Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aju_UD.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 6.A N LEU 639.A O no hydrogen 2.876 N/A ARG 7.A NE GLU 643.A OE1 no hydrogen 2.433 N/A CYS 8.A N ILE 641.A O no hydrogen 2.868 N/A ARG 9.A N ARG 7.A O no hydrogen 2.874 N/A ARG 9.A NH1 ASN 645.A OD1 no hydrogen 2.350 N/A THR 17.A OG1 GLY 323.A O no hydrogen 3.321 N/A THR 19.A N GLY 42.A O no hydrogen 2.672 N/A THR 19.A OG1 GLY 42.A O no hydrogen 2.256 N/A THR 19.A OG1 ILE 71.A O no hydrogen 2.814 N/A SER 20.A N GLY 42.A O no hydrogen 3.014 N/A ALA 22.A N ALA 40.A O no hydrogen 2.989 N/A SER 24.A N ARG 38.A O no hydrogen 2.954 N/A SER 24.A OG ARG 38.A O no hydrogen 2.542 N/A HIS 25.A NE2 ASP 36.A OD2 no hydrogen 3.225 N/A LYS 26.A NZ ASP 123.A OD1 no hydrogen 3.544 N/A SER 27.A OG GLN 312.A O no hydrogen 2.735 N/A SER 27.A OG GLN 312.A OE1 no hydrogen 2.840 N/A LYS 31.A N ASN 28.A O no hydrogen 2.948 N/A LYS 31.A N ASN 28.A OD1 no hydrogen 3.074 N/A THR 33.A OG1 PRO 34.A O no hydrogen 3.110 N/A LEU 37.A N PRO 34.A O no hydrogen 3.419 N/A ARG 38.A N SER 24.A OG no hydrogen 2.687 N/A ARG 38.A NE GLU 60.A OE1 no hydrogen 2.909 N/A ARG 38.A NH1 LEU 37.A O no hydrogen 2.598 N/A ARG 38.A NH2 GLU 60.A OE1 no hydrogen 3.559 N/A LEU 39.A N TRP 51.A O no hydrogen 2.943 N/A ALA 40.A N ALA 22.A O no hydrogen 2.829 N/A ILE 41.A N GLU 49.A O no hydrogen 2.884 N/A GLY 42.A N SER 20.A O no hydrogen 2.868 N/A ARG 43.A N ASN 47.A O no hydrogen 2.870 N/A ARG 43.A NH2 THR 346.A O no hydrogen 2.981 N/A SER 44.A N THR 17.A O no hydrogen 3.354 N/A ASN 47.A N ARG 43.A O no hydrogen 2.972 N/A ILE 48.A N ILE 63.A O no hydrogen 2.893 N/A GLU 49.A N ILE 41.A O no hydrogen 2.895 N/A ILE 50.A N MET 61.A O no hydrogen 2.858 N/A TRP 51.A N LEU 39.A O no hydrogen 2.913 N/A ASN 52.A N PHE 58.A O no hydrogen 2.883 N/A ASN 52.A ND2 GLU 60.A OE2 no hydrogen 3.380 N/A ARG 54.A N ASN 52.A OD1 no hydrogen 3.344 N/A ARG 54.A NH2 PRO 34.A O no hydrogen 3.515 N/A TRP 57.A N PRO 53.A O no hydrogen 2.784 N/A PHE 58.A N ASN 52.A O no hydrogen 2.942 N/A GLU 60.A N ILE 50.A O no hydrogen 2.861 N/A MET 61.A N ILE 50.A O no hydrogen 3.025 N/A ILE 63.A N ILE 48.A O no hydrogen 2.886 N/A GLY 66.A N ASN 45.A O no hydrogen 3.372 N/A LYS 67.A N GLN 391.A OE1 no hydrogen 2.876 N/A LYS 67.A NZ ASP 68.A OD1 no hydrogen 2.599 N/A GLY 73.A N ILE 89.A O no hydrogen 2.934 N/A CYS 75.A N PHE 87.A O no hydrogen 2.936 N/A CYS 75.A SG TRP 76.A O no hydrogen 3.862 N/A SER 77.A OG ARG 85.A O no hydrogen 2.834 N/A GLU 82.A N VAL 79.A O no hydrogen 3.219 N/A ARG 85.A N SER 77.A O no hydrogen 2.899 N/A PHE 87.A N CYS 75.A O no hydrogen 2.922 N/A SER 88.A N THR 96.A O no hydrogen 2.928 N/A ILE 89.A N GLY 73.A O no hydrogen 2.916 N/A SER 92.A OG VAL 94.A O no hydrogen 3.175 N/A VAL 94.A N SER 92.A OG no hydrogen 3.294 N/A VAL 95.A N TYR 109.A O no hydrogen 2.895 N/A THR 96.A N SER 88.A O no hydrogen 2.942 N/A THR 96.A OG1 SER 88.A O no hydrogen 3.190 N/A GLU 97.A N ARG 107.A O no hydrogen 2.903 N/A TRP 98.A N LEU 86.A O no hydrogen 2.980 N/A ASP 99.A N LEU 104.A O no hydrogen 3.055 N/A ALA 101.A N ASP 99.A OD1 no hydrogen 3.049 N/A THR 102.A N ASP 99.A O no hydrogen 3.274 N/A GLY 103.A N ASP 99.A O no hydrogen 2.584 N/A ARG 107.A N GLU 97.A O no hydrogen 2.934 N/A TYR 109.A N VAL 95.A O no hydrogen 2.927 N/A CYS 111.A N THR 93.A O no hydrogen 3.084 N/A ASN 112.A ND2 HIS 151.A ND1 no hydrogen 2.955 N/A ILE 116.A N SER 92.A O no hydrogen 3.054 N/A TRP 117.A N GLY 131.A O no hydrogen 2.701 N/A SER 118.A N GLY 131.A O no hydrogen 3.018 N/A SER 120.A N SER 129.A O no hydrogen 2.951 N/A SER 120.A OG SER 129.A OG no hydrogen 2.906 N/A ASN 122.A ND2 ASP 170.A OD1 no hydrogen 3.053 N/A SER 124.A OG ASP 123.A O no hydrogen 2.549 N/A SER 124.A OG ASP 126.A OD2 no hydrogen 2.366 N/A LEU 128.A N ILE 140.A O no hydrogen 2.947 N/A SER 129.A N SER 120.A O no hydrogen 2.894 N/A SER 129.A OG SER 120.A O no hydrogen 3.419 N/A SER 129.A OG SER 120.A OG no hydrogen 2.906 N/A VAL 130.A N VAL 138.A O no hydrogen 2.943 N/A GLY 131.A N SER 118.A O no hydrogen 2.877 N/A CYS 132.A N THR 136.A O no hydrogen 2.914 N/A CYS 132.A SG SER 113.A O no hydrogen 3.026 N/A CYS 132.A SG SER 113.A OG no hydrogen 3.237 N/A CYS 132.A SG THR 136.A O no hydrogen 3.073 N/A ASP 133.A N VAL 115.A O no hydrogen 2.928 N/A ASN 134.A ND2 SER 113.A OG no hydrogen 3.044 N/A THR 136.A N CYS 132.A O no hydrogen 3.012 N/A THR 136.A OG1 SER 113.A OG no hydrogen 3.389 N/A THR 136.A OG1 ASN 134.A O no hydrogen 3.187 N/A VAL 138.A N VAL 130.A O no hydrogen 2.934 N/A LEU 139.A N THR 153.A O no hydrogen 2.875 N/A ILE 140.A N LEU 128.A O no hydrogen 2.886 N/A ASP 141.A N GLU 150.A O no hydrogen 3.035 N/A ILE 142.A N ASP 126.A O no hydrogen 2.931 N/A SER 143.A OG ILE 142.A O no hydrogen 2.546 N/A GLU 150.A N ASP 141.A O no hydrogen 3.344 N/A ASP 152.A N LEU 139.A O no hydrogen 3.088 N/A THR 153.A N LEU 139.A O no hydrogen 2.953 N/A THR 153.A OG1 ASP 152.A OD1 no hydrogen 2.335 N/A LEU 155.A N VAL 137.A O no hydrogen 3.045 N/A MET 156.A N GLY 195.A O no hydrogen 3.474 N/A LEU 163.A N GLY 176.A O no hydrogen 2.671 N/A THR 164.A N GLY 176.A O no hydrogen 3.022 N/A ALA 166.A N ILE 174.A O no hydrogen 2.904 N/A TRP 167.A NE1 SER 120.A O no hydrogen 2.513 N/A LYS 168.A N PHE 172.A O no hydrogen 2.970 N/A VAL 173.A N TRP 185.A O no hydrogen 2.944 N/A ILE 174.A N ALA 166.A O no hydrogen 2.890 N/A GLY 175.A N ARG 183.A O no hydrogen 2.879 N/A GLY 176.A N THR 164.A O no hydrogen 2.893 N/A CYS 177.A N ARG 181.A O no hydrogen 2.926 N/A CYS 177.A SG ARG 181.A O no hydrogen 3.135 N/A SER 178.A N ARG 161.A O no hydrogen 3.264 N/A ARG 181.A N CYS 177.A O no hydrogen 3.017 N/A ILE 182.A N MET 201.A O no hydrogen 2.884 N/A ARG 183.A N GLY 175.A O no hydrogen 2.899 N/A ARG 183.A NH2 ASP 179.A OD1 no hydrogen 3.503 N/A ILE 184.A N HIS 199.A O no hydrogen 2.863 N/A TRP 185.A N VAL 173.A O no hydrogen 2.864 N/A TRP 185.A NE1 MET 156.A O no hydrogen 2.975 N/A SER 186.A N ARG 196.A O no hydrogen 3.296 N/A ALA 187.A N ASP 171.A O no hydrogen 2.881 N/A GLN 188.A NE2 ASP 171.A OD1 no hydrogen 3.473 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.619 N/A ASN 193.A N ASP 191.A OD1 no hydrogen 2.740 N/A GLY 195.A N SER 186.A O no hydrogen 3.225 N/A ARG 196.A N ASN 193.A O no hydrogen 3.056 N/A HIS 199.A N ILE 184.A O no hydrogen 3.011 N/A MET 201.A N ILE 182.A O no hydrogen 2.812 N/A VAL 203.A N GLY 180.A O no hydrogen 2.927 N/A LYS 205.A NZ THR 211.A O no hydrogen 2.306 N/A SER 210.A OG SER 210.A O no hydrogen 2.480 N/A TRP 214.A N GLY 228.A O no hydrogen 3.038 N/A SER 215.A N GLY 228.A O no hydrogen 2.989 N/A ILE 217.A N ALA 226.A O no hydrogen 2.912 N/A LEU 219.A N GLN 224.A O no hydrogen 2.833 N/A ARG 221.A N ASN 264.A OD1 no hydrogen 2.844 N/A GLN 224.A N LEU 219.A O no hydrogen 3.079 N/A GLN 224.A NE2 ASN 245.A OD1 no hydrogen 3.053 N/A ILE 225.A N TRP 237.A O no hydrogen 2.884 N/A ALA 226.A N ILE 217.A O no hydrogen 2.880 N/A SER 227.A N LYS 235.A O no hydrogen 2.911 N/A GLY 228.A N SER 215.A O no hydrogen 2.897 N/A ASP 229.A N SER 233.A O no hydrogen 2.971 N/A SER 230.A N LEU 212.A O no hydrogen 2.980 N/A THR 231.A OG1 ASP 229.A OD1 no hydrogen 2.789 N/A THR 231.A OG1 ASP 229.A OD2 no hydrogen 3.232 N/A THR 231.A OG1 SER 233.A OG no hydrogen 2.808 N/A SER 233.A N ASP 229.A O no hydrogen 3.052 N/A SER 233.A OG THR 231.A O no hydrogen 3.190 N/A SER 233.A OG THR 231.A OG1 no hydrogen 2.808 N/A ILE 234.A N PHE 248.A O no hydrogen 2.960 N/A LYS 235.A N SER 227.A O no hydrogen 2.877 N/A LYS 235.A NZ SER 247.A OG no hydrogen 2.426 N/A PHE 236.A N GLN 246.A O no hydrogen 2.834 N/A TRP 237.A N ILE 225.A O no hydrogen 2.927 N/A ASP 238.A N THR 243.A O no hydrogen 2.676 N/A PHE 239.A N ASP 223.A O no hydrogen 2.859 N/A GLN 240.A N ASP 223.A OD2 no hydrogen 2.945 N/A ALA 242.A N PHE 239.A O no hydrogen 2.911 N/A THR 243.A N ASP 238.A OD1 no hydrogen 3.072 N/A THR 243.A OG1 ASP 238.A OD1 no hydrogen 3.101 N/A ASN 245.A N PHE 236.A O no hydrogen 2.521 N/A GLN 246.A N PHE 236.A O no hydrogen 2.996 N/A PHE 248.A N ILE 234.A O no hydrogen 2.907 N/A HIS 251.A NE2 ASP 254.A O no hydrogen 3.349 N/A VAL 255.A N ASP 229.A O no hydrogen 3.462 N/A LEU 256.A N ALA 270.A O no hydrogen 2.963 N/A CYS 257.A N ALA 270.A O no hydrogen 2.989 N/A CYS 257.A SG LEU 258.A O no hydrogen 3.985 N/A CYS 257.A SG ILE 308.A O no hydrogen 3.804 N/A THR 259.A N PHE 268.A O no hydrogen 2.932 N/A THR 259.A OG1 THR 260.A O no hydrogen 3.466 N/A THR 260.A OG1 ASP 261.A O no hydrogen 3.144 N/A THR 260.A OG1 ASP 261.A OD1 no hydrogen 3.218 N/A THR 260.A OG1 TYR 266.A O no hydrogen 2.823 N/A ASN 264.A N ASP 261.A O no hydrogen 3.277 N/A ASN 264.A ND2 THR 260.A OG1 no hydrogen 3.417 N/A TYR 266.A N ASP 261.A OD1 no hydrogen 3.356 N/A VAL 267.A N PHE 279.A O no hydrogen 2.980 N/A PHE 268.A N THR 259.A O no hydrogen 2.881 N/A SER 269.A N PHE 277.A O no hydrogen 2.886 N/A ALA 270.A N CYS 257.A O no hydrogen 2.905 N/A GLY 271.A N LYS 275.A O no hydrogen 3.000 N/A VAL 272.A N ASP 254.A O no hydrogen 3.201 N/A ARG 274.A NH2 HIS 301.A O no hydrogen 3.390 N/A LYS 275.A N ASP 273.A OD1 no hydrogen 3.201 N/A ILE 276.A N ARG 298.A O no hydrogen 2.847 N/A PHE 277.A N SER 269.A O no hydrogen 2.860 N/A GLN 278.A N SER 296.A O no hydrogen 2.882 N/A PHE 279.A N VAL 267.A O no hydrogen 2.871 N/A SER 280.A N VAL 293.A O no hydrogen 3.203 N/A GLN 281.A N ASN 265.A O no hydrogen 2.902 N/A GLN 281.A NE2 SER 286.A O no hydrogen 2.912 N/A SER 286.A N THR 283.A OG1 no hydrogen 3.283 N/A SER 286.A OG THR 283.A OG1 no hydrogen 3.102 N/A GLN 287.A N THR 283.A O no hydrogen 2.909 N/A LYS 288.A N ASN 284.A O no hydrogen 2.879 N/A ASN 289.A N LYS 285.A O no hydrogen 2.886 N/A ARG 291.A N SER 286.A O no hydrogen 2.934 N/A TRP 292.A NE1 GLN 224.A OE1 no hydrogen 3.211 N/A SER 296.A N GLN 278.A O no hydrogen 3.011 N/A SER 296.A OG ASN 297.A O no hydrogen 3.522 N/A ARG 298.A N ILE 276.A O no hydrogen 2.901 N/A HIS 301.A NE2 SER 321.A OG no hydrogen 2.672 N/A ASN 303.A ND2 LYS 654.A O no hydrogen 3.241 N/A ARG 306.A N GLY 322.A O no hydrogen 2.690 N/A ALA 307.A N GLY 322.A O no hydrogen 2.976 N/A CYS 309.A N VAL 320.A O no hydrogen 2.926 N/A TYR 311.A N PHE 318.A O no hydrogen 2.884 N/A TYR 311.A OH LYS 26.A O no hydrogen 3.372 N/A TYR 311.A OH SER 313.A OG no hydrogen 2.611 N/A GLN 312.A N SER 27.A OG no hydrogen 2.899 N/A SER 313.A N ALA 316.A O no hydrogen 2.887 N/A SER 313.A OG SER 27.A O no hydrogen 3.065 N/A SER 313.A OG TYR 311.A OH no hydrogen 2.611 N/A SER 313.A OG GLN 312.A O no hydrogen 2.401 N/A LYS 314.A N LYS 31.A O no hydrogen 3.137 N/A ALA 316.A N SER 313.A O no hydrogen 2.942 N/A PHE 318.A N TYR 311.A O no hydrogen 2.940 N/A LEU 319.A N ASN 331.A O no hydrogen 2.843 N/A VAL 320.A N CYS 309.A O no hydrogen 2.907 N/A SER 321.A N VAL 329.A O no hydrogen 2.868 N/A SER 321.A OG HIS 301.A NE2 no hydrogen 2.672 N/A GLY 322.A N ALA 307.A O no hydrogen 2.861 N/A THR 327.A OG1 GLU 325.A OE1 no hydrogen 3.028 N/A LEU 328.A N MET 344.A O no hydrogen 2.932 N/A VAL 329.A N SER 321.A O no hydrogen 2.910 N/A ILE 330.A N ARG 342.A O no hydrogen 2.879 N/A ASN 331.A N LEU 319.A O no hydrogen 2.927 N/A SER 332.A OG ASP 317.A OD2 no hydrogen 3.535 N/A SER 332.A OG SER 335.A OG no hydrogen 2.926 N/A LEU 333.A N ASP 317.A O no hydrogen 2.879 N/A LEU 333.A N ASP 317.A OD2 no hydrogen 3.235 N/A THR 334.A N ASP 317.A OD2 no hydrogen 2.850 N/A THR 334.A OG1 ASP 317.A OD2 no hydrogen 3.259 N/A SER 335.A OG SER 332.A OG no hydrogen 2.926 N/A PHE 336.A N LEU 333.A O no hydrogen 3.213 N/A ASN 338.A N SER 335.A O no hydrogen 2.769 N/A GLY 339.A N SER 335.A O no hydrogen 2.395 N/A ARG 342.A N ILE 330.A O no hydrogen 2.930 N/A ARG 342.A NH2 ASN 56.A O no hydrogen 3.517 N/A MET 344.A N LEU 328.A O no hydrogen 2.870 N/A THR 346.A OG1 LYS 326.A O no hydrogen 3.351 N/A LEU 355.A N VAL 364.A O no hydrogen 2.888 N/A ASN 357.A N LEU 362.A O no hydrogen 2.796 N/A GLU 359.A N ASN 357.A OD1 no hydrogen 3.032 N/A ARG 361.A N LYS 358.A O no hydrogen 3.175 N/A LEU 362.A N ASN 357.A O no hydrogen 2.975 N/A VAL 363.A N TRP 374.A O no hydrogen 2.893 N/A VAL 364.A N LEU 355.A O no hydrogen 2.915 N/A SER 365.A N LYS 372.A O no hydrogen 2.888 N/A SER 365.A OG LYS 372.A O no hydrogen 3.477 N/A TRP 366.A N ASN 353.A O no hydrogen 3.024 N/A SER 367.A OG THR 370.A OG1 no hydrogen 2.177 N/A SER 369.A OG GLU 368.A OE2 no hydrogen 2.276 N/A SER 369.A OG ASP 390.A O no hydrogen 3.394 N/A SER 369.A OG ASN 392.A O no hydrogen 3.371 N/A THR 370.A N SER 367.A O no hydrogen 2.913 N/A VAL 371.A N LEU 385.A O no hydrogen 2.890 N/A LYS 372.A N SER 365.A O no hydrogen 2.885 N/A LYS 372.A NZ ILE 373.A O no hydrogen 3.088 N/A LYS 372.A NZ CYS 383.A O no hydrogen 3.190 N/A ILE 373.A N CYS 383.A O no hydrogen 2.915 N/A TRP 374.A N VAL 363.A O no hydrogen 2.924 N/A THR 375.A N LYS 380.A O no hydrogen 2.938 N/A THR 375.A OG1 GLN 360.A O no hydrogen 3.389 N/A THR 375.A OG1 ARG 361.A O no hydrogen 3.070 N/A MET 376.A N ARG 361.A O no hydrogen 2.873 N/A GLY 377.A N ASN 378.A O no hydrogen 2.900 N/A LYS 380.A N THR 375.A O no hydrogen 2.910 N/A LYS 380.A NZ ASN 378.A O no hydrogen 3.022 N/A VAL 382.A N ILE 373.A O no hydrogen 2.966 N/A CYS 383.A N ILE 373.A O no hydrogen 2.971 N/A LYS 384.A NZ LEU 381.A O no hydrogen 3.538 N/A LEU 385.A N VAL 371.A O no hydrogen 2.893 N/A LEU 387.A N SER 369.A O no hydrogen 2.941 N/A GLN 391.A NE2 GLY 65.A O no hydrogen 2.938 N/A ASN 392.A N ASP 390.A OD1 no hydrogen 2.981 N/A ASN 392.A ND2 SER 411.A OG no hydrogen 3.080 N/A SER 394.A OG GLY 408.A O no hydrogen 3.145 N/A THR 395.A N SER 394.A OG no hydrogen 2.586 N/A CYS 396.A SG SER 394.A O no hydrogen 3.405 N/A SER 397.A N VAL 406.A O no hydrogen 2.935 N/A SER 399.A N VAL 404.A O no hydrogen 2.910 N/A SER 399.A OG VAL 404.A O no hydrogen 3.233 N/A GLY 402.A N SER 399.A O no hydrogen 3.286 N/A LEU 405.A N PHE 416.A O no hydrogen 2.885 N/A VAL 406.A N SER 397.A O no hydrogen 2.873 N/A VAL 407.A N LYS 414.A O no hydrogen 2.898 N/A GLY 408.A N THR 395.A O no hydrogen 2.858 N/A ARG 409.A N THR 412.A O no hydrogen 3.030 N/A THR 412.A OG1 LEU 436.A O no hydrogen 3.305 N/A THR 413.A OG1 LEU 435.A O no hydrogen 2.089 N/A THR 413.A OG1 THR 438.A O no hydrogen 3.387 N/A THR 413.A OG1 THR 438.A OG1 no hydrogen 2.971 N/A LYS 414.A N VAL 407.A O no hydrogen 2.909 N/A LYS 414.A NZ ASP 389.A OD2 no hydrogen 3.264 N/A PHE 416.A N LEU 405.A O no hydrogen 2.870 N/A HIS 417.A N THR 428.A O no hydrogen 2.863 N/A LEU 418.A N GLN 403.A O no hydrogen 2.866 N/A GLN 419.A N LYS 426.A O no hydrogen 2.890 N/A VAL 421.A N LYS 424.A O no hydrogen 2.966 N/A LYS 424.A NZ VAL 382.A O no hydrogen 2.446 N/A LYS 426.A N GLN 419.A O no hydrogen 2.911 N/A THR 428.A N HIS 417.A O no hydrogen 2.886 N/A THR 428.A OG1 HIS 417.A O no hydrogen 3.542 N/A LEU 430.A N VAL 415.A O no hydrogen 2.929 N/A LEU 434.A N ASN 432.A OD1 no hydrogen 2.884 N/A LEU 436.A N ASN 432.A O no hydrogen 2.894 N/A ARG 437.A N ASP 433.A O no hydrogen 2.890 N/A ARG 437.A N LEU 434.A O no hydrogen 3.272 N/A THR 438.A N LEU 434.A O no hydrogen 2.893 N/A THR 438.A OG1 THR 413.A OG1 no hydrogen 2.971 N/A THR 438.A OG1 LEU 434.A O no hydrogen 2.961 N/A THR 438.A OG1 LEU 435.A O no hydrogen 3.130 N/A SER 439.A OG SER 439.A O no hydrogen 2.526 N/A THR 440.A OG1 LEU 442.A O no hydrogen 2.722 N/A THR 440.A OG1 CYS 454.A O no hydrogen 2.346 N/A LYS 441.A N CYS 454.A O no hydrogen 2.313 N/A LYS 441.A NZ ASP 458.A OD1 no hydrogen 3.109 N/A LYS 441.A NZ ILE 489.A O no hydrogen 3.215 N/A LEU 442.A N CYS 454.A O no hydrogen 2.996 N/A LYS 444.A N VAL 452.A O no hydrogen 2.930 N/A LYS 444.A NZ LEU 492.A O no hydrogen 2.473 N/A ILE 446.A N LYS 450.A O no hydrogen 2.948 N/A ASP 447.A N LYS 450.A O no hydrogen 3.324 N/A ASN 448.A ND2 ASP 401.A O no hydrogen 3.650 N/A LYS 450.A NZ ASN 497.A OD1 no hydrogen 3.478 N/A ILE 451.A N VAL 463.A O no hydrogen 2.873 N/A VAL 452.A N LYS 444.A O no hydrogen 2.886 N/A ILE 453.A N PHE 461.A O no hydrogen 2.864 N/A CYS 454.A N LEU 442.A O no hydrogen 2.838 N/A CYS 454.A SG SER 455.A O no hydrogen 3.940 N/A CYS 454.A SG ASP 458.A OD1 no hydrogen 3.615 N/A SER 455.A N ASP 459.A O no hydrogen 2.882 N/A SER 455.A OG SER 439.A O no hydrogen 3.094 N/A SER 455.A OG GLU 457.A OE1 no hydrogen 2.681 N/A SER 455.A OG GLU 457.A OE2 no hydrogen 2.842 N/A CYS 456.A N SER 439.A O no hydrogen 2.990 N/A CYS 456.A SG SER 439.A O no hydrogen 3.330 N/A CYS 456.A SG THR 440.A O no hydrogen 3.564 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.499 N/A ASP 459.A N SER 455.A O no hydrogen 3.001 N/A PHE 461.A N ILE 453.A O no hydrogen 2.874 N/A ILE 462.A N GLN 467.A O no hydrogen 2.431 N/A VAL 463.A N ILE 451.A O no hydrogen 3.000 N/A SER 476.A OG SER 480.A OG no hydrogen 2.733 N/A SER 480.A OG SER 476.A OG no hydrogen 2.733 N/A SER 480.A OG THR 477.A O no hydrogen 2.494 N/A ILE 481.A N THR 477.A O no hydrogen 2.896 N/A LYS 482.A N LYS 478.A O no hydrogen 2.904 N/A LYS 482.A NZ HIS 25.A NE2 no hydrogen 3.552 N/A LYS 482.A NZ ASP 36.A OD2 no hydrogen 2.762 N/A VAL 483.A N SER 479.A O no hydrogen 2.922 N/A TYR 485.A OH GLU 60.A OE1 no hydrogen 2.358 N/A ARG 488.A N TYR 485.A O no hydrogen 3.438 N/A ARG 488.A NE ASP 458.A OD2 no hydrogen 2.950 N/A ILE 489.A N ASP 458.A OD1 no hydrogen 3.250 N/A ILE 489.A N ASP 458.A OD2 no hydrogen 2.961 N/A ASN 490.A N SER 502.A O no hydrogen 2.411 N/A HIS 491.A N SER 502.A O no hydrogen 2.987 N/A GLU 493.A N VAL 500.A O no hydrogen 3.002 N/A ASP 495.A N ILE 498.A O no hydrogen 2.589 N/A ILE 498.A N ASP 495.A O no hydrogen 2.686 N/A ALA 499.A N LEU 511.A O no hydrogen 2.920 N/A VAL 500.A N GLU 493.A O no hydrogen 2.843 N/A ILE 501.A N ASP 509.A O no hydrogen 2.888 N/A SER 502.A N HIS 491.A O no hydrogen 2.900 N/A SER 502.A OG HIS 491.A O no hydrogen 3.418 N/A ARG 503.A N VAL 507.A O no hydrogen 2.902 N/A ARG 503.A NH1 ASP 458.A OD2 no hydrogen 2.623 N/A ARG 503.A NH2 GLU 473.A OE1 no hydrogen 3.086 N/A GLY 504.A N ARG 488.A O no hydrogen 3.388 N/A CYS 505.A SG ASN 487.A OD1 no hydrogen 3.061 N/A VAL 507.A N ARG 503.A O no hydrogen 2.980 N/A VAL 508.A N ALA 522.A O no hydrogen 3.279 N/A ASP 509.A N ILE 501.A O no hydrogen 2.994 N/A ILE 510.A N LYS 519.A O no hydrogen 2.919 N/A LEU 511.A N ALA 499.A O no hydrogen 2.821 N/A ASP 512.A N ILE 517.A O no hydrogen 2.911 N/A LYS 514.A N ASP 512.A OD1 no hydrogen 3.257 N/A ILE 517.A N ASP 512.A O no hydrogen 2.906 N/A LYS 519.A N ILE 510.A O no hydrogen 2.843 N/A LEU 521.A N VAL 508.A O no hydrogen 3.126 N/A ASN 526.A ND2 ASP 546.A OD1 no hydrogen 2.640 N/A THR 529.A N ILE 543.A O no hydrogen 2.663 N/A ALA 530.A N ILE 543.A O no hydrogen 2.936 N/A HIS 532.A N VAL 541.A O no hydrogen 2.909 N/A HIS 532.A NE2 SER 589.A OG no hydrogen 2.414 N/A ASN 534.A N SER 539.A O no hydrogen 2.877 N/A ASN 534.A ND2 SER 594.A O no hydrogen 3.245 N/A SER 536.A N ASN 534.A OD1 no hydrogen 3.199 N/A SER 536.A OG ASN 534.A OD1 no hydrogen 2.714 N/A SER 536.A OG SER 594.A OG no hydrogen 2.262 N/A ARG 537.A NH1 GLU 551.A OE2 no hydrogen 3.291 N/A LYS 538.A N THR 535.A O no hydrogen 3.002 N/A LYS 538.A NZ SER 536.A O no hydrogen 2.495 N/A SER 539.A N ASN 534.A O no hydrogen 2.946 N/A SER 539.A OG PHE 552.A O no hydrogen 2.310 N/A VAL 540.A N PHE 552.A O no hydrogen 2.917 N/A VAL 541.A N HIS 532.A O no hydrogen 2.857 N/A VAL 542.A N TYR 550.A O no hydrogen 2.851 N/A ILE 543.A N ALA 530.A O no hydrogen 2.867 N/A THR 544.A N LYS 548.A O no hydrogen 2.904 N/A THR 544.A OG1 ASN 526.A OD1 no hydrogen 3.417 N/A THR 544.A OG1 ASP 546.A OD1 no hydrogen 2.458 N/A THR 544.A OG1 LYS 548.A O no hydrogen 3.182 N/A ALA 545.A N PHE 527.A O no hydrogen 3.391 N/A LYS 548.A N THR 544.A O no hydrogen 2.986 N/A LYS 548.A NZ TYR 550.A OH no hydrogen 3.151 N/A TYR 550.A N VAL 542.A O no hydrogen 2.904 N/A PHE 552.A N VAL 540.A O no hydrogen 2.854 N/A MET 554.A N LYS 538.A O no hydrogen 3.388 N/A ASN 555.A ND2 SER 560.A O no hydrogen 3.123 N/A SER 560.A OG LEU 562.A O no hydrogen 2.879 N/A THR 563.A N GLU 551.A O no hydrogen 3.407 N/A SER 566.A OG GLU 551.A O no hydrogen 3.050 N/A LYS 567.A N THR 563.A O no hydrogen 2.891 N/A ASN 568.A N GLN 564.A O no hydrogen 2.880 N/A ASN 569.A N TRP 565.A O no hydrogen 2.899 N/A THR 570.A N SER 566.A O no hydrogen 2.849 N/A THR 570.A OG1 ILE 549.A O no hydrogen 2.840 N/A THR 570.A OG1 SER 566.A O no hydrogen 2.651 N/A ASP 571.A N LYS 567.A O no hydrogen 2.944 N/A ASN 572.A N ASN 568.A O no hydrogen 2.868 N/A GLU 576.A N GLU 576.A OE1 no hydrogen 2.488 N/A LYS 578.A N PRO 574.A O no hydrogen 2.910 N/A LYS 578.A NZ LEU 573.A O no hydrogen 2.314 N/A THR 579.A N LYS 575.A O no hydrogen 2.911 N/A LEU 580.A N GLU 576.A O no hydrogen 2.913 N/A CYS 584.A N ASN 583.A OD1 no hydrogen 2.607 N/A CYS 584.A SG GLY 586.A O no hydrogen 3.148 N/A VAL 585.A N TRP 600.A O no hydrogen 3.178 N/A GLY 586.A N TRP 600.A O no hydrogen 2.908 N/A PHE 588.A N TRP 598.A O no hydrogen 2.948 N/A SER 589.A OG HIS 532.A NE2 no hydrogen 2.414 N/A ASP 590.A N ARG 596.A O no hydrogen 2.908 N/A GLU 592.A N ASP 590.A OD1 no hydrogen 2.944 N/A SER 594.A OG SER 536.A OG no hydrogen 2.262 N/A SER 595.A OG ASP 609.A OD1 no hydrogen 2.413 N/A ARG 596.A N ASN 593.A O no hydrogen 2.818 N/A ARG 596.A NH2 ASP 609.A OD2 no hydrogen 3.504 N/A LEU 597.A N ILE 608.A O no hydrogen 2.865 N/A TRP 598.A N PHE 588.A O no hydrogen 2.855 N/A PHE 599.A N SER 606.A O no hydrogen 2.883 N/A TRP 600.A N GLY 586.A O no hydrogen 2.889 N/A TRP 604.A NE1 GLU 582.A O no hydrogen 3.131 N/A SER 606.A N PHE 599.A O no hydrogen 2.844 N/A ILE 608.A N LEU 597.A O no hydrogen 2.894 N/A PHE 610.A N SER 595.A O no hydrogen 2.665 N/A PHE 610.A N SER 595.A OG no hydrogen 2.989 N/A THR 622.A N ILE 605.A O no hydrogen 3.401 N/A LYS 626.A NZ THR 603.A O no hydrogen 3.062 N/A LEU 629.A N ILE 642.A O no hydrogen 2.120 N/A PHE 630.A N ILE 642.A O no hydrogen 3.027 N/A ASP 632.A N ALA 640.A O no hydrogen 2.990 N/A ILE 634.A N GLU 638.A O no hydrogen 2.594 N/A SER 635.A N GLU 638.A O no hydrogen 3.183 N/A SER 635.A OG GLU 638.A OE1 no hydrogen 2.821 N/A GLU 638.A N SER 635.A OG no hydrogen 3.195 N/A LEU 639.A N ILE 4.A O no hydrogen 2.886 N/A ALA 640.A N ASP 632.A O no hydrogen 2.843 N/A ILE 641.A N HIS 6.A O no hydrogen 2.921 N/A ILE 642.A N PHE 630.A O no hydrogen 2.810 N/A GLU 643.A N CYS 8.A O no hydrogen 3.103 N/A HIS 650.A NE2 ASP 12.A OD2 no hydrogen 2.791 N/A SER 651.A OG PRO 646.A O no hydrogen 3.142 N/A SER 651.A OG LEU 647.A O no hydrogen 3.298 N/A