Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8agu_a.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ARG 4.A O no hydrogen 3.097 N/A MET 1.A N PHE 309.A O no hydrogen 3.155 N/A LYS 2.A NZ GLN 3.A OE1 no hydrogen 2.991 N/A GLN 3.A NE2 LYS 2.A O no hydrogen 3.178 N/A ARG 4.A NH1 GLY 57.A O no hydrogen 2.987 N/A ARG 4.A NH2 GLY 57.A O no hydrogen 3.416 N/A SER 6.A N ASP 9.A OD2 no hydrogen 2.856 N/A LEU 10.A N SER 6.A O no hydrogen 2.760 N/A LEU 11.A N ALA 7.A O no hydrogen 2.930 N/A LEU 12.A N LEU 8.A O no hydrogen 2.890 N/A LEU 13.A N ASP 9.A O no hydrogen 3.140 N/A ALA 14.A N LEU 10.A O no hydrogen 2.832 N/A ARG 15.A N LEU 11.A O no hydrogen 3.041 N/A LEU 17.A N LEU 13.A O no hydrogen 2.937 N/A LYS 18.A N ALA 14.A O no hydrogen 2.719 N/A GLN 19.A N ARG 15.A O no hydrogen 3.294 N/A ASP 20.A N GLU 16.A O no hydrogen 3.079 N/A LEU 21.A N LEU 17.A O no hydrogen 2.669 N/A GLU 22.A N LYS 18.A O no hydrogen 3.352 N/A GLY 23.A N LEU 89.A O no hydrogen 3.052 N/A TYR 24.A N LEU 21.A O no hydrogen 3.177 N/A TYR 24.A OH SER 48.A OG no hydrogen 2.766 N/A ARG 25.A N ASN 44.A O no hydrogen 2.861 N/A LEU 26.A N LYS 87.A O no hydrogen 3.012 N/A ILE 29.A N ASN 28.A OD1 no hydrogen 2.963 N/A TYR 30.A N LEU 40.A O no hydrogen 2.854 N/A ALA 33.A N PRO 68.A O no hydrogen 2.722 N/A SER 35.A N ILE 32.A O no hydrogen 3.254 N/A PHE 39.A N VAL 54.A O no hydrogen 2.661 N/A LEU 40.A N TYR 30.A O no hydrogen 2.649 N/A LEU 41.A N VAL 52.A O no hydrogen 2.805 N/A LYS 42.A N ASN 28.A O no hydrogen 3.008 N/A LYS 42.A NZ ASN 51.A OD1 no hydrogen 3.486 N/A PHE 43.A N LEU 50.A O no hydrogen 2.684 N/A ASN 44.A N ARG 25.A O no hydrogen 2.664 N/A LYS 45.A N SER 48.A O no hydrogen 2.949 N/A SER 48.A N LYS 45.A O no hydrogen 2.892 N/A SER 48.A OG TYR 24.A OH no hydrogen 2.766 N/A LEU 50.A N PHE 43.A O no hydrogen 2.740 N/A VAL 52.A N LEU 41.A O no hydrogen 3.014 N/A VAL 53.A N TYR 61.A O no hydrogen 3.081 N/A VAL 54.A N PHE 39.A O no hydrogen 2.771 N/A ASP 55.A N ARG 59.A O no hydrogen 2.878 N/A CYS 56.A SG LYS 37.A O no hydrogen 3.426 N/A GLY 57.A N GLU 115.A O no hydrogen 2.757 N/A LEU 58.A N ASP 55.A O no hydrogen 3.167 N/A TYR 61.A N VAL 53.A O no hydrogen 3.336 N/A THR 63.A N ASN 51.A O no hydrogen 3.235 N/A GLU 64.A N ASP 338.A OD2 no hydrogen 3.009 N/A PHE 65.A N THR 63.A OG1 no hydrogen 3.289 N/A SER 66.A N LYS 522.A O no hydrogen 2.727 N/A SER 66.A OG LYS 522.A O no hydrogen 3.101 N/A ARG 67.A NE GLU 345.A OE1 no hydrogen 3.138 N/A ARG 67.A NH1 PHE 65.A O no hydrogen 3.183 N/A ARG 67.A NH1 ASP 338.A OD1 no hydrogen 3.188 N/A ARG 67.A NH2 GLU 345.A OE2 no hydrogen 3.399 N/A VAL 78.A N SER 74.A O no hydrogen 2.856 N/A LYS 79.A N GLY 75.A O no hydrogen 3.136 N/A LEU 80.A N PHE 76.A O no hydrogen 3.043 N/A ARG 81.A N VAL 77.A O no hydrogen 2.907 N/A ARG 81.A NE ILE 29.A O no hydrogen 2.829 N/A ARG 81.A NH2 ILE 29.A O no hydrogen 2.884 N/A LYS 82.A N VAL 78.A O no hydrogen 2.934 N/A LEU 84.A N LEU 80.A O no hydrogen 2.828 N/A LYS 85.A N LEU 80.A O no hydrogen 3.342 N/A ALA 86.A N LEU 26.A O no hydrogen 2.732 N/A LYS 87.A N LEU 84.A O no hydrogen 3.327 N/A LEU 89.A N TYR 24.A O no hydrogen 2.827 N/A THR 90.A N GLN 104.A O no hydrogen 2.794 N/A LYS 93.A N VAL 102.A O no hydrogen 2.894 N/A GLN 94.A NE2 ALA 7.A O no hydrogen 3.427 N/A GLN 94.A NE2 ASP 96.A O no hydrogen 3.559 N/A VAL 95.A N ILE 100.A O no hydrogen 2.937 N/A ASP 96.A N GLN 94.A O no hydrogen 2.903 N/A ILE 100.A N ASP 98.A O no hydrogen 2.827 N/A LEU 101.A N LEU 114.A O no hydrogen 2.913 N/A VAL 102.A N LYS 93.A O no hydrogen 2.732 N/A LEU 103.A N LEU 112.A O no hydrogen 2.857 N/A GLN 104.A N ALA 91.A O no hydrogen 2.888 N/A ALA 106.A N ARG 88.A O no hydrogen 2.760 N/A GLY 108.A N THR 90.A OG1 no hydrogen 3.208 N/A HIS 109.A N ALA 106.A O no hydrogen 3.426 N/A HIS 109.A ND1 ALA 106.A O no hydrogen 2.675 N/A PHE 110.A N PHE 105.A O no hydrogen 3.202 N/A TYR 111.A N LEU 125.A O no hydrogen 2.882 N/A LEU 112.A N LEU 103.A O no hydrogen 3.027 N/A VAL 113.A N ILE 123.A O no hydrogen 2.750 N/A LEU 114.A N LEU 101.A O no hydrogen 2.937 N/A PHE 116.A N ARG 99.A O no hydrogen 2.817 N/A GLY 120.A N PHE 117.A O no hydrogen 2.783 N/A ILE 123.A N VAL 113.A O no hydrogen 2.715 N/A LEU 124.A N ALA 133.A O no hydrogen 2.855 N/A LEU 125.A N TYR 111.A O no hydrogen 2.795 N/A ARG 129.A N ASP 126.A O no hydrogen 2.829 N/A ILE 131.A N GLN 147.A O no hydrogen 2.693 N/A MET 132.A N ARG 130.A O no hydrogen 2.906 N/A GLN 135.A N VAL 122.A O no hydrogen 2.859 N/A ARG 136.A N ASN 121.A OD1 no hydrogen 3.449 N/A LYS 144.A NZ VAL 145.A O no hydrogen 3.048 N/A GLN 147.A N LYS 144.A O no hydrogen 3.105 N/A SER 155.A OG ASP 153.A OD2 no hydrogen 2.854 N/A PHE 157.A N ASP 153.A O no hydrogen 3.291 N/A THR 158.A N GLU 154.A O no hydrogen 3.284 N/A THR 158.A OG1 GLU 154.A O no hydrogen 2.964 N/A THR 159.A N SER 155.A O no hydrogen 2.892 N/A THR 159.A OG1 SER 155.A O no hydrogen 3.504 N/A THR 159.A OG1 LEU 156.A O no hydrogen 2.803 N/A THR 159.A OG1 ASN 161.A OD1 no hydrogen 3.015 N/A GLU 162.A N GLU 162.A OE2 no hydrogen 2.942 N/A ASP 165.A N ASN 161.A O no hydrogen 3.249 N/A GLU 166.A N GLU 162.A O no hydrogen 3.151 N/A SER 167.A N SER 163.A O no hydrogen 2.888 N/A SER 167.A OG ALA 164.A O no hydrogen 2.714 N/A ILE 168.A N ALA 164.A O no hydrogen 3.032 N/A GLU 169.A N ASP 165.A O no hydrogen 3.225 N/A LYS 170.A N GLU 166.A O no hydrogen 2.930 N/A LYS 170.A NZ ASN 171.A OD1 no hydrogen 3.164 N/A ASN 171.A N SER 167.A O no hydrogen 2.879 N/A ARG 172.A N ILE 168.A O no hydrogen 3.247 N/A LYS 173.A N GLU 169.A O no hydrogen 3.163 N/A ALA 174.A N LYS 170.A O no hydrogen 2.863 N/A THR 177.A OG1 GLU 179.A OE2 no hydrogen 2.920 N/A LEU 180.A N THR 177.A OG1 no hydrogen 3.359 N/A VAL 181.A N THR 177.A O no hydrogen 3.061 N/A ASN 182.A N SER 178.A O no hydrogen 2.778 N/A GLU 183.A N GLU 179.A O no hydrogen 2.958 N/A TRP 184.A N LEU 180.A O no hydrogen 2.896 N/A ILE 185.A N VAL 181.A O no hydrogen 2.760 N/A LYS 186.A N ASN 182.A O no hydrogen 2.938 N/A ALA 187.A N GLU 183.A O no hydrogen 3.105 N/A VAL 188.A N TRP 184.A O no hydrogen 2.740 N/A GLN 189.A N ILE 185.A O no hydrogen 2.625 N/A ALA 190.A N LYS 186.A O no hydrogen 3.059 N/A LYS 191.A N ALA 187.A O no hydrogen 2.885 N/A TYR 192.A N VAL 188.A O no hydrogen 2.806 N/A GLU 193.A N GLN 189.A O no hydrogen 3.009 N/A SER 194.A N ALA 190.A O no hydrogen 2.993 N/A SER 194.A OG LYS 191.A O no hydrogen 2.705 N/A SER 194.A OG ASP 195.A OD1 no hydrogen 3.493 N/A ASP 195.A N LYS 191.A O no hydrogen 2.906 N/A ILE 196.A N TYR 192.A O no hydrogen 2.879 N/A THR 197.A N GLU 193.A O no hydrogen 3.018 N/A THR 197.A OG1 GLU 193.A O no hydrogen 3.001 N/A VAL 198.A N SER 194.A O no hydrogen 2.944 N/A ILE 199.A N ASP 195.A O no hydrogen 2.792 N/A LYS 200.A N ILE 196.A O no hydrogen 2.901 N/A GLN 201.A N THR 197.A O no hydrogen 3.178 N/A LEU 202.A N VAL 198.A O no hydrogen 2.928 N/A ASN 203.A N ILE 199.A O no hydrogen 2.874 N/A ILE 204.A N LYS 200.A O no hydrogen 2.965 N/A GLN 205.A N GLN 201.A O no hydrogen 3.084 N/A LYS 214.A NZ VAL 215.A O no hydrogen 2.992 N/A LYS 216.A NZ TYR 192.A OH no hydrogen 3.024 N/A HIS 221.A N PRO 247.A O no hydrogen 2.772 N/A LEU 223.A N SER 219.A O no hydrogen 2.825 N/A LEU 224.A N ILE 220.A O no hydrogen 2.879 N/A LEU 225.A N HIS 221.A O no hydrogen 2.774 N/A SER 226.A N LYS 222.A O no hydrogen 2.893 N/A LYS 227.A N LEU 223.A O no hydrogen 2.918 N/A VAL 228.A N LEU 224.A O no hydrogen 2.824 N/A LEU 236.A N SER 232.A O no hydrogen 2.835 N/A SER 237.A N SER 233.A O no hydrogen 2.825 N/A LYS 238.A N ASP 234.A O no hydrogen 3.021 N/A ASN 239.A N LEU 235.A O no hydrogen 2.830 N/A LEU 240.A N LEU 236.A O no hydrogen 2.677 N/A LYS 241.A N SER 237.A O no hydrogen 2.949 N/A VAL 242.A N LYS 238.A O no hydrogen 2.960 N/A PHE 243.A N ASN 239.A O no hydrogen 2.821 N/A ASN 244.A N LYS 241.A O no hydrogen 3.243 N/A ILE 245.A N LEU 240.A O no hydrogen 2.687 N/A ASP 246.A N GLU 249.A OE1 no hydrogen 3.027 N/A GLU 249.A N ASP 246.A O no hydrogen 3.257 N/A LEU 254.A N SER 250.A O no hydrogen 2.794 N/A LEU 255.A N CYS 251.A O no hydrogen 2.979 N/A GLU 256.A N LEU 252.A O no hydrogen 3.191 N/A GLU 257.A N ASN 253.A O no hydrogen 2.752 N/A THR 258.A OG1 ASN 182.A OD1 no hydrogen 2.655 N/A THR 258.A OG1 LEU 255.A O no hydrogen 3.159 N/A SER 260.A OG GLU 257.A OE1 no hydrogen 3.163 N/A LEU 261.A N GLU 257.A O no hydrogen 3.226 N/A ALA 262.A N THR 258.A O no hydrogen 2.995 N/A GLU 263.A N ASP 259.A O no hydrogen 2.828 N/A LEU 264.A N SER 260.A O no hydrogen 2.981 N/A LEU 265.A N LEU 261.A O no hydrogen 2.766 N/A ASN 266.A N ALA 262.A O no hydrogen 2.868 N/A SER 267.A N GLU 263.A O no hydrogen 2.838 N/A THR 268.A N LEU 264.A O no hydrogen 2.829 N/A GLN 269.A N LEU 265.A O no hydrogen 2.899 N/A LEU 270.A N ASN 266.A O no hydrogen 2.919 N/A GLU 271.A N SER 267.A O no hydrogen 2.860 N/A TYR 272.A N THR 268.A O no hydrogen 2.778 N/A ASN 273.A N GLN 269.A O no hydrogen 2.808 N/A GLN 274.A N LEU 270.A O no hydrogen 2.983 N/A LEU 275.A N GLU 271.A O no hydrogen 2.971 N/A LEU 276.A N TYR 272.A O no hydrogen 2.747 N/A THR 277.A N ASN 273.A O no hydrogen 2.857 N/A THR 278.A N GLN 274.A O no hydrogen 3.009 N/A TYR 284.A N HIS 310.A O no hydrogen 2.834 N/A ILE 285.A N ILE 327.A O no hydrogen 2.753 N/A LEU 286.A N THR 308.A O no hydrogen 3.104 N/A ALA 287.A N CYS 325.A O no hydrogen 3.130 N/A LYS 288.A N ILE 305.A O no hydrogen 2.705 N/A ARG 289.A N SER 323.A O no hydrogen 2.872 N/A ASN 292.A N ASN 290.A OD1 no hydrogen 3.320 N/A ILE 294.A N ASP 298.A OD2 no hydrogen 2.922 N/A LYS 297.A NZ ASP 298.A OD2 no hydrogen 2.904 N/A ASP 298.A N ILE 294.A O no hydrogen 2.730 N/A LEU 302.A N THR 299.A OG1 no hydrogen 3.173 N/A GLU 303.A N THR 299.A O no hydrogen 2.941 N/A PHE 304.A N ALA 300.A O no hydrogen 2.988 N/A ILE 305.A N LYS 288.A O no hydrogen 2.991 N/A HIS 310.A N TYR 284.A O no hydrogen 3.033 N/A LYS 313.A NZ PRO 314.A O no hydrogen 3.047 N/A THR 321.A N ASN 317.A O no hydrogen 2.752 N/A THR 321.A OG1 GLY 318.A O no hydrogen 2.747 N/A THR 321.A OG1 ASP 322.A OD1 no hydrogen 3.124 N/A SER 323.A N GLY 319.A O no hydrogen 3.524 N/A SER 323.A OG ASP 320.A O no hydrogen 2.875 N/A SER 324.A N ASP 320.A O no hydrogen 2.739 N/A CYS 325.A N ALA 287.A O no hydrogen 2.811 N/A ILE 327.A N ILE 285.A O no hydrogen 2.534 N/A VAL 329.A N GLY 283.A O no hydrogen 2.891 N/A LEU 337.A N TYR 333.A O no hydrogen 3.004 N/A ASP 338.A N ASN 334.A O no hydrogen 2.847 N/A LYS 339.A N ARG 335.A O no hydrogen 2.817 N/A PHE 340.A N THR 336.A O no hydrogen 3.172 N/A PHE 341.A N LEU 337.A O no hydrogen 2.867 N/A SER 342.A N ASP 338.A O no hydrogen 2.719 N/A SER 342.A OG ASP 338.A O no hydrogen 2.927 N/A SER 342.A OG LYS 339.A O no hydrogen 3.038 N/A THR 343.A N LYS 339.A O no hydrogen 3.152 N/A THR 343.A OG1 LYS 339.A O no hydrogen 3.004 N/A THR 343.A OG1 PHE 340.A O no hydrogen 2.747 N/A ILE 344.A N PHE 340.A O no hydrogen 3.378 N/A GLU 345.A N PHE 341.A O no hydrogen 2.973 N/A SER 346.A N SER 342.A O no hydrogen 2.911 N/A SER 346.A OG SER 342.A O no hydrogen 3.144 N/A SER 346.A OG THR 343.A O no hydrogen 2.814 N/A SER 347.A N THR 343.A O no hydrogen 2.969 N/A SER 347.A OG THR 343.A O no hydrogen 3.216 N/A SER 347.A OG ILE 344.A O no hydrogen 2.445 N/A LYS 348.A N ILE 344.A O no hydrogen 2.979 N/A TYR 349.A N GLU 345.A O no hydrogen 3.091 N/A ALA 350.A N SER 346.A O no hydrogen 3.038 N/A LEU 351.A N SER 347.A O no hydrogen 2.915 N/A ARG 352.A N LYS 348.A O no hydrogen 3.044 N/A ILE 353.A N TYR 349.A O no hydrogen 3.086 N/A GLN 354.A N ALA 350.A O no hydrogen 2.960 N/A ASN 355.A N LEU 351.A O no hydrogen 2.900 N/A GLN 356.A N ARG 352.A O no hydrogen 3.260 N/A SER 358.A N GLN 354.A O no hydrogen 3.087 N/A SER 358.A OG ASN 355.A O no hydrogen 2.735 N/A GLN 359.A N ASN 355.A O no hydrogen 3.061 N/A ALA 360.A N GLN 356.A O no hydrogen 3.153 N/A GLN 361.A N GLU 357.A O no hydrogen 3.086 N/A LYS 362.A N SER 358.A O no hydrogen 3.033 N/A LYS 363.A N GLN 359.A O no hydrogen 2.992 N/A ILE 364.A N ALA 360.A O no hydrogen 3.198 N/A ASP 365.A N GLN 361.A O no hydrogen 3.109 N/A ASP 366.A N LYS 362.A O no hydrogen 2.833 N/A ALA 367.A N LYS 363.A O no hydrogen 3.015 N/A ARG 368.A N ILE 364.A O no hydrogen 3.093 N/A ARG 368.A NE GLU 503.A OE2 no hydrogen 3.350 N/A ARG 368.A NH2 GLU 503.A OE2 no hydrogen 3.046 N/A ALA 369.A N ASP 365.A O no hydrogen 2.970 N/A GLU 370.A N ASP 366.A O no hydrogen 2.847 N/A ASN 371.A N ALA 367.A O no hydrogen 3.043 N/A ASP 372.A N ARG 368.A O no hydrogen 3.005 N/A ARG 373.A N ALA 369.A O no hydrogen 2.876 N/A ARG 373.A NE ALA 369.A O no hydrogen 3.138 N/A LYS 374.A N GLU 370.A O no hydrogen 2.953 N/A ILE 375.A N ASN 371.A O no hydrogen 2.995 N/A GLN 376.A N ASP 372.A O no hydrogen 2.957 N/A GLN 376.A NE2 ASP 380.A OD1 no hydrogen 2.941 N/A ALA 377.A N ARG 373.A O no hydrogen 2.889 N/A LEU 378.A N LYS 374.A O no hydrogen 3.019 N/A LEU 379.A N ILE 375.A O no hydrogen 3.064 N/A ASP 380.A N GLN 376.A O no hydrogen 2.872 N/A VAL 381.A N ALA 377.A O no hydrogen 2.945 N/A GLN 382.A N LEU 378.A O no hydrogen 3.049 N/A GLN 382.A NE2 SER 484.A OG no hydrogen 3.067 N/A GLN 382.A NE2 GLN 488.A OE1 no hydrogen 2.822 N/A GLU 383.A N LEU 379.A O no hydrogen 2.885 N/A LEU 384.A N ASP 380.A O no hydrogen 2.836 N/A ASN 385.A N VAL 381.A O no hydrogen 2.878 N/A GLU 386.A N GLN 382.A O no hydrogen 2.873 N/A ARG 387.A N GLU 383.A O no hydrogen 2.866 N/A LYS 388.A N LEU 384.A O no hydrogen 2.799 N/A GLY 389.A N ASN 385.A O no hydrogen 2.823 N/A HIS 390.A N GLU 386.A O no hydrogen 2.934 N/A HIS 390.A ND1 GLU 386.A O no hydrogen 2.836 N/A LEU 391.A N ARG 387.A O no hydrogen 2.796 N/A ILE 392.A N LYS 388.A O no hydrogen 2.804 N/A ILE 393.A N GLY 389.A O no hydrogen 3.059 N/A GLU 394.A N HIS 390.A O no hydrogen 3.019 N/A ASN 395.A N LEU 391.A O no hydrogen 2.889 N/A ALA 396.A N ILE 393.A O no hydrogen 3.311 N/A ILE 399.A N ASN 395.A O no hydrogen 2.867 N/A GLU 400.A N ALA 396.A O no hydrogen 2.888 N/A GLU 401.A N PRO 397.A O no hydrogen 3.177 N/A VAL 402.A N LEU 398.A O no hydrogen 2.963 N/A LYS 403.A N ILE 399.A O no hydrogen 2.882 N/A LYS 403.A NZ GLU 400.A OE1 no hydrogen 3.154 N/A LYS 403.A NZ GLU 400.A OE2 no hydrogen 3.163 N/A LYS 403.A NZ LEU 468.A O no hydrogen 3.131 N/A LEU 404.A N GLU 400.A O no hydrogen 2.965 N/A ALA 405.A N GLU 401.A O no hydrogen 2.896 N/A VAL 406.A N VAL 402.A O no hydrogen 2.994 N/A GLN 407.A N LYS 403.A O no hydrogen 2.914 N/A GLY 408.A N LEU 404.A O no hydrogen 2.968 N/A LEU 409.A N ALA 405.A O no hydrogen 3.437 N/A ILE 410.A N VAL 406.A O no hydrogen 3.068 N/A ASP 411.A N GLN 407.A O no hydrogen 2.821 N/A GLN 412.A N GLY 408.A O no hydrogen 3.073 N/A GLN 412.A NE2 GLY 408.A O no hydrogen 3.343 N/A GLN 413.A N ILE 410.A O no hydrogen 2.875 N/A ASN 417.A N ASP 415.A OD1 no hydrogen 3.319 N/A THR 418.A OG1 ASP 415.A O no hydrogen 2.709 N/A ILE 419.A N ASP 415.A O no hydrogen 2.871 N/A GLU 420.A N TRP 416.A O no hydrogen 3.097 N/A LYS 421.A N ASN 417.A O no hydrogen 3.117 N/A LEU 422.A N THR 418.A O no hydrogen 3.003 N/A ILE 423.A N ILE 419.A O no hydrogen 3.026 N/A LYS 424.A N GLU 420.A O no hydrogen 3.011 N/A SER 425.A N LYS 421.A O no hydrogen 2.908 N/A GLU 426.A N LEU 422.A O no hydrogen 2.898 N/A GLN 427.A N ILE 423.A O no hydrogen 3.029 N/A GLN 427.A NE2 ALA 434.A O no hydrogen 2.981 N/A LYS 428.A N LYS 424.A O no hydrogen 3.090 N/A LYS 429.A N SER 425.A O no hydrogen 2.830 N/A LYS 429.A NZ GLU 426.A OE2 no hydrogen 3.240 N/A GLY 430.A N GLU 426.A O no hydrogen 2.804 N/A GLY 430.A N GLN 427.A O no hydrogen 3.032 N/A ASN 431.A N GLU 426.A O no hydrogen 2.977 N/A ASN 431.A ND2 GLU 426.A OE1 no hydrogen 3.094 N/A GLN 435.A N ASN 431.A O no hydrogen 3.071 N/A LEU 436.A N ARG 432.A O no hydrogen 3.120 N/A LEU 437.A N ILE 433.A O no hydrogen 3.420 N/A ASN 438.A N SER 449.A O no hydrogen 2.904 N/A LEU 441.A N GLU 420.A OE2 no hydrogen 3.044 N/A GLN 445.A N ASN 442.A OD1 no hydrogen 3.346 N/A ASN 446.A N LEU 443.A O no hydrogen 2.868 N/A LYS 447.A N ASN 442.A O no hydrogen 2.807 N/A ILE 448.A N ILE 464.A O no hydrogen 2.834 N/A VAL 450.A N VAL 462.A O no hydrogen 2.994 N/A LYS 451.A N LEU 436.A O no hydrogen 2.924 N/A LYS 451.A NZ GLN 435.A O no hydrogen 3.350 N/A LEU 452.A N ILE 460.A O no hydrogen 2.765 N/A LEU 454.A N GLU 458.A O no hydrogen 2.668 N/A ILE 460.A N LEU 452.A O no hydrogen 2.659 N/A VAL 462.A N VAL 450.A O no hydrogen 2.929 N/A ILE 464.A N ILE 448.A O no hydrogen 2.698 N/A ASP 465.A N ASN 473.A OD1 no hydrogen 2.981 N/A LEU 466.A N ASN 446.A O no hydrogen 2.977 N/A ALA 470.A N GLU 400.A OE2 no hydrogen 2.998 N/A ALA 472.A N SER 469.A OG no hydrogen 3.099 N/A ASN 473.A N SER 469.A O no hydrogen 2.886 N/A ASN 473.A ND2 ASP 465.A O no hydrogen 3.478 N/A ASN 473.A ND2 LEU 468.A O no hydrogen 3.266 N/A ALA 474.A N ALA 470.A O no hydrogen 3.061 N/A THR 475.A N TYR 471.A O no hydrogen 2.914 N/A THR 475.A OG1 ALA 472.A O no hydrogen 2.614 N/A GLU 476.A N ALA 472.A O no hydrogen 2.969 N/A TYR 477.A N ASN 473.A O no hydrogen 3.295 N/A PHE 478.A N ALA 474.A O no hydrogen 3.071 N/A ASN 479.A N THR 475.A O no hydrogen 2.720 N/A ILE 480.A N GLU 476.A O no hydrogen 2.950 N/A LYS 481.A N TYR 477.A O no hydrogen 3.087 N/A LYS 481.A NZ PHE 478.A O no hydrogen 3.462 N/A LYS 482.A N PHE 478.A O no hydrogen 2.881 N/A THR 483.A N ASN 479.A O no hydrogen 2.907 N/A THR 483.A OG1 ASN 479.A O no hydrogen 3.239 N/A THR 483.A OG1 ILE 480.A O no hydrogen 2.763 N/A SER 484.A N ILE 480.A O no hydrogen 2.953 N/A ALA 485.A N LYS 481.A O no hydrogen 2.920 N/A GLN 486.A N LYS 482.A O no hydrogen 3.047 N/A LYS 487.A N THR 483.A O no hydrogen 2.980 N/A GLN 488.A N SER 484.A O no hydrogen 2.845 N/A LYS 489.A N ALA 485.A O no hydrogen 2.952 N/A LYS 489.A NZ ALA 485.A O no hydrogen 3.057 N/A LYS 490.A N GLN 486.A O no hydrogen 3.238 N/A LYS 490.A NZ GLN 486.A O no hydrogen 3.110 N/A VAL 491.A N LYS 487.A O no hydrogen 2.976 N/A GLU 492.A N GLN 488.A O no hydrogen 2.871 N/A LYS 493.A N LYS 489.A O no hydrogen 3.349 N/A LYS 493.A NZ LYS 489.A O no hydrogen 3.005 N/A ASN 494.A N LYS 490.A O no hydrogen 3.074 N/A VAL 495.A N VAL 491.A O no hydrogen 2.783 N/A ALA 498.A N ASN 494.A O no hydrogen 3.194 N/A MET 499.A N VAL 495.A O no hydrogen 2.905 N/A LYS 500.A N GLY 496.A O no hydrogen 3.345 N/A ASN 501.A N LYS 497.A O no hydrogen 3.145 N/A ILE 502.A N ALA 498.A O no hydrogen 2.894 N/A GLU 503.A N MET 499.A O no hydrogen 2.945 N/A VAL 504.A N LYS 500.A O no hydrogen 3.091 N/A LYS 505.A N ASN 501.A O no hydrogen 3.034 N/A ILE 506.A N ILE 502.A O no hydrogen 3.001 N/A ASP 507.A N GLU 503.A O no hydrogen 3.040 N/A GLN 508.A N VAL 504.A O no hydrogen 3.086 N/A GLN 509.A N LYS 505.A O no hydrogen 3.046 N/A LEU 510.A N ILE 506.A O no hydrogen 2.891 N/A LYS 511.A N ASP 507.A O no hydrogen 3.091 N/A LYS 512.A N GLN 508.A O no hydrogen 3.236 N/A LYS 513.A N GLN 509.A O no hydrogen 2.986 N/A LEU 514.A N LEU 510.A O no hydrogen 3.097 N/A LYS 515.A N LYS 511.A O no hydrogen 3.366 N/A ASP 516.A N LYS 512.A O no hydrogen 3.017 N/A SER 517.A N LYS 513.A O no hydrogen 3.124 N/A SER 517.A OG LYS 513.A O no hydrogen 3.522 N/A SER 517.A OG LEU 514.A O no hydrogen 3.069 N/A LYS 522.A N SER 66.A OG no hydrogen 3.361 N/A LYS 523.A NZ GLU 64.A O no hydrogen 3.248 N/A LYS 523.A NZ ILE 524.A O no hydrogen 3.005 N/A ILE 524.A N GLU 64.A O no hydrogen 2.874 N/A ARG 525.A NH1 GLU 531.A OE2 no hydrogen 2.966 N/A ARG 525.A NH2 GLU 531.A OE1 no hydrogen 3.467 N/A ARG 525.A NH2 GLU 531.A OE2 no hydrogen 3.144 N/A TYR 528.A OH GLU 753.A OE1 no hydrogen 2.764 N/A GLU 531.A N TYR 528.A O no hydrogen 3.095 N/A SER 538.A OG GLN 593.A OE1 no hydrogen 3.002 N/A SER 539.A N GLN 593.A OE1 no hydrogen 3.157 N/A GLU 540.A N SER 538.A OG no hydrogen 3.144 N/A MET 545.A N TRP 577.A O no hydrogen 2.792 N/A MET 546.A N SER 534.A O no hydrogen 2.729 N/A LYS 548.A NZ LYS 532.A O no hydrogen 3.475 N/A THR 553.A N SER 549.A O no hydrogen 2.781 N/A THR 553.A OG1 SER 549.A O no hydrogen 2.729 N/A ASP 554.A N PRO 550.A O no hydrogen 2.915 N/A GLN 555.A N ALA 551.A O no hydrogen 2.861 N/A GLN 555.A NE2 TYR 533.A OH no hydrogen 3.355 N/A ILE 556.A N GLU 552.A O no hydrogen 3.013 N/A TYR 557.A N THR 553.A O no hydrogen 3.055 N/A TYR 557.A OH VAL 621.A O no hydrogen 3.241 N/A SER 558.A N ASP 554.A O no hydrogen 2.958 N/A LYS 559.A N GLN 555.A O no hydrogen 2.761 N/A TYR 560.A N ILE 556.A O no hydrogen 2.781 N/A GLU 562.A N ASP 565.A OD2 no hydrogen 3.062 N/A ASP 565.A N GLU 562.A O no hydrogen 3.194 N/A TYR 567.A N CYS 616.A O no hydrogen 2.702 N/A TYR 567.A OH HIS 575.A ND1 no hydrogen 2.723 N/A MET 568.A N VAL 576.A O no hydrogen 2.885 N/A SER 569.A N TRP 614.A O no hydrogen 2.993 N/A SER 569.A OG ASN 570.A O no hydrogen 3.462 N/A SER 569.A OG SER 574.A O no hydrogen 2.925 N/A ASN 570.A ND2 SER 602.A OG no hydrogen 2.961 N/A ASN 573.A N ASN 570.A O no hydrogen 2.811 N/A SER 574.A OG CYS 598.A O no hydrogen 3.339 N/A SER 574.A OG SER 602.A OG no hydrogen 2.833 N/A HIS 575.A ND1 TYR 567.A OH no hydrogen 2.723 N/A VAL 576.A N MET 568.A O no hydrogen 3.042 N/A TRP 577.A N MET 545.A O no hydrogen 2.990 N/A ILE 578.A N ILE 566.A O no hydrogen 2.988 N/A LYS 579.A NZ TYR 560.A O no hydrogen 3.148 N/A LYS 579.A NZ TYR 747.A OH no hydrogen 3.002 N/A ASN 580.A ND2 ASP 564.A OD2 no hydrogen 2.910 N/A LYS 583.A NZ GLU 562.A OE1 no hydrogen 3.419 N/A LYS 583.A NZ PRO 581.A O no hydrogen 3.127 N/A THR 584.A N GLU 582.A O no hydrogen 2.859 N/A ASN 589.A ND2 GLU 540.A OE2 no hydrogen 3.045 N/A THR 590.A OG1 PRO 587.A O no hydrogen 3.367 N/A LEU 591.A N PRO 587.A O no hydrogen 3.236 N/A MET 592.A N PRO 588.A O no hydrogen 2.907 N/A GLN 593.A N ASN 589.A O no hydrogen 3.047 N/A GLN 593.A NE2 SER 539.A OG no hydrogen 3.087 N/A ALA 594.A N THR 590.A O no hydrogen 2.883 N/A GLY 595.A N LEU 591.A O no hydrogen 2.825 N/A ILE 596.A N MET 592.A O no hydrogen 2.957 N/A LEU 597.A N GLN 593.A O no hydrogen 3.051 N/A CYS 598.A N ALA 594.A O no hydrogen 2.818 N/A CYS 598.A SG SER 574.A O no hydrogen 3.763 N/A CYS 598.A SG SER 574.A OG no hydrogen 3.112 N/A MET 599.A N GLY 595.A O no hydrogen 2.853 N/A SER 600.A N ILE 596.A O no hydrogen 3.093 N/A SER 600.A OG ILE 596.A O no hydrogen 3.052 N/A SER 601.A N LEU 597.A O no hydrogen 3.016 N/A SER 602.A N CYS 598.A O no hydrogen 2.816 N/A SER 602.A OG SER 574.A OG no hydrogen 2.833 N/A SER 602.A OG CYS 598.A O no hydrogen 2.767 N/A GLU 603.A N MET 599.A O no hydrogen 3.224 N/A GLU 603.A N SER 600.A O no hydrogen 3.297 N/A LYS 607.A N GLU 603.A O no hydrogen 3.089 N/A LYS 607.A NZ GLU 603.A O no hydrogen 3.069 N/A LYS 608.A N TRP 605.A O no hydrogen 3.035 N/A ILE 609.A N ALA 604.A O no hydrogen 2.990 N/A SER 612.A OG HIS 647.A ND1 no hydrogen 3.188 N/A TRP 614.A N SER 569.A O no hydrogen 2.866 N/A TRP 615.A N ASN 646.A O no hydrogen 2.663 N/A CYS 616.A N TYR 567.A O no hydrogen 2.804 N/A CYS 616.A SG PHE 617.A O no hydrogen 3.629 N/A CYS 616.A SG ASP 644.A OD1 no hydrogen 2.106 N/A ALA 618.A N ASP 565.A O no hydrogen 3.049 N/A ASN 620.A N PHE 617.A O no hydrogen 3.311 N/A SER 622.A N ARG 638.A O no hydrogen 2.785 N/A SER 622.A OG PHE 624.A O no hydrogen 2.929 N/A LYS 623.A N TYR 557.A OH no hydrogen 3.344 N/A LYS 623.A NZ ASP 554.A OD2 no hydrogen 2.951 N/A LYS 623.A NZ LEU 632.A O no hydrogen 2.956 N/A ASP 625.A N SER 630.A O no hydrogen 3.303 N/A ASN 629.A N ASP 625.A O no hydrogen 3.206 N/A LEU 632.A N LYS 623.A O no hydrogen 3.128 N/A GLY 635.A N ASP 554.A OD1 no hydrogen 2.947 N/A ALA 636.A N PRO 633.A O no hydrogen 3.026 N/A ARG 638.A N SER 622.A O no hydrogen 3.326 N/A ARG 638.A NE ARG 638.A O no hydrogen 2.992 N/A LYS 640.A NZ LYS 619.A O no hydrogen 2.880 N/A LYS 640.A NZ ASN 620.A O no hydrogen 3.166 N/A GLN 645.A NE2 GLU 642.A O no hydrogen 3.252 N/A ASN 646.A N TRP 615.A O no hydrogen 2.815 N/A ASN 646.A ND2 TRP 615.A O no hydrogen 3.299 N/A HIS 647.A ND1 SER 612.A O no hydrogen 3.115 N/A LEU 648.A N PRO 613.A O no hydrogen 2.733 N/A MET 655.A N ILE 786.A O no hydrogen 2.838 N/A GLY 656.A N ALA 772.A O no hydrogen 2.566 N/A PHE 657.A N VAL 784.A O no hydrogen 2.821 N/A GLY 658.A N VAL 770.A O no hydrogen 3.131 N/A LEU 660.A N ILE 768.A O no hydrogen 2.708 N/A LYS 662.A NZ TYR 528.A OH no hydrogen 3.138 N/A VAL 663.A N GLU 753.A O no hydrogen 2.798 N/A LYS 673.A NZ GLY 669.A O no hydrogen 2.992 N/A LEU 674.A N LYS 670.A O no hydrogen 2.918 N/A LYS 675.A N ARG 671.A O no hydrogen 3.044 N/A LYS 676.A N GLY 672.A O no hydrogen 3.226 N/A ILE 677.A N LYS 673.A O no hydrogen 2.948 N/A GLN 678.A N LEU 674.A O no hydrogen 3.101 N/A LYS 679.A N LYS 675.A O no hydrogen 2.918 N/A LYS 680.A N LYS 676.A O no hydrogen 2.948 N/A TYR 681.A N ILE 677.A O no hydrogen 3.070 N/A THR 687.A OG1 ASP 685.A OD2 no hydrogen 2.701 N/A GLU 688.A N ASP 685.A OD2 no hydrogen 3.164 N/A ARG 689.A N ASP 685.A O no hydrogen 3.103 N/A LEU 690.A N GLU 686.A O no hydrogen 3.019 N/A LEU 691.A N THR 687.A O no hydrogen 3.075 N/A ARG 692.A N GLU 688.A O no hydrogen 2.882 N/A LEU 693.A N ARG 689.A O no hydrogen 2.907 N/A GLU 694.A N LEU 690.A O no hydrogen 3.062 N/A ALA 695.A N LEU 691.A O no hydrogen 3.118 N/A LEU 696.A N ARG 692.A O no hydrogen 2.884 N/A GLY 697.A N LEU 693.A O no hydrogen 2.932 N/A THR 698.A OG1 LEU 693.A O no hydrogen 3.480 N/A GLY 701.A N GLY 697.A O no hydrogen 3.479 N/A ILE 702.A N THR 698.A O no hydrogen 3.106 N/A GLU 703.A N LEU 699.A O no hydrogen 2.997 N/A LYS 704.A N LYS 700.A O no hydrogen 2.883 N/A GLN 705.A N GLY 701.A O no hydrogen 2.968 N/A GLN 706.A N ILE 702.A O no hydrogen 3.128 N/A GLN 707.A N GLU 703.A O no hydrogen 2.889 N/A ARG 708.A N LYS 704.A O no hydrogen 2.944 N/A LYS 709.A N GLN 705.A O no hydrogen 3.205 N/A LYS 710.A N GLN 706.A O no hydrogen 3.117 N/A GLU 711.A N GLN 707.A O no hydrogen 2.961 N/A GLU 712.A N ARG 708.A O no hydrogen 3.063 N/A ILE 713.A N LYS 709.A O no hydrogen 3.277 N/A MET 714.A N LYS 710.A O no hydrogen 3.038 N/A LYS 715.A N GLU 711.A O no hydrogen 2.972 N/A ARG 716.A N GLU 712.A O no hydrogen 3.461 N/A GLU 717.A N ILE 713.A O no hydrogen 3.342 N/A VAL 718.A N MET 714.A O no hydrogen 3.028 N/A ARG 719.A N LYS 715.A O no hydrogen 3.155 N/A GLU 720.A N ARG 716.A O no hydrogen 3.215 N/A ASP 721.A N GLU 717.A O no hydrogen 2.946 N/A ARG 722.A N VAL 718.A O no hydrogen 3.013 N/A ARG 722.A NE VAL 718.A O no hydrogen 3.313 N/A LYS 723.A N ARG 719.A O no hydrogen 3.101 N/A ASN 724.A N GLU 720.A O no hydrogen 2.952 N/A LYS 725.A N ASP 721.A O no hydrogen 2.965 N/A ARG 726.A N ARG 722.A O no hydrogen 3.018 N/A ARG 726.A NE LYS 723.A O no hydrogen 3.412 N/A GLU 727.A N LYS 723.A O no hydrogen 3.037 N/A LYS 728.A N ASN 724.A O no hydrogen 3.064 N/A LYS 728.A NZ ASN 724.A O no hydrogen 3.165 N/A GLN 729.A N LYS 725.A O no hydrogen 3.021 N/A ARG 730.A N ARG 726.A O no hydrogen 2.991 N/A ARG 731.A N GLU 727.A O no hydrogen 3.027 N/A LEU 732.A N LYS 728.A O no hydrogen 3.048 N/A GLN 733.A N GLN 729.A O no hydrogen 2.964 N/A ALA 734.A N ARG 730.A O no hydrogen 3.055 N/A LEU 735.A N ARG 731.A O no hydrogen 3.109 N/A LYS 736.A N LEU 732.A O no hydrogen 3.176 N/A PHE 737.A N GLN 733.A O no hydrogen 3.418 N/A THR 738.A N ALA 734.A O no hydrogen 3.323 N/A THR 738.A OG1 LEU 735.A O no hydrogen 2.727 N/A LYS 751.A N TYR 747.A O no hydrogen 3.242 N/A LYS 751.A NZ ASP 748.A OD1 no hydrogen 3.488 N/A SER 752.A N ASP 748.A O no hydrogen 2.974 N/A SER 752.A OG ASP 748.A O no hydrogen 3.419 N/A SER 752.A OG LYS 749.A O no hydrogen 2.735 N/A GLU 753.A N LYS 749.A O no hydrogen 2.998 N/A LEU 754.A N HIS 750.A O no hydrogen 2.869 N/A LYS 755.A N TRP 661.A O no hydrogen 2.709 N/A SER 757.A OG LEU 758.A O no hydrogen 3.461 N/A LYS 760.A NZ ASP 762.A OD1 no hydrogen 3.437 N/A ASP 762.A N ASP 759.A O no hydrogen 3.061 N/A ILE 768.A N LEU 660.A O no hydrogen 2.820 N/A VAL 770.A N GLY 658.A O no hydrogen 2.702 N/A ALA 772.A N GLY 656.A O no hydrogen 3.039 N/A TRP 774.A N VAL 654.A O no hydrogen 3.456 N/A LEU 777.A N PRO 773.A O no hydrogen 3.055 N/A LEU 778.A N PRO 775.A O no hydrogen 3.385 N/A LYS 779.A N ALA 776.A O no hydrogen 3.411 N/A LYS 781.A N PRO 756.A O no hydrogen 3.314 N/A LYS 781.A NZ LEU 758.A O no hydrogen 3.158 N/A LYS 781.A NZ GLU 823.A OE2 no hydrogen 3.236 N/A TYR 782.A OH ASP 819.A OD2 no hydrogen 2.792 N/A LYS 783.A NZ LEU 778.A O no hydrogen 3.164 N/A VAL 784.A N PHE 657.A O no hydrogen 3.042 N/A ILE 786.A N MET 655.A O no hydrogen 2.651 N/A GLN 787.A N LYS 845.A O no hydrogen 2.708 N/A THR 796.A N LYS 792.A O no hydrogen 3.253 N/A THR 796.A OG1 LYS 792.A O no hydrogen 3.273 N/A THR 796.A OG1 LYS 793.A O no hydrogen 2.692 N/A LEU 797.A N LYS 793.A O no hydrogen 2.954 N/A THR 798.A N THR 794.A O no hydrogen 3.199 N/A THR 798.A OG1 LYS 795.A O no hydrogen 2.678 N/A GLU 799.A N LYS 795.A O no hydrogen 3.076 N/A ILE 800.A N THR 796.A O no hydrogen 2.863 N/A LEU 801.A N LEU 797.A O no hydrogen 2.999 N/A HIS 802.A N THR 798.A O no hydrogen 3.050 N/A HIS 802.A ND1 THR 798.A O no hydrogen 2.871 N/A TYR 803.A N GLU 799.A O no hydrogen 2.885 N/A PHE 804.A N ILE 800.A O no hydrogen 2.991 N/A LYS 805.A N LEU 801.A O no hydrogen 2.883 N/A SER 806.A N HIS 802.A O no hydrogen 2.847 N/A SER 806.A OG HIS 802.A O no hydrogen 2.965 N/A SER 806.A OG TYR 803.A O no hydrogen 2.962 N/A ARG 807.A NE TYR 803.A OH no hydrogen 3.445 N/A ARG 807.A NH1 LYS 781.A O no hydrogen 2.991 N/A ARG 807.A NH2 TYR 803.A OH no hydrogen 3.110 N/A ASP 810.A N ASP 819.A O no hydrogen 2.905 N/A ASP 819.A N PRO 808.A O no hydrogen 2.865 N/A TRP 820.A N GLU 823.A OE1 no hydrogen 3.095 N/A GLN 822.A NE2 ASP 762.A O no hydrogen 3.653 N/A HIS 824.A N TRP 820.A O no hydrogen 3.199 N/A HIS 824.A NE2 ASP 819.A OD2 no hydrogen 2.987 N/A GLU 825.A N PRO 821.A O no hydrogen 3.001 N/A MET 826.A N GLN 822.A O no hydrogen 2.861 N/A ILE 827.A N GLU 823.A O no hydrogen 2.956 N/A LYS 828.A N HIS 824.A O no hydrogen 3.040 N/A GLY 829.A N GLU 825.A O no hydrogen 2.869 N/A LEU 830.A N MET 826.A O no hydrogen 2.847 N/A GLU 832.A N GLU 832.A OE1 no hydrogen 2.195 N/A LEU 835.A N LYS 831.A O no hydrogen 3.472 N/A VAL 836.A N GLU 832.A O no hydrogen 2.927 N/A LEU 837.A N GLN 833.A O no hydrogen 3.503 N/A LEU 838.A N ASP 834.A O no hydrogen 3.392 N/A LEU 839.A N LEU 835.A O no hydrogen 3.142 N/A LYS 843.A NZ ASP 842.A O no hydrogen 3.314 N/A LYS 843.A NZ ASP 842.A OD2 no hydrogen 3.531 N/A LEU 844.A N ALA 791.A O no hydrogen 3.009 N/A LYS 845.A N GLN 787.A O no hydrogen 2.664 N/A LYS 845.A NZ GLN 787.A OE1 no hydrogen 3.504 N/A LYS 845.A NZ THR 847.A OG1 no hydrogen 2.937 N/A THR 847.A N LYS 785.A O no hydrogen 2.751 N/A THR 847.A OG1 LYS 785.A O no hydrogen 3.309 N/A THR 847.A OG1 GLN 787.A OE1 no hydrogen 3.014 N/A