Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aju_JD.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 9.A N GLU 9.A OE1 no hydrogen 2.615 N/A ARG 12.A N ASN 8.A O no hydrogen 2.928 N/A MET 16.A N ARG 12.A O no hydrogen 3.051 N/A ALA 17.A N SER 13.A O no hydrogen 3.093 N/A LYS 18.A N GLY 14.A O no hydrogen 2.965 N/A LEU 19.A N HIS 15.A O no hydrogen 2.966 N/A LYS 20.A N MET 16.A O no hydrogen 2.926 N/A GLU 21.A N ALA 17.A O no hydrogen 3.007 N/A LEU 22.A N LYS 18.A O no hydrogen 2.933 N/A LYS 23.A N LEU 19.A O no hydrogen 2.876 N/A ARG 24.A N LYS 20.A O no hydrogen 2.913 N/A ILE 25.A N GLU 21.A O no hydrogen 3.071 N/A ARG 26.A N LEU 22.A O no hydrogen 2.951 N/A ASN 27.A N LYS 23.A O no hydrogen 2.951 N/A THR 31.A N ASN 27.A O no hydrogen 2.971 N/A ARG 32.A N LYS 28.A O no hydrogen 2.859 N/A SER 36.A OG SER 33.A O no hydrogen 2.464 N/A ARG 37.A N SER 33.A O no hydrogen 2.900 N/A LEU 38.A N LYS 34.A O no hydrogen 2.912 N/A LYS 39.A N VAL 35.A O no hydrogen 2.831 N/A LYS 40.A N SER 36.A O no hydrogen 2.932 N/A LYS 41.A N ARG 37.A O no hydrogen 2.872 N/A LYS 41.A NZ ARG 37.A O no hydrogen 2.880 N/A ARG 42.A N LEU 38.A O no hydrogen 2.885 N/A LEU 43.A N LYS 39.A O no hydrogen 2.860 N/A ASP 44.A N LYS 40.A O no hydrogen 2.913 N/A LYS 45.A N LYS 41.A O no hydrogen 2.932 N/A PHE 46.A N ARG 42.A O no hydrogen 2.837 N/A ILE 47.A N LEU 43.A O no hydrogen 2.903 N/A GLU 48.A N ASP 44.A O no hydrogen 2.903 N/A HIS 49.A N LYS 45.A O no hydrogen 2.846 N/A GLN 50.A N PHE 46.A O no hydrogen 2.917 N/A LEU 51.A N ILE 47.A O no hydrogen 2.919 N/A LYS 52.A N GLU 48.A O no hydrogen 2.856 N/A ARG 53.A N HIS 49.A O no hydrogen 2.800 N/A ARG 53.A NE HIS 49.A NE2 no hydrogen 3.108 N/A GLU 54.A N GLN 50.A O no hydrogen 2.928 N/A GLU 55.A N LEU 51.A O no hydrogen 2.909 N/A ARG 56.A N LYS 52.A O no hydrogen 2.855 N/A ARG 56.A NE LYS 52.A O no hydrogen 3.246 N/A LYS 57.A N ARG 53.A O no hydrogen 2.914 N/A THR 58.A N GLU 54.A O no hydrogen 2.913 N/A THR 58.A OG1 GLU 54.A O no hydrogen 2.966 N/A THR 58.A OG1 GLU 55.A O no hydrogen 2.469 N/A ILE 59.A N GLU 55.A O no hydrogen 2.912 N/A ILE 60.A N ARG 56.A O no hydrogen 2.843 N/A GLY 61.A N LYS 57.A O no hydrogen 2.907 N/A LYS 62.A N THR 58.A O no hydrogen 2.907 N/A LEU 63.A N ILE 59.A O no hydrogen 2.900 N/A GLN 64.A N ILE 60.A O no hydrogen 2.952 N/A ASP 65.A N GLY 61.A O no hydrogen 2.906 N/A TYR 66.A N LYS 62.A O no hydrogen 2.858 N/A LYS 67.A N LEU 63.A O no hydrogen 2.938 N/A ASN 73.A N TYR 69.A O no hydrogen 2.864 N/A GLU 74.A N VAL 70.A O no hydrogen 2.904 N/A ASN 75.A N PRO 71.A O no hydrogen 2.956 N/A SER 76.A N ILE 72.A O no hydrogen 2.830 N/A SER 76.A OG ILE 72.A O no hydrogen 3.240 N/A SER 76.A OG ASN 73.A O no hydrogen 2.867 N/A SER 76.A OG ASP 147.A OD2 no hydrogen 2.804 N/A THR 77.A N ASN 73.A O no hydrogen 2.919 N/A THR 77.A OG1 ASN 73.A O no hydrogen 2.793 N/A THR 77.A OG1 ASN 73.A OD1 no hydrogen 3.567 N/A THR 77.A OG1 PHE 140.A O no hydrogen 2.723 N/A ARG 78.A N GLU 74.A O no hydrogen 2.906 N/A LYS 79.A N ASN 75.A O no hydrogen 2.902 N/A LYS 79.A NZ HIS 176.A O no hydrogen 2.834 N/A ALA 80.A N SER 76.A O no hydrogen 2.859 N/A PHE 81.A N THR 77.A O no hydrogen 2.928 N/A TYR 82.A N ARG 78.A O no hydrogen 2.901 N/A VAL 83.A N LYS 79.A O no hydrogen 2.887 N/A GLU 84.A N ALA 80.A O no hydrogen 2.891 N/A VAL 85.A N PHE 81.A O no hydrogen 2.917 N/A VAL 85.A N TYR 82.A O no hydrogen 3.320 N/A SER 86.A N TYR 82.A O no hydrogen 2.904 N/A SER 86.A OG TYR 82.A O no hydrogen 2.223 N/A ARG 87.A N VAL 83.A O no hydrogen 3.319 N/A SER 88.A N VAL 83.A O no hydrogen 2.888 N/A SER 88.A OG VAL 83.A O no hydrogen 2.900 N/A SER 88.A OG GLN 92.A OE1 no hydrogen 2.277 N/A GLN 92.A N SER 88.A O no hydrogen 2.891 N/A ALA 94.A N GLU 90.A O no hydrogen 2.927 N/A ARG 95.A N ILE 91.A O no hydrogen 2.859 N/A ARG 95.A NE GLN 130.A OE1 no hydrogen 3.017 N/A ARG 95.A NH2 GLU 137.A OE2 no hydrogen 2.544 N/A ILE 96.A N GLN 92.A O no hydrogen 2.902 N/A GLN 97.A N LYS 93.A O no hydrogen 2.888 N/A LEU 98.A N ALA 94.A O no hydrogen 2.957 N/A PHE 101.A N LEU 98.A O no hydrogen 3.351 N/A GLY 102.A N PRO 99.A O no hydrogen 3.304 N/A GLU 103.A N VAL 100.A O no hydrogen 2.958 N/A GLU 104.A N PHE 101.A O no hydrogen 3.123 N/A LYS 106.A NZ GLU 103.A OE2 no hydrogen 2.639 N/A ILE 107.A N GLU 103.A O no hydrogen 2.872 N/A MET 108.A N GLU 104.A O no hydrogen 2.907 N/A GLU 109.A N HIS 105.A O no hydrogen 2.927 N/A ALA 110.A N LYS 106.A O no hydrogen 2.887 N/A ILE 111.A N ILE 107.A O no hydrogen 2.923 N/A HIS 112.A N MET 108.A O no hydrogen 2.881 N/A HIS 113.A N GLU 109.A O no hydrogen 2.905 N/A VAL 117.A N LEU 262.A O no hydrogen 2.915 N/A ILE 118.A N PRO 286.A O no hydrogen 2.978 N/A ILE 119.A N ILE 264.A O no hydrogen 2.869 N/A CYS 120.A N LEU 288.A O no hydrogen 2.877 N/A CYS 120.A SG ALA 267.A O no hydrogen 3.198 N/A GLY 121.A N SER 266.A O no hydrogen 2.901 N/A SER 125.A OG GLU 122.A O no hydrogen 3.157 N/A THR 129.A N GLY 126.A O no hydrogen 3.049 N/A THR 129.A OG1 GLN 133.A OE1 no hydrogen 3.202 N/A GLN 130.A N GLY 126.A O no hydrogen 2.678 N/A GLN 133.A N THR 129.A O no hydrogen 2.968 N/A PHE 134.A N GLN 130.A O no hydrogen 2.811 N/A LEU 135.A N VAL 131.A O no hydrogen 2.951 N/A TYR 136.A N PRO 132.A O no hydrogen 2.889 N/A GLU 137.A N GLN 133.A O no hydrogen 2.888 N/A ALA 138.A N PHE 134.A O no hydrogen 2.847 N/A GLY 139.A N LEU 135.A O no hydrogen 2.854 N/A PHE 140.A N TYR 136.A O no hydrogen 2.988 N/A GLY 141.A N GLU 137.A O no hydrogen 2.862 N/A ALA 142.A N ALA 138.A O no hydrogen 2.894 N/A SER 145.A OG PRO 146.A O no hydrogen 3.386 N/A GLY 150.A N PRO 146.A O no hydrogen 2.924 N/A MET 151.A N SER 218.A OG no hydrogen 3.194 N/A VAL 152.A N LYS 195.A O no hydrogen 2.961 N/A GLY 153.A N SER 219.A O no hydrogen 2.918 N/A ILE 154.A N LYS 197.A O no hydrogen 2.882 N/A THR 155.A N ILE 221.A O no hydrogen 2.911 N/A THR 155.A OG1 ASP 201.A OD1 no hydrogen 2.750 N/A GLN 156.A N MET 199.A O no hydrogen 2.961 N/A ALA 162.A N ARG 158.A O no hydrogen 2.966 N/A VAL 163.A N ARG 159.A O no hydrogen 2.882 N/A SER 164.A N VAL 160.A O no hydrogen 2.917 N/A SER 164.A OG VAL 160.A O no hydrogen 2.486 N/A SER 164.A OG ALA 161.A O no hydrogen 2.952 N/A MET 165.A N ALA 161.A O no hydrogen 2.874 N/A ALA 166.A N ALA 162.A O no hydrogen 2.908 N/A GLU 167.A N VAL 163.A O no hydrogen 2.943 N/A ARG 168.A N SER 164.A O no hydrogen 2.867 N/A VAL 169.A N MET 165.A O no hydrogen 2.885 N/A ALA 170.A N ALA 166.A O no hydrogen 2.876 N/A ASN 171.A N GLU 167.A O no hydrogen 2.946 N/A GLU 172.A N ARG 168.A O no hydrogen 2.882 N/A LEU 173.A N VAL 169.A O no hydrogen 2.847 N/A LEU 173.A N ALA 170.A O no hydrogen 3.214 N/A GLY 174.A N ASN 171.A O no hydrogen 3.073 N/A LYS 179.A NZ LEU 173.A O no hydrogen 3.383 N/A GLY 181.A N VAL 196.A O no hydrogen 2.892 N/A GLN 183.A N PHE 198.A O no hydrogen 2.902 N/A ILE 184.A N ASP 187.A O no hydrogen 2.957 N/A ASP 187.A N ILE 184.A O no hydrogen 3.107 N/A SER 188.A OG GLN 183.A OE1 no hydrogen 2.799 N/A LYS 191.A NZ TYR 217.A OH no hydrogen 2.214 N/A THR 194.A OG1 ASP 193.A O no hydrogen 2.503 N/A LYS 195.A NZ HIS 178.A ND1 no hydrogen 2.839 N/A VAL 196.A N LYS 179.A O no hydrogen 2.906 N/A LYS 197.A N VAL 152.A O no hydrogen 2.909 N/A PHE 198.A N GLY 181.A O no hydrogen 2.852 N/A MET 199.A N ILE 154.A O no hydrogen 2.895 N/A THR 200.A OG1 GLN 156.A O no hydrogen 3.268 N/A ASP 201.A N THR 200.A OG1 no hydrogen 2.669 N/A LEU 204.A N THR 200.A O no hydrogen 2.984 N/A LEU 205.A N ASP 201.A O no hydrogen 2.892 N/A ARG 206.A N GLY 202.A O no hydrogen 2.889 N/A GLU 207.A N VAL 203.A O no hydrogen 2.933 N/A MET 208.A N LEU 204.A O no hydrogen 2.883 N/A MET 209.A N LEU 205.A O no hydrogen 2.850 N/A HIS 210.A N ARG 206.A O no hydrogen 3.053 N/A HIS 210.A ND1 ARG 206.A O no hydrogen 3.198 N/A ASP 211.A N MET 208.A O no hydrogen 2.956 N/A LYS 213.A NZ PHE 212.A O no hydrogen 3.495 N/A LEU 214.A N ASP 211.A O no hydrogen 2.647 N/A THR 215.A N ASP 211.A OD1 no hydrogen 3.026 N/A THR 215.A OG1 ASP 211.A OD1 no hydrogen 3.228 N/A LYS 216.A N ASP 211.A OD2 no hydrogen 3.184 N/A SER 218.A OG PRO 149.A O no hydrogen 2.249 N/A SER 219.A N MET 151.A O no hydrogen 3.268 N/A ILE 220.A N LYS 261.A O no hydrogen 2.934 N/A ILE 221.A N GLY 153.A O no hydrogen 2.891 N/A ILE 222.A N ILE 263.A O no hydrogen 2.917 N/A ASP 223.A N THR 155.A O no hydrogen 3.006 N/A ALA 225.A N MET 265.A O no hydrogen 2.965 N/A ARG 228.A N ALA 225.A O no hydrogen 3.275 N/A ARG 228.A NH1 THR 496.A OG1 no hydrogen 3.205 N/A ILE 230.A N ASN 229.A OD1 no hydrogen 2.627 N/A THR 232.A OG1 ASN 229.A O no hydrogen 2.252 N/A ASP 233.A N ASN 229.A O no hydrogen 2.919 N/A ILE 234.A N ILE 230.A O no hydrogen 2.919 N/A LEU 235.A N ASN 231.A O no hydrogen 2.875 N/A ILE 236.A N THR 232.A O no hydrogen 2.920 N/A GLY 237.A N ASP 233.A O no hydrogen 2.967 N/A MET 238.A N ILE 234.A O no hydrogen 2.923 N/A LEU 239.A N LEU 235.A O no hydrogen 2.861 N/A SER 240.A N ILE 236.A O no hydrogen 2.951 N/A SER 240.A OG ILE 236.A O no hydrogen 3.147 N/A SER 240.A OG GLY 237.A O no hydrogen 2.286 N/A ARG 241.A N GLY 237.A O no hydrogen 2.989 N/A ARG 241.A NH1 ASN 491.A O no hydrogen 3.427 N/A CYS 242.A N MET 238.A O no hydrogen 2.854 N/A CYS 242.A SG MET 238.A O no hydrogen 3.762 N/A CYS 242.A SG LEU 239.A O no hydrogen 3.076 N/A VAL 243.A N LEU 239.A O no hydrogen 2.886 N/A ARG 244.A N SER 240.A O no hydrogen 2.940 N/A LEU 245.A N ARG 241.A O no hydrogen 2.969 N/A LYS 248.A NZ GLU 256.A OE2 no hydrogen 2.983 N/A GLU 252.A N LEU 249.A O no hydrogen 3.280 N/A ASN 253.A N HIS 250.A O no hydrogen 3.045 N/A LYS 258.A NZ VAL 243.A O no hydrogen 2.309 N/A LYS 261.A N SER 218.A O no hydrogen 2.843 N/A LYS 261.A NZ HIS 257.A ND1 no hydrogen 3.441 N/A LYS 261.A NZ LYS 258.A O no hydrogen 2.323 N/A LEU 262.A N ASP 115.A O no hydrogen 2.898 N/A ILE 263.A N ILE 220.A O no hydrogen 2.901 N/A ILE 264.A N VAL 117.A O no hydrogen 2.919 N/A MET 265.A N ILE 222.A O no hydrogen 2.860 N/A SER 266.A N ILE 119.A O no hydrogen 2.934 N/A SER 266.A OG ALA 267.A O no hydrogen 3.549 N/A PHE 274.A N ARG 270.A O no hydrogen 2.953 N/A SER 275.A N SER 272.A O no hydrogen 3.340 N/A GLU 276.A N SER 272.A O no hydrogen 2.560 N/A LEU 280.A N ASN 277.A O no hydrogen 2.978 N/A ILE 283.A N LEU 280.A O no hydrogen 3.293 N/A ALA 284.A N LEU 280.A O no hydrogen 2.717 N/A LEU 288.A N ILE 118.A O no hydrogen 2.906 N/A VAL 290.A N CYS 120.A O no hydrogen 2.930 N/A SER 296.A N GLY 446.A O no hydrogen 2.875 N/A SER 296.A OG HIS 298.A NE2 no hydrogen 3.096 N/A SER 296.A OG GLY 446.A O no hydrogen 3.564 N/A SER 296.A OG HIS 447.A ND1 no hydrogen 2.374 N/A HIS 298.A NE2 SER 296.A OG no hydrogen 3.096 N/A ASN 300.A N TYR 452.A O no hydrogen 2.868 N/A ASN 300.A ND2 SER 453.A OG no hydrogen 3.159 N/A ARG 301.A NH2 SER 453.A OG no hydrogen 2.681 N/A THR 303.A N PHE 299.A O no hydrogen 2.893 N/A THR 303.A OG1 PHE 299.A O no hydrogen 2.951 N/A ASN 306.A ND2 ASN 300.A OD1 no hydrogen 2.169 N/A ALA 311.A N TYR 307.A O no hydrogen 2.868 N/A PHE 312.A N THR 308.A O no hydrogen 2.934 N/A ARG 313.A N ASP 309.A O no hydrogen 2.878 N/A ARG 313.A NE ARG 313.A O no hydrogen 2.680 N/A LYS 314.A N GLU 310.A O no hydrogen 2.874 N/A THR 315.A N ALA 311.A O no hydrogen 2.869 N/A THR 315.A OG1 ALA 311.A O no hydrogen 3.440 N/A THR 315.A OG1 PHE 312.A O no hydrogen 2.319 N/A CYS 316.A N PHE 312.A O no hydrogen 2.973 N/A CYS 316.A SG PHE 312.A O no hydrogen 3.164 N/A LYS 317.A N ARG 313.A O no hydrogen 2.861 N/A ILE 318.A N LYS 314.A O no hydrogen 2.893 N/A HIS 319.A N THR 315.A O no hydrogen 2.887 N/A GLN 320.A N CYS 316.A O no hydrogen 2.944 N/A LYS 321.A N LYS 317.A O no hydrogen 2.852 N/A ALA 326.A N GLY 399.A O no hydrogen 3.270 N/A ILE 327.A N LEU 383.A O no hydrogen 2.972 N/A LEU 328.A N TYR 402.A O no hydrogen 2.888 N/A VAL 329.A N ILE 385.A O no hydrogen 2.916 N/A PHE 330.A N VAL 404.A O no hydrogen 2.887 N/A LEU 331.A N ALA 387.A O no hydrogen 2.923 N/A GLU 336.A N GLU 336.A OE1 no hydrogen 2.556 N/A ILE 337.A N GLY 333.A O no hydrogen 2.845 N/A THR 338.A N GLN 334.A O no hydrogen 2.799 N/A HIS 339.A N GLN 335.A O no hydrogen 2.918 N/A MET 340.A N GLU 336.A O no hydrogen 2.853 N/A VAL 341.A N ILE 337.A O no hydrogen 2.891 N/A LYS 342.A N THR 338.A O no hydrogen 2.901 N/A ARG 343.A N HIS 339.A O no hydrogen 2.882 N/A ARG 343.A NE HIS 339.A NE2 no hydrogen 3.014 N/A ARG 343.A NH1 HIS 339.A NE2 no hydrogen 3.457 N/A LEU 344.A N MET 340.A O no hydrogen 2.852 N/A LEU 344.A N VAL 341.A O no hydrogen 3.284 N/A ARG 345.A N VAL 341.A O no hydrogen 2.931 N/A ARG 345.A N LYS 342.A O no hydrogen 3.063 N/A LYS 346.A N LYS 342.A O no hydrogen 2.897 N/A GLU 347.A N GLU 347.A OE1 no hydrogen 2.748 N/A THR 351.A OG1 GLU 348.A OE1 no hydrogen 3.410 N/A ALA 352.A N GLY 349.A O no hydrogen 3.188 N/A ASN 353.A N GLY 349.A O no hydrogen 2.839 N/A ASP 354.A N GLN 350.A O no hydrogen 2.917 N/A LEU 356.A N ASN 353.A O no hydrogen 2.858 N/A TYR 357.A N ARG 382.A O no hydrogen 2.371 N/A LEU 361.A N VAL 386.A O no hydrogen 2.898 N/A LEU 365.A N TYR 362.A O no hydrogen 2.929 N/A THR 367.A OG1 GLN 370.A OE1 no hydrogen 3.524 N/A LYS 368.A N LEU 365.A O no hydrogen 3.398 N/A LYS 368.A NZ TYR 362.A O no hydrogen 2.359 N/A LYS 368.A NZ SER 363.A O no hydrogen 2.864 N/A LYS 368.A NZ LEU 365.A O no hydrogen 2.155 N/A GLN 370.A N PRO 366.A O no hydrogen 2.875 N/A ARG 372.A NE GLN 370.A OE1 no hydrogen 3.315 N/A PHE 374.A N GLN 375.A OE1 no hydrogen 3.192 N/A GLN 375.A NE2 MET 371.A O no hydrogen 2.771 N/A SER 381.A N PRO 378.A O no hydrogen 2.938 N/A SER 381.A OG ASP 354.A O no hydrogen 2.984 N/A ARG 382.A N PRO 355.A O no hydrogen 2.860 N/A ARG 382.A NE HIS 319.A ND1 no hydrogen 2.952 N/A ARG 382.A NH1 LEU 322.A O no hydrogen 2.188 N/A CYS 384.A N TYR 357.A O no hydrogen 2.909 N/A CYS 384.A SG ILE 327.A O no hydrogen 4.021 N/A ILE 385.A N ILE 327.A O no hydrogen 2.850 N/A VAL 386.A N LEU 359.A O no hydrogen 2.953 N/A ALA 387.A N VAL 329.A O no hydrogen 2.953 N/A THR 388.A OG1 LEU 331.A O no hydrogen 3.479 N/A ASN 389.A ND2 SER 409.A OG no hydrogen 3.075 N/A GLU 392.A N THR 388.A O no hydrogen 2.957 N/A THR 393.A N ASN 389.A O no hydrogen 2.885 N/A THR 393.A OG1 GLU 224.A OE1 no hydrogen 3.137 N/A SER 394.A N VAL 390.A O no hydrogen 2.948 N/A SER 394.A OG VAL 390.A O no hydrogen 2.409 N/A THR 396.A OG1 THR 396.A O no hydrogen 2.368 N/A ARG 401.A N ALA 326.A O no hydrogen 3.117 N/A ARG 401.A NE PRO 445.A O no hydrogen 3.294 N/A ARG 401.A NH1 PRO 445.A O no hydrogen 2.263 N/A TYR 402.A N ALA 326.A O no hydrogen 2.919 N/A TYR 402.A OH PRO 323.A O no hydrogen 2.459 N/A VAL 403.A N HIS 447.A O no hydrogen 2.878 N/A VAL 404.A N LEU 328.A O no hydrogen 2.863 N/A ASP 405.A N TYR 449.A O no hydrogen 2.892 N/A SER 406.A N PHE 330.A O no hydrogen 2.987 N/A SER 406.A OG PHE 330.A O no hydrogen 2.930 N/A GLY 407.A N ASP 405.A OD1 no hydrogen 2.418 N/A SER 409.A N GLY 426.A O no hydrogen 2.792 N/A SER 409.A OG ASN 389.A OD1 no hydrogen 3.154 N/A SER 409.A OG ARG 408.A O no hydrogen 2.707 N/A GLU 411.A N GLU 424.A O no hydrogen 2.889 N/A LYS 413.A NZ TYR 414.A O no hydrogen 2.632 N/A ASN 415.A N VAL 420.A O no hydrogen 3.303 N/A GLU 416.A N GLU 416.A OE1 no hydrogen 2.536 N/A ASN 418.A ND2 LEU 561.A O no hydrogen 3.413 N/A ASN 418.A ND2 SER 562.A O no hydrogen 2.900 N/A GLY 419.A N ASN 415.A O no hydrogen 2.466 N/A VAL 420.A N ASN 415.A OD1 no hydrogen 3.468 N/A SER 422.A N LYS 413.A O no hydrogen 2.890 N/A SER 422.A OG GLU 424.A OE1 no hydrogen 2.295 N/A GLU 424.A N GLU 411.A O no hydrogen 2.915 N/A VAL 428.A N GLY 407.A O no hydrogen 3.401 N/A SER 429.A OG GLU 462.A O no hydrogen 2.337 N/A LYS 430.A N GLU 462.A O no hydrogen 2.967 N/A LYS 430.A NZ PHE 461.A O no hydrogen 2.384 N/A LYS 430.A NZ GLN 463.A OE1 no hydrogen 2.434 N/A ALA 431.A N SER 429.A OG no hydrogen 3.313 N/A SER 432.A OG SER 429.A O no hydrogen 2.219 N/A ALA 433.A N SER 429.A O no hydrogen 2.911 N/A ASN 434.A N LYS 430.A O no hydrogen 2.894 N/A GLN 435.A N ALA 431.A O no hydrogen 2.856 N/A ARG 436.A N SER 432.A O no hydrogen 2.892 N/A SER 437.A N ALA 433.A O no hydrogen 2.924 N/A SER 437.A OG ALA 433.A O no hydrogen 3.079 N/A GLY 438.A N ASN 434.A O no hydrogen 2.882 N/A ARG 439.A N GLN 435.A O no hydrogen 2.865 N/A ARG 439.A NE GLU 392.A O no hydrogen 2.389 N/A ARG 439.A NH1 GLN 435.A O no hydrogen 3.331 N/A ARG 439.A NH2 THR 393.A O no hydrogen 3.224 N/A ALA 440.A N ARG 436.A O no hydrogen 2.907 N/A GLY 441.A N SER 437.A O no hydrogen 2.933 N/A ARG 442.A N ARG 439.A O no hydrogen 3.221 N/A THR 443.A OG1 PRO 398.A O no hydrogen 2.263 N/A THR 443.A OG1 VAL 400.A O no hydrogen 3.010 N/A GLY 446.A N PRO 294.A O no hydrogen 2.897 N/A HIS 447.A N ARG 401.A O no hydrogen 2.922 N/A CYS 448.A N SER 296.A O no hydrogen 2.884 N/A TYR 449.A N VAL 403.A O no hydrogen 2.891 N/A ARG 450.A N HIS 298.A O no hydrogen 2.890 N/A LEU 451.A N ASP 405.A O no hydrogen 2.969 N/A TYR 452.A OH ASP 405.A OD2 no hydrogen 3.340 N/A PHE 457.A N SER 453.A O no hydrogen 2.892 N/A GLU 458.A N SER 454.A O no hydrogen 2.892 N/A HIS 459.A N ALA 455.A O no hydrogen 2.923 N/A ASP 460.A N VAL 456.A O no hydrogen 2.901 N/A GLN 463.A N GLU 462.A OE2 no hydrogen 2.791 N/A LEU 470.A N PRO 467.A O no hydrogen 2.752 N/A ARG 471.A N PRO 467.A O no hydrogen 2.937 N/A ARG 471.A NE LYS 466.A O no hydrogen 2.535 N/A ARG 471.A NH2 LYS 466.A O no hydrogen 2.677 N/A GLU 475.A N GLU 475.A OE1 no hydrogen 2.397 N/A SER 476.A OG PRO 473.A O no hydrogen 2.339 N/A ILE 477.A N PRO 473.A O no hydrogen 2.903 N/A VAL 478.A N VAL 474.A O no hydrogen 2.902 N/A LEU 479.A N GLU 475.A O no hydrogen 2.949 N/A GLN 480.A N SER 476.A O no hydrogen 2.819 N/A MET 481.A N ILE 477.A O no hydrogen 2.914 N/A LYS 482.A N VAL 478.A O no hydrogen 2.926 N/A LYS 482.A NZ HIS 487.A ND1 no hydrogen 3.034 N/A LYS 482.A NZ GLU 520.A O no hydrogen 2.935 N/A SER 483.A N LEU 479.A O no hydrogen 2.815 N/A SER 483.A OG LEU 479.A O no hydrogen 2.654 N/A SER 483.A OG GLN 480.A O no hydrogen 2.760 N/A MET 484.A N GLN 480.A O no hydrogen 2.908 N/A ALA 485.A N LYS 482.A O no hydrogen 2.773 N/A ILE 486.A N MET 481.A O no hydrogen 2.742 N/A PHE 492.A N ILE 489.A O no hydrogen 3.043 N/A THR 496.A OG1 THR 496.A O no hydrogen 2.403 N/A ALA 502.A N ASP 499.A OD2 no hydrogen 2.227 N/A LEU 503.A N ASP 499.A O no hydrogen 2.905 N/A SER 504.A N ARG 500.A O no hydrogen 2.910 N/A SER 504.A OG ARG 500.A O no hydrogen 3.121 N/A SER 504.A OG VAL 501.A O no hydrogen 2.439 N/A LYS 505.A N VAL 501.A O no hydrogen 2.905 N/A ALA 506.A N ALA 502.A O no hydrogen 2.873 N/A ILE 507.A N LEU 503.A O no hydrogen 2.861 N/A GLN 508.A N SER 504.A O no hydrogen 2.930 N/A LEU 509.A N LYS 505.A O no hydrogen 2.878 N/A LEU 510.A N ALA 506.A O no hydrogen 2.880 N/A GLN 511.A N ILE 507.A O no hydrogen 2.902 N/A GLN 511.A NE2 ASP 517.A O no hydrogen 2.223 N/A TYR 512.A N GLN 508.A O no hydrogen 2.827 N/A LEU 513.A N LEU 509.A O no hydrogen 2.833 N/A GLY 514.A N LEU 510.A O no hydrogen 2.928 N/A ASP 517.A N MET 521.A O no hydrogen 2.909 N/A LYS 519.A N ASP 517.A OD2 no hydrogen 3.026 N/A GLU 520.A N ASP 517.A O no hydrogen 2.861 N/A MET 521.A N ASP 517.A OD1 no hydrogen 2.325 N/A THR 523.A N ALA 515.A O no hydrogen 2.683 N/A THR 523.A OG1 GLY 514.A O no hydrogen 2.748 N/A THR 523.A OG1 ALA 515.A O no hydrogen 3.116 N/A GLY 526.A N THR 523.A OG1 no hydrogen 3.156 N/A LYS 527.A N THR 523.A O no hydrogen 2.886 N/A LYS 528.A N GLU 524.A O no hydrogen 3.000 N/A LYS 528.A NZ GLU 524.A OE1 no hydrogen 2.321 N/A MET 529.A N ASP 525.A O no hydrogen 2.833 N/A SER 530.A N GLY 526.A O no hydrogen 2.886 N/A SER 530.A OG GLY 526.A O no hydrogen 3.171 N/A SER 530.A OG LYS 527.A O no hydrogen 2.427 N/A LEU 531.A N LYS 527.A O no hydrogen 2.932 N/A PHE 532.A N LYS 528.A O no hydrogen 2.947 N/A ARG 537.A NE VAL 659.A O no hydrogen 3.370 N/A ARG 537.A NH1 VAL 659.A O no hydrogen 3.383 N/A SER 539.A N SER 535.A O no hydrogen 2.973 N/A SER 539.A OG SER 535.A O no hydrogen 3.086 N/A SER 539.A OG PRO 536.A O no hydrogen 2.524 N/A LYS 540.A N PRO 536.A O no hydrogen 2.915 N/A MET 541.A N ARG 537.A O no hydrogen 2.968 N/A LEU 542.A N PHE 538.A O no hydrogen 2.896 N/A LEU 543.A N SER 539.A O no hydrogen 2.949 N/A VAL 544.A N LYS 540.A O no hydrogen 3.050 N/A SER 545.A N MET 541.A O no hydrogen 2.899 N/A SER 545.A OG MET 541.A O no hydrogen 3.367 N/A SER 545.A OG LEU 542.A O no hydrogen 2.333 N/A ASP 546.A N LEU 542.A O no hydrogen 2.921 N/A GLU 547.A N LEU 543.A O no hydrogen 3.054 N/A LYS 548.A N VAL 544.A O no hydrogen 2.926 N/A ALA 549.A N SER 545.A O no hydrogen 2.960 N/A CYS 550.A SG LYS 548.A O no hydrogen 3.676 N/A ILE 554.A N CYS 550.A O no hydrogen 2.972 N/A VAL 555.A N LEU 551.A O no hydrogen 2.885 N/A ALA 556.A N PRO 552.A O no hydrogen 2.951 N/A ILE 557.A N TYR 553.A O no hydrogen 2.995 N/A VAL 558.A N ILE 554.A O no hydrogen 2.882 N/A SER 559.A N VAL 555.A O no hydrogen 2.897 N/A SER 559.A OG ILE 616.A O no hydrogen 2.689 N/A ALA 560.A N ALA 556.A O no hydrogen 2.954 N/A LEU 561.A N ILE 557.A O no hydrogen 2.904 N/A SER 562.A N VAL 558.A O no hydrogen 2.882 N/A SER 562.A OG VAL 558.A O no hydrogen 3.202 N/A SER 562.A OG SER 559.A O no hydrogen 2.913 N/A VAL 563.A N SER 559.A O no hydrogen 2.952 N/A SER 568.A N LYS 564.A O no hydrogen 2.908 N/A SER 568.A OG LYS 564.A O no hydrogen 3.016 N/A SER 568.A OG PHE 565.A O no hydrogen 2.661 N/A ARG 569.A N PHE 565.A O no hydrogen 2.881 N/A SER 570.A N TYR 566.A O no hydrogen 2.916 N/A SER 570.A OG TYR 566.A O no hydrogen 3.009 N/A SER 570.A OG LYS 567.A O no hydrogen 2.522 N/A GLN 571.A N LYS 567.A O no hydrogen 2.892 N/A GLN 571.A NE2 GLN 571.A O no hydrogen 2.412 N/A PHE 572.A N SER 568.A O no hydrogen 2.928 N/A SER 573.A N ARG 569.A O no hydrogen 2.804 N/A SER 573.A N SER 570.A O no hydrogen 3.035 N/A SER 573.A OG ARG 569.A O no hydrogen 2.486 N/A LYS 574.A N SER 570.A O no hydrogen 2.992 N/A LYS 577.A NZ LYS 574.A O no hydrogen 2.312 N/A SER 579.A OG ASP 580.A OD1 no hydrogen 3.220 N/A SER 579.A OG LEU 740.A O no hydrogen 2.110 N/A ARG 583.A N SER 579.A O no hydrogen 3.007 N/A LEU 584.A N ASP 580.A O no hydrogen 2.879 N/A LEU 585.A N VAL 581.A O no hydrogen 2.890 N/A SER 586.A N PHE 582.A O no hydrogen 2.903 N/A VAL 587.A N ARG 583.A O no hydrogen 2.921 N/A VAL 588.A N LEU 584.A O no hydrogen 2.910 N/A SER 589.A N LEU 585.A O no hydrogen 2.869 N/A SER 589.A OG LEU 585.A O no hydrogen 3.149 N/A SER 589.A OG SER 586.A O no hydrogen 2.565 N/A ALA 590.A N SER 586.A O no hydrogen 2.903 N/A MET 591.A N VAL 587.A O no hydrogen 2.885 N/A ASP 592.A N VAL 588.A O no hydrogen 2.956 N/A TYR 593.A N SER 589.A O no hydrogen 2.879 N/A VAL 594.A N ALA 590.A O no hydrogen 2.891 N/A LYS 599.A N LYS 596.A O no hydrogen 2.365 N/A ILE 601.A N GLU 597.A O no hydrogen 2.946 N/A PHE 602.A N GLN 598.A O no hydrogen 2.842 N/A MET 603.A N LYS 599.A O no hydrogen 2.929 N/A LYS 604.A N GLU 600.A O no hydrogen 2.934 N/A LYS 605.A N ILE 601.A O no hydrogen 2.915 N/A LYS 605.A NZ ILE 601.A O no hydrogen 3.410 N/A ASN 606.A N PHE 602.A O no hydrogen 2.939 N/A ASN 606.A ND2 PHE 602.A O no hydrogen 2.292 N/A LEU 608.A N MET 603.A O no hydrogen 3.012 N/A LYS 611.A NZ GLU 615.A OE2 no hydrogen 3.033 N/A MET 613.A N ARG 609.A O no hydrogen 2.967 N/A GLU 614.A N GLY 610.A O no hydrogen 2.943 N/A GLU 615.A N LYS 611.A O no hydrogen 2.905 N/A ILE 616.A N LEU 612.A O no hydrogen 2.877 N/A VAL 617.A N MET 613.A O no hydrogen 2.924 N/A LYS 618.A N GLU 614.A O no hydrogen 3.045 N/A LYS 618.A NZ GLU 614.A O no hydrogen 3.074 N/A LYS 618.A NZ GLU 614.A OE1 no hydrogen 2.473 N/A LEU 619.A N GLU 615.A O no hydrogen 2.941 N/A ARG 620.A N ILE 616.A O no hydrogen 2.853 N/A LYS 621.A N VAL 617.A O no hydrogen 2.969 N/A GLN 622.A N LYS 618.A O no hydrogen 2.882 N/A LEU 623.A N LEU 619.A O no hydrogen 2.917 N/A MET 624.A N ARG 620.A O no hydrogen 2.958 N/A TYR 625.A N LYS 621.A O no hydrogen 2.989 N/A ILE 626.A N GLN 622.A O no hydrogen 2.886 N/A ILE 627.A N LEU 623.A O no hydrogen 2.927 N/A LYS 628.A N MET 624.A O no hydrogen 2.937 N/A LYS 628.A NZ VAL 638.A O no hydrogen 3.429 N/A SER 629.A N TYR 625.A O no hydrogen 2.871 N/A SER 629.A OG TYR 625.A O no hydrogen 3.062 N/A SER 629.A OG ILE 626.A O no hydrogen 2.181 N/A ASN 630.A N ILE 626.A O no hydrogen 2.879 N/A THR 631.A N LYS 628.A O no hydrogen 2.905 N/A THR 631.A OG1 SER 629.A O no hydrogen 3.143 N/A SER 632.A OG ASP 546.A OD2 no hydrogen 3.071 N/A SER 632.A OG ILE 627.A O no hydrogen 3.460 N/A ASN 635.A ND2 VAL 638.A O no hydrogen 2.743 N/A GLU 643.A N ASN 642.A OD1 no hydrogen 2.433 N/A LEU 650.A N GLN 646.A O no hydrogen 2.963 N/A LYS 651.A N ILE 647.A O no hydrogen 2.896 N/A LYS 651.A NZ ASP 742.A O no hydrogen 3.030 N/A LYS 651.A NZ ASP 742.A OD1 no hydrogen 2.893 N/A GLN 652.A N LYS 648.A O no hydrogen 2.945 N/A MET 653.A N LEU 649.A O no hydrogen 2.883 N/A ILE 654.A N LEU 650.A O no hydrogen 2.936 N/A CYS 655.A N LYS 651.A O no hydrogen 2.862 N/A ALA 656.A N GLN 652.A O no hydrogen 2.971 N/A GLY 657.A N MET 653.A O no hydrogen 3.017 N/A PHE 658.A N ILE 654.A O no hydrogen 2.847 N/A VAL 659.A N CYS 655.A O no hydrogen 2.976 N/A HIS 661.A N PHE 658.A O no hydrogen 3.298 N/A VAL 662.A N LEU 691.A O no hydrogen 3.150 N/A VAL 664.A N PRO 689.A O no hydrogen 2.911 N/A ARG 665.A N LYS 720.A O no hydrogen 2.979 N/A ARG 665.A NE PRO 719.A O no hydrogen 2.973 N/A ARG 665.A NH1 PRO 719.A O no hydrogen 2.211 N/A ALA 666.A N TYR 687.A O no hydrogen 2.970 N/A ALA 674.A N PRO 671.A O no hydrogen 3.149 N/A LYS 675.A N ASP 672.A O no hydrogen 3.285 N/A LYS 675.A NZ ASN 684.A OD1 no hydrogen 2.467 N/A LYS 675.A NZ GLU 716.A OE1 no hydrogen 2.739 N/A THR 677.A OG1 THR 677.A O no hydrogen 2.455 N/A ASN 678.A ND2 SER 681.A O no hydrogen 2.787 N/A ARG 679.A N ASN 678.A OD1 no hydrogen 2.738 N/A ARG 679.A NH2 ARG 679.A O no hydrogen 3.136 N/A SER 681.A OG ARG 679.A O no hydrogen 3.167 N/A ASN 684.A N ASN 713.A O no hydrogen 3.083 N/A ASN 684.A ND2 ALA 674.A O no hydrogen 2.951 N/A ILE 688.A N VAL 703.A O no hydrogen 3.039 N/A VAL 690.A N CYS 701.A O no hydrogen 2.817 N/A LEU 691.A N VAL 662.A O no hydrogen 2.844 N/A THR 693.A OG1 GLU 699.A OE2 no hydrogen 3.554 N/A THR 695.A N ALA 692.A O no hydrogen 2.789 N/A THR 695.A OG1 ALA 692.A O no hydrogen 2.901 N/A THR 695.A OG1 THR 695.A O no hydrogen 2.446 N/A CYS 701.A N VAL 690.A O no hydrogen 2.987 N/A CYS 701.A SG PHE 702.A O no hydrogen 3.311 N/A VAL 703.A N ILE 688.A O no hydrogen 2.874 N/A TYR 704.A N THR 735.A O no hydrogen 3.410 N/A THR 708.A N HIS 706.A ND1 no hydrogen 3.122 N/A THR 708.A OG1 HIS 706.A ND1 no hydrogen 2.423 N/A SER 709.A N HIS 706.A O no hydrogen 3.196 N/A SER 709.A OG HIS 706.A O no hydrogen 2.586 N/A ASN 713.A ND2 TYR 704.A OH no hydrogen 3.170 N/A LEU 714.A N LEU 711.A O no hydrogen 3.339 N/A TYR 721.A N ILE 743.A O no hydrogen 3.077 N/A MET 722.A N ALA 663.A O no hydrogen 2.831 N/A LEU 723.A N CYS 741.A O no hydrogen 2.888 N/A TYR 724.A N HIS 661.A O no hydrogen 2.915 N/A TYR 725.A N THR 739.A O no hydrogen 2.881 N/A TYR 725.A OH ASN 418.A O no hydrogen 2.394 N/A HIS 728.A N ARG 736.A O no hydrogen 2.931 N/A GLY 730.A N LYS 734.A O no hydrogen 2.865 N/A LYS 734.A N GLY 730.A O no hydrogen 2.955 N/A LYS 734.A N GLY 731.A O no hydrogen 3.230 N/A THR 735.A OG1 HIS 728.A O no hydrogen 3.479 N/A ARG 736.A N HIS 728.A O no hydrogen 2.907 N/A ARG 736.A NH1 GLY 731.A O no hydrogen 2.924 N/A THR 739.A OG1 ASP 580.A OD1 no hydrogen 2.691 N/A THR 739.A OG1 ASP 580.A OD2 no hydrogen 2.491 N/A LEU 740.A N ASP 580.A OD1 no hydrogen 3.488 N/A CYS 741.A N LEU 723.A O no hydrogen 2.870 N/A ASP 742.A N ASP 742.A OD1 no hydrogen 2.432 N/A ILE 743.A N TYR 721.A O no hydrogen 2.865 N/A LEU 748.A N ALA 744.A O no hydrogen 3.091 N/A ALA 749.A N SER 745.A O no hydrogen 2.876 N/A ASN 750.A N THR 746.A O no hydrogen 2.887 N/A ILE 751.A N PRO 747.A O no hydrogen 3.040 N/A ALA 752.A N LEU 748.A O no hydrogen 2.911 N/A ARG 753.A N ALA 749.A O no hydrogen 2.874 N/A LYS 754.A N ASN 750.A O no hydrogen 3.026 N/A GLY 755.A N ILE 751.A O no hydrogen 2.900 N/A THR 759.A OG1 LEU 757.A O no hydrogen 3.464 N/A SER 761.A OG LYS 762.A O no hydrogen 3.143 N/A SER 761.A OG VAL 781.A O no hydrogen 3.233 N/A LEU 764.A N TYR 779.A O no hydrogen 3.213 N/A LEU 771.A N GLU 775.A O no hydrogen 2.838 N/A SER 772.A N GLU 775.A O no hydrogen 3.064 N/A GLU 775.A N SER 772.A O no hydrogen 2.666 N/A ARG 776.A N GLN 798.A O no hydrogen 3.239 N/A TYR 777.A N VAL 769.A O no hydrogen 2.912 N/A CYS 778.A N VAL 796.A O no hydrogen 2.972 N/A VAL 780.A N ILE 794.A O no hydrogen 2.898 N/A VAL 781.A N SER 761.A OG no hydrogen 3.265 N/A ARG 783.A N THR 759.A O no hydrogen 3.339 N/A PHE 784.A N TRP 789.A O no hydrogen 2.938 N/A ASN 792.A ND2 SER 745.A OG no hydrogen 2.885 N/A ILE 794.A N VAL 780.A O no hydrogen 2.872 N/A VAL 796.A N CYS 778.A O no hydrogen 2.881 N/A HIS 797.A N LYS 809.A O no hydrogen 3.058 N/A HIS 797.A NE2 GLU 775.A OE2 no hydrogen 2.341 N/A GLN 798.A N ARG 776.A O no hydrogen 3.230 N/A LYS 799.A N THR 806.A O no hydrogen 2.664 N/A LYS 800.A N THR 774.A O no hydrogen 2.369 N/A GLN 801.A N GLN 804.A O no hydrogen 3.117 N/A GLN 801.A NE2 THR 806.A OG1 no hydrogen 3.154 N/A GLN 804.A N GLN 801.A O no hydrogen 3.201 N/A THR 806.A OG1 LYS 799.A O no hydrogen 3.440 N/A ILE 808.A N HIS 797.A O no hydrogen 2.936 N/A LYS 809.A N HIS 797.A O no hydrogen 3.330 N/A LYS 809.A NZ PHE 810.A O no hydrogen 3.282 N/A