Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1taq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N GLY 108.A O no hydrogen 2.631 N/A ARG 4.A N ASP 51.A OD1 no hydrogen 3.212 N/A VAL 5.A N GLU 110.A O no hydrogen 2.919 N/A LEU 6.A N ALA 52.A O no hydrogen 2.857 N/A LEU 7.A N ARG 112.A O no hydrogen 2.976 N/A VAL 8.A N ILE 54.A O no hydrogen 2.753 N/A ASP 9.A N LEU 114.A O no hydrogen 3.203 N/A HIS 11.A N VAL 56.A O no hydrogen 3.077 N/A HIS 12.A N ASP 9.A OD1 no hydrogen 3.108 N/A LEU 13.A N ASP 9.A O no hydrogen 2.832 N/A ALA 14.A N GLY 10.A O no hydrogen 2.836 N/A TYR 15.A N HIS 11.A O no hydrogen 3.197 N/A ARG 16.A N HIS 12.A O no hydrogen 3.038 N/A THR 17.A N LEU 13.A O no hydrogen 3.032 N/A THR 17.A OG1 LEU 13.A O no hydrogen 3.286 N/A THR 17.A OG1 ALA 34.A O no hydrogen 2.912 N/A PHE 18.A N TYR 15.A O no hydrogen 3.200 N/A HIS 19.A N ARG 16.A O no hydrogen 3.075 N/A LEU 24.A N LEU 21.A O no hydrogen 2.839 N/A THR 26.A N GLU 30.A O no hydrogen 2.693 N/A SER 27.A OG GLU 252.A OE1 no hydrogen 3.291 N/A SER 27.A OG GLU 252.A OE2 no hydrogen 3.479 N/A ARG 28.A NH2 ARG 250.A O no hydrogen 3.499 N/A VAL 32.A N LEU 24.A O no hydrogen 2.921 N/A GLN 33.A NE2 LEU 24.A O no hydrogen 3.087 N/A VAL 35.A N GLN 70.A OE1 no hydrogen 2.963 N/A TYR 36.A N VAL 32.A O no hydrogen 2.976 N/A GLY 37.A N GLN 33.A O no hydrogen 2.918 N/A PHE 38.A N ALA 34.A O no hydrogen 2.967 N/A ALA 39.A N VAL 35.A O no hydrogen 2.823 N/A LYS 40.A N TYR 36.A O no hydrogen 2.800 N/A SER 41.A N GLY 37.A O no hydrogen 3.018 N/A SER 41.A OG GLY 37.A O no hydrogen 2.836 N/A SER 41.A OG PHE 38.A O no hydrogen 3.211 N/A LEU 42.A N PHE 38.A O no hydrogen 2.946 N/A LEU 43.A N ALA 39.A O no hydrogen 3.047 N/A LYS 44.A N LYS 40.A O no hydrogen 3.283 N/A LYS 44.A NZ GLU 48.A OE1 no hydrogen 3.108 N/A ALA 45.A N SER 41.A O no hydrogen 3.400 N/A LEU 46.A N LEU 42.A O no hydrogen 2.908 N/A LYS 47.A N LEU 43.A O no hydrogen 2.702 N/A LYS 47.A N LYS 44.A O no hydrogen 3.075 N/A GLU 48.A N ALA 45.A O no hydrogen 2.953 N/A ASP 49.A N ALA 45.A O no hydrogen 2.555 N/A ASP 51.A N ARG 4.A O no hydrogen 3.016 N/A ALA 52.A N ARG 4.A O no hydrogen 3.312 N/A ILE 54.A N LEU 6.A O no hydrogen 3.078 N/A VAL 55.A N ALA 84.A O no hydrogen 2.736 N/A VAL 56.A N VAL 8.A O no hydrogen 2.788 N/A PHE 57.A N LEU 86.A O no hydrogen 3.032 N/A ARG 60.A N THR 63.A OG1 no hydrogen 2.663 N/A ARG 60.A NH2 ASP 58.A O no hydrogen 3.065 N/A PHE 67.A N PRO 64.A O no hydrogen 3.056 N/A ARG 69.A NH1 PRO 31.A O no hydrogen 3.390 N/A ARG 69.A NH1 ASP 66.A OD1 no hydrogen 3.116 N/A ARG 69.A NH2 PRO 31.A O no hydrogen 2.873 N/A GLN 70.A N ASP 66.A O no hydrogen 3.304 N/A GLN 70.A NE2 GLN 33.A OE1 no hydrogen 2.639 N/A GLN 70.A NE2 ASP 66.A OD2 no hydrogen 3.120 N/A LEU 71.A N PHE 67.A O no hydrogen 2.805 N/A ALA 72.A N PRO 68.A O no hydrogen 2.814 N/A ILE 74.A N GLN 70.A O no hydrogen 2.959 N/A LYS 75.A N LEU 71.A O no hydrogen 3.083 N/A GLU 76.A N ALA 72.A O no hydrogen 3.107 N/A LEU 77.A N LEU 73.A O no hydrogen 2.894 N/A VAL 78.A N ILE 74.A O no hydrogen 2.816 N/A ASP 79.A N LYS 75.A O no hydrogen 2.870 N/A LEU 80.A N GLU 76.A O no hydrogen 2.984 N/A LEU 81.A N VAL 78.A O no hydrogen 3.140 N/A GLY 82.A N ASP 79.A O no hydrogen 2.606 N/A LEU 83.A N VAL 78.A O no hydrogen 3.240 N/A ALA 84.A N VAL 53.A O no hydrogen 3.246 N/A LEU 86.A N VAL 55.A O no hydrogen 2.900 N/A GLY 90.A N ALA 59.A O no hydrogen 2.991 N/A TYR 91.A N VAL 88.A O no hydrogen 3.052 N/A ALA 93.A N ASP 58.A OD1 no hydrogen 3.354 N/A ASP 95.A N GLU 92.A O no hydrogen 2.718 N/A LEU 97.A N ALA 93.A O no hydrogen 2.860 N/A ALA 98.A N ASP 94.A O no hydrogen 2.818 N/A SER 99.A N ASP 95.A O no hydrogen 2.923 N/A SER 99.A OG ASP 95.A O no hydrogen 2.920 N/A SER 99.A OG ARG 224.A O no hydrogen 2.904 N/A LEU 100.A N VAL 96.A O no hydrogen 2.748 N/A ALA 101.A N LEU 97.A O no hydrogen 2.866 N/A LYS 102.A N ALA 98.A O no hydrogen 2.959 N/A LYS 102.A NZ GLU 105.A OE1 no hydrogen 2.918 N/A LYS 102.A NZ GLU 105.A OE2 no hydrogen 3.262 N/A LYS 103.A N SER 99.A O no hydrogen 2.949 N/A LYS 103.A NZ GLU 230.A O no hydrogen 2.877 N/A ALA 104.A N LEU 100.A O no hydrogen 3.012 N/A GLU 105.A N ALA 101.A O no hydrogen 2.907 N/A LYS 106.A N LYS 102.A O no hydrogen 2.874 N/A GLU 107.A N LYS 103.A O no hydrogen 2.882 N/A GLY 108.A N GLU 105.A O no hydrogen 3.007 N/A TYR 109.A N ALA 104.A O no hydrogen 2.781 N/A GLU 110.A N GLY 3.A O no hydrogen 2.849 N/A VAL 111.A N ARG 127.A O no hydrogen 2.633 N/A ARG 112.A N VAL 5.A O no hydrogen 2.883 N/A ARG 112.A NH2 ALA 45.A O no hydrogen 3.246 N/A ILE 113.A N HIS 129.A O no hydrogen 3.100 N/A LEU 114.A N LEU 7.A O no hydrogen 2.777 N/A THR 115.A N LEU 131.A O no hydrogen 2.830 N/A THR 115.A OG1 ASP 9.A OD2 no hydrogen 3.354 N/A THR 115.A OG1 ASP 117.A OD1 no hydrogen 2.648 N/A TYR 121.A N LYS 118.A O no hydrogen 2.721 N/A GLN 122.A N ASP 119.A O no hydrogen 3.077 N/A GLN 122.A NE2 ASP 119.A O no hydrogen 3.115 N/A GLN 122.A NE2 LEU 220.A O no hydrogen 2.916 N/A LEU 123.A N LEU 120.A O no hydrogen 3.163 N/A LEU 124.A N TYR 121.A O no hydrogen 3.017 N/A SER 125.A N ILE 128.A O no hydrogen 2.801 N/A SER 125.A OG LEU 124.A O no hydrogen 2.678 N/A ASP 126.A N ASP 126.A OD1 no hydrogen 2.613 N/A HIS 129.A N VAL 111.A O no hydrogen 2.732 N/A VAL 130.A N ILE 138.A O no hydrogen 3.161 N/A LEU 131.A N ILE 113.A O no hydrogen 2.687 N/A HIS 132.A N GLY 135.A O no hydrogen 2.991 N/A GLU 134.A N HIS 132.A ND1 no hydrogen 3.177 N/A GLY 135.A N HIS 132.A O no hydrogen 2.844 N/A TRP 142.A N THR 139.A OG1 no hydrogen 3.404 N/A LEU 143.A N THR 139.A O no hydrogen 3.008 N/A TRP 144.A N PRO 140.A O no hydrogen 3.042 N/A GLU 145.A N ALA 141.A O no hydrogen 2.702 N/A LYS 146.A N TRP 142.A O no hydrogen 2.937 N/A TYR 147.A N LEU 143.A O no hydrogen 2.703 N/A GLY 148.A N LEU 143.A O no hydrogen 2.711 N/A LEU 149.A N LEU 143.A O no hydrogen 3.425 N/A ARG 150.A N GLN 153.A OE1 no hydrogen 3.133 N/A ARG 150.A NH1 ASP 152.A OD1 no hydrogen 3.265 N/A GLN 153.A N ARG 150.A O no hydrogen 2.908 N/A TRP 154.A N PRO 151.A O no hydrogen 3.137 N/A ARG 158.A N TRP 154.A O no hydrogen 3.237 N/A ALA 159.A N ASP 156.A O no hydrogen 2.759 N/A THR 161.A OG1 TYR 157.A O no hydrogen 3.243 N/A ASN 167.A N SER 165.A O no hydrogen 2.515 N/A LYS 177.A N ILE 174.A O no hydrogen 2.825 N/A THR 178.A OG1 LYS 177.A O no hydrogen 2.634 N/A ALA 179.A N THR 178.A OG1 no hydrogen 2.543 N/A ARG 180.A N THR 178.A OG1 no hydrogen 2.854 N/A LEU 183.A N ALA 179.A O no hydrogen 2.669 N/A GLU 185.A N LEU 182.A O no hydrogen 2.747 N/A GLY 187.A N GLU 184.A O no hydrogen 2.937 N/A ALA 191.A N LYS 194.A O no hydrogen 2.610 N/A ALA 191.A N ASN 195.A O no hydrogen 2.873 N/A LYS 194.A NZ LEU 193.A O no hydrogen 2.845 N/A ARG 204.A N LYS 200.A O no hydrogen 2.805 N/A ARG 204.A NE ASP 197.A O no hydrogen 3.436 N/A GLU 205.A N LYS 200.A O no hydrogen 3.353 N/A LYS 206.A N ALA 202.A O no hydrogen 2.774 N/A LEU 208.A N ARG 204.A O no hydrogen 3.369 N/A ALA 209.A N GLU 205.A O no hydrogen 3.017 N/A LYS 215.A NZ ASP 212.A OD1 no hydrogen 2.825 N/A SER 217.A OG ASN 167.A O no hydrogen 3.456 N/A SER 217.A OG ASP 213.A O no hydrogen 2.733 N/A ASP 219.A N LEU 216.A O no hydrogen 3.188 N/A LEU 220.A N SER 217.A O no hydrogen 3.352 N/A ALA 221.A N TRP 218.A O no hydrogen 2.838 N/A LYS 222.A N ASP 219.A O no hydrogen 3.098 N/A LYS 222.A NZ GLU 92.A OE1 no hydrogen 3.224 N/A LYS 222.A NZ ASP 95.A OD2 no hydrogen 3.366 N/A ARG 224.A N ASP 95.A OD1 no hydrogen 3.156 N/A LEU 227.A N SER 99.A OG no hydrogen 3.021 N/A ALA 234.A N ASP 232.A O no hydrogen 3.036 N/A ARG 237.A N GLY 82.A O no hydrogen 2.824 N/A ASP 240.A N LEU 80.A O no hydrogen 2.944 N/A ARG 243.A N ASP 240.A OD1 no hydrogen 3.029 N/A LEU 244.A N ASP 240.A O no hydrogen 2.729 N/A ARG 245.A N ARG 241.A O no hydrogen 3.464 N/A ALA 246.A N GLU 242.A O no hydrogen 3.159 N/A PHE 247.A N ARG 243.A O no hydrogen 2.680 N/A LEU 248.A N LEU 244.A O no hydrogen 2.804 N/A GLU 249.A N ARG 245.A O no hydrogen 2.874 N/A ARG 250.A N ALA 246.A O no hydrogen 3.116 N/A ARG 250.A N PHE 247.A O no hydrogen 2.941 N/A LEU 251.A N PHE 247.A O no hydrogen 3.359 N/A GLU 252.A N GLU 249.A O no hydrogen 3.131 N/A PHE 253.A N LEU 248.A O no hydrogen 2.692 N/A SER 255.A OG GLU 252.A O no hydrogen 3.071 N/A LEU 256.A N PHE 253.A O no hydrogen 3.256 N/A LEU 257.A N GLY 254.A O no hydrogen 2.990 N/A GLU 259.A N LEU 256.A O no hydrogen 3.298 N/A PHE 260.A N LEU 257.A O no hydrogen 2.734 N/A GLY 261.A N HIS 258.A O no hydrogen 3.028 N/A LEU 262.A N GLU 259.A O no hydrogen 3.051 N/A GLU 264.A N GLY 261.A O no hydrogen 3.351 N/A ALA 272.A N VAL 307.A O no hydrogen 3.153 N/A ALA 280.A N PRO 277.A O no hydrogen 3.392 N/A PHE 281.A N ALA 302.A O no hydrogen 2.820 N/A VAL 282.A N ARG 324.A O no hydrogen 2.805 N/A GLY 283.A N ALA 300.A O no hydrogen 2.863 N/A VAL 285.A N ALA 298.A O no hydrogen 2.875 N/A SER 287.A N ASP 295.A O no hydrogen 2.798 N/A SER 287.A OG ASP 295.A O no hydrogen 3.494 N/A ARG 288.A NE GLU 290.A OE1 no hydrogen 3.046 N/A GLU 290.A N GLU 290.A OE1 no hydrogen 2.699 N/A TRP 293.A N GLU 290.A O no hydrogen 3.138 N/A ALA 294.A N PRO 291.A O no hydrogen 3.295 N/A ASP 295.A N SER 287.A OG no hydrogen 2.735 N/A LEU 296.A N TYR 314.A OH no hydrogen 3.443 N/A LEU 297.A N VAL 285.A O no hydrogen 2.629 N/A ALA 298.A N VAL 285.A O no hydrogen 3.107 N/A ALA 300.A N GLY 283.A O no hydrogen 2.865 N/A ALA 301.A N HIS 308.A O no hydrogen 2.772 N/A ALA 302.A N PHE 281.A O no hydrogen 2.781 N/A ARG 303.A N ARG 306.A O no hydrogen 3.400 N/A GLY 304.A N GLU 385.A OE2 no hydrogen 2.958 N/A ARG 306.A N ARG 303.A O no hydrogen 3.090 N/A VAL 307.A N GLU 270.A O no hydrogen 2.942 N/A HIS 308.A N ALA 301.A O no hydrogen 2.763 N/A HIS 308.A ND1 ARG 306.A O no hydrogen 3.167 N/A ARG 309.A NE GLU 376.A OE2 no hydrogen 3.381 N/A ARG 309.A NH2 GLU 376.A OE1 no hydrogen 2.903 N/A ARG 309.A NH2 GLU 376.A OE2 no hydrogen 3.536 N/A ALA 310.A N LEU 299.A O no hydrogen 2.992 N/A TYR 314.A N GLU 312.A OE1 no hydrogen 3.119 N/A TYR 314.A OH ASP 295.A OD1 no hydrogen 2.779 N/A LYS 315.A N GLU 312.A OE2 no hydrogen 3.185 N/A ALA 316.A N GLU 312.A O no hydrogen 2.989 N/A LEU 317.A N PRO 313.A O no hydrogen 2.880 N/A LEU 317.A N TYR 314.A O no hydrogen 3.301 N/A ARG 318.A N LYS 315.A O no hydrogen 2.994 N/A ARG 318.A NH1 TYR 314.A O no hydrogen 2.684 N/A ASP 319.A N ALA 316.A O no hydrogen 2.922 N/A LEU 320.A N LEU 317.A O no hydrogen 3.490 N/A ALA 323.A N PRO 343.A O no hydrogen 3.063 N/A ARG 324.A NE ASP 346.A OD2 no hydrogen 3.302 N/A ARG 324.A NH1 GLY 279.A O no hydrogen 2.628 N/A ARG 324.A NH2 ASP 346.A OD2 no hydrogen 3.286 N/A GLY 325.A N ASP 346.A O no hydrogen 2.896 N/A LEU 326.A N SER 384.A OG no hydrogen 2.879 N/A ALA 328.A N ASP 347.A OD2 no hydrogen 3.342 N/A LYS 329.A NZ GLU 420.A OE1 no hydrogen 2.733 N/A LYS 329.A NZ PHE 539.A O no hydrogen 2.752 N/A LEU 331.A N ALA 328.A O no hydrogen 3.038 N/A SER 332.A N ALA 328.A O no hydrogen 3.232 N/A SER 332.A OG LEU 342.A O no hydrogen 2.483 N/A VAL 333.A N LYS 329.A O no hydrogen 3.125 N/A ALA 335.A N LEU 331.A O no hydrogen 2.874 N/A LEU 336.A N SER 332.A O no hydrogen 2.822 N/A ARG 337.A N VAL 333.A O no hydrogen 3.040 N/A ARG 337.A NE MET 292.A O no hydrogen 3.103 N/A ARG 337.A NH1 GLU 338.A OE2 no hydrogen 2.506 N/A GLU 338.A N LEU 334.A O no hydrogen 2.800 N/A GLY 339.A N LEU 336.A O no hydrogen 2.656 N/A LEU 340.A N ALA 335.A O no hydrogen 2.665 N/A LEU 342.A N LEU 340.A O no hydrogen 3.127 N/A GLY 345.A N ALA 323.A O no hydrogen 2.735 N/A ASP 347.A N TYR 405.A OH no hydrogen 3.362 N/A MET 349.A N ASP 347.A OD1 no hydrogen 2.888 N/A LEU 350.A N ASP 347.A O no hydrogen 3.167 N/A ALA 352.A N PRO 348.A O no hydrogen 2.824 N/A TYR 353.A N MET 349.A O no hydrogen 2.874 N/A TYR 353.A OH THR 544.A O no hydrogen 2.754 N/A LEU 354.A N LEU 350.A O no hydrogen 3.284 N/A LEU 355.A N LEU 351.A O no hydrogen 2.980 N/A ASP 356.A N ALA 352.A O no hydrogen 2.898 N/A SER 358.A N ASP 356.A OD1 no hydrogen 3.133 N/A SER 358.A OG ASP 356.A OD1 no hydrogen 2.797 N/A ASN 359.A N ASP 356.A O no hydrogen 2.777 N/A ASN 359.A ND2 ALA 352.A O no hydrogen 2.955 N/A ASN 359.A ND2 TYR 369.A OH no hydrogen 3.016 N/A GLU 363.A N GLU 363.A OE1 no hydrogen 2.870 N/A GLY 364.A N THR 361.A OG1 no hydrogen 3.288 N/A VAL 365.A N THR 361.A O no hydrogen 2.796 N/A ALA 366.A N PRO 362.A O no hydrogen 2.808 N/A ARG 367.A N GLU 363.A O no hydrogen 3.151 N/A ARG 368.A N GLY 364.A O no hydrogen 2.974 N/A ARG 368.A NH1 SER 358.A OG no hydrogen 3.254 N/A ARG 368.A NH1 ASN 359.A OD1 no hydrogen 2.937 N/A ARG 368.A NH2 ASP 356.A OD2 no hydrogen 3.332 N/A TYR 369.A N VAL 365.A O no hydrogen 3.203 N/A THR 374.A OG1 GLU 379.A OE1 no hydrogen 2.960 N/A GLY 378.A N GLU 376.A OE2 no hydrogen 2.835 N/A GLU 379.A N GLU 376.A O no hydrogen 2.777 N/A ARG 380.A N GLU 376.A O no hydrogen 3.035 N/A ARG 380.A NE PHE 284.A O no hydrogen 3.328 N/A ARG 380.A NH1 THR 374.A O no hydrogen 2.728 N/A ARG 380.A NH2 PHE 284.A O no hydrogen 2.920 N/A ALA 381.A N ALA 377.A O no hydrogen 3.223 N/A ALA 382.A N GLY 378.A O no hydrogen 3.336 N/A LEU 383.A N GLU 379.A O no hydrogen 2.895 N/A SER 384.A N ARG 380.A O no hydrogen 2.916 N/A SER 384.A OG ARG 380.A O no hydrogen 2.738 N/A GLU 385.A N ALA 381.A O no hydrogen 2.983 N/A GLU 385.A N ALA 382.A O no hydrogen 2.919 N/A ARG 386.A N ALA 382.A O no hydrogen 2.984 N/A LEU 387.A N LEU 383.A O no hydrogen 2.998 N/A ALA 389.A N GLU 385.A O no hydrogen 2.974 N/A ASN 390.A N ARG 386.A O no hydrogen 2.812 N/A ASN 390.A ND2 TYR 369.A O no hydrogen 3.622 N/A LEU 391.A N LEU 387.A O no hydrogen 2.955 N/A TRP 392.A N PHE 388.A O no hydrogen 2.836 N/A GLY 393.A N ALA 389.A O no hydrogen 3.376 N/A ARG 394.A N LEU 391.A O no hydrogen 3.178 N/A LEU 395.A N LEU 391.A O no hydrogen 3.223 N/A GLU 396.A N TRP 392.A O no hydrogen 2.841 N/A GLY 397.A N ARG 394.A O no hydrogen 2.838 N/A GLU 398.A N LEU 395.A O no hydrogen 2.693 N/A ARG 400.A NH1 LEU 698.A O no hydrogen 2.922 N/A ARG 400.A NH2 LEU 698.A O no hydrogen 2.907 N/A LEU 402.A N GLU 398.A O no hydrogen 2.878 N/A TRP 403.A N GLU 399.A O no hydrogen 2.986 N/A LEU 404.A N ARG 400.A O no hydrogen 3.308 N/A TYR 405.A N LEU 401.A O no hydrogen 2.961 N/A TYR 405.A OH ASP 346.A OD1 no hydrogen 2.646 N/A ARG 406.A N LEU 402.A O no hydrogen 3.081 N/A GLU 407.A N TRP 403.A O no hydrogen 2.834 N/A VAL 408.A N LEU 404.A O no hydrogen 2.567 N/A GLU 409.A N LEU 404.A O no hydrogen 3.002 N/A ARG 410.A N TYR 405.A O no hydrogen 2.906 N/A LEU 412.A N VAL 408.A O no hydrogen 2.975 N/A SER 413.A N GLU 409.A O no hydrogen 3.088 N/A SER 413.A N ARG 410.A O no hydrogen 3.191 N/A SER 413.A OG GLU 409.A O no hydrogen 2.838 N/A SER 413.A OG ARG 410.A O no hydrogen 2.833 N/A SER 413.A OG GLN 541.A OE1 no hydrogen 3.535 N/A VAL 415.A N PRO 411.A O no hydrogen 3.298 N/A LEU 416.A N LEU 412.A O no hydrogen 2.733 N/A ALA 417.A N SER 413.A O no hydrogen 2.956 N/A HIS 418.A ND1 ALA 414.A O no hydrogen 3.217 N/A MET 419.A N VAL 415.A O no hydrogen 3.158 N/A GLU 420.A N LEU 416.A O no hydrogen 2.916 N/A ALA 421.A N ALA 417.A O no hydrogen 2.990 N/A THR 422.A N MET 419.A O no hydrogen 3.319 N/A THR 422.A OG1 HIS 418.A O no hydrogen 2.616 N/A GLY 423.A N MET 419.A O no hydrogen 3.250 N/A VAL 424.A N LEU 535.A O no hydrogen 2.977 N/A ASP 427.A N GLY 572.A O no hydrogen 2.878 N/A TYR 430.A N ASP 427.A OD1 no hydrogen 2.719 N/A TYR 430.A OH ARG 568.A O no hydrogen 2.845 N/A LEU 431.A N ASP 427.A O no hydrogen 2.873 N/A ARG 432.A N VAL 428.A O no hydrogen 3.042 N/A ALA 433.A N ALA 429.A O no hydrogen 3.285 N/A LEU 434.A N TYR 430.A O no hydrogen 2.628 N/A SER 435.A N LEU 431.A O no hydrogen 2.875 N/A SER 435.A OG ASP 522.A OD1 no hydrogen 2.824 N/A LEU 436.A N ARG 432.A O no hydrogen 2.914 N/A GLU 437.A N ALA 433.A O no hydrogen 2.992 N/A VAL 438.A N LEU 434.A O no hydrogen 2.775 N/A ALA 439.A N SER 435.A O no hydrogen 2.765 N/A GLU 440.A N LEU 436.A O no hydrogen 3.375 N/A GLU 441.A N GLU 437.A O no hydrogen 3.468 N/A ILE 442.A N VAL 438.A O no hydrogen 3.291 N/A ILE 442.A N ALA 439.A O no hydrogen 3.104 N/A ALA 443.A N ALA 439.A O no hydrogen 3.088 N/A ARG 444.A N GLU 440.A O no hydrogen 2.923 N/A GLU 446.A N ILE 442.A O no hydrogen 3.016 N/A GLU 446.A N ALA 443.A O no hydrogen 2.914 N/A ALA 447.A N ALA 443.A O no hydrogen 2.853 N/A GLU 448.A N ARG 444.A O no hydrogen 2.926 N/A VAL 449.A N LEU 445.A O no hydrogen 3.267 N/A PHE 450.A N ALA 447.A O no hydrogen 2.888 N/A ARG 451.A N ALA 447.A O no hydrogen 2.687 N/A LEU 452.A N GLU 448.A O no hydrogen 3.081 N/A HIS 455.A NE2 ASP 471.A OD2 no hydrogen 2.759 N/A SER 461.A N LEU 459.A O no hydrogen 2.798 N/A SER 461.A OG ASN 458.A O no hydrogen 3.552 N/A SER 461.A OG LEU 459.A O no hydrogen 3.506 N/A ARG 462.A NH1 ARG 462.A O no hydrogen 3.031 N/A GLN 464.A N SER 461.A O no hydrogen 2.967 N/A VAL 468.A N GLN 464.A O no hydrogen 2.942 N/A LEU 469.A N GLU 466.A O no hydrogen 3.219 N/A PHE 470.A N ARG 467.A O no hydrogen 2.847 N/A ASP 471.A N ARG 467.A O no hydrogen 3.286 N/A GLY 485.A N LYS 483.A O no hydrogen 2.892 N/A SER 488.A OG GLY 485.A O no hydrogen 2.732 N/A THR 489.A N GLY 485.A O no hydrogen 2.910 N/A THR 489.A OG1 GLY 485.A O no hydrogen 3.304 N/A THR 489.A OG1 LYS 486.A O no hydrogen 2.577 N/A SER 490.A N LYS 486.A O no hydrogen 3.420 N/A SER 490.A OG LYS 486.A O no hydrogen 2.767 N/A SER 490.A OG ARG 487.A O no hydrogen 3.349 N/A ALA 492.A N SER 488.A O no hydrogen 3.285 N/A VAL 493.A N THR 489.A O no hydrogen 2.651 N/A GLU 495.A N VAL 493.A O no hydrogen 2.825 N/A ARG 498.A N GLU 495.A O no hydrogen 3.113 N/A GLU 505.A N PRO 502.A O no hydrogen 2.986 N/A LYS 506.A N PRO 502.A O no hydrogen 2.761 N/A ILE 507.A N ILE 503.A O no hydrogen 3.283 N/A LEU 508.A N GLU 505.A O no hydrogen 2.906 N/A GLN 509.A N GLU 505.A O no hydrogen 3.127 N/A TYR 510.A N LYS 506.A O no hydrogen 2.959 N/A ARG 511.A N ILE 507.A O no hydrogen 3.034 N/A ARG 511.A NH2 SER 490.A O no hydrogen 2.555 N/A GLU 512.A N LEU 508.A O no hydrogen 2.855 N/A LEU 513.A N GLN 509.A O no hydrogen 3.133 N/A THR 514.A N TYR 510.A O no hydrogen 3.004 N/A THR 514.A OG1 ARG 511.A O no hydrogen 2.877 N/A LEU 516.A N GLU 512.A O no hydrogen 3.048 N/A LYS 517.A N LEU 513.A O no hydrogen 3.082 N/A SER 518.A N THR 514.A O no hydrogen 2.774 N/A SER 518.A OG THR 514.A O no hydrogen 3.209 N/A SER 518.A OG LYS 515.A O no hydrogen 2.857 N/A THR 519.A N LYS 515.A O no hydrogen 2.732 N/A THR 519.A OG1 LYS 515.A O no hydrogen 2.940 N/A TYR 520.A N LEU 516.A O no hydrogen 2.864 N/A TYR 520.A OH ASN 555.A O no hydrogen 2.910 N/A ILE 521.A N LYS 517.A O no hydrogen 2.917 N/A ASP 522.A N LYS 517.A O no hydrogen 3.116 N/A LEU 527.A N LEU 524.A O no hydrogen 3.194 N/A HIS 529.A N ARG 534.A O no hydrogen 3.054 N/A HIS 529.A NE2 MET 292.A O no hydrogen 2.935 N/A ARG 531.A N HIS 529.A ND1 no hydrogen 3.334 N/A ARG 531.A NH1 GLU 338.A OE2 no hydrogen 3.061 N/A THR 532.A OG1 ARG 534.A O no hydrogen 3.420 N/A THR 532.A OG1 HIS 536.A NE2 no hydrogen 2.652 N/A GLY 533.A N HIS 529.A O no hydrogen 2.642 N/A ARG 534.A N THR 532.A OG1 no hydrogen 3.076 N/A ARG 534.A NH1 GLY 423.A O no hydrogen 2.631 N/A ARG 534.A NH1 GLU 765.A OE1 no hydrogen 3.234 N/A ARG 534.A NH2 GLU 765.A OE1 no hydrogen 2.908 N/A ARG 534.A NH2 GLU 765.A OE2 no hydrogen 3.247 N/A LEU 535.A N VAL 424.A O no hydrogen 2.903 N/A HIS 536.A ND1 GLU 420.A O no hydrogen 2.859 N/A HIS 536.A NE2 THR 532.A OG1 no hydrogen 2.652 N/A ARG 538.A N CYS 552.A O no hydrogen 2.846 N/A ARG 538.A NH1 ASP 553.A OD2 no hydrogen 2.837 N/A PHE 539.A N GLU 420.A OE1 no hydrogen 3.393 N/A ASN 540.A N CYS 550.A O no hydrogen 2.628 N/A GLN 541.A NE2 SER 413.A OG no hydrogen 3.336 N/A THR 542.A N ASN 540.A OD1 no hydrogen 3.393 N/A THR 542.A OG1 THR 360.A O no hydrogen 3.433 N/A THR 542.A OG1 ASN 540.A OD1 no hydrogen 3.330 N/A THR 544.A N THR 542.A O no hydrogen 2.912 N/A THR 544.A OG1 ARG 548.A O no hydrogen 2.654 N/A GLY 547.A N THR 544.A OG1 no hydrogen 3.141 N/A CYS 550.A N ASN 540.A O no hydrogen 2.913 N/A CYS 551.A SG ASN 555.A OD1 no hydrogen 4.021 N/A CYS 552.A N ARG 538.A O no hydrogen 3.002 N/A GLN 557.A N ASN 555.A OD1 no hydrogen 3.242 N/A ASN 558.A N ASN 555.A O no hydrogen 3.134 N/A ILE 559.A N LEU 556.A O no hydrogen 3.096 N/A GLY 566.A N THR 563.A OG1 no hydrogen 2.937 N/A GLN 567.A N THR 563.A O no hydrogen 3.120 N/A ARG 568.A N PRO 564.A O no hydrogen 3.237 N/A ARG 568.A NE PRO 564.A O no hydrogen 2.851 N/A ARG 568.A NH1 GLU 437.A OE2 no hydrogen 3.052 N/A ARG 568.A NH1 GLU 441.A OE1 no hydrogen 3.512 N/A ARG 568.A NH1 GLU 441.A OE2 no hydrogen 2.771 N/A ILE 569.A N LEU 565.A O no hydrogen 2.789 N/A ARG 570.A N GLY 566.A O no hydrogen 3.042 N/A ARG 570.A NH1 TRP 802.A O no hydrogen 3.056 N/A ARG 571.A N ARG 568.A O no hydrogen 3.293 N/A ARG 571.A NH1 ARG 571.A O no hydrogen 2.962 N/A GLY 572.A N ILE 569.A O no hydrogen 2.988 N/A PHE 573.A N ARG 570.A O no hydrogen 3.158 N/A ILE 574.A N ARG 425.A O no hydrogen 2.984 N/A ALA 575.A N GLU 800.A O no hydrogen 2.685 N/A GLU 576.A N GLU 765.A OE2 no hydrogen 3.058 N/A TRP 579.A N GLU 576.A O no hydrogen 2.880 N/A LEU 580.A N ALA 766.A O no hydrogen 2.762 N/A LEU 581.A N GLY 799.A O no hydrogen 2.616 N/A VAL 582.A N LEU 764.A O no hydrogen 2.946 N/A ALA 583.A N GLY 797.A O no hydrogen 3.016 N/A LEU 584.A N LEU 762.A O no hydrogen 2.871 N/A ASP 585.A N GLU 795.A O no hydrogen 2.657 N/A TYR 586.A N ASP 760.A O no hydrogen 2.965 N/A TYR 586.A OH MET 782.A O no hydrogen 2.910 N/A SER 587.A N GLU 793.A O no hydrogen 2.863 N/A LEU 591.A N GLN 588.A O no hydrogen 2.946 N/A ARG 592.A N GLN 588.A O no hydrogen 3.047 N/A ARG 592.A NE PRO 791.A O no hydrogen 3.061 N/A ARG 592.A NH1 SER 587.A O no hydrogen 3.214 N/A VAL 593.A N ILE 589.A O no hydrogen 2.852 N/A LEU 594.A N GLU 590.A O no hydrogen 2.859 N/A ALA 595.A N LEU 591.A O no hydrogen 2.889 N/A HIS 596.A N ARG 592.A O no hydrogen 3.433 N/A LEU 597.A N VAL 593.A O no hydrogen 2.948 N/A SER 598.A N LEU 594.A O no hydrogen 2.733 N/A SER 598.A OG LEU 594.A O no hydrogen 2.623 N/A SER 598.A OG ALA 595.A O no hydrogen 3.309 N/A GLY 599.A N ALA 595.A O no hydrogen 2.819 N/A ASP 600.A N SER 598.A OG no hydrogen 3.255 N/A LEU 603.A N ASP 600.A O no hydrogen 3.053 N/A LEU 603.A N ASP 600.A OD2 no hydrogen 2.767 N/A ILE 604.A N ASP 600.A O no hydrogen 2.710 N/A ARG 605.A N GLU 601.A O no hydrogen 2.698 N/A VAL 606.A N ASN 602.A O no hydrogen 3.290 N/A PHE 607.A N LEU 603.A O no hydrogen 3.351 N/A GLN 608.A N ILE 604.A O no hydrogen 2.923 N/A GLU 609.A N ARG 605.A O no hydrogen 2.735 N/A GLY 610.A N VAL 606.A O no hydrogen 3.017 N/A ARG 611.A N VAL 606.A O no hydrogen 2.993 N/A HIS 614.A N ASP 612.A OD1 no hydrogen 2.942 N/A THR 615.A N ASP 612.A O no hydrogen 2.890 N/A THR 615.A N ASP 612.A OD1 no hydrogen 2.993 N/A GLU 616.A N ASP 612.A O no hydrogen 3.031 N/A THR 617.A N ILE 613.A O no hydrogen 3.014 N/A THR 617.A OG1 ILE 613.A O no hydrogen 2.454 N/A ALA 618.A N HIS 614.A O no hydrogen 3.251 N/A SER 619.A N THR 615.A O no hydrogen 2.806 N/A SER 619.A OG VAL 624.A O no hydrogen 2.816 N/A TRP 620.A N GLU 616.A O no hydrogen 3.089 N/A MET 621.A N ALA 618.A O no hydrogen 3.284 N/A PHE 622.A N ALA 618.A O no hydrogen 2.808 N/A ARG 626.A NE GLU 616.A OE2 no hydrogen 2.791 N/A ARG 626.A NH2 GLU 616.A OE1 no hydrogen 2.869 N/A ARG 626.A NH2 GLU 616.A OE2 no hydrogen 3.150 N/A ALA 628.A N PRO 625.A O no hydrogen 2.715 N/A VAL 629.A N ARG 626.A O no hydrogen 2.916 N/A MET 633.A N ASP 630.A OD1 no hydrogen 3.069 N/A ARG 634.A N ASP 630.A O no hydrogen 3.101 N/A ARG 634.A NE ASP 612.A OD1 no hydrogen 3.238 N/A ARG 634.A NE ASP 612.A OD2 no hydrogen 3.397 N/A ARG 634.A NE THR 615.A OG1 no hydrogen 3.409 N/A ARG 634.A NH2 ASP 612.A OD1 no hydrogen 3.003 N/A ARG 634.A NH2 ASP 612.A OD2 no hydrogen 2.697 N/A ARG 635.A N PRO 631.A O no hydrogen 3.088 N/A ARG 635.A N LEU 632.A O no hydrogen 3.003 N/A ALA 636.A N LEU 632.A O no hydrogen 2.973 N/A ALA 637.A N MET 633.A O no hydrogen 3.031 N/A LYS 638.A N ARG 634.A O no hydrogen 2.942 N/A THR 639.A N ARG 635.A O no hydrogen 3.121 N/A ILE 640.A N ALA 636.A O no hydrogen 3.032 N/A ASN 641.A N ALA 637.A O no hydrogen 2.867 N/A ASN 641.A ND2 ILE 613.A O no hydrogen 3.407 N/A ASN 641.A ND2 THR 617.A OG1 no hydrogen 3.115 N/A PHE 642.A N THR 639.A O no hydrogen 2.961 N/A GLY 643.A N THR 639.A O no hydrogen 2.529 N/A VAL 644.A N ILE 640.A O no hydrogen 2.783 N/A TYR 646.A N GLY 643.A O no hydrogen 3.139 N/A GLY 647.A N VAL 644.A O no hydrogen 2.851 N/A SER 649.A N GLY 647.A O no hydrogen 2.787 N/A SER 649.A OG MET 648.A O no hydrogen 2.607 N/A ARG 652.A N SER 649.A OG no hydrogen 3.246 N/A LEU 653.A N SER 649.A O no hydrogen 3.086 N/A SER 654.A N ALA 650.A O no hydrogen 2.707 N/A SER 654.A OG ILE 659.A O no hydrogen 3.175 N/A GLN 655.A N HIS 651.A O no hydrogen 2.698 N/A GLU 656.A N ARG 652.A O no hydrogen 2.659 N/A LEU 657.A N LEU 653.A O no hydrogen 3.197 N/A ILE 659.A N LEU 657.A O no hydrogen 2.727 N/A ALA 664.A N PRO 660.A O no hydrogen 3.244 N/A GLN 665.A N TYR 661.A O no hydrogen 3.064 N/A GLN 665.A N GLU 662.A O no hydrogen 3.057 N/A ALA 666.A N GLU 662.A O no hydrogen 3.236 N/A PHE 667.A N GLU 663.A O no hydrogen 2.938 N/A ILE 668.A N ALA 664.A O no hydrogen 3.305 N/A GLU 669.A N GLN 665.A O no hydrogen 3.189 N/A ARG 670.A N ALA 666.A O no hydrogen 2.973 N/A ARG 670.A NH1 MET 621.A O no hydrogen 2.705 N/A TYR 671.A N PHE 667.A O no hydrogen 3.073 N/A TYR 671.A OH ASN 641.A OD1 no hydrogen 3.064 N/A PHE 672.A N ILE 668.A O no hydrogen 2.970 N/A GLN 673.A N GLU 669.A O no hydrogen 2.767 N/A GLN 673.A N ARG 670.A O no hydrogen 3.060 N/A GLN 673.A NE2 GLU 669.A OE1 no hydrogen 3.265 N/A SER 674.A N ARG 670.A O no hydrogen 3.015 N/A SER 674.A OG ARG 670.A O no hydrogen 2.514 N/A SER 674.A OG TYR 671.A O no hydrogen 3.013 N/A LYS 677.A NZ GLU 601.A OE2 no hydrogen 3.210 N/A VAL 678.A N PHE 675.A O no hydrogen 3.259 N/A ARG 679.A NH2 GLU 669.A OE1 no hydrogen 3.281 N/A ALA 680.A N PRO 676.A O no hydrogen 2.904 N/A TRP 681.A N LYS 677.A O no hydrogen 2.764 N/A ILE 682.A N VAL 678.A O no hydrogen 3.171 N/A GLU 683.A N ARG 679.A O no hydrogen 2.958 N/A LYS 684.A N ALA 680.A O no hydrogen 2.970 N/A LYS 684.A NZ GLU 687.A OE1 no hydrogen 3.227 N/A THR 685.A N TRP 681.A O no hydrogen 2.815 N/A THR 685.A OG1 TRP 681.A O no hydrogen 2.579 N/A LEU 686.A N ILE 682.A O no hydrogen 3.134 N/A GLU 688.A N LYS 684.A O no hydrogen 2.800 N/A GLY 689.A N THR 685.A O no hydrogen 2.828 N/A ARG 690.A N LEU 686.A O no hydrogen 2.762 N/A ARG 691.A N GLU 687.A O no hydrogen 2.779 N/A ARG 692.A N GLU 688.A O no hydrogen 2.748 N/A GLY 693.A N GLY 689.A O no hydrogen 2.768 N/A VAL 695.A N ARG 703.A O no hydrogen 3.270 N/A THR 697.A N ARG 701.A O no hydrogen 3.251 N/A THR 697.A OG1 ASP 734.A OD2 no hydrogen 3.028 N/A LEU 698.A N THR 731.A OG1 no hydrogen 2.993 N/A GLY 700.A N THR 697.A O no hydrogen 2.993 N/A ARG 701.A N THR 697.A OG1 no hydrogen 3.043 N/A ARG 701.A NE ASP 734.A OD1 no hydrogen 2.970 N/A ARG 701.A NH2 GLU 409.A OE2 no hydrogen 2.687 N/A ARG 701.A NH2 ASP 734.A OD1 no hydrogen 3.253 N/A ARG 702.A NE GLU 696.A OE2 no hydrogen 3.356 N/A ARG 702.A NH1 GLU 398.A OE1 no hydrogen 3.331 N/A ARG 702.A NH1 GLU 398.A OE2 no hydrogen 3.022 N/A ARG 702.A NH2 GLU 696.A OE2 no hydrogen 3.162 N/A ARG 703.A N VAL 695.A O no hydrogen 3.476 N/A ARG 703.A NE ALA 545.A O no hydrogen 2.925 N/A VAL 705.A N GLY 693.A O no hydrogen 2.898 N/A LYS 713.A NZ GLU 717.A OE2 no hydrogen 2.722 N/A VAL 715.A N VAL 712.A O no hydrogen 2.962 N/A ARG 716.A N VAL 712.A O no hydrogen 2.873 N/A GLU 717.A N LYS 713.A O no hydrogen 2.993 N/A ALA 718.A N VAL 715.A O no hydrogen 3.089 N/A ALA 719.A N VAL 715.A O no hydrogen 3.409 N/A GLU 720.A N ARG 716.A O no hydrogen 3.194 N/A ARG 721.A N ALA 718.A O no hydrogen 2.887 N/A ARG 721.A NH1 GLU 717.A O no hydrogen 2.988 N/A ARG 721.A NH2 MET 648.A O no hydrogen 3.182 N/A MET 722.A N ALA 718.A O no hydrogen 3.237 N/A ALA 723.A N ALA 719.A O no hydrogen 2.660 N/A ASN 725.A N ARG 721.A O no hydrogen 2.959 N/A GLN 729.A NE2 GLU 590.A OE2 no hydrogen 3.357 N/A GLY 730.A N MET 726.A O no hydrogen 2.529 N/A THR 731.A N PRO 727.A O no hydrogen 2.899 N/A THR 731.A OG1 PRO 727.A O no hydrogen 2.659 N/A ALA 732.A N VAL 728.A O no hydrogen 3.157 N/A ALA 733.A N GLN 729.A O no hydrogen 2.796 N/A ASP 734.A N GLY 730.A O no hydrogen 2.904 N/A LEU 735.A N THR 731.A O no hydrogen 2.992 N/A MET 736.A N ALA 732.A O no hydrogen 3.322 N/A LYS 737.A N ALA 733.A O no hydrogen 2.984 N/A LYS 737.A NZ GLY 547.A O no hydrogen 2.595 N/A LEU 738.A N ASP 734.A O no hydrogen 3.018 N/A ALA 739.A N LEU 735.A O no hydrogen 2.852 N/A MET 740.A N MET 736.A O no hydrogen 2.860 N/A VAL 741.A N LYS 737.A O no hydrogen 3.026 N/A LYS 742.A N LEU 738.A O no hydrogen 3.096 N/A LYS 742.A N ALA 739.A O no hydrogen 2.850 N/A LYS 742.A NZ VAL 785.A O no hydrogen 2.534 N/A LEU 743.A N ALA 739.A O no hydrogen 2.859 N/A PHE 744.A N MET 740.A O no hydrogen 2.851 N/A ARG 746.A N LEU 743.A O no hydrogen 2.865 N/A ARG 746.A NE LYS 742.A O no hydrogen 3.479 N/A ARG 746.A NH2 LYS 742.A O no hydrogen 3.161 N/A LEU 747.A N LEU 743.A O no hydrogen 3.294 N/A LEU 747.A N PHE 744.A O no hydrogen 3.140 N/A MET 750.A N ARG 746.A O no hydrogen 3.226 N/A GLY 751.A N GLU 748.A O no hydrogen 3.026 N/A ALA 752.A N LEU 747.A O no hydrogen 2.836 N/A ARG 753.A N GLU 765.A O no hydrogen 2.735 N/A ARG 753.A NH1 GLU 765.A OE1 no hydrogen 3.234 N/A LEU 755.A N VAL 763.A O no hydrogen 2.802 N/A LEU 756.A N VAL 763.A O no hydrogen 3.203 N/A VAL 758.A N GLU 761.A O no hydrogen 2.996 N/A HIS 759.A N GLN 557.A OE1 no hydrogen 2.889 N/A GLU 761.A N VAL 758.A O no hydrogen 2.750 N/A LEU 762.A N LEU 584.A O no hydrogen 2.871 N/A VAL 763.A N LEU 756.A O no hydrogen 2.792 N/A LEU 764.A N VAL 582.A O no hydrogen 2.760 N/A GLU 765.A N ARG 753.A O no hydrogen 2.846 N/A ALA 766.A N LEU 580.A O no hydrogen 2.912 N/A LYS 768.A N GLY 578.A O no hydrogen 3.043 N/A ALA 771.A N PRO 767.A O no hydrogen 2.861 N/A ALA 771.A N LYS 768.A O no hydrogen 3.330 N/A VAL 774.A N ARG 770.A O no hydrogen 2.862 N/A ALA 775.A N ALA 771.A O no hydrogen 2.779 N/A ARG 776.A N GLU 772.A O no hydrogen 3.146 N/A LEU 777.A N ALA 773.A O no hydrogen 2.933 N/A ALA 778.A N VAL 774.A O no hydrogen 2.965 N/A LYS 779.A N ALA 775.A O no hydrogen 3.111 N/A LYS 779.A NZ GLU 783.A OE2 no hydrogen 2.918 N/A LYS 779.A NZ GLU 793.A OE2 no hydrogen 3.250 N/A GLU 780.A N ARG 776.A O no hydrogen 3.214 N/A VAL 781.A N LEU 777.A O no hydrogen 3.065 N/A MET 782.A N ALA 778.A O no hydrogen 2.842 N/A GLU 783.A N LYS 779.A O no hydrogen 2.753 N/A GLY 784.A N GLU 780.A O no hydrogen 2.850 N/A VAL 785.A N MET 782.A O no hydrogen 3.252 N/A ALA 789.A N HIS 596.A ND1 no hydrogen 3.006 N/A VAL 794.A N GLU 783.A OE2 no hydrogen 3.137 N/A VAL 794.A N GLU 793.A OE2 no hydrogen 3.070 N/A GLU 795.A N ASP 585.A O no hydrogen 2.627 N/A GLY 797.A N ALA 583.A O no hydrogen 2.860 N/A GLY 799.A N LEU 581.A O no hydrogen 2.906 N/A TRP 802.A N PHE 573.A O no hydrogen 2.957 N/A TRP 802.A NE1 GLU 761.A OE2 no hydrogen 3.342 N/A SER 804.A N ASP 801.A O no hydrogen 2.794 N/A SER 804.A OG ASP 801.A OD1 no hydrogen 2.657 N/A