340 -6.305 22.202 15.159 1.00 8.81 C ATOM 490 CG ASN A 340 -6.384 20.767 15.633 1.00 9.29 C ATOM 491 OD1 ASN A 340 -6.662 19.861 14.847 1.00 8.86 O ATOM 492 ND2 ASN A 340 -6.142 20.548 16.922 1.00 9.59 N ATOM 493 HD22 ASN A 340 -5.911 21.344 17.550 1.00 0.00 H ATOM 494 HD21 ASN A 340 -6.184 19.581 17.302 1.00 0.00 H ATOM 495 H ASN A 340 -4.401 21.073 12.971 1.00 0.00 H ATOM 496 N GLY A 341 -6.068 23.963 11.865 1.00 11.54 N ATOM 497 CA GLY A 341 -6.488 25.181 11.187 1.00 14.40 C ATOM 498 C GLY A 341 -5.745 26.439 11.611 1.00 13.43 C ATOM 499 O GLY A 341 -5.971 27.515 11.050 1.00 18.63 O ATOM 500 H GLY A 341 -5.407 23.319 11.385 1.00 0.00 H ATOM 501 N VAL A 342 -4.868 26.318 12.603 1.00 9.85 N ATOM 502 CA VAL A 342 -4.051 27.442 13.033 1.00 9.39 C ATOM 503 C VAL A 342 -2.784 27.491 12.187 1.00 8.64 C ATOM 504 O VAL A 342 -1.987 26.555 12.198 1.00 8.70 O ATOM 505 CB VAL A 342 -3.671 27.342 14.523 1.00 9.67 C ATOM 506 CG1 VAL A 342 -2.857 28.554 14.942 1.00 10.46 C ATOM 507 CG2 VAL A 342 -4.918 27.229 15.393 1.00 10.39 C ATOM 508 H VAL A 342 -4.764 25.400 13.082 1.00 0.00 H ATOM 509 N ASN A 343 -2.608 28.583 11.448 1.00 9.00 N ATOM 510 CA ASN A 343 -1.449 28.775 10.593 1.00 9.10 C ATOM 511 C ASN A 343 -0.181 28.886 11.423 1.00 8.28 C ATOM 512 O ASN A 343 -0.115 29.661 12.376 1.00 10.52 O ATOM 513 CB ASN A 343 -1.629 30.047 9.756 1.00 9.93 C ATOM 514 CG ASN A 343 -0.549 30.220 8.713 1.00 12.44 C ATOM 515 OD1 ASN A 343 0.170 29.282 8.382 1.00 14.54 O ATOM 516 ND2 ASN A 343 -0.439 31.429 8.173 1.00 16.79 N ATOM 517 HD22 ASN A 343 -1.069 32.196 8.483 1.00 0.00 H ATOM 518 HD21 ASN A 343 0.277 31.608 7.440 1.00 0.00 H ATOM 519 H ASN A 343 -3.330 29.331 11.484 1.00 0.00 H ATOM 520 N LEU A 344 0.821 28.095 11.070 1.00 7.07 N ATOM 521 CA LEU A 344 2.105 28.153 11.744 1.00 8.53 C ATOM 522 C LEU A 344 3.209 28.644 10.824 1.00 9.94 C ATOM 523 O LEU A 344 4.367 28.668 11.206 1.00 10.71 O ATOM 524 CB LEU A 344 2.479 26.777 12.297 1.00 7.80 C ATOM 525 CG LEU A 344 1.570 26.211 13.393 1.00 7.05 C ATOM 526 CD1 LEU A 344 2.011 24.809 13.793 1.00 10.67 C ATOM 527 CD2 LEU A 344 1.545 27.132 14.610 1.00 11.54 C ATOM 528 H LEU A 344 0.685 27.418 10.293 1.00 0.00 H ATOM 529 N ARG A 345 2.848 29.026 9.604 1.00 9.32 N ATOM 530 CA ARG A 345 3.843 29.450 8.622 1.00 9.69 C ATOM 531 C ARG A 345 4.657 30.667 9.073 1.00 10.90 C ATOM 532 O ARG A 345 5.836 30.772 8.754 1.00 16.85 O ATOM 533 CB ARG A 345 3.180 29.732 7.271 1.00 11.21 C ATOM 534 CG ARG A 345 2.594 28.509 6.576 1.00 12.53 C ATOM 535 CD ARG A 345 1.623 28.960 5.486 1.00 12.58 C ATOM 536 NE ARG A 345 1.006 27.863 4.745 1.00 10.20 N ATOM 537 CZ ARG A 345 -0.081 27.202 5.138 1.00 13.00 C ATOM 538 NH1 ARG A 345 -0.670 27.500 6.290 1.00 10.17 N ATOM 539 NH2 ARG A 345 -0.575 26.225 4.383 1.00 15.61 N ATOM 540 HE ARG A 345 1.447 27.578 3.847 1.00 0.00 H ATOM 541 HH12 ARG A 345 -1.519 26.979 6.590 1.00 0.00 H ATOM 542 HH11 ARG A 345 -0.283 28.254 6.892 1.00 0.00 H ATOM 543 HH22 ARG A 345 -1.424 25.709 4.690 1.00 0.00 H ATOM 544 HH21 ARG A 345 -0.112 25.977 3.485 1.00 0.00 H ATOM 545 H ARG A 345 1.841 29.023 9.344 1.00 0.00 H ATOM 546 N ASP A 346 4.032 31.575 9.817 1.00 9.81 N ATOM 547 CA ASP A 346 4.677 32.835 10.193 1.00 11.59 C ATOM 548 C ASP A 346 4.881 32.941 11.701 1.00 11.14 C ATOM 549 O ASP A 346 4.983 34.037 12.255 1.00 16.44 O ATOM 550 CB ASP A 346 3.837 34.019 9.703 1.00 20.24 C ATOM 551 CG ASP A 346 4.664 35.271 9.476 1.00 37.42 C ATOM 552 OD1 ASP A 346 5.808 35.147 8.989 1.00 43.00 O ATOM 553 OD2 ASP A 346 4.168 36.377 9.782 1.00 39.67 O ATOM 554 H ASP A 346 3.062 31.386 10.140 1.00 0.00 H ATOM 555 N THR A 347 4.959 31.796 12.367 1.00 9.15 N ATOM 556 CA THR A 347 5.012 31.785 13.815 1.00 9.11 C ATOM 557 C THR A 347 6.447 31.655 14.309 1.00 6.77 C ATOM 558 O THR A 347 7.256 30.904 13.735 1.00 8.05 O ATOM 559 CB THR A 347 4.127 30.660 14.385 1.00 14.75 C ATOM 560 OG1 THR A 347 4.729 29.383 14.130 1.00 20.24 O ATOM 561 CG2 THR A 347 2.769 30.711 13.702 1.00 15.51 C ATOM 562 HG1 THR A 347 4.829 29.256 13.153 1.00 0.00 H ATOM 563 H THR A 347 4.982 30.897 11.844 1.00 0.00 H ATOM 564 N LYS A 348 6.759 32.394 15.370 1.00 8.41 N ATOM 565 CA LYS A 348 8.027 32.240 16.069 1.00 6.88 C ATOM 566 C LYS A 348 8.065 30.904 16.796 1.00 7.46 C ATOM 567 O LYS A 348 7.023 30.297 17.087 1.00 6.20 O ATOM 568 CB LYS A 348 8.251 33.378 17.065 1.00 10.13 C ATOM 569 CG LYS A 348 8.294 34.759 16.422 1.00 15.33 C ATOM 570 CD LYS A 348 8.452 35.829 17.496 1.00 18.65 C ATOM 571 CE LYS A 348 7.982 37.182 17.015 1.00 29.43 C ATOM 572 NZ LYS A 348 8.179 38.220 18.067 1.00 33.33 N ATOM 573 HZ1 LYS A 348 7.636 37.960 18.915 1.00 0.00 H ATOM 574 HZ2 LYS A 348 9.189 38.282 18.306 1.00 0.00 H ATOM 575 HZ3 LYS A 348 7.848 39.140 17.711 1.00 0.00 H ATOM 576 H LYS A 348 6.078 33.102 15.710 1.00 0.00 H ATOM 577 N HIS A 349 9.273 30.440 17.086 1.00 6.61 N ATOM 578 CA HIS A 349 9.470 29.119 17.673 1.00 5.55 C ATOM 579 C HIS A 349 8.601 28.873 18.905 1.00 6.21 C ATOM 580 O HIS A 349 7.877 27.882 18.972 1.00 6.52 O ATOM 581 CB HIS A 349 10.939 28.914 18.037 1.00 7.03 C ATOM 582 CG HIS A 349 11.236 27.542 18.546 1.00 6.55 C ATOM 583 ND1 HIS A 349 11.559 26.494 17.708 1.00 6.82 N ATOM 584 CD2 HIS A 349 11.221 27.030 19.799 1.00 5.45 C ATOM 585 CE1 HIS A 349 11.767 25.406 18.426 1.00 6.35 C ATOM 586 NE2 HIS A 349 11.565 25.703 19.699 1.00 7.54 N ATOM 587 H HIS A 349 10.103 31.035 16.889 1.00 0.00 H ATOM 588 N LYS A 350 8.667 29.774 19.882 1.00 5.95 N ATOM 589 CA LYS A 350 7.944 29.567 21.135 1.00 5.64 C ATOM 590 C LYS A 350 6.441 29.745 20.978 1.00 5.68 C ATOM 591 O LYS A 350 5.661 29.110 21.684 1.00 6.10 O ATOM 592 CB LYS A 350 8.493 30.475 22.241 1.00 6.50 C ATOM 593 CG LYS A 350 9.908 30.098 22.679 1.00 7.07 C ATOM 594 CD LYS A 350 10.394 30.944 23.858 1.00 8.88 C ATOM 595 CE LYS A 350 9.759 30.480 25.155 1.00 13.26 C ATOM 596 NZ LYS A 350 10.118 31.361 26.308 1.00 13.36 N ATOM 597 HZ1 LYS A 350 11.150 31.360 26.435 1.00 0.00 H ATOM 598 HZ2 LYS A 350 9.792 32.330 26.117 1.00 0.00 H ATOM 599 HZ3 LYS A 350 9.661 31.004 27.171 1.00 0.00 H ATOM 600 H LYS A 350 9.238 30.633 19.753 1.00 0.00 H ATOM 601 N GLU A 351 6.035 30.596 20.041 1.00 6.53 N ATOM 602 CA GLU A 351 4.622 30.696 19.693 1.00 6.73 C ATOM 603 C GLU A 351 4.111 29.344 19.216 1.00 5.85 C ATOM 604 O GLU A 351 3.064 28.874 19.667 1.00 6.70 O ATOM 605 CB GLU A 351 4.406 31.769 18.619 1.00 5.51 C ATOM 606 CG GLU A 351 4.856 33.149 19.063 1.00 6.67 C ATOM 607 CD GLU A 351 4.733 34.182 17.965 1.00 8.21 C ATOM 608 OE1 GLU A 351 4.645 33.793 16.778 1.00 8.21 O ATOM 609 OE2 GLU A 351 4.729 35.387 18.281 1.00 11.38 O ATOM 610 H GLU A 351 6.730 31.195 19.552 1.00 0.00 H ATOM 611 N ALA A 352 4.872 28.696 18.340 1.00 5.88 N ATOM 612 CA ALA A 352 4.503 27.382 17.813 1.00 6.02 C ATOM 613 C ALA A 352 4.467 26.330 18.909 1.00 5.06 C ATOM 614 O ALA A 352 3.597 25.467 18.900 1.00 5.36 O ATOM 615 CB ALA A 352 5.460 26.947 16.713 1.00 7.56 C ATOM 616 H ALA A 352 5.758 29.137 18.019 1.00 0.00 H ATOM 617 N VAL A 353 5.401 26.393 19.857 1.00 7.01 N ATOM 618 CA VAL A 353 5.383 25.443 20.967 1.00 8.43 C ATOM 619 C VAL A 353 4.090 25.568 21.753 1.00 5.81 C ATOM 620 O VAL A 353 3.426 24.573 22.036 1.00 6.19 O ATOM 621 CB VAL A 353 6.577 25.627 21.924 1.00 6.50 C ATOM 622 CG1 VAL A 353 6.362 24.822 23.194 1.00 6.19 C ATOM 623 CG2 VAL A 353 7.852 25.167 21.244 1.00 7.52 C ATOM 624 H VAL A 353 6.144 27.119 19.807 1.00 0.00 H ATOM 625 N THR A 354 3.714 26.798 22.090 1.00 6.02 N ATOM 626 CA THR A 354 2.479 27.028 22.836 1.00 6.68 C ATOM 627 C THR A 354 1.266 26.500 22.068 1.00 6.30 C ATOM 628 O THR A 354 0.434 25.755 22.609 1.00 6.12 O ATOM 629 CB THR A 354 2.324 28.527 23.179 1.00 8.26 C ATOM 630 OG1 THR A 354 3.283 28.887 24.179 1.00 8.19 O ATOM 631 CG2 THR A 354 0.929 28.850 23.700 1.00 8.54 C ATOM 632 HG1 THR A 354 4.196 28.718 23.835 1.00 0.00 H ATOM 633 H THR A 354 4.307 27.608 21.819 1.00 0.00 H ATOM 634 N ILE A 355 1.179 26.854 20.790 1.00 5.72 N ATOM 635 CA ILE A 355 0.050 26.421 19.975 1.00 6.16 C ATOM 636 C ILE A 355 0.009 24.906 19.851 1.00 6.34 C ATOM 637 O ILE A 355 -1.031 24.284 20.083 1.00 6.06 O ATOM 638 CB ILE A 355 0.088 27.061 18.581 1.00 7.17 C ATOM 639 CG1 ILE A 355 -0.068 28.574 18.711 1.00 5.70 C ATOM 640 CG2 ILE A 355 -1.006 26.486 17.679 1.00 7.09 C ATOM 641 CD1 ILE A 355 0.354 29.321 17.462 1.00 7.56 C ATOM 642 H ILE A 355 1.923 27.445 20.367 1.00 0.00 H ATOM 643 N LEU A 356 1.140 24.295 19.508 1.00 5.70 N ATOM 644 CA LEU A 356 1.160 22.854 19.313 1.00 5.68 C ATOM 645 C LEU A 356 0.838 22.070 20.589 1.00 4.60 C ATOM 646 O LEU A 356 0.078 21.100 20.547 1.00 4.67 O ATOM 647 CB LEU A 356 2.501 22.413 18.725 1.00 5.61 C ATOM 648 CG LEU A 356 2.622 22.730 17.231 1.00 4.17 C ATOM 649 CD1 LEU A 356 4.088 22.891 16.839 1.00 6.83 C ATOM 650 CD2 LEU A 356 1.948 21.656 16.389 1.00 6.77 C ATOM 651 H LEU A 356 2.011 24.849 19.379 1.00 0.00 H ATOM 652 N SER A 357 1.390 22.498 21.721 1.00 5.07 N ATOM 653 CA SER A 357 1.186 21.765 22.971 1.00 6.34 C ATOM 654 C SER A 357 -0.220 21.938 23.523 1.00 5.88 C ATOM 655 O SER A 357 -0.649 21.155 24.370 1.00 8.35 O ATOM 656 CB SER A 357 2.208 22.199 24.032 1.00 5.85 C ATOM 657 OG SER A 357 3.499 21.732 23.682 1.00 6.23 O ATOM 658 HG SER A 357 3.487 20.744 23.626 1.00 0.00 H ATOM 659 H SER A 357 1.971 23.360 21.718 1.00 0.00 H ATOM 660 N GLN A 358 -0.940 22.948 23.046 1.00 6.52 N ATOM 661 CA GLN A 358 -2.325 23.175 23.456 1.00 7.78 C ATOM 662 C GLN A 358 -3.280 22.167 22.829 1.00 5.77 C ATOM 663 O GLN A 358 -4.376 21.955 23.352 1.00 7.71 O ATOM 664 CB GLN A 358 -2.794 24.586 23.067 1.00 7.07 C ATOM 665 CG GLN A 358 -2.426 25.649 24.077 1.00 10.21 C ATOM 666 CD GLN A 358 -2.878 27.028 23.661 1.00 10.47 C ATOM 667 OE1 GLN A 358 -3.542 27.196 22.641 1.00 20.78 O ATOM 668 NE2 GLN A 358 -2.515 28.033 24.452 1.00 10.17 N ATOM 669 HE22 GLN A 358 -1.953 27.845 25.306 1.00 0.00 H ATOM 670 HE21 GLN A 358 -2.794 29.007 24.216 1.00 0.00 H ATOM 671 H GLN A 358 -0.505 23.597 22.360 1.00 0.00 H ATOM 672 N GLN A 359 -2.892 21.546 21.715 1.00 5.18 N ATOM 673 CA GLN A 359 -3.841 20.700 20.998 1.00 5.43 C ATOM 674 C GLN A 359 -4.025 19.362 21.701 1.00 4.87 C ATOM 675 O GLN A 359 -3.065 18.801 22.240 1.00 7.22 O ATOM 676 CB GLN A 359 -3.385 20.507 19.548 1.00 6.57 C ATOM 677 CG GLN A 359 -3.013 21.806 18.820 1.00 5.95 C ATOM 678 CD GLN A 359 -4.104 22.864 18.900 1.00 7.37 C ATOM 679 OE1 GLN A 359 -5.282 22.587 18.654 1.00 8.96 O ATOM 680 NE2 GLN A 359 -3.720 24.076 19.289 1.00 9.15 N ATOM 681 HE22 GLN A 359 -2.716 24.265 19.486 1.00 0.00 H ATOM 682 HE21 GLN A 359 -4.423 24.835 19.397 1.00 0.00 H ATOM 683 H GLN A 359 -1.922 21.663 21.360 1.00 0.00 H ATOM 684 N ARG A 360 -5.251 18.841 21.684 1.00 6.10 N ATOM 685 CA ARG A 360 -5.574 17.589 22.368 1.00 6.76 C ATOM 686 C ARG A 360 -6.334 16.624 21.471 1.00 6.55 C ATOM 687 O ARG A 360 -7.047 17.046 20.572 1.00 7.66 O ATOM 688 CB ARG A 360 -6.413 17.860 23.624 1.00 11.67 C ATOM 689 CG ARG A 360 -5.731 18.714 24.678 1.00 14.98 C ATOM 690 CD ARG A 360 -6.707 19.129 25.775 1.00 17.10 C ATOM 691 NE ARG A 360 -7.217 17.984 26.523 1.00 18.33 N ATOM 692 CZ ARG A 360 -8.495 17.813 26.848 1.00 32.28 C ATOM 693 NH1 ARG A 360 -9.400 18.712 26.486 1.00 37.97 N ATOM 694 NH2 ARG A 360 -8.870 16.741 27.532 1.00 32.96 N ATOM 695 HE ARG A 360 -6.537 17.255 26.821 1.00 0.00 H ATOM 696 HH12 ARG A 360 -10.399 18.576 26.741 1.00 0.00 H ATOM 697 HH11 ARG A 360 -9.111 19.553 25.947 1.00 0.00 H ATOM 698 HH22 ARG A 360 -9.870 16.609 27.785 1.00 0.00 H ATOM 699 HH21 ARG A 360 -8.164 16.032 27.815 1.00 0.00 H ATOM 700 H ARG A 360 -6.003 19.341 21.168 1.00 0.00 H ATOM 701 N GLY A 361 -6.172 15.331 21.732 1.00 6.02 N ATOM 702 CA GLY A 361 -7.027 14.315 21.136 1.00 5.12 C ATOM 703 C GLY A 361 -6.739 14.030 19.675 1.00 5.95 C ATOM 704 O GLY A 361 -5.661 13.546 19.312 1.00 6.92 O ATOM 705 H GLY A 361 -5.413 15.037 22.380 1.00 0.00 H ATOM 706 N GLU A 362 -7.715 14.333 18.828 1.00 5.95 N ATOM 707 CA GLU A 362 -7.584 14.144 17.390 1.00 6.99 C ATOM 708 C GLU A 362 -7.103 15.442 16.774 1.00 8.59 C ATOM 709 O GLU A 362 -7.823 16.440 16.757 1.00 9.26 O ATOM 710 CB GLU A 362 -8.922 13.727 16.785 1.00 7.25 C ATOM 711 CG GLU A 362 -9.404 12.383 17.283 1.00 7.59 C ATOM 712 CD GLU A 362 -10.764 11.999 16.750 1.00 10.19 C ATOM 713 OE1 GLU A 362 -11.501 12.879 16.251 1.00 12.36 O ATOM 714 OE2 GLU A 362 -11.099 10.810 16.838 1.00 11.04 O ATOM 715 H GLU A 362 -8.604 14.719 19.204 1.00 0.00 H ATOM 716 N ILE A 363 -5.879 15.426 16.270 1.00 7.17 N ATOM 717 CA ILE A 363 -5.183 16.643 15.891 1.00 6.59 C ATOM 718 C ILE A 363 -4.808 16.582 14.413 1.00 5.28 C ATOM 719 O ILE A 363 -4.101 15.658 13.988 1.00 7.08 O ATOM 720 CB ILE A 363 -3.929 16.822 16.759 1.00 5.05 C ATOM 721 CG1 ILE A 363 -4.323 16.884 18.240 1.00 5.96 C ATOM 722 CG2 ILE A 363 -3.170 18.073 16.324 1.00 8.43 C ATOM 723 CD1 ILE A 363 -3.162 16.766 19.212 1.00 8.18 C ATOM 724 H ILE A 363 -5.400 14.512 16.141 1.00 0.00 H ATOM 725 N GLU A 364 -5.269 17.556 13.631 1.00 6.22 N ATOM 726 CA GLU A 364 -4.979 17.585 12.200 1.00 6.89 C ATOM 727 C GLU A 364 -3.785 18.480 11.902 1.00 9.31 C ATOM 728 O GLU A 364 -3.732 19.619 12.337 1.00 11.71 O ATOM 729 CB GLU A 364 -6.215 18.056 11.434 1.00 11.27 C ATOM 730 CG GLU A 364 -7.385 17.087 11.601 1.00 29.35 C ATOM 731 CD GLU A 364 -8.695 17.603 11.037 1.00 43.74 C ATOM 732 OE1 GLU A 364 -9.038 18.780 11.281 1.00 46.30 O ATOM 733 OE2 GLU A 364 -9.387 16.817 10.354 1.00 47.77 O ATOM 734 H GLU A 364 -5.848 18.312 14.048 1.00 0.00 H ATOM 735 N PHE A 365 -2.822 17.937 11.170 1.00 7.21 N ATOM 736 CA PHE A 365 -1.635 18.669 10.754 1.00 6.84 C ATOM 737 C PHE A 365 -1.679 18.914 9.257 1.00 8.11 C ATOM 738 O PHE A 365 -2.136 18.069 8.486 1.00 10.50 O ATOM 739 CB PHE A 365 -0.383 17.857 11.086 1.00 8.77 C ATOM 740 CG PHE A 365 -0.038 17.849 12.542 1.00 8.05 C ATOM 741 CD1 PHE A 365 -0.644 16.954 13.400 1.00 8.26 C ATOM 742 CD2 PHE A 365 0.905 18.733 13.046 1.00 11.94 C ATOM 743 CE1 PHE A 365 -0.322 16.939 14.750 1.00 7.41 C ATOM 744 CE2 PHE A 365 1.234 18.721 14.395 1.00 10.96 C ATOM 745 CZ PHE A 365 0.617 17.819 15.246 1.00 6.54 C ATOM 746 H PHE A 365 -2.919 16.943 10.880 1.00 0.00 H ATOM 747 N GLU A 366 -1.202 20.083 8.851 1.00 5.54 N ATOM 748 CA GLU A 366 -0.936 20.342 7.443 1.00 7.34 C ATOM 749 C GLU A 366 0.573 20.458 7.328 1.00 6.67 C ATOM 750 O GLU A 366 1.186 21.304 7.982 1.00 6.56 O ATOM 751 CB GLU A 366 -1.620 21.634 7.011 1.00 9.36 C ATOM 752 CG GLU A 366 -1.443 21.977 5.540 1.00 13.81 C ATOM 753 CD GLU A 366 -2.319 23.145 5.110 1.00 26.75 C ATOM 754 OE1 GLU A 366 -3.134 23.606 5.932 1.00 27.98 O ATOM 755 OE2 GLU A 366 -2.197 23.602 3.954 1.00 30.40 O ATOM 756 H GLU A 366 -1.014 20.829 9.551 1.00 0.00 H ATOM 757 N VAL A 367 1.179 19.579 6.529 1.00 6.05 N ATOM 758 CA VAL A 367 2.632 19.468 6.474 1.00 5.91 C ATOM 759 C VAL A 367 3.146 19.350 5.046 1.00 6.42 C ATOM 760 O VAL A 367 2.422 18.960 4.138 1.00 6.91 O ATOM 761 CB VAL A 367 3.148 18.256 7.314 1.00 4.78 C ATOM 762 CG1 VAL A 367 2.778 18.409 8.784 1.00 6.01 C ATOM 763 CG2 VAL A 367 2.588 16.944 6.761 1.00 10.25 C ATOM 764 H VAL A 367 0.600 18.957 5.930 1.00 0.00 H ATOM 765 N VAL A 368 4.412 19.675 4.853 1.00 6.42 N ATOM 766 CA VAL A 368 5.012 19.496 3.541 1.00 7.03 C ATOM 767 C VAL A 368 6.481 19.176 3.710 1.00 7.95 C ATOM 768 O VAL A 368 7.159 19.781 4.534 1.00 7.65 O ATOM 769 CB VAL A 368 4.824 20.736 2.626 1.00 5.00 C ATOM 770 CG1 VAL A 368 5.562 21.945 3.171 1.00 7.18 C ATOM 771 CG2 VAL A 368 5.268 20.439 1.198 1.00 7.05 C ATOM 772 H VAL A 368 4.978 20.058 5.637 1.00 0.00 H ATOM 773 N TYR A 369 6.965 18.210 2.936 1.00 6.87 N ATOM 774 CA TYR A 369 8.383 17.898 2.923 1.00 9.68 C ATOM 775 C TYR A 369 9.041 18.556 1.728 1.00 9.35 C ATOM 776 O TYR A 369 8.634 18.318 0.590 1.00 10.55 O ATOM 777 CB TYR A 369 8.601 16.393 2.842 1.00 11.13 C ATOM 778 CG TYR A 369 10.049 15.989 2.901 1.00 11.96 C ATOM 779 CD1 TYR A 369 10.635 15.627 4.102 1.00 10.06 C ATOM 780 CD2 TYR A 369 10.836 15.976 1.752 1.00 14.54 C ATOM 781 CE1 TYR A 369 11.965 15.259 4.160 1.00 15.27 C ATOM 782 CE2 TYR A 369 12.164 15.607 1.804 1.00 15.16 C ATOM 783 CZ TYR A 369 12.720 15.252 3.012 1.00 18.82 C ATOM 784 OH TYR A 369 14.047 14.887 3.071 1.00 23.78 O ATOM 785 HH TYR A 369 14.285 14.664 4.006 1.00 0.00 H ATOM 786 H TYR A 369 6.317 17.668 2.329 1.00 0.00 H ATOM 787 N VAL A 370 10.064 19.363 1.984 1.00 10.45 N ATOM 788 CA VAL A 370 10.847 19.981 0.921 1.00 17.28 C ATOM 789 C VAL A 370 12.291 19.494 0.966 1.00 18.51 C ATOM 790 O VAL A 370 12.872 19.364 2.047 1.00 19.31 O ATOM 791 CB VAL A 370 10.845 21.504 1.052 1.00 17.37 C ATOM 792 CG1 VAL A 370 11.732 22.125 -0.018 1.00 25.01 C ATOM 793 CG2 VAL A 370 9.420 22.041 0.975 1.00 18.12 C ATOM 794 H VAL A 370 10.314 19.560 2.974 1.00 0.00 H TER 795 VAL A 370 HETATM 796 O HOH 1 3.729 19.118 24.228 1.00 6.22 O HETATM 797 O HOH 2 -1.324 8.953 16.446 1.00 7.77 O HETATM 798 O HOH 3 -0.312 18.617 21.784 1.00 5.78 O HETATM 799 O HOH 4 6.295 10.245 17.961 1.00 6.77 O HETATM 800 O HOH 5 4.821 9.332 11.437 1.00 7.01 O HETATM 801 O HOH 6 5.299 16.620 1.284 1.00 9.27 O HETATM 802 O HOH 7 0.710 25.004 25.338 1.00 7.60 O HETATM 803 O HOH 8 5.813 26.680 9.836 1.00 9.79 O HETATM 804 O HOH 9 6.078 28.978 24.399 1.00 9.96 O HETATM 805 O HOH 10 -4.577 14.503 24.153 1.00 10.29 O HETATM 806 O HOH 11 4.869 11.633 24.747 1.00 13.40 O HETATM 807 O HOH 12 11.102 10.456 10.066 1.00 14.80 O HETATM 808 O HOH 13 10.387 32.108 19.820 1.00 9.83 O HETATM 809 O HOH 14 13.749 11.113 14.607 1.00 12.52 O HETATM 810 O HOH 15 -7.645 18.527 18.286 1.00 13.34 O HETATM 811 O HOH 16 -7.448 20.665 20.956 1.00 16.73 O HETATM 812 O HOH 17 -2.236 7.085 19.401 1.00 13.67 O HETATM 813 O HOH 18 5.892 6.641 11.351 1.00 12.68 O HETATM 814 O HOH 19 8.676 30.926 9.601 1.00 15.59 O HETATM 815 O HOH 20 -4.575 22.078 10.070 1.00 17.77 O HETATM 816 O HOH 21 11.334 7.913 14.205 1.00 15.73 O HETATM 817 O HOH 22 1.758 11.991 5.017 1.00 15.14 O HETATM 818 O HOH 23 5.120 5.815 8.777 1.00 14.71 O HETATM 819 O HOH 24 -4.019 5.918 20.969 1.00 15.69 O HETATM 820 O HOH 25 7.018 29.594 11.387 1.00 14.71 O HETATM 821 O HOH 26 9.842 20.653 4.619 1.00 12.32 O HETATM 822 O HOH 27 1.875 5.866 27.013 1.00 17.59 O HETATM 823 O HOH 28 9.824 17.954 -3.243 1.00 17.10 O HETATM 824 O HOH 29 9.089 7.307 12.403 1.00 17.70 O HETATM 825 O HOH 30 12.704 9.412 12.217 1.00 17.45 O HETATM 826 O HOH 31 -4.293 30.884 11.752 1.00 18.24 O HETATM 827 O HOH 32 12.083 12.210 6.278 1.00 18.86 O HETATM 828 O HOH 33 -10.251 15.666 19.621 1.00 19.39 O HETATM 829 O HOH 34 1.543 31.861 11.058 1.00 17.47 O HETATM 830 O HOH 35 7.655 13.464 4.624 1.00 16.30 O HETATM 831 O HOH 36 9.105 8.653 10.121 1.00 22.05 O HETATM 832 O HOH 37 -7.275 6.806 20.986 1.00 17.94 O HETATM 833 O HOH 38 -8.123 14.104 24.584 1.00 26.21 O HETATM 834 O HOH 39 9.514 3.636 15.301 1.00 23.15 O HETATM 835 O HOH 40 -9.819 18.354 21.453 1.00 32.36 O HETATM 836 O HOH 41 16.408 18.394 22.482 1.00 26.50 O HETATM 837 O HOH 42 14.185 10.088 17.236 1.00 28.24 O HETATM 838 O HOH 43 -2.460 23.021 28.118 1.00 25.99 O HETATM 839 O HOH 44 10.080 23.609 4.422 1.00 20.05 O HETATM 840 O HOH 45 5.266 5.500 26.254 1.00 20.24 O HETATM 841 O HOH 46 9.965 11.796 4.410 1.00 22.37 O HETATM 842 O HOH 47 8.570 15.758 -4.323 1.00 25.42 O HETATM 843 O HOH 48 7.913 5.211 23.037 1.00 22.99 O HETATM 844 O HOH 49 12.835 19.297 4.746 1.00 27.66 O HETATM 845 O HOH 50 -1.081 18.382 -2.154 1.00 24.12 O HETATM 846 O HOH 51 -13.856 12.438 15.342 1.00 24.95 O HETATM 847 O HOH 52 1.033 32.361 5.899 1.00 24.42 O HETATM 848 O HOH 53 -3.600 21.542 1.849 1.00 37.50 O HETATM 849 O HOH 54 -9.783 15.974 23.508 1.00 41.36 O HETATM 850 O HOH 55 -0.037 23.065 26.973 1.00 24.21 O HETATM 851 O HOH 56 -3.397 18.727 1.324 1.00 36.36 O HETATM 852 O HOH 57 -8.549 14.119 9.413 1.00 32.37 O HETATM 853 O HOH 58 -2.895 25.741 27.899 1.00 21.27 O HETATM 854 O HOH 59 0.633 13.199 -0.452 1.00 38.11 O HETATM 855 O HOH 60 11.768 17.010 -1.601 1.00 26.12 O HETATM 856 O HOH 61 -11.361 15.113 14.418 1.00 32.27 O HETATM 857 O HOH 62 -15.729 14.147 15.903 1.00 30.28 O HETATM 858 O HOH 63 3.341 10.665 3.302 1.00 35.85 O HETATM 859 O HOH 64 -6.620 31.365 12.528 1.00 35.41 O HETATM 860 O HOH 65 -7.416 24.139 18.387 1.00 29.10 O HETATM 861 O HOH 66 5.062 2.891 22.256 1.00 27.87 O HETATM 862 O HOH 67 10.126 34.540 21.403 1.00 38.99 O HETATM 863 O HOH 68 8.195 14.443 -1.611 1.00 35.98 O HETATM 864 O HOH 69 -8.350 25.290 16.186 1.00 30.88 O HETATM 865 O HOH 70 -9.375 20.266 18.964 1.00 38.09 O HETATM 866 O HOH 71 8.337 25.239 3.001 1.00 40.91 O HETATM 867 O HOH 72 15.270 17.326 5.190 1.00 37.87 O HETATM 868 O HOH 73 13.910 30.926 18.855 1.00 28.42 O HETATM 869 O HOH 74 15.602 16.955 20.247 1.00 24.61 O HETATM 870 O HOH 75 3.661 12.089 -0.641 1.00 44.64 O HETATM 871 O HOH 76 -10.246 12.018 9.015 1.00 22.63 O HETATM 872 O HOH 77 13.605 33.384 5.247 1.00 33.38 O HETATM 873 O HOH 78 12.560 24.602 3.899 1.00 40.44 O HETATM 874 O HOH 79 -10.420 15.137 11.757 1.00 44.51 O HETATM 875 O HOH 80 15.494 17.544 8.026 1.00 40.75 O HETATM 876 O HOH 81 -12.369 14.930 18.264 1.00 37.81 O HETATM 877 O HOH 82 -13.542 10.007 16.523 1.00 13.93 O HETATM 878 O HOH 83 -3.182 14.850 2.257 1.00 17.79 O HETATM 879 O HOH 84 6.231 14.144 0.157 1.00 19.51 O HETATM 880 O HOH 85 15.927 12.739 13.951 1.00 18.61 O HETATM 881 O HOH 86 -2.477 19.810 25.520 1.00 24.05 O HETATM 882 O HOH 87 16.979 16.107 12.238 1.00 23.60 O HETATM 883 O HOH 88 6.100 12.488 2.629 1.00 24.02 O HETATM 884 O HOH 89 -1.320 15.461 -0.344 1.00 33.66 O HETATM 885 O HOH 90 -3.198 26.123 6.217 1.00 31.63 O HETATM 886 O HOH 91 -8.119 21.082 10.941 1.00 41.56 O HETATM 887 O HOH 92 -7.624 28.162 9.329 1.00 36.55 O HETATM 888 O HOH 93 -1.726 12.445 2.002 1.00 35.06 O HETATM 889 O HOH 94 -4.065 27.855 7.972 1.00 43.88 O HETATM 890 O HOH 95 -4.698 23.364 7.846 1.00 35.43 O HETATM 891 O HOH 96 -5.275 13.400 2.697 1.00 44.15 O HETATM 892 O HOH 97 11.948 20.705 25.007 1.00 5.96 O HETATM 893 O HOH 98 10.396 26.456 23.663 1.00 7.36 O HETATM 894 O HOH 99 13.952 22.605 25.259 1.00 11.22 O HETATM 895 O HOH 100 13.514 24.813 23.740 1.00 12.67 O HETATM 896 O HOH 101 12.823 27.776 23.293 1.00 17.75 O HETATM 897 O HOH 102 16.701 19.584 16.244 1.00 20.74 O HETATM 898 O HOH 103 18.808 22.931 18.251 1.00 25.96 O HETATM 899 O HOH 104 18.125 22.968 14.139 1.00 23.32 O HETATM 900 O HOH 105 15.389 20.747 23.653 1.00 23.81 O HETATM 901 O HOH 106 17.803 24.199 21.573 1.00 21.23 O HETATM 902 O HOH 107 17.893 20.073 13.848 1.00 31.52 O HETATM 903 O HOH 108 16.941 16.136 24.698 1.00 22.20 O HETATM 904 O HOH 109 18.968 16.722 26.253 1.00 28.41 O HETATM 905 O HOH 110 16.979 17.274 17.575 1.00 31.08 O HETATM 906 O HOH 111 13.462 30.066 21.754 1.00 38.66 O HETATM 907 O HOH 112 17.006 13.902 23.425 1.00 35.16 O HETATM 908 N ARG A 113 22.388 29.773 15.931 1.00 0.24 N HETATM 909 CA ARG A 113 21.646 28.675 15.324 1.00 0.07 C HETATM 910 C ARG A 113 20.207 28.639 15.836 1.00 0.23 C HETATM 911 O ARG A 113 19.791 29.516 16.598 1.00 -0.39 O HETATM 912 N ARG A 113 19.450 27.628 15.415 1.00 -0.26 N HETATM 913 CA ARG A 113 18.045 27.516 15.800 1.00 0.14 C HETATM 914 C ARG A 113 17.837 26.643 17.031 1.00 0.21 C HETATM 915 O ARG A 113 18.499 25.622 17.202 1.00 -0.39 O HETATM 916 N ARG A 113 16.881 27.028 17.876 1.00 -0.25 N HETATM 917 CA ARG A 113 16.533 26.205 19.034 1.00 0.13 C HETATM 918 C ARG A 113 15.723 24.973 18.632 1.00 0.20 C HETATM 919 O ARG A 113 15.100 24.935 17.565 1.00 -0.39 O HETATM 920 N ARG A 113 15.742 23.972 19.501 1.00 -0.26 N HETATM 921 CA ARG A 113 14.922 22.790 19.326 1.00 0.16 C HETATM 922 C ARG A 113 14.087 22.595 20.578 1.00 0.21 C HETATM 923 O ARG A 113 14.600 22.733 21.688 1.00 -0.39 O HETATM 924 N ARG A 113 12.804 22.282 20.401 1.00 -0.26 N HETATM 925 CA ARG A 113 11.942 21.949 21.525 1.00 0.15 C HETATM 926 C ARG A 113 11.352 20.565 21.299 1.00 0.21 C HETATM 927 O ARG A 113 10.956 20.215 20.181 1.00 -0.39 O HETATM 928 N ARG A 113 11.316 19.765 22.358 1.00 -0.26 N HETATM 929 CA ARG A 113 10.611 18.490 22.322 1.00 0.13 C HETATM 930 C ARG A 113 9.214 18.722 22.844 1.00 0.20 C HETATM 931 O ARG A 113 9.034 19.323 23.903 1.00 -0.39 O HETATM 932 N ARG A 113 8.229 18.242 22.095 1.00 -0.27 N HETATM 933 CA ARG A 113 6.826 18.505 22.385 1.00 0.10 C HETATM 934 C ARG A 113 5.972 17.265 22.171 1.00 0.06 C HETATM 935 O ARG A 113 6.436 16.247 21.657 1.00 -0.57 O HETATM 936 OXT ARG A 113 4.793 17.307 22.496 1.00 -0.57 O HETATM 937 CB ARG A 113 6.269 19.661 21.514 1.00 -0.01 C HETATM 938 CG1 ARG A 113 6.357 19.316 20.029 1.00 -0.05 C HETATM 939 CD1 ARG A 113 5.714 20.379 19.146 1.00 -0.06 C HETATM 940 H ARG A 113 5.804 20.083 18.090 1.00 0.02 H HETATM 941 H ARG A 113 6.223 21.342 19.302 1.00 0.02 H HETATM 942 H ARG A 113 4.651 20.480 19.409 1.00 0.02 H HETATM 943 H ARG A 113 5.845 18.358 19.858 1.00 0.03 H HETATM 944 H ARG A 113 7.417 19.220 19.751 1.00 0.03 H HETATM 945 CG2 ARG A 113 7.013 20.968 21.805 1.00 -0.06 C HETATM 946 H ARG A 113 6.939 21.201 22.878 1.00 0.02 H HETATM 947 H ARG A 113 6.563 21.784 21.221 1.00 0.02 H HETATM 948 H ARG A 113 8.071 20.858 21.526 1.00 0.02 H HETATM 949 H ARG A 113 5.209 19.804 21.771 1.00 0.03 H HETATM 950 H ARG A 113 6.750 18.800 23.442 1.00 0.07 H HETATM 951 H ARG A 113 8.459 17.678 21.302 1.00 0.19 H HETATM 952 CB ARG A 113 11.336 17.453 23.192 1.00 -0.01 C HETATM 953 CG ARG A 113 12.811 17.302 22.839 1.00 -0.05 C HETATM 954 CD ARG A 113 13.386 15.963 23.300 1.00 -0.03 C HETATM 955 CE ARG A 113 13.351 15.808 24.812 1.00 0.03 C HETATM 956 NZ ARG A 113 14.274 16.770 25.445 1.00 -0.28 N HETATM 957 CH ARG A 113 13.886 17.985 26.128 1.00 0.30 C HETATM 958 OH ARG A 113 12.671 18.285 26.189 1.00 -0.34 O HETATM 959 CT ARG A 113 14.896 18.736 26.921 1.00 0.47 C HETATM 960 FI1 ARG A 113 16.122 18.447 26.490 1.00 -0.17 F HETATM 961 FI2 ARG A 113 14.648 20.034 26.810 1.00 -0.17 F HETATM 962 FI3 ARG A 113 14.800 18.371 28.187 1.00 -0.17 F HETATM 963 H ARG A 113 15.252 16.564 25.398 1.00 0.19 H HETATM 964 H ARG A 113 13.653 14.785 25.079 1.00 0.05 H HETATM 965 H ARG A 113 12.329 15.994 25.173 1.00 0.05 H HETATM 966 H ARG A 113 14.430 15.891 22.962 1.00 0.03 H HETATM 967 H ARG A 113 12.797 15.151 22.848 1.00 0.03 H HETATM 968 H ARG A 113 13.375 18.114 23.322 1.00 0.03 H HETATM 969 H ARG A 113 12.922 17.377 21.747 1.00 0.03 H HETATM 970 H ARG A 113 10.843 16.479 23.059 1.00 0.03 H HETATM 971 H ARG A 113 11.258 17.763 24.244 1.00 0.03 H HETATM 972 H ARG A 113 10.563 18.123 21.286 1.00 0.08 H HETATM 973 H ARG A 113 11.782 20.043 23.198 1.00 0.19 H HETATM 974 CB ARG A 113 10.813 22.969 21.674 1.00 0.08 C HETATM 975 OG ARG A 113 11.348 24.250 21.972 1.00 -0.39 O HETATM 976 H ARG A 113 11.924 24.523 21.268 1.00 0.21 H HETATM 977 H ARG A 113 10.145 22.655 22.489 1.00 0.06 H HETATM 978 H ARG A 113 10.244 23.022 20.734 1.00 0.06 H HETATM 979 H ARG A 113 12.541 21.944 22.448 1.00 0.08 H HETATM 980 H ARG A 113 12.425 22.276 19.476 1.00 0.19 H HETATM 981 CB ARG A 113 15.792 21.550 19.094 1.00 0.09 C HETATM 982 OG1 ARG A 113 16.515 21.723 17.874 1.00 -0.39 O HETATM 983 H ARG A 113 17.063 22.496 17.939 1.00 0.21 H HETATM 984 CG2 ARG A 113 14.925 20.303 18.992 1.00 -0.03 C HETATM 985 H ARG A 113 15.565 19.424 18.826 1.00 0.03 H HETATM 986 H ARG A 113 14.225 20.411 18.151 1.00 0.03 H HETATM 987 H ARG A 113 14.359 20.173 19.926 1.00 0.03 H HETATM 988 H ARG A 113 16.497 21.435 19.930 1.00 0.06 H HETATM 989 H ARG A 113 14.260 22.932 18.459 1.00 0.08 H HETATM 990 H ARG A 113 16.340 24.034 20.300 1.00 0.19 H HETATM 991 CB ARG A 113 15.648 27.139 19.854 1.00 -0.01 C HETATM 992 CG ARG A 113 14.978 27.988 18.829 1.00 -0.03 C HETATM 993 CD ARG A 113 16.027 28.224 17.770 1.00 0.04 C HETATM 994 H ARG A 113 15.571 28.297 16.772 1.00 0.05 H HETATM 995 H ARG A 113 16.601 29.139 17.979 1.00 0.05 H HETATM 996 H ARG A 113 14.652 28.942 19.270 1.00 0.03 H HETATM 997 H ARG A 113 14.109 27.466 18.402 1.00 0.03 H HETATM 998 H ARG A 113 16.254 27.754 20.536 1.00 0.03 H HETATM 999 H ARG A 113 14.908 26.568 20.434 1.00 0.03 H HETATM 1000 H ARG A 113 17.431 25.899 19.591 1.00 0.08 H HETATM 1001 CB ARG A 113 17.200 26.929 14.669 1.00 0.00 C HETATM 1002 CG ARG A 113 17.498 27.433 13.295 1.00 -0.04 C HETATM 1003 CD1 ARG A 113 18.020 28.648 12.949 1.00 0.02 C HETATM 1004 NE1 ARG A 113 18.146 28.731 11.582 1.00 -0.29 N HETATM 1005 CE2 ARG A 113 17.708 27.556 11.023 1.00 0.06 C HETATM 1006 CD2 ARG A 113 17.292 26.720 12.078 1.00 -0.02 C HETATM 1007 CE3 ARG A 113 16.793 25.450 11.774 1.00 -0.07 C HETATM 1008 CZ3 ARG A 113 16.725 25.062 10.446 1.00 -0.08 C HETATM 1009 CH2 ARG A 113 17.146 25.919 9.421 1.00 -0.08 C HETATM 1010 CZ2 ARG A 113 17.639 27.168 9.688 1.00 -0.04 C HETATM 1011 H ARG A 113 17.963 27.828 8.892 1.00 0.05 H HETATM 1012 H ARG A 113 17.080 25.585 8.392 1.00 0.05 H HETATM 1013 H ARG A 113 16.340 24.080 10.196 1.00 0.05 H HETATM 1014 H ARG A 113 16.466 24.782 12.562 1.00 0.05 H HETATM 1015 H ARG A 113 18.510 29.543 11.062 1.00 0.22 H HETATM 1016 H ARG A 113 18.295 29.433 13.651 1.00 0.08 H HETATM 1017 H ARG A 113 16.145 27.152 14.887 1.00 0.04 H HETATM 1018 H ARG A 113 17.352 25.840 14.667 1.00 0.04 H HETATM 1019 H ARG A 113 17.679 28.528 16.026 1.00 0.08 H HETATM 1020 H ARG A 113 19.852 26.930 14.822 1.00 0.19 H HETATM 1021 CB ARG A 113 22.346 27.338 15.588 1.00 0.01 C HETATM 1022 CG ARG A 113 21.888 26.612 16.844 1.00 -0.01 C HETATM 1023 CD ARG A 113 21.820 25.111 16.585 1.00 0.06 C HETATM 1024 NE ARG A 113 22.001 24.801 15.166 1.00 -0.27 N HETATM 1025 CZ ARG A 113 21.026 24.816 14.259 1.00 0.29 C HETATM 1026 NH1 ARG A 113 21.291 24.524 12.994 1.00 -0.28 N HETATM 1027 H ARG A 113 20.536 24.536 12.294 1.00 0.26 H HETATM 1028 H ARG A 113 22.252 24.285 12.711 1.00 0.26 H HETATM 1029 NH2 ARG A 113 19.788 25.128 14.614 1.00 -0.28 N HETATM 1030 H ARG A 113 19.576 25.356 15.596 1.00 0.26 H HETATM 1031 H ARG A 113 19.038 25.143 13.908 1.00 0.26 H HETATM 1032 H ARG A 113 22.949 24.554 14.847 1.00 0.26 H HETATM 1033 H ARG A 113 20.838 24.737 16.910 1.00 0.07 H HETATM 1034 H ARG A 113 22.612 24.613 17.163 1.00 0.07 H HETATM 1035 H ARG A 113 20.891 26.977 17.133 1.00 0.03 H HETATM 1036 H ARG A 113 22.601 26.809 17.659 1.00 0.03 H HETATM 1037 H ARG A 113 23.425 27.529 15.678 1.00 0.03 H HETATM 1038 H ARG A 113 22.161 26.680 14.726 1.00 0.03 H HETATM 1039 H ARG A 113 21.619 28.840 14.237 1.00 0.11 H HETATM 1040 H ARG A 113 23.332 29.776 15.578 1.00 0.20 H HETATM 1041 H ARG A 113 22.404 29.655 16.932 1.00 0.20 H HETATM 1042 H ARG A 113 21.941 30.647 15.703 1.00 0.20 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 908 909 1040 1041 1042 CONECT 909 908 910 1021 1039 CONECT 910 909 911 912 CONECT 911 910 CONECT 912 910 913 1020 CONECT 913 912 914 1001 1019 CONECT 914 913 915 916 CONECT 915 914 CONECT 916 914 917 993 CONECT 917 916 918 991 1000 CONECT 918 917 919 920 CONECT 919 918 CONECT 920 918 921 990 CONECT 921 920 922 981 989 CONECT 922 921 923 924 CONECT 923 922 CONECT 924 922 925 980 CONECT 925 924 926 974 979 CONECT 926 925 927 928 CONECT 927 926 CONECT 928 926 929 973 CONECT 929 928 930 952 972 CONECT 930 929 931 932 CONECT 931 930 CONECT 932 930 933 951 CONECT 933 932 934 937 950 CONECT 934 933 935 936 CONECT 935 934 CONECT 936 934 CONECT 937 933 938 945 949 CONECT 938 937 939 943 944 CONECT 939 938 940 941 942 CONECT 940 939 CONECT 941 939 CONECT 942 939 CONECT 943 938 CONECT 944 938 CONECT 945 937 946 947 948 CONECT 946 945 CONECT 947 945 CONECT 948 945 CONECT 949 937 CONECT 950 933 CONECT 951 932 CONECT 952 929 953 970 971 CONECT 953 952 954 968 969 CONECT 954 953 955 966 967 CONECT 955 954 956 964 965 CONECT 956 955 957 963 CONECT 957 956 958 959 CONECT 958 957 CONECT 959 957 960 961 962 CONECT 960 959 CONECT 961 959 CONECT 962 959 CONECT 963 956 CONECT 964 955 CONECT 965 955 CONECT 966 954 CONECT 967 954 CONECT 968 953 CONECT 969 953 CONECT 970 952 CONECT 971 952 CONECT 972 929 CONECT 973 928 CONECT 974 925 975 977 978 CONECT 975 974 976 CONECT 976 975 CONECT 977 974 CONECT 978 974 CONECT 979 925 CONECT 980 924 CONECT 981 921 982 984 988 CONECT 982 981 983 CONECT 983 982 CONECT 984 981 985 986 987 CONECT 985 984 CONECT 986 984 CONECT 987 984 CONECT 988 981 CONECT 989 921 CONECT 990 920 CONECT 991 917 992 998 999 CONECT 992 991 993 996 997 CONECT 993 916 992 994 995 CONECT 994 993 CONECT 995 993 CONECT 996 992 CONECT 997 992 CONECT 998 991 CONECT 999 991 CONECT 1000 917 CONECT 1001 913 1002 1017 1018 CONECT 1002 1001 1003 1006 CONECT 1003 1002 1004 1016 CONECT 1004 1003 1005 1015 CONECT 1005 1004 1006 1010 CONECT 1006 1002 1005 1007 CONECT 1007 1006 1008 1014 CONECT 1008 1007 1009 1013 CONECT 1009 1008 1010 1012 CONECT 1010 1005 1009 1011 CONECT 1011 1010 CONECT 1012 1009 CONECT 1013 1008 CONECT 1014 1007 CONECT 1015 1004 CONECT 1016 1003 CONECT 1017 1001 CONECT 1018 1001 CONECT 1019 913 CONECT 1020 912 CONECT 1021 909 1022 1037 1038 CONECT 1022 1021 1023 1035 1036 CONECT 1023 1022 1024 1033 1034 CONECT 1024 1023 1025 1032 CONECT 1025 1024 1026 1029 CONECT 1026 1025 1027 1028 CONECT 1027 1026 CONECT 1028 1026 CONECT 1029 1025 1030 1031 CONECT 1030 1029 CONECT 1031 1029 CONECT 1032 1024 CONECT 1033 1023 CONECT 1034 1023 CONECT 1035 1022 CONECT 1036 1022 CONECT 1037 1021 CONECT 1038 1021 CONECT 1039 909 CONECT 1040 908 CONECT 1041 908 CONECT 1042 908 MASTER 0 0 0 0 0 0 0 0 1041 1 139 7 END
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Related entries of code: 4nmt
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4e34
RCSB PDB
PDBbind
87aa, >4E34_1|Chains... *
4e35
RCSB PDB
PDBbind
87aa, >4E35_1|Chains... at 100%
4joe
RCSB PDB
PDBbind
87aa, >4JOE_1|Chains... at 100%
4jof
RCSB PDB
PDBbind
87aa, >4JOF_1|Chains... at 100%
4jog
RCSB PDB
PDBbind
87aa, >4JOG_1|Chains... at 100%
4joh
RCSB PDB
PDBbind
87aa, >4JOH_1|Chains... at 100%
4joj
RCSB PDB
PDBbind
87aa, >4JOJ_1|Chains... at 100%
4jok
RCSB PDB
PDBbind
87aa, >4JOK_1|Chains... at 100%
4k6y
RCSB PDB
PDBbind
87aa, >4K6Y_1|Chains... at 100%
4k72
RCSB PDB
PDBbind
87aa, >4K72_1|Chains... at 100%
4k75
RCSB PDB
PDBbind
87aa, >4K75_1|Chain... at 100%
4k76
RCSB PDB
PDBbind
87aa, >4K76_1|Chains... at 100%
4k78
RCSB PDB
PDBbind
87aa, >4K78_1|Chain... at 98%
4nmo
RCSB PDB
PDBbind
87aa, >4NMO_1|Chains... at 100%
4nmp
RCSB PDB
PDBbind
87aa, >4NMP_1|Chains... at 100%
4nmq
RCSB PDB
PDBbind
87aa, >4NMQ_1|Chains... at 100%
4nmr
RCSB PDB
PDBbind
87aa, >4NMR_1|Chains... at 100%
4nms
RCSB PDB
PDBbind
87aa, >4NMS_1|Chains... at 100%
4nmv
RCSB PDB
PDBbind
87aa, >4NMV_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1aqc
RCSB PDB
PDBbind
10-mer
1awi
RCSB PDB
PDBbind
10-mer
1aze
RCSB PDB
PDBbind
10-mer
1bjr
RCSB PDB
PDBbind
10-mer
1cka
RCSB PDB
PDBbind
10-mer
1ckb
RCSB PDB
PDBbind
10-mer
1eb1
RCSB PDB
PDBbind
10-mer
1gbq
RCSB PDB
PDBbind
10-mer
1gvu
RCSB PDB
PDBbind
10-mer
1him
RCSB PDB
PDBbind
10-mer
1jd5
RCSB PDB
PDBbind
10-mer
1jd6
RCSB PDB
PDBbind
10-mer
1jmq
RCSB PDB
PDBbind
10-mer
1pyw
RCSB PDB
PDBbind
10-mer
1vj6
RCSB PDB
PDBbind
10-mer
1vr1
RCSB PDB
PDBbind
10-mer
1y2a
RCSB PDB
PDBbind
10-mer
1ywi
RCSB PDB
PDBbind
10-mer
1yy6
RCSB PDB
PDBbind
10-mer
1zkk
RCSB PDB
PDBbind
10-mer
2a0t
RCSB PDB
PDBbind
10-mer
2aoh
RCSB PDB
PDBbind
10-mer
2aoj
RCSB PDB
PDBbind
10-mer
2axi
RCSB PDB
PDBbind
10-mer
2azm
RCSB PDB
PDBbind
10-mer
2b7f
RCSB PDB
PDBbind
10-mer
2c2l
RCSB PDB
PDBbind
10-mer
2gfa
RCSB PDB
PDBbind
10-mer
2h13
RCSB PDB
PDBbind
10-mer
2hrp
RCSB PDB
PDBbind
10-mer
2ig0
RCSB PDB
PDBbind
10-mer
2jmj
RCSB PDB
PDBbind
10-mer
2jqi
RCSB PDB
PDBbind
10-mer
2jql
RCSB PDB
PDBbind
10-mer
2k2r
RCSB PDB
PDBbind
10-mer
2ke1
RCSB PDB
PDBbind
10-mer
2mnz
RCSB PDB
PDBbind
10-mer
2nxd
RCSB PDB
PDBbind
10-mer
2nxl
RCSB PDB
PDBbind
10-mer
2nxm
RCSB PDB
PDBbind
10-mer
2o9v
RCSB PDB
PDBbind
10-mer
2peh
RCSB PDB
PDBbind
10-mer
2pr9
RCSB PDB
PDBbind
10-mer
2puy
RCSB PDB
PDBbind
10-mer
2qqs
RCSB PDB
PDBbind
10-mer
2r3y
RCSB PDB
PDBbind
10-mer
2r7g
RCSB PDB
PDBbind
10-mer
2rr4
RCSB PDB
PDBbind
10-mer
2v7d
RCSB PDB
PDBbind
10-mer
2vnf
RCSB PDB
PDBbind
10-mer
2w6t
RCSB PDB
PDBbind
10-mer
2w77
RCSB PDB
PDBbind
10-mer
2wa8
RCSB PDB
PDBbind
10-mer
2wp1
RCSB PDB
PDBbind
10-mer
2z5o
RCSB PDB
PDBbind
10-mer
3al3
RCSB PDB
PDBbind
10-mer
3bh8
RCSB PDB
PDBbind
10-mer
3bh9
RCSB PDB
PDBbind
10-mer
3bhb
RCSB PDB
PDBbind
10-mer
3c94
RCSB PDB
PDBbind
10-mer
3d1e
RCSB PDB
PDBbind
10-mer
3diw
RCSB PDB
PDBbind
10-mer
3dnj
RCSB PDB
PDBbind
10-mer
3dpc
RCSB PDB
PDBbind
10-mer
3dvp
RCSB PDB
PDBbind
10-mer
3ebb
RCSB PDB
PDBbind
10-mer
3er5
RCSB PDB
PDBbind
10-mer
3f9w
RCSB PDB
PDBbind
10-mer
3f9y
RCSB PDB
PDBbind
10-mer
3fe7
RCSB PDB
PDBbind
10-mer
3fea
RCSB PDB
PDBbind
10-mer
3gbq
RCSB PDB
PDBbind
10-mer
3gds
RCSB PDB
PDBbind
10-mer
3hg1
RCSB PDB
PDBbind
10-mer
3iqj
RCSB PDB
PDBbind
10-mer
3ivv
RCSB PDB
PDBbind
10-mer
3nkx
RCSB PDB
PDBbind
10-mer
3oq5
RCSB PDB
PDBbind
10-mer
3puj
RCSB PDB
PDBbind
10-mer
3puk
RCSB PDB
PDBbind
10-mer
3pxe
RCSB PDB
PDBbind
10-mer
3q8d
RCSB PDB
PDBbind
10-mer
3qzt
RCSB PDB
PDBbind
10-mer
3rwi
RCSB PDB
PDBbind
10-mer
3shv
RCSB PDB
PDBbind
10-mer
3szm
RCSB PDB
PDBbind
10-mer
3tkz
RCSB PDB
PDBbind
10-mer
3tl0
RCSB PDB
PDBbind
10-mer
3uii
RCSB PDB
PDBbind
10-mer
3uik
RCSB PDB
PDBbind
10-mer
3uvm
RCSB PDB
PDBbind
10-mer
3zmp
RCSB PDB
PDBbind
10-mer
3zmq
RCSB PDB
PDBbind
10-mer
4bg6
RCSB PDB
PDBbind
10-mer
4e34
RCSB PDB
PDBbind
10-mer
4e35
RCSB PDB
PDBbind
10-mer
4e3b
RCSB PDB
PDBbind
10-mer
4e81
RCSB PDB
PDBbind
10-mer
4e9d
RCSB PDB
PDBbind
10-mer
4er4
RCSB PDB
PDBbind
10-mer
4h39
RCSB PDB
PDBbind
10-mer
4h3b
RCSB PDB
PDBbind
10-mer
4hcz
RCSB PDB
PDBbind
10-mer
4i2w
RCSB PDB
PDBbind
10-mer
4i2z
RCSB PDB
PDBbind
10-mer
4jfd
RCSB PDB
PDBbind
10-mer
4jfe
RCSB PDB
PDBbind
10-mer
4jff
RCSB PDB
PDBbind
10-mer
4jjq
RCSB PDB
PDBbind
10-mer
4joe
RCSB PDB
PDBbind
10-mer
4jof
RCSB PDB
PDBbind
10-mer
4jog
RCSB PDB
PDBbind
10-mer
4joh
RCSB PDB
PDBbind
10-mer
4joj
RCSB PDB
PDBbind
10-mer
4jok
RCSB PDB
PDBbind
10-mer
4k6y
RCSB PDB
PDBbind
10-mer
4k72
RCSB PDB
PDBbind
10-mer
4k75
RCSB PDB
PDBbind
10-mer
4k76
RCSB PDB
PDBbind
10-mer
4k78
RCSB PDB
PDBbind
10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1p
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1r
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5c13
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
4nmt
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Golgi-associated PDZ and coiled-coil motif-containing protein CAL PDZ (CALP) domain
Ligand Name
10-mer
EC.Number
E.C.-.-.-.-
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
Kd=14.1uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Plos One Vol. 9. e103650: pp.1-9
Ligand Properties
Formula
C
4
3
H
6
7
F
3
N
1
2
O
1
1
Molecular Weight
985.061
Exact Mass
984.500
No. of atoms
136
No. of bonds
138
Polar Surface Area
382.11
LOGP Value
0.08 (
Computed with XLOGP3
)
-1.09 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 35
No. of Nitrogen and Oxygen Atoms: 23
No. of Rings: 3
Canonical SMILES
CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1c[nH]c2c1cccc2)CO)CCCCNC(=O)C(F)(F)F)C
InChI String
InChI=1S/C43H65F3N12O11/c1-4-22(2)32(40(67)68)56-35(62)28(14-7-8-16-50-41(69)43(44,45)46)53-36(63)30(21-59)55-38(65)33(23(3)60)57-37(64)31-15-10-18-58(31)39(66)29(19-24-20-52-27-13-6-5-11-25(24)27)54-34(61)26(47)12-9-17-51-42(48)49/h5-6,11,13,20,22-23,26,28-33,52,59-60H,4,7-10,12,14-19,21,47H2,1-3H3,(H,50,69)(H,53,63)(H,54,61)(H,55,65)(H,56,62)(H,57,64)(H,67,68)(H4,48,49,51)/p+2/t22-,23+,26-,28-,29-,30-,31-,32-,33-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9HD26
Entrez Gene ID
NCBI Entrez Gene ID:
57120
ASD
Information of known allosteric effects of PDB entries
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