Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mtd_v.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLY 43.A O no hydrogen 3.204 N/A PHE 3.A N ILE 45.A O no hydrogen 2.913 N/A THR 4.A N GLN 7.A OE1 no hydrogen 3.073 N/A VAL 5.A N THR 4.A OG1 no hydrogen 2.715 N/A ILE 8.A N THR 4.A O no hydrogen 2.981 N/A ARG 9.A N VAL 5.A O no hydrogen 2.893 N/A ARG 9.A NE ASP 444.A OD1 no hydrogen 2.616 N/A ARG 9.A NE ASP 444.A OD2 no hydrogen 3.097 N/A ARG 9.A NH1 ARG 9.A O no hydrogen 3.039 N/A ARG 9.A NH2 ASP 444.A OD2 no hydrogen 2.673 N/A ALA 10.A N ASP 6.A O no hydrogen 3.337 N/A ILE 11.A N GLN 7.A O no hydrogen 3.369 N/A MET 12.A N ILE 8.A O no hydrogen 2.913 N/A LYS 15.A NZ SER 368.A O no hydrogen 3.347 N/A ASN 17.A ND2 ASP 75.A O no hydrogen 2.515 N/A ARG 19.A N LEU 80.A O no hydrogen 2.895 N/A ARG 19.A NE LEU 339.A O no hydrogen 2.449 N/A ARG 19.A NH1 ILE 18.A O no hydrogen 3.251 N/A ASN 20.A N ASN 20.A OD1 no hydrogen 2.416 N/A SER 22.A N GLY 105.A O no hydrogen 2.918 N/A SER 22.A OG GLY 105.A O no hydrogen 3.401 N/A ILE 24.A N LEU 107.A O no hydrogen 2.946 N/A LYS 31.A NZ SER 86.A O no hydrogen 2.867 N/A THR 33.A OG1 GLY 30.A O no hydrogen 2.792 N/A LEU 34.A N GLY 30.A O no hydrogen 2.934 N/A THR 35.A N LYS 31.A O no hydrogen 2.836 N/A THR 35.A OG1 LYS 31.A O no hydrogen 2.576 N/A ASP 36.A N SER 32.A O no hydrogen 2.914 N/A SER 37.A N THR 33.A O no hydrogen 2.918 N/A SER 37.A OG THR 33.A O no hydrogen 3.565 N/A SER 37.A OG LEU 34.A O no hydrogen 2.371 N/A LEU 38.A N LEU 34.A O no hydrogen 3.008 N/A VAL 39.A N THR 35.A O no hydrogen 2.917 N/A CYS 40.A N ASP 36.A O no hydrogen 2.878 N/A LYS 41.A N SER 37.A O no hydrogen 2.957 N/A ALA 42.A N LEU 38.A O no hydrogen 2.926 N/A GLY 43.A N VAL 39.A O no hydrogen 2.836 N/A ILE 44.A N SER 57.A O no hydrogen 3.520 N/A ILE 45.A N VAL 1.A O no hydrogen 3.114 N/A THR 50.A OG1 SER 386.A OG no hydrogen 2.936 N/A SER 53.A OG ASP 85.A OD2 no hydrogen 2.754 N/A THR 54.A N SER 53.A OG no hydrogen 2.661 N/A THR 54.A OG1 LYS 52.A O no hydrogen 3.195 N/A ALA 55.A N SER 53.A O no hydrogen 2.701 N/A ILE 56.A N LEU 83.A O no hydrogen 2.940 N/A LEU 58.A N ILE 81.A O no hydrogen 2.870 N/A PHE 59.A N ALA 42.A O no hydrogen 3.224 N/A TYR 60.A N PHE 79.A O no hydrogen 2.935 N/A SER 63.A OG ASN 65.A OD1 no hydrogen 2.967 N/A GLU 64.A N GLU 64.A OE1 no hydrogen 2.751 N/A ASP 66.A N SER 63.A O no hydrogen 2.744 N/A LEU 67.A N SER 63.A O no hydrogen 2.931 N/A ASN 68.A ND2 GLY 226.A O no hydrogen 2.365 N/A GLN 72.A NE2 LEU 339.A O no hydrogen 3.480 N/A PHE 79.A N TYR 60.A O no hydrogen 2.884 N/A LEU 80.A N ASN 17.A O no hydrogen 2.974 N/A ILE 81.A N LEU 58.A O no hydrogen 2.877 N/A ASN 82.A N ARG 19.A O no hydrogen 2.935 N/A ILE 84.A N MET 21.A O no hydrogen 2.890 N/A SER 86.A OG VAL 23.A O no hydrogen 2.354 N/A SER 86.A OG SER 86.A O no hydrogen 2.550 N/A PHE 92.A N HIS 89.A O no hydrogen 2.989 N/A THR 97.A N SER 93.A O no hydrogen 2.863 N/A ALA 98.A N SER 94.A O no hydrogen 2.922 N/A ALA 99.A N GLU 95.A O no hydrogen 2.886 N/A LEU 100.A N VAL 96.A O no hydrogen 2.835 N/A ARG 101.A N ALA 98.A O no hydrogen 3.376 N/A VAL 102.A N ALA 99.A O no hydrogen 3.035 N/A THR 103.A N ALA 99.A O no hydrogen 2.927 N/A THR 103.A OG1 ASN 20.A O no hydrogen 2.470 N/A THR 103.A OG1 GLY 105.A O no hydrogen 3.037 N/A ASP 104.A N ASN 20.A O no hydrogen 3.192 N/A GLY 105.A N THR 103.A OG1 no hydrogen 3.238 N/A ALA 106.A N LYS 133.A O no hydrogen 2.923 N/A LEU 107.A N SER 22.A O no hydrogen 2.946 N/A VAL 108.A N VAL 135.A O no hydrogen 2.897 N/A VAL 109.A N ILE 24.A O no hydrogen 2.914 N/A VAL 110.A N MET 137.A O no hydrogen 2.862 N/A ASP 111.A N HIS 29.A ND1 no hydrogen 3.318 N/A CYS 112.A SG ASN 139.A O no hydrogen 3.213 N/A CYS 112.A SG LYS 140.A O no hydrogen 3.270 N/A SER 114.A N ASP 111.A OD2 no hydrogen 2.390 N/A SER 114.A OG ASP 111.A OD2 no hydrogen 2.744 N/A CYS 117.A SG SER 114.A O no hydrogen 3.889 N/A CYS 117.A SG SER 114.A OG no hydrogen 3.580 N/A CYS 117.A SG GLY 115.A O no hydrogen 3.470 N/A GLN 119.A NE2 HIS 89.A O no hydrogen 2.492 N/A GLU 121.A N CYS 117.A O no hydrogen 2.927 N/A THR 122.A OG1 VAL 118.A O no hydrogen 3.018 N/A THR 122.A OG1 GLU 121.A OE1 no hydrogen 3.097 N/A VAL 123.A N GLN 119.A O no hydrogen 2.907 N/A ARG 125.A N GLU 121.A O no hydrogen 3.006 N/A ARG 125.A NE GLU 121.A OE1 no hydrogen 3.524 N/A GLN 126.A N THR 122.A O no hydrogen 2.982 N/A GLN 126.A NE2 THR 97.A OG1 no hydrogen 2.856 N/A ALA 127.A N VAL 123.A O no hydrogen 2.903 N/A ILE 128.A N LEU 124.A O no hydrogen 2.961 N/A ALA 129.A N ARG 125.A O no hydrogen 2.910 N/A GLU 130.A N ALA 127.A O no hydrogen 3.093 N/A ARG 131.A NH1 TYR 348.A O no hydrogen 3.065 N/A ILE 132.A N ALA 127.A O no hydrogen 3.125 N/A LYS 133.A N ASP 104.A O no hydrogen 3.102 N/A LYS 133.A NZ HIS 338.A O no hydrogen 2.752 N/A VAL 135.A N ALA 106.A O no hydrogen 2.880 N/A LEU 136.A N THR 192.A O no hydrogen 3.051 N/A MET 137.A N VAL 108.A O no hydrogen 2.906 N/A MET 138.A N GLY 194.A O no hydrogen 2.777 N/A ASN 139.A N VAL 110.A O no hydrogen 2.940 N/A ASN 139.A ND2 HIS 29.A O no hydrogen 2.865 N/A ASN 139.A ND2 GLY 30.A O no hydrogen 3.542 N/A LYS 140.A NZ ASP 28.A O no hydrogen 2.769 N/A LYS 140.A NZ ASP 111.A OD1 no hydrogen 3.294 N/A MET 141.A N GLY 196.A O no hydrogen 3.311 N/A ARG 143.A N ASP 142.A OD1 no hydrogen 2.639 N/A ALA 144.A N LYS 140.A O no hydrogen 2.990 N/A LEU 145.A N MET 141.A O no hydrogen 2.922 N/A GLU 147.A N ARG 143.A O no hydrogen 2.962 N/A LEU 148.A N ARG 143.A O no hydrogen 3.355 N/A LEU 150.A N ALA 144.A O no hydrogen 3.461 N/A LEU 155.A N GLU 151.A O no hydrogen 2.952 N/A TYR 156.A N PRO 152.A O no hydrogen 2.945 N/A TYR 156.A OH TRP 242.A O no hydrogen 3.267 N/A GLN 157.A N GLU 153.A O no hydrogen 2.945 N/A THR 158.A N GLU 154.A O no hydrogen 2.929 N/A THR 158.A OG1 GLU 154.A O no hydrogen 2.844 N/A PHE 159.A N LEU 155.A O no hydrogen 2.963 N/A GLN 160.A N TYR 156.A O no hydrogen 2.925 N/A GLN 160.A NE2 GLU 164.A OE2 no hydrogen 2.702 N/A ARG 161.A N GLN 157.A O no hydrogen 2.878 N/A ILE 162.A N THR 158.A O no hydrogen 3.013 N/A VAL 163.A N PHE 159.A O no hydrogen 2.981 N/A GLU 164.A N GLN 160.A O no hydrogen 2.970 N/A ASN 165.A N ARG 161.A O no hydrogen 3.447 N/A VAL 166.A N ILE 162.A O no hydrogen 2.952 N/A ASN 167.A N VAL 163.A O no hydrogen 2.977 N/A ASN 167.A ND2 ILE 186.A O no hydrogen 3.123 N/A VAL 168.A N GLU 164.A O no hydrogen 2.906 N/A ILE 169.A N ASN 165.A O no hydrogen 2.933 N/A ILE 170.A N VAL 166.A O no hydrogen 3.017 N/A SER 171.A N ASN 167.A O no hydrogen 2.948 N/A SER 171.A OG ASN 167.A O no hydrogen 3.059 N/A THR 172.A N VAL 168.A O no hydrogen 2.890 N/A THR 172.A OG1 VAL 168.A O no hydrogen 2.336 N/A GLY 174.A N ILE 170.A O no hydrogen 2.968 N/A SER 178.A OG GLU 175.A OE2 no hydrogen 2.354 N/A SER 178.A OG GLY 176.A O no hydrogen 2.832 N/A GLY 182.A N SER 178.A O no hydrogen 3.041 N/A ILE 186.A N ASN 167.A OD1 no hydrogen 2.660 N/A LEU 190.A N ASP 187.A O no hydrogen 3.273 N/A GLY 191.A N PRO 188.A O no hydrogen 3.162 N/A THR 192.A N ASP 187.A O no hydrogen 3.321 N/A THR 192.A OG1 THR 192.A O no hydrogen 2.569 N/A PHE 195.A N PHE 204.A O no hydrogen 2.415 N/A GLY 196.A N MET 138.A O no hydrogen 3.004 N/A SER 197.A N TRP 202.A O no hydrogen 2.781 N/A SER 197.A OG TRP 202.A O no hydrogen 3.561 N/A GLY 198.A N ASN 139.A OD1 no hydrogen 2.987 N/A TRP 202.A N SER 197.A O no hydrogen 3.023 N/A ALA 203.A N LEU 325.A O no hydrogen 3.274 N/A PHE 204.A N PHE 195.A O no hydrogen 2.527 N/A THR 205.A OG1 VAL 193.A O no hydrogen 3.064 N/A GLN 208.A N GLN 208.A OE1 no hydrogen 2.744 N/A PHE 209.A N LEU 206.A O no hydrogen 3.261 N/A ALA 210.A N LEU 206.A O no hydrogen 2.907 N/A GLU 211.A N LYS 207.A O no hydrogen 2.885 N/A TYR 213.A N ALA 210.A O no hydrogen 3.255 N/A TYR 213.A OH LEU 273.A O no hydrogen 2.322 N/A VAL 214.A N ALA 210.A O no hydrogen 2.919 N/A ALA 215.A N GLU 211.A O no hydrogen 2.892 N/A LYS 216.A N TYR 213.A O no hydrogen 3.262 N/A PHE 217.A N TYR 213.A O no hydrogen 2.954 N/A GLN 224.A NE2 GLU 229.A OE2 no hydrogen 2.717 N/A GLU 229.A N GLU 229.A OE1 no hydrogen 2.839 N/A LYS 232.A N GLU 229.A O no hydrogen 3.280 N/A LYS 233.A N GLU 229.A O no hydrogen 2.909 N/A VAL 234.A N ARG 230.A O no hydrogen 2.881 N/A ASP 236.A N LYS 232.A O no hydrogen 2.866 N/A MET 237.A N LYS 233.A O no hydrogen 2.929 N/A MET 238.A N VAL 234.A O no hydrogen 2.809 N/A LYS 239.A N GLU 235.A O no hydrogen 2.899 N/A LYS 239.A NZ GLU 235.A O no hydrogen 2.752 N/A LYS 240.A N MET 237.A O no hydrogen 3.079 N/A LEU 241.A N MET 237.A O no hydrogen 2.949 N/A ARG 245.A NE GLY 243.A O no hydrogen 2.409 N/A ARG 245.A NH1 LYS 239.A O no hydrogen 2.552 N/A ARG 245.A NH2 LYS 239.A O no hydrogen 2.812 N/A TYR 246.A N SER 255.A O no hydrogen 3.109 N/A TYR 246.A OH ASP 244.A OD1 no hydrogen 3.186 N/A ASP 248.A N LYS 253.A O no hydrogen 2.985 N/A LYS 253.A N ASN 251.A O no hydrogen 2.787 N/A SER 255.A N TYR 246.A O no hydrogen 2.596 N/A SER 255.A OG SER 257.A O no hydrogen 3.331 N/A SER 257.A OG SER 255.A OG no hydrogen 3.203 N/A SER 257.A OG THR 259.A O no hydrogen 2.745 N/A THR 259.A OG1 SER 260.A O no hydrogen 2.964 N/A THR 259.A OG1 LYS 264.A O no hydrogen 2.360 N/A SER 260.A N LYS 264.A O no hydrogen 2.944 N/A SER 260.A OG GLU 262.A OE1 no hydrogen 2.380 N/A GLU 262.A N GLU 262.A OE1 no hydrogen 2.872 N/A GLY 263.A N SER 260.A O no hydrogen 3.427 N/A LYS 265.A NZ THR 259.A OG1 no hydrogen 3.271 N/A THR 269.A N ARG 245.A O no hydrogen 2.988 N/A CYS 271.A N ARG 268.A O no hydrogen 3.145 N/A CYS 271.A SG PRO 267.A O no hydrogen 3.198 N/A CYS 271.A SG ARG 268.A O no hydrogen 3.722 N/A GLN 272.A N THR 269.A O no hydrogen 3.407 N/A GLN 272.A NE2 GLN 272.A O no hydrogen 2.893 N/A LEU 273.A N THR 269.A O no hydrogen 2.844 N/A ILE 274.A N PHE 270.A O no hydrogen 2.879 N/A LEU 275.A N PHE 270.A O no hydrogen 3.193 N/A PHE 279.A N LEU 275.A O no hydrogen 2.742 N/A LYS 280.A N ASP 276.A O no hydrogen 2.931 N/A LYS 280.A NZ ASP 276.A OD1 no hydrogen 3.022 N/A VAL 281.A N PRO 277.A O no hydrogen 3.360 N/A PHE 282.A N ILE 278.A O no hydrogen 2.976 N/A ASP 283.A N PHE 279.A O no hydrogen 2.850 N/A ALA 284.A N LYS 280.A O no hydrogen 2.928 N/A ILE 285.A N VAL 281.A O no hydrogen 2.960 N/A MET 286.A N PHE 282.A O no hydrogen 2.887 N/A ASN 287.A ND2 ASP 283.A O no hydrogen 2.884 N/A LYS 289.A N ALA 284.A O no hydrogen 2.967 N/A LYS 289.A NZ ASP 283.A O no hydrogen 2.685 N/A THR 293.A N LYS 289.A O no hydrogen 2.913 N/A ALA 294.A N LYS 290.A O no hydrogen 2.944 N/A LEU 296.A N GLU 292.A O no hydrogen 2.890 N/A ILE 297.A N THR 293.A O no hydrogen 2.858 N/A LYS 299.A N LYS 295.A O no hydrogen 2.929 N/A LEU 300.A N LEU 296.A O no hydrogen 2.876 N/A LEU 317.A N GLY 313.A O no hydrogen 2.862 N/A LYS 318.A N LYS 314.A O no hydrogen 2.924 N/A LYS 318.A NZ LEU 199.A O no hydrogen 3.225 N/A ALA 319.A N PRO 315.A O no hydrogen 2.929 N/A VAL 320.A N LEU 316.A O no hydrogen 2.861 N/A MET 321.A N LEU 317.A O no hydrogen 2.938 N/A ARG 323.A N ALA 319.A O no hydrogen 2.930 N/A ARG 323.A NE LYS 303.A O no hydrogen 3.028 N/A TRP 324.A N VAL 320.A O no hydrogen 2.903 N/A LEU 325.A N MET 321.A O no hydrogen 2.907 N/A ALA 330.A N ALA 327.A O no hydrogen 3.237 N/A LEU 331.A N ALA 327.A O no hydrogen 2.957 N/A LEU 332.A N GLY 328.A O no hydrogen 2.856 N/A ILE 335.A N LEU 331.A O no hydrogen 2.892 N/A THR 336.A OG1 LEU 332.A O no hydrogen 3.568 N/A THR 336.A OG1 GLN 333.A O no hydrogen 2.349 N/A ILE 337.A N GLN 333.A O no hydrogen 2.973 N/A HIS 338.A NE2 LEU 190.A O no hydrogen 2.696 N/A LEU 339.A N ILE 335.A O no hydrogen 2.873 N/A SER 341.A N GLN 72.A OE1 no hydrogen 3.230 N/A THR 344.A N SER 341.A O no hydrogen 3.048 N/A THR 344.A OG1 SER 341.A O no hydrogen 2.562 N/A ALA 345.A N SER 341.A O no hydrogen 2.881 N/A GLN 346.A N PRO 342.A O no hydrogen 2.902 N/A TYR 348.A N ALA 345.A O no hydrogen 3.309 N/A ARG 349.A N ALA 345.A O no hydrogen 2.922 N/A ARG 349.A NH2 ARG 101.A O no hydrogen 2.862 N/A ARG 349.A NH2 GLU 130.A OE2 no hydrogen 3.411 N/A CYS 350.A SG LYS 347.A O no hydrogen 3.324 N/A LEU 353.A N CYS 350.A O no hydrogen 3.218 N/A TYR 354.A N CYS 350.A O no hydrogen 3.214 N/A GLU 355.A N ASN 474.A O no hydrogen 3.460 N/A ASP 360.A N PRO 357.A O no hydrogen 3.467 N/A ALA 362.A N ASP 360.A OD2 no hydrogen 2.918 N/A MET 364.A N ASP 360.A O no hydrogen 2.915 N/A GLY 365.A N GLU 361.A O no hydrogen 2.883 N/A ILE 366.A N ALA 362.A O no hydrogen 2.935 N/A LYS 367.A N ALA 363.A O no hydrogen 2.923 N/A LYS 367.A NZ PRO 358.A O no hydrogen 3.086 N/A CYS 369.A N ILE 366.A O no hydrogen 3.023 N/A CYS 369.A SG SER 368.A O no hydrogen 3.155 N/A ASP 370.A N GLY 365.A O no hydrogen 3.368 N/A LEU 375.A N THR 468.A OG1 no hydrogen 2.964 N/A MET 376.A N SER 399.A O no hydrogen 2.411 N/A MET 377.A N ILE 466.A O no hydrogen 3.287 N/A TYR 378.A N ARG 396.A O no hydrogen 2.897 N/A SER 380.A N PHE 394.A O no hydrogen 2.891 N/A SER 380.A OG ALA 98.A O no hydrogen 3.250 N/A LYS 381.A NZ THR 54.A OG1 no hydrogen 3.328 N/A THR 385.A OG1 ASP 387.A OD1 no hydrogen 2.287 N/A THR 385.A OG1 ARG 390.A O no hydrogen 3.079 N/A SER 386.A OG THR 50.A O no hydrogen 2.324 N/A SER 386.A OG THR 50.A OG1 no hydrogen 2.936 N/A ARG 390.A NH1 ARG 390.A O no hydrogen 3.330 N/A TYR 392.A N VAL 383.A O no hydrogen 3.002 N/A ALA 393.A N LEU 453.A O no hydrogen 2.905 N/A GLY 395.A N VAL 451.A O no hydrogen 2.927 N/A ARG 396.A N TYR 378.A O no hydrogen 3.115 N/A PHE 398.A N MET 376.A O no hydrogen 2.486 N/A SER 399.A N MET 376.A O no hydrogen 2.769 N/A SER 399.A OG ASP 370.A O no hydrogen 3.250 N/A SER 399.A OG ASP 370.A OD1 no hydrogen 3.472 N/A SER 399.A OG PRO 374.A O no hydrogen 3.197 N/A GLY 400.A N ASP 370.A O no hydrogen 3.119 N/A VAL 402.A N ASP 444.A O no hydrogen 3.003 N/A THR 404.A OG1 GLU 443.A O no hydrogen 3.455 N/A LEU 406.A N SER 403.A O no hydrogen 3.281 N/A VAL 408.A N LYS 426.A O no hydrogen 2.891 N/A ARG 409.A N THR 467.A O no hydrogen 2.835 N/A ILE 410.A N TYR 424.A O no hydrogen 2.941 N/A MET 411.A N THR 465.A O no hydrogen 2.791 N/A GLY 412.A N ASP 422.A O no hydrogen 2.958 N/A LYS 419.A NZ GLU 470.A O no hydrogen 3.138 N/A LYS 420.A NZ PRO 417.A O no hydrogen 3.498 N/A LYS 420.A NZ GLY 418.A O no hydrogen 2.693 N/A GLU 421.A N LYS 419.A O no hydrogen 2.635 N/A TYR 424.A N ILE 410.A O no hydrogen 2.949 N/A LYS 426.A N VAL 408.A O no hydrogen 2.923 N/A GLN 429.A N VAL 454.A O no hydrogen 3.049 N/A ILE 442.A N THR 431.A O no hydrogen 2.437 N/A VAL 445.A N ASP 444.A OD1 no hydrogen 2.735 N/A CYS 447.A SG CYS 369.A O no hydrogen 3.269 N/A CYS 447.A SG GLY 400.A O no hydrogen 3.207 N/A ASN 449.A N CYS 447.A O no hydrogen 2.637 N/A ASN 449.A ND2 MET 12.A O no hydrogen 3.505 N/A VAL 451.A N GLY 395.A O no hydrogen 2.847 N/A LEU 453.A N ALA 393.A O no hydrogen 2.866 N/A GLY 455.A N ASP 457.A OD1 no hydrogen 3.192 N/A GLY 455.A N ASP 457.A OD2 no hydrogen 3.398 N/A PHE 459.A N VAL 456.A O no hydrogen 3.436 N/A LYS 462.A NZ PRO 513.A O no hydrogen 3.333 N/A THR 463.A OG1 TYR 378.A OH no hydrogen 2.734 N/A THR 463.A OG1 ILE 379.A O no hydrogen 2.688 N/A GLY 464.A N THR 463.A OG1 no hydrogen 2.665 N/A THR 465.A N MET 411.A O no hydrogen 2.970 N/A ILE 466.A N MET 377.A O no hydrogen 3.442 N/A THR 467.A N ARG 409.A O no hydrogen 2.901 N/A THR 468.A N LEU 375.A O no hydrogen 3.158 N/A HIS 471.A ND1 GLU 470.A OE2 no hydrogen 2.403 N/A HIS 473.A N TYR 354.A OH no hydrogen 3.368 N/A MET 475.A N THR 465.A OG1 no hydrogen 3.069 N/A ARG 476.A N LEU 353.A O no hydrogen 2.427 N/A SER 481.A OG GLN 126.A OE1 no hydrogen 2.534 N/A ARG 487.A NH2 TYR 725.A OH no hydrogen 2.731 N/A VAL 488.A N ILE 527.A O no hydrogen 2.956 N/A ALA 489.A N SER 554.A O no hydrogen 2.893 N/A VAL 490.A N HIS 525.A O no hydrogen 2.902 N/A LYS 500.A N ASP 497.A O no hydrogen 2.764 N/A LEU 505.A N LEU 501.A O no hydrogen 2.845 N/A LYS 506.A N VAL 502.A O no hydrogen 2.924 N/A ARG 507.A N GLU 503.A O no hydrogen 2.894 N/A LEU 508.A N GLY 504.A O no hydrogen 2.847 N/A ALA 509.A N LEU 505.A O no hydrogen 2.866 N/A LYS 510.A N LYS 506.A O no hydrogen 2.951 N/A LYS 510.A NZ ASP 457.A O no hydrogen 2.435 N/A LYS 510.A NZ LEU 460.A O no hydrogen 3.063 N/A SER 511.A OG LEU 508.A O no hydrogen 2.696 N/A GLN 516.A N ALA 528.A O no hydrogen 2.908 N/A CYS 517.A SG LEU 505.A O no hydrogen 3.239 N/A ILE 518.A N ILE 526.A O no hydrogen 2.953 N/A GLU 520.A N GLU 524.A O no hydrogen 2.929 N/A GLY 523.A N GLU 520.A O no hydrogen 3.078 N/A ILE 526.A N ILE 518.A O no hydrogen 2.929 N/A ILE 527.A N VAL 488.A O no hydrogen 2.937 N/A ALA 528.A N GLN 516.A O no hydrogen 2.882 N/A GLY 529.A N VAL 486.A O no hydrogen 3.177 N/A ALA 530.A N HIS 534.A ND1 no hydrogen 3.208 N/A HIS 534.A N ASP 91.A OD2 no hydrogen 2.471 N/A LEU 535.A N GLY 531.A O no hydrogen 2.947 N/A GLU 536.A N GLU 532.A O no hydrogen 2.818 N/A ILE 537.A N LEU 533.A O no hydrogen 3.010 N/A CYS 538.A SG HIS 534.A O no hydrogen 3.955 N/A CYS 538.A SG LEU 535.A O no hydrogen 3.211 N/A LEU 539.A N LEU 535.A O no hydrogen 2.857 N/A LYS 540.A N GLU 536.A O no hydrogen 2.923 N/A ASP 541.A N ILE 537.A O no hydrogen 3.049 N/A LEU 542.A N CYS 538.A O no hydrogen 2.879 N/A HIS 546.A ND1 LEU 542.A O no hydrogen 3.206 N/A CYS 548.A SG ALA 547.A O no hydrogen 3.194 N/A LYS 552.A N GLU 491.A O no hydrogen 2.904 N/A LYS 553.A NZ LEU 539.A O no hydrogen 3.431 N/A ARG 561.A N MET 721.A O no hydrogen 3.063 N/A ARG 561.A NE ASN 677.A OD1 no hydrogen 2.547 N/A ARG 561.A NH2 GLU 521.A OE2 no hydrogen 2.961 N/A THR 563.A N ARG 719.A O no hydrogen 2.867 N/A THR 563.A OG1 VAL 564.A O no hydrogen 3.344 N/A THR 563.A OG1 ARG 719.A O no hydrogen 3.023 N/A SER 565.A OG GLU 566.A OE1 no hydrogen 2.353 N/A SER 565.A OG ALA 716.A O no hydrogen 2.783 N/A SER 565.A OG GLN 717.A O no hydrogen 2.916 N/A SER 568.A OG SER 712.A O no hydrogen 2.845 N/A SER 568.A OG THR 715.A OG1 no hydrogen 3.162 N/A ASN 569.A N THR 715.A O no hydrogen 3.074 N/A CYS 572.A N MET 585.A O no hydrogen 2.946 N/A CYS 572.A SG MET 585.A O no hydrogen 3.255 N/A CYS 572.A SG CYS 708.A O no hydrogen 3.699 N/A SER 574.A N LEU 583.A O no hydrogen 2.967 N/A SER 574.A OG LEU 573.A O no hydrogen 2.668 N/A SER 574.A OG ARG 707.A O no hydrogen 2.529 N/A HIS 580.A N SER 576.A OG no hydrogen 3.037 N/A ASN 581.A N SER 576.A OG no hydrogen 3.242 N/A ARG 582.A N THR 689.A O no hydrogen 2.940 N/A LEU 583.A N SER 574.A O no hydrogen 2.900 N/A MET 585.A N CYS 572.A O no hydrogen 2.963 N/A LYS 586.A N ASP 684.A O no hydrogen 2.904 N/A LYS 586.A NZ SER 568.A O no hydrogen 2.545 N/A ARG 588.A N ARG 682.A O no hydrogen 2.904 N/A GLU 596.A N GLY 593.A O no hydrogen 2.999 N/A ASP 597.A N GLY 593.A O no hydrogen 2.940 N/A ASP 599.A N GLU 596.A O no hydrogen 2.998 N/A LYS 600.A N ASP 597.A O no hydrogen 3.347 N/A LYS 600.A NZ TYR 615.A OH no hydrogen 3.267 N/A LYS 610.A N GLU 608.A OE2 no hydrogen 3.357 N/A GLN 611.A N GLU 608.A OE1 no hydrogen 2.698 N/A ARG 612.A N GLU 608.A O no hydrogen 2.980 N/A ALA 613.A N LEU 609.A O no hydrogen 2.895 N/A ARG 614.A N LYS 610.A O no hydrogen 2.886 N/A TYR 615.A N GLN 611.A O no hydrogen 2.875 N/A LEU 616.A N ARG 612.A O no hydrogen 2.889 N/A ALA 617.A N ALA 613.A O no hydrogen 2.935 N/A GLU 618.A N TYR 615.A O no hydrogen 3.373 N/A LYS 619.A N TYR 615.A O no hydrogen 2.911 N/A LYS 619.A NZ TYR 615.A OH no hydrogen 2.797 N/A TYR 620.A N LEU 616.A O no hydrogen 2.904 N/A TYR 620.A OH ASP 597.A OD2 no hydrogen 2.289 N/A VAL 624.A N ASP 623.A OD1 no hydrogen 2.648 N/A ALA 627.A N ASP 623.A O no hydrogen 2.904 N/A ALA 627.A N VAL 624.A O no hydrogen 3.271 N/A ARG 628.A NH2 ASP 645.A OD2 no hydrogen 3.425 N/A TRP 631.A N LEU 643.A O no hydrogen 2.853 N/A CYS 632.A SG PHE 633.A O no hydrogen 3.277 N/A GLY 634.A N ASN 641.A O no hydrogen 3.230 N/A ASP 636.A N GLN 665.A OE1 no hydrogen 2.484 N/A THR 638.A N PRO 635.A O no hydrogen 3.261 N/A THR 638.A OG1 ASP 636.A O no hydrogen 3.531 N/A ILE 642.A N VAL 681.A O no hydrogen 2.954 N/A THR 644.A N PHE 683.A O no hydrogen 2.939 N/A THR 644.A OG1 PHE 683.A O no hydrogen 2.845 N/A THR 644.A OG1 ASP 684.A OD1 no hydrogen 2.447 N/A ILE 646.A N VAL 685.A O no hydrogen 3.081 N/A LYS 648.A NZ VAL 650.A O no hydrogen 2.540 N/A ASP 658.A N GLU 655.A O no hydrogen 3.281 N/A SER 659.A N GLU 655.A O no hydrogen 2.788 N/A VAL 661.A N ILE 656.A O no hydrogen 2.867 N/A GLY 663.A N SER 659.A O no hydrogen 2.886 N/A PHE 664.A N VAL 660.A O no hydrogen 2.900 N/A GLN 665.A N VAL 661.A O no hydrogen 2.898 N/A GLN 665.A NE2 PHE 633.A O no hydrogen 2.355 N/A TRP 666.A N ALA 662.A O no hydrogen 2.843 N/A ALA 667.A N GLY 663.A O no hydrogen 3.118 N/A THR 668.A OG1 THR 668.A O no hydrogen 2.617 N/A LYS 669.A N GLN 665.A O no hydrogen 3.264 N/A LYS 669.A NZ ASP 636.A OD1 no hydrogen 3.552 N/A CYS 674.A N GLU 562.A OE2 no hydrogen 3.053 N/A CYS 674.A SG THR 818.A OG1 no hydrogen 2.888 N/A GLU 676.A N GLU 562.A OE2 no hydrogen 3.329 N/A ARG 679.A N GLU 562.A O no hydrogen 2.648 N/A VAL 681.A N PRO 640.A O no hydrogen 2.969 N/A ARG 682.A N ARG 588.A O no hydrogen 2.823 N/A ARG 682.A NE ASP 684.A OD1 no hydrogen 2.419 N/A ARG 682.A NH2 GLU 626.A OE1 no hydrogen 3.071 N/A PHE 683.A N ILE 642.A O no hydrogen 2.824 N/A ASP 684.A N LYS 586.A O no hydrogen 2.909 N/A HIS 686.A N TYR 584.A O no hydrogen 3.176 N/A THR 689.A N ARG 582.A O no hydrogen 2.865 N/A GLN 700.A N GLY 697.A O no hydrogen 3.096 N/A ILE 701.A N GLY 698.A O no hydrogen 3.346 N/A ILE 702.A N GLY 698.A O no hydrogen 2.922 N/A THR 704.A OG1 LYS 575.A O no hydrogen 3.463 N/A THR 704.A OG1 GLN 700.A O no hydrogen 3.061 N/A ALA 705.A N ILE 701.A O no hydrogen 2.601 N/A ARG 706.A N ILE 702.A O no hydrogen 2.954 N/A ARG 706.A NH1 TYR 710.A OH no hydrogen 2.833 N/A ARG 707.A NE PRO 703.A O no hydrogen 2.358 N/A ARG 707.A NH2 THR 704.A OG1 no hydrogen 3.416 N/A CYS 708.A N ALA 705.A O no hydrogen 3.201 N/A LEU 709.A N ALA 705.A O no hydrogen 2.938 N/A TYR 710.A OH GLU 670.A O no hydrogen 2.296 N/A TYR 710.A OH GLU 670.A OE1 no hydrogen 2.976 N/A SER 712.A N CYS 708.A O no hydrogen 2.892 N/A SER 712.A OG CYS 708.A O no hydrogen 3.358 N/A SER 712.A OG LEU 709.A O no hydrogen 2.594 N/A VAL 713.A N LEU 709.A O no hydrogen 3.005 N/A LEU 714.A N TYR 710.A O no hydrogen 2.861 N/A THR 715.A N ALA 711.A O no hydrogen 2.890 N/A THR 715.A OG1 SER 568.A OG no hydrogen 3.162 N/A THR 715.A OG1 ALA 711.A O no hydrogen 2.679 N/A THR 715.A OG1 SER 712.A O no hydrogen 3.099 N/A ALA 716.A N SER 712.A O no hydrogen 2.952 N/A GLN 717.A N LEU 714.A O no hydrogen 3.026 N/A GLN 717.A NE2 GLU 566.A OE1 no hydrogen 2.398 N/A GLN 717.A NE2 GLU 566.A OE2 no hydrogen 3.263 N/A ARG 719.A N THR 563.A O no hydrogen 2.937 N/A ARG 719.A NH1 GLN 717.A OE1 no hydrogen 2.448 N/A ARG 719.A NH2 GLN 717.A OE1 no hydrogen 3.057 N/A MET 721.A N ARG 561.A O no hydrogen 2.788 N/A GLU 722.A N GLN 798.A O no hydrogen 2.925 N/A ILE 724.A N HIS 796.A O no hydrogen 2.870 N/A TYR 725.A N LEU 768.A O no hydrogen 2.525 N/A LEU 726.A N VAL 793.A O no hydrogen 2.805 N/A VAL 727.A N ALA 766.A O no hydrogen 2.923 N/A GLU 728.A N GLN 791.A O no hydrogen 2.886 N/A ILE 729.A N VAL 764.A O no hydrogen 2.984 N/A GLN 730.A N PHE 789.A O no hydrogen 2.895 N/A CYS 731.A N PHE 762.A O no hydrogen 2.923 N/A CYS 731.A SG PRO 732.A O no hydrogen 3.499 N/A CYS 731.A SG VAL 735.A O no hydrogen 3.479 N/A GLN 734.A N GLN 734.A OE1 no hydrogen 2.739 N/A ILE 739.A N VAL 736.A O no hydrogen 3.221 N/A LEU 743.A N ILE 739.A O no hydrogen 2.980 N/A ASN 744.A N TYR 740.A O no hydrogen 2.920 N/A ARG 745.A N GLY 741.A O no hydrogen 2.936 N/A LYS 746.A N VAL 742.A O no hydrogen 2.865 N/A LYS 746.A NZ ASP 779.A OD2 no hydrogen 2.609 N/A ARG 747.A NH1 GLU 722.A OE2 no hydrogen 2.702 N/A ARG 747.A NH2 GLU 722.A OE2 no hydrogen 2.951 N/A GLY 748.A N LEU 743.A O no hydrogen 2.807 N/A SER 754.A OG GLU 752.A OE1 no hydrogen 3.116 N/A SER 754.A OG GLU 752.A OE2 no hydrogen 3.528 N/A THR 759.A OG1 MET 761.A O no hydrogen 2.855 N/A PHE 762.A N CYS 731.A O no hydrogen 2.838 N/A VAL 763.A N SER 754.A O no hydrogen 3.237 N/A VAL 764.A N ILE 729.A O no hydrogen 2.963 N/A ALA 766.A N VAL 727.A O no hydrogen 2.947 N/A TYR 767.A N HIS 749.A O no hydrogen 2.919 N/A LEU 768.A N TYR 725.A O no hydrogen 3.199 N/A VAL 770.A N PRO 723.A O no hydrogen 3.250 N/A ASN 771.A ND2 TYR 560.A OH no hydrogen 2.433 N/A GLU 772.A N ASN 771.A OD1 no hydrogen 2.662 N/A SER 773.A OG PRO 769.A O no hydrogen 3.316 N/A SER 773.A OG VAL 770.A O no hydrogen 2.587 N/A LEU 780.A N PHE 776.A O no hydrogen 2.913 N/A ARG 781.A N THR 777.A O no hydrogen 2.907 N/A ARG 781.A NE ALA 788.A O no hydrogen 3.360 N/A SER 782.A N ALA 778.A O no hydrogen 2.913 N/A SER 782.A OG ALA 778.A O no hydrogen 3.335 N/A SER 782.A OG ASP 779.A O no hydrogen 3.080 N/A ASN 783.A N ASP 779.A O no hydrogen 2.941 N/A THR 784.A N ARG 781.A O no hydrogen 3.293 N/A THR 784.A OG1 LEU 780.A O no hydrogen 2.547 N/A GLY 785.A N ARG 781.A O no hydrogen 2.884 N/A GLY 786.A N ARG 781.A O no hydrogen 2.880 N/A PHE 789.A N GLN 730.A O no hydrogen 2.913 N/A GLN 791.A N GLU 728.A O no hydrogen 2.828 N/A VAL 793.A N LEU 726.A O no hydrogen 3.001 N/A HIS 796.A N ILE 724.A O no hydrogen 3.454 N/A HIS 796.A ND1 ASP 795.A OD1 no hydrogen 3.020 N/A GLN 798.A N GLU 722.A O no hydrogen 2.979 N/A LEU 800.A N LEU 720.A O no hydrogen 3.335 N/A ASP 806.A N ASP 803.A O no hydrogen 2.813 N/A SER 808.A N ASP 806.A OD1 no hydrogen 3.468 N/A SER 809.A N ASP 806.A O no hydrogen 3.519 N/A SER 812.A OG ASN 807.A OD1 no hydrogen 3.383 N/A GLN 813.A NE2 ASN 807.A O no hydrogen 2.885 N/A VAL 814.A N ARG 810.A O no hydrogen 2.928 N/A VAL 815.A N PRO 811.A O no hydrogen 2.935 N/A ALA 816.A N GLN 813.A O no hydrogen 3.234 N/A GLU 817.A N GLU 817.A OE1 no hydrogen 3.213 N/A THR 818.A N VAL 814.A O no hydrogen 2.968 N/A THR 818.A OG1 VAL 814.A O no hydrogen 3.158 N/A ARG 819.A N ALA 816.A O no hydrogen 3.176 N/A LYS 820.A N ALA 816.A O no hydrogen 2.958 N/A ARG 821.A N GLU 817.A O no hydrogen 2.874 N/A ARG 821.A NH1 SER 522.A OG no hydrogen 2.896 N/A ARG 821.A NH2 SER 522.A OG no hydrogen 2.719 N/A LYS 822.A N ARG 819.A O no hydrogen 3.100 N/A LYS 822.A NZ CYS 674.A O no hydrogen 3.115 N/A GLY 823.A N ARG 819.A O no hydrogen 2.835 N/A LEU 831.A N PRO 829.A O no hydrogen 2.766 N/A LEU 835.A N LEU 831.A O no hydrogen 3.219 N/A