# atom's volumes :: for residue file TS5H.rd atom Count Mean volume SD SD() Minimum Maximum GLY O 297 16.188 1.270 7.843 13.263 19.995 C 394 9.546 0.722 7.564 7.627 12.060 CA 182 23.472 2.055 8.757 19.386 28.561 N 354 14.480 1.219 8.422 11.026 19.363 Total 1227 63.686 2.801 4.398 ALA O 488 16.039 1.195 7.452 11.753 21.098 C 831 8.819 0.526 5.969 7.828 11.063 CA 533 13.965 1.160 8.308 11.595 18.123 N 567 13.796 1.050 7.613 11.564 17.525 CB 284 36.670 2.791 7.611 29.350 44.854 Total 2703 89.289 3.456 3.871 VAL O 492 16.010 1.176 7.347 13.266 20.987 C 816 8.485 0.533 6.276 7.148 10.390 CA 652 13.066 0.941 7.201 10.791 17.340 N 660 13.484 0.797 5.909 11.340 17.500 CB 609 14.493 1.604 11.064 2.247 18.973 CG1 363 36.439 2.927 8.033 16.906 46.985 CG2 404 36.358 3.035 8.346 20.029 45.018 Total 3996 138.335 4.851 3.507 LEU O 563 15.969 1.277 7.995 12.950 19.813 C 808 8.730 0.571 6.535 7.153 11.923 CA 738 13.074 0.844 6.454 10.522 15.954 N 763 13.448 0.888 6.600 10.692 19.657 CB 534 22.791 2.317 10.165 4.902 28.870 CG 788 14.696 1.277 8.693 4.515 19.817 CD1 456 37.370 3.439 9.202 19.102 47.591 CD2 394 37.056 3.656 9.867 10.739 46.123 Total 5044 163.134 5.970 3.660 ILE O 404 15.908 1.201 7.551 12.369 19.853 C 637 8.416 0.532 6.320 6.985 10.674 CA 526 12.955 1.011 7.805 10.734 15.814 N 539 13.420 0.824 6.141 9.891 16.114 CB 525 14.151 1.184 8.367 3.279 18.783 CG1 411 24.107 1.938 8.039 19.425 30.851 CG2 320 35.970 2.901 8.065 28.784 44.492 CD1 305 38.240 3.058 7.997 30.552 47.213 Total 3667 163.168 5.133 3.146 PRO O 166 15.826 1.310 8.279 12.756 20.177 C 375 8.757 0.445 5.086 7.749 10.487 CA 222 13.782 1.041 7.552 10.897 16.388 N 307 8.620 0.588 6.821 7.265 10.490 CB 69 25.337 2.128 8.397 20.702 31.594 CG 60 25.226 1.743 6.909 21.639 30.059 CD 82 23.550 1.914 8.126 19.727 29.741 Total 1281 121.098 3.817 3.152 MET O 141 15.895 1.313 8.260 12.866 20.826 C 208 8.725 0.584 6.699 7.648 10.773 CA 178 13.199 1.069 8.101 10.697 18.186 N 184 13.342 0.895 6.706 11.150 16.277 CB 124 23.458 1.768 7.535 18.912 27.823 CG 125 23.714 1.828 7.710 19.002 28.746 SD 133 30.286 2.455 8.105 23.949 36.007 CE 80 36.770 3.615 9.830 25.817 44.758 Total 1173 165.391 5.438 3.288 PHE O 326 15.965 1.236 7.743 12.657 21.717 C 480 8.624 0.639 7.412 7.312 10.411 CA 352 13.347 0.989 7.409 11.396 16.507 N 399 13.453 0.915 6.800 11.156 16.689 CB 290 23.670 1.891 7.989 18.782 30.259 CG 513 9.644 0.636 6.595 8.137 12.619 CD1 329 20.360 1.710 8.397 16.120 26.870 CD2 323 21.033 1.688 8.026 17.430 27.179 CE1 308 21.545 1.895 8.797 16.182 28.524 CE2 321 21.664 1.808 8.346 17.212 28.819 CZ 301 21.617 1.898 8.780 16.959 28.882 Total 3942 190.922 4.896 2.564 TYR O 240 15.880 1.151 7.247 12.315 18.984 C 405 8.622 0.607 7.036 7.344 10.383 CA 301 13.237 0.952 7.195 10.950 16.972 N 338 13.389 0.946 7.065 11.203 16.367 CB 216 23.520 2.321 9.868 2.884 29.421 CG 417 9.645 0.587 6.089 8.256 11.828 CD1 238 20.116 1.780 8.849 16.520 25.352 CD2 221 20.656 1.579 7.646 16.348 26.402 CE1 150 20.565 1.687 8.204 16.373 25.525 CE2 136 20.645 1.799 8.712 16.932 26.511 CZ 223 9.788 0.659 6.736 7.999 11.392 OH 75 18.496 1.574 8.508 15.103 21.881 Total 2960 194.558 4.887 2.512 TRP O 126 15.768 1.268 8.041 13.432 19.579 C 172 8.612 0.654 7.594 7.512 10.759 CA 135 13.280 0.877 6.602 11.370 17.390 N 137 13.507 0.890 6.591 11.243 16.380 CB 93 24.071 1.777 7.383 20.678 28.264 CG 179 9.866 0.659 6.678 8.503 12.159 CD1 76 20.450 2.194 10.730 10.214 27.057 NE1 81 16.664 1.552 9.311 13.008 21.982 CD2 186 10.049 0.682 6.787 8.550 11.883 CE2 154 9.754 0.736 7.551 8.033 12.266 CE3 147 20.360 1.985 9.750 11.543 25.444 CZ3 123 21.484 1.770 8.238 17.801 26.278 CZ2 67 20.731 1.709 8.245 17.162 26.251 CH2 96 21.332 1.860 8.721 18.045 26.508 Total 1772 225.927 5.373 2.378 SER O 327 15.875 1.261 7.943 12.208 19.836 C 554 8.810 0.594 6.745 3.793 10.625 CA 357 13.288 1.140 8.582 3.254 16.583 N 329 13.764 0.986 7.163 11.428 17.190 CB 125 23.233 3.497 15.053 4.028 30.962 OG 135 18.108 1.828 10.097 13.980 23.787 Total 1827 93.078 4.448 4.779 THR O 332 15.763 1.268 8.047 12.619 20.144 C 631 8.592 0.535 6.230 6.970 10.211 CA 438 12.943 0.891 6.884 11.218 16.141 N 405 13.505 0.946 7.008 11.081 21.357 CB 199 14.750 1.365 9.252 11.378 20.415 OG1 121 17.865 1.813 10.148 14.682 23.506 CG2 112 36.207 3.048 8.419 27.159 46.100 Total 2238 119.626 4.246 3.549 ASN O 186 15.955 1.344 8.427 12.907 21.292 C 392 8.789 0.609 6.928 7.385 10.823 CA 232 12.999 0.878 6.752 9.973 17.336 N 383 13.484 1.030 7.637 10.868 16.962 CB 96 22.551 2.993 13.274 4.968 30.340 CG 172 9.397 0.812 8.646 4.363 11.348 OD1 82 16.113 1.978 12.278 10.481 22.936 ND2 43 22.575 2.544 11.269 16.703 28.777 Total 1586 121.863 4.901 4.021 GLN O 161 15.785 1.363 8.636 11.827 19.745 C 310 8.730 0.600 6.870 7.473 10.736 CA 209 13.188 0.960 7.282 10.590 16.396 N 288 13.338 0.938 7.033 11.173 16.455 CB 87 22.928 1.827 7.968 19.186 27.517 CG 77 23.104 1.619 7.005 19.597 26.536 CD 108 9.433 0.640 6.790 8.205 12.136 OE1 49 16.667 1.423 8.536 13.654 20.525 NE2 23 22.486 2.670 11.873 16.772 30.231 Total 1312 145.659 4.420 3.035 CYS O 50 16.427 1.341 8.162 13.680 20.134 C 70 8.745 0.523 5.986 7.648 10.374 CA 54 13.720 1.237 9.019 11.941 16.712 N 67 13.765 0.954 6.930 11.957 16.697 CB 40 23.566 2.814 11.942 10.577 27.841 SG 37 36.822 3.477 9.444 24.056 42.053 Total 318 113.044 4.952 4.381 CSS O 63 16.035 1.350 8.416 13.462 19.843 C 110 8.650 0.573 6.623 7.538 10.149 CA 96 12.982 0.933 7.184 9.753 15.470 N 96 13.611 0.788 5.789 12.159 15.362 CB 52 23.170 1.991 8.592 19.593 30.500 SG 76 27.552 2.102 7.630 22.883 32.481 Total 493 102.000 3.467 3.399 HIS O 114 15.922 1.278 8.030 12.442 18.917 C 199 8.704 0.554 6.370 7.122 10.339 CA 117 13.185 0.953 7.226 11.630 16.200 N 170 13.461 1.052 7.817 11.457 18.326 CB 68 23.488 1.819 7.745 19.889 27.130 CG 134 9.756 0.621 6.366 8.721 11.417 ND1 65 15.432 1.606 10.407 10.209 21.377 CD2 56 20.926 1.852 8.848 16.895 25.652 CE1 22 20.077 1.745 8.690 16.288 23.691 NE2 33 15.552 1.067 6.860 13.214 18.562 Total 978 156.503 4.224 2.699 GLU O 207 15.748 1.216 7.722 12.513 19.422 C 452 8.594 0.509 5.917 7.417 10.535 CA 245 13.262 0.902 6.804 11.144 16.790 N 354 13.360 0.948 7.099 10.838 16.833 CB 80 23.417 1.801 7.691 19.259 28.227 CG 75 23.062 3.000 13.008 3.556 28.818 CD 69 9.387 0.903 9.617 5.524 11.327 OE1 48 15.518 1.343 8.655 9.874 18.286 OE2 22 16.309 1.951 11.962 13.079 22.335 Total 1552 138.657 4.703 3.392 ASP O 241 15.759 1.234 7.829 11.100 20.574 C 519 8.678 0.580 6.680 6.632 11.012 CA 246 13.214 1.019 7.710 11.107 17.720 N 355 13.647 1.003 7.348 11.073 17.257 CB 69 22.484 2.602 11.575 9.509 26.459 CG 123 9.221 1.080 11.709 2.607 10.928 OD1 90 15.127 1.511 9.988 12.201 19.548 OD2 41 15.159 2.200 14.514 9.288 22.577 Total 1684 113.289 4.355 3.844 ARG O 237 15.882 1.132 7.125 12.805 19.952 C 408 8.717 0.616 7.067 3.431 10.771 CA 273 13.253 1.001 7.549 11.125 16.716 N 329 13.424 1.018 7.585 10.623 16.858 CB 117 22.626 1.696 7.496 18.977 27.809 CG 94 23.265 1.815 7.802 18.294 27.220 CD 62 23.079 1.514 6.561 19.438 26.137 NE 81 14.857 1.008 6.787 11.909 17.802 CZ 112 9.500 0.683 7.186 8.335 11.866 NH1 28 21.935 1.421 6.479 19.812 25.830 NH2 21 23.692 2.228 9.405 19.692 28.817 Total 1762 190.231 4.542 2.388 LYS O 231 15.869 1.142 7.199 13.086 19.152 C 525 8.647 0.566 6.550 7.127 10.697 CA 266 13.180 0.908 6.891 10.990 16.590 N 370 13.342 1.053 7.889 10.059 18.470 CB 88 22.582 2.685 11.892 8.929 28.192 CG 71 23.255 3.592 15.447 2.895 28.765 CD 25 22.474 4.729 21.041 2.982 28.589 CE 5 23.189 2.308 9.954 19.103 25.473 NZ 6 21.560 1.283 5.951 19.680 23.588 Total 1587 164.099 7.281 4.437