Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ke6_AG.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N GLN 1.A OE1 no hydrogen 2.712 N/A LYS 3.A N GLY 763.A O no hydrogen 2.872 N/A LYS 3.A NZ THR 764.A O no hydrogen 2.882 N/A SER 5.A N VAL 761.A O no hydrogen 2.891 N/A SER 5.A OG VAL 6.A O no hydrogen 3.107 N/A VAL 7.A N LEU 759.A O no hydrogen 3.223 N/A SER 8.A N LEU 759.A O no hydrogen 3.162 N/A LYS 11.A NZ ASN 345.A OD1 no hydrogen 3.520 N/A ASN 15.A N LYS 24.A O no hydrogen 3.148 N/A SER 19.A OG SER 18.A O no hydrogen 2.554 N/A SER 19.A OG TYR 155.A OH no hydrogen 2.335 N/A LYS 24.A N GLY 22.A O no hydrogen 2.700 N/A ALA 27.A N ASN 25.A OD1 no hydrogen 2.813 N/A ARG 28.A N ILE 37.A O no hydrogen 2.922 N/A SER 30.A N ASN 35.A O no hydrogen 3.068 N/A SER 30.A OG ASP 32.A OD1 no hydrogen 2.613 N/A GLN 31.A N GLN 31.A OE1 no hydrogen 2.887 N/A ARG 34.A N ASP 32.A O no hydrogen 2.451 N/A TYR 36.A N TYR 47.A O no hydrogen 2.868 N/A ILE 37.A N ARG 28.A O no hydrogen 2.853 N/A ILE 38.A N LYS 45.A O no hydrogen 2.892 N/A PHE 40.A N GLN 43.A O no hydrogen 2.767 N/A ASN 41.A N LYS 11.A O no hydrogen 3.155 N/A ASN 41.A ND2 GLU 756.A OE1 no hydrogen 3.220 N/A ILE 44.A N LEU 58.A O no hydrogen 3.123 N/A LYS 45.A N ILE 38.A O no hydrogen 2.900 N/A LYS 45.A NZ TYR 47.A OH no hydrogen 2.892 N/A VAL 46.A N LYS 56.A O no hydrogen 2.992 N/A TYR 47.A N TYR 36.A O no hydrogen 2.929 N/A TYR 47.A OH GLU 445.A OE1 no hydrogen 2.482 N/A SER 48.A N GLN 53.A O no hydrogen 2.898 N/A SER 48.A OG THR 51.A OG1 no hydrogen 2.433 N/A VAL 49.A N ARG 34.A O no hydrogen 2.919 N/A THR 51.A OG1 SER 48.A OG no hydrogen 2.433 N/A ARG 52.A N SER 48.A O no hydrogen 2.844 N/A GLN 53.A NE2 THR 51.A O no hydrogen 2.719 N/A CYS 54.A SG VAL 46.A O no hydrogen 3.834 N/A VAL 55.A N VAL 46.A O no hydrogen 2.924 N/A LYS 56.A N VAL 46.A O no hydrogen 3.416 N/A LYS 56.A NZ GLY 113.A O no hydrogen 3.073 N/A PHE 60.A N ASN 42.A O no hydrogen 2.949 N/A ASN 62.A N LYS 59.A O no hydrogen 3.499 N/A SER 67.A N ASN 63.A O no hydrogen 3.263 N/A ILE 69.A N LEU 66.A O no hydrogen 3.321 N/A PHE 70.A N SER 67.A O no hydrogen 3.256 N/A LEU 71.A N GLN 72.A OE1 no hydrogen 3.110 N/A GLN 72.A NE2 GLU 75.A O no hydrogen 2.371 N/A ASN 76.A N GLU 74.A O no hydrogen 3.135 N/A SER 79.A N ASN 102.A OD1 no hydrogen 3.324 N/A SER 79.A OG ASN 77.A O no hydrogen 3.038 N/A VAL 81.A N PHE 100.A O no hydrogen 2.740 N/A LYS 82.A N PHE 100.A O no hydrogen 2.943 N/A LYS 82.A NZ VAL 134.A O no hydrogen 2.475 N/A LEU 84.A N THR 98.A O no hydrogen 2.900 N/A THR 89.A N ASP 87.A OD1 no hydrogen 3.169 N/A THR 89.A OG1 ASP 87.A OD1 no hydrogen 3.140 N/A THR 89.A OG1 ASP 87.A OD2 no hydrogen 2.522 N/A ILE 97.A N LEU 109.A O no hydrogen 2.950 N/A THR 98.A N LEU 84.A O no hydrogen 2.913 N/A VAL 99.A N ILE 107.A O no hydrogen 2.884 N/A PHE 100.A N LYS 82.A O no hydrogen 2.827 N/A THR 101.A N HIS 105.A O no hydrogen 3.243 N/A THR 101.A OG1 GLU 78.A OE2 no hydrogen 2.217 N/A THR 101.A OG1 SER 79.A O no hydrogen 2.518 N/A ASN 102.A N SER 79.A O no hydrogen 2.761 N/A VAL 106.A N PHE 122.A O no hydrogen 2.880 N/A ILE 107.A N VAL 99.A O no hydrogen 2.929 N/A LEU 109.A N ILE 97.A O no hydrogen 2.894 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.875 N/A SER 118.A OG PRO 119.A O no hydrogen 3.046 N/A LYS 120.A N VAL 108.A O no hydrogen 3.123 N/A PHE 122.A N VAL 106.A O no hydrogen 2.885 N/A ILE 124.A N GLY 104.A O no hydrogen 2.892 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.931 N/A LYS 130.A NZ ASN 103.A OD1 no hydrogen 2.495 N/A ALA 132.A N LEU 144.A O no hydrogen 2.850 N/A PHE 135.A N ARG 142.A O no hydrogen 2.851 N/A SER 137.A N ASN 140.A O no hydrogen 3.459 N/A ASN 140.A N GLU 138.A O no hydrogen 2.686 N/A ARG 142.A N PHE 135.A O no hydrogen 2.969 N/A ARG 142.A NE LEU 209.A O no hydrogen 2.728 N/A ILE 143.A N TYR 158.A O no hydrogen 2.888 N/A LEU 144.A N ASN 133.A O no hydrogen 2.877 N/A THR 145.A N ARG 156.A O no hydrogen 2.907 N/A THR 145.A OG1 ARG 156.A O no hydrogen 2.579 N/A SER 151.A OG ASN 150.A O no hydrogen 2.840 N/A GLN 153.A NE2 THR 146.A OG1 no hydrogen 2.374 N/A SER 154.A OG HIS 178.A O no hydrogen 2.343 N/A TYR 155.A N TRP 177.A O no hydrogen 2.875 N/A ARG 156.A N THR 145.A O no hydrogen 2.900 N/A ARG 156.A NH1 GLU 176.A OE2 no hydrogen 2.549 N/A ARG 156.A NH2 TYR 158.A OH no hydrogen 2.969 N/A LEU 157.A N ALA 175.A O no hydrogen 2.872 N/A TYR 158.A N ILE 143.A O no hydrogen 2.867 N/A TYR 158.A OH GLU 129.A OE2 no hydrogen 3.071 N/A LEU 160.A N TYR 141.A O no hydrogen 2.920 N/A THR 161.A N GLU 170.A O no hydrogen 2.922 N/A THR 161.A OG1 GLU 170.A O no hydrogen 3.230 N/A THR 161.A OG1 GLU 170.A OE1 no hydrogen 2.738 N/A LYS 166.A NZ ASP 163.A O no hydrogen 2.383 N/A LYS 167.A N ALA 165.A O no hydrogen 2.939 N/A LYS 167.A NZ HIS 121.A O no hydrogen 3.187 N/A GLN 168.A N ALA 165.A O no hydrogen 3.288 N/A GLU 170.A N THR 161.A O no hydrogen 2.864 N/A HIS 173.A NE2 GLU 176.A OE2 no hydrogen 2.876 N/A ALA 175.A N LEU 157.A O no hydrogen 3.425 N/A TRP 177.A N TYR 155.A O no hydrogen 2.899 N/A VAL 180.A N GLN 153.A O no hydrogen 3.070 N/A SER 183.A OG SER 19.A O no hydrogen 3.261 N/A ASN 184.A N ALA 193.A O no hydrogen 2.914 N/A ASN 184.A ND2 MET 241.A O no hydrogen 2.327 N/A ILE 185.A N ASN 184.A OD1 no hydrogen 2.558 N/A SER 186.A N LEU 191.A O no hydrogen 2.898 N/A SER 186.A OG ASN 188.A OD1 no hydrogen 2.394 N/A ASN 188.A N SER 186.A OG no hydrogen 3.385 N/A GLY 189.A N SER 186.A O no hydrogen 3.037 N/A LYS 190.A N ASN 188.A OD1 no hydrogen 3.253 N/A LEU 192.A N VAL 207.A O no hydrogen 2.847 N/A ALA 193.A N ASN 184.A O no hydrogen 2.870 N/A HIS 194.A N SER 205.A O no hydrogen 2.895 N/A MET 195.A N LEU 182.A O no hydrogen 2.924 N/A CYS 196.A N SER 203.A O no hydrogen 2.883 N/A CYS 196.A SG SER 203.A O no hydrogen 4.032 N/A CYS 196.A SG SER 205.A OG no hydrogen 2.887 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.767 N/A SER 203.A OG PHE 218.A O no hydrogen 3.039 N/A ILE 204.A N PHE 218.A O no hydrogen 2.905 N/A SER 205.A N HIS 194.A O no hydrogen 2.898 N/A SER 205.A OG HIS 194.A NE2 no hydrogen 2.513 N/A VAL 206.A N LEU 216.A O no hydrogen 2.875 N/A VAL 207.A N LEU 192.A O no hydrogen 2.880 N/A SER 208.A N VAL 214.A O no hydrogen 2.854 N/A SER 208.A OG LYS 190.A O no hydrogen 2.947 N/A SER 208.A OG ASP 211.A O no hydrogen 3.269 N/A LEU 216.A N VAL 206.A O no hydrogen 2.900 N/A PHE 218.A N ILE 204.A O no hydrogen 2.944 N/A SER 222.A N PRO 219.A O no hydrogen 2.909 N/A SER 222.A OG PRO 219.A O no hydrogen 2.299 N/A LEU 224.A N LEU 220.A O no hydrogen 2.824 N/A GLN 227.A N GLN 227.A OE1 no hydrogen 3.324 N/A THR 228.A OG1 THR 235.A O no hydrogen 3.020 N/A GLN 229.A NE2 SER 225.A O no hydrogen 2.645 N/A LEU 231.A N THR 228.A O no hydrogen 3.078 N/A ASN 234.A ND2 ALA 384.A O no hydrogen 2.708 N/A THR 235.A N SER 232.A O no hydrogen 3.150 N/A THR 235.A OG1 SER 232.A O no hydrogen 2.309 N/A ARG 236.A N TYR 233.A O no hydrogen 3.270 N/A ARG 236.A NH1 THR 228.A O no hydrogen 2.703 N/A ARG 236.A NH1 LEU 231.A O no hydrogen 2.568 N/A ARG 236.A NH2 LEU 231.A O no hydrogen 2.759 N/A SER 239.A N GLY 253.A O no hydrogen 2.919 N/A SER 239.A OG GLY 253.A O no hydrogen 3.174 N/A SER 239.A OG PHE 254.A O no hydrogen 2.586 N/A SER 239.A OG VAL 279.A O no hydrogen 2.573 N/A SER 240.A N GLY 253.A O no hydrogen 2.969 N/A SER 240.A OG GLY 253.A O no hydrogen 3.447 N/A ALA 242.A N ALA 251.A O no hydrogen 2.877 N/A ASN 245.A ND2 SER 186.A OG no hydrogen 2.356 N/A MET 246.A N ASP 244.A OD2 no hydrogen 2.957 N/A GLN 248.A N ASP 244.A OD1 no hydrogen 2.820 N/A GLN 249.A N ASP 244.A OD1 no hydrogen 3.425 N/A GLN 249.A NE2 GLY 288.A O no hydrogen 2.836 N/A LEU 250.A N VAL 262.A O no hydrogen 2.918 N/A ALA 251.A N ALA 242.A O no hydrogen 2.889 N/A VAL 252.A N SER 260.A O no hydrogen 2.912 N/A GLY 253.A N SER 240.A O no hydrogen 2.856 N/A PHE 254.A N VAL 258.A O no hydrogen 3.075 N/A ILE 259.A N LEU 272.A O no hydrogen 2.918 N/A SER 260.A N VAL 252.A O no hydrogen 2.849 N/A SER 260.A OG VAL 252.A O no hydrogen 3.004 N/A ILE 261.A N ARG 270.A O no hydrogen 2.876 N/A VAL 262.A N LEU 250.A O no hydrogen 2.861 N/A SER 263.A N GLN 268.A O no hydrogen 2.910 N/A LEU 264.A N GLN 248.A O no hydrogen 2.701 N/A ASP 266.A N SER 263.A O no hydrogen 3.296 N/A LEU 267.A N SER 263.A O no hydrogen 2.758 N/A ARG 270.A N ILE 261.A O no hydrogen 2.887 N/A ARG 270.A NH2 LEU 305.A O no hydrogen 2.796 N/A LEU 272.A N ILE 259.A O no hydrogen 2.855 N/A HIS 275.A ND1 GLU 297.A OE2 no hydrogen 2.418 N/A HIS 275.A NE2 SER 293.A OG no hydrogen 2.500 N/A SER 278.A N ASP 277.A OD1 no hydrogen 2.816 N/A SER 278.A OG ALA 255.A O no hydrogen 3.399 N/A VAL 279.A N PHE 254.A O no hydrogen 3.363 N/A LEU 280.A N GLY 294.A O no hydrogen 3.076 N/A SER 281.A N GLY 294.A O no hydrogen 2.888 N/A SER 283.A N LEU 292.A O no hydrogen 2.923 N/A SER 283.A OG LEU 282.A O no hydrogen 2.742 N/A SER 283.A OG CYS 323.A O no hydrogen 2.315 N/A SER 285.A N TYR 290.A O no hydrogen 2.850 N/A GLY 288.A N SER 285.A O no hydrogen 3.275 N/A SER 289.A N ASP 287.A OD1 no hydrogen 2.950 N/A SER 289.A OG ASP 287.A OD1 no hydrogen 2.710 N/A LEU 291.A N TRP 303.A O no hydrogen 2.939 N/A SER 293.A N SER 301.A O no hydrogen 2.865 N/A SER 293.A OG HIS 275.A NE2 no hydrogen 2.500 N/A GLY 294.A N SER 281.A O no hydrogen 2.903 N/A TRP 296.A NE1 ILE 382.A O no hydrogen 2.551 N/A GLU 297.A N GLU 297.A OE1 no hydrogen 2.671 N/A VAL 299.A N GLU 297.A O no hydrogen 2.778 N/A MET 300.A N LEU 313.A O no hydrogen 2.903 N/A SER 301.A N SER 293.A O no hydrogen 2.992 N/A LEU 302.A N GLN 311.A O no hydrogen 2.944 N/A TRP 303.A N LEU 291.A O no hydrogen 2.827 N/A GLN 304.A N SER 309.A O no hydrogen 2.841 N/A GLN 304.A NE2 THR 307.A OG1 no hydrogen 2.961 N/A LEU 305.A N SER 289.A O no hydrogen 3.089 N/A THR 307.A OG1 SER 309.A OG no hydrogen 3.068 N/A SER 309.A N GLN 304.A O no hydrogen 3.038 N/A SER 309.A OG THR 307.A OG1 no hydrogen 3.068 N/A GLN 310.A N GLN 310.A OE1 no hydrogen 2.994 N/A GLN 311.A N LEU 302.A O no hydrogen 2.958 N/A LEU 313.A N MET 300.A O no hydrogen 2.929 N/A LEU 316.A N LYS 298.A O no hydrogen 3.109 N/A ILE 321.A N ILE 336.A O no hydrogen 2.944 N/A CYS 323.A SG SER 281.A OG no hydrogen 2.872 N/A GLN 324.A N SER 334.A O no hydrogen 2.968 N/A LEU 326.A N TYR 332.A O no hydrogen 2.884 N/A TYR 333.A N LEU 353.A O no hydrogen 2.789 N/A SER 334.A N GLN 324.A O no hydrogen 2.890 N/A SER 334.A OG GLN 324.A O no hydrogen 3.472 N/A LEU 335.A N LEU 351.A O no hydrogen 2.558 N/A ILE 336.A N ASP 322.A O no hydrogen 2.868 N/A LEU 337.A N GLN 349.A O no hydrogen 2.875 N/A GLN 338.A N ILE 319.A O no hydrogen 2.841 N/A THR 340.A OG1 THR 340.A O no hydrogen 2.541 N/A THR 340.A OG1 ASN 389.A O no hydrogen 2.993 N/A GLU 341.A N GLU 341.A OE2 no hydrogen 2.659 N/A ASN 342.A N ASN 342.A OD1 no hydrogen 2.636 N/A ASN 342.A ND2 ASP 347.A OD2 no hydrogen 3.553 N/A ASN 343.A ND2 LYS 388.A O no hydrogen 2.961 N/A SER 346.A OG TYR 348.A OH no hydrogen 2.608 N/A GLN 349.A N LEU 337.A O no hydrogen 2.818 N/A GLN 349.A NE2 SER 363.A OG no hydrogen 2.427 N/A PHE 350.A N ILE 364.A O no hydrogen 2.915 N/A LEU 351.A N LEU 335.A O no hydrogen 2.976 N/A LEU 353.A N TYR 333.A O no hydrogen 3.039 N/A ASN 354.A N THR 359.A O no hydrogen 3.321 N/A ALA 355.A N ASN 331.A O no hydrogen 2.516 N/A LEU 358.A N ASN 354.A O no hydrogen 3.136 N/A THR 359.A OG1 ASN 354.A OD1 no hydrogen 3.094 N/A THR 359.A OG1 ASP 357.A OD1 no hydrogen 3.079 N/A THR 359.A OG1 ASP 357.A OD2 no hydrogen 3.395 N/A SER 363.A OG PHE 350.A O no hydrogen 3.528 N/A ILE 364.A N PHE 350.A O no hydrogen 2.795 N/A ASN 365.A ND2 GLN 446.A OE1 no hydrogen 3.693 N/A LEU 368.A N GLN 437.A OE1 no hydrogen 2.573 N/A PHE 371.A N SER 344.A OG no hydrogen 2.949 N/A SER 383.A OG ASP 277.A OD1 no hydrogen 3.384 N/A SER 383.A OG ASP 277.A OD2 no hydrogen 3.566 N/A ALA 384.A N SER 383.A OG no hydrogen 2.514 N/A LYS 388.A N THR 387.A OG1 no hydrogen 2.414 N/A LYS 388.A NZ ASN 468.A O no hydrogen 3.312 N/A ASN 389.A ND2 THR 340.A O no hydrogen 3.263 N/A ASN 389.A ND2 GLU 341.A O no hydrogen 3.432 N/A SER 390.A OG MET 385.A O no hydrogen 3.303 N/A ASN 391.A N PRO 381.A O no hydrogen 3.384 N/A SER 392.A N SER 395.A OG no hydrogen 3.216 N/A SER 392.A OG THR 394.A OG1 no hydrogen 3.342 N/A THR 394.A N SER 392.A OG no hydrogen 3.304 N/A THR 394.A OG1 SER 392.A OG no hydrogen 3.342 N/A SER 395.A N SER 392.A OG no hydrogen 3.095 N/A SER 399.A N SER 395.A O no hydrogen 2.937 N/A SER 399.A OG SER 395.A O no hydrogen 3.295 N/A LYS 400.A N LEU 396.A O no hydrogen 2.907 N/A LYS 401.A N ASN 397.A O no hydrogen 2.997 N/A LYS 402.A N HIS 398.A O no hydrogen 2.900 N/A GLN 403.A N SER 399.A O no hydrogen 2.882 N/A SER 404.A N LYS 400.A O no hydrogen 2.919 N/A ARG 405.A N LYS 401.A O no hydrogen 2.959 N/A LYS 406.A N LYS 402.A O no hydrogen 2.837 N/A LEU 407.A N GLN 403.A O no hydrogen 2.939 N/A ILE 408.A N SER 404.A O no hydrogen 2.971 N/A LYS 409.A N ARG 405.A O no hydrogen 2.834 N/A GLN 413.A N ARG 411.A O no hydrogen 3.170 N/A GLN 413.A NE2 SER 410.A O no hydrogen 3.632 N/A ASP 414.A N ARG 412.A O no hydrogen 2.790 N/A PHE 415.A N TYR 738.A OH no hydrogen 2.913 N/A THR 416.A OG1 SER 740.A O no hydrogen 2.400 N/A ASN 418.A N ASN 418.A OD1 no hydrogen 2.582 N/A GLU 420.A N TYR 429.A O no hydrogen 3.243 N/A ASN 422.A N ASN 427.A O no hydrogen 2.945 N/A ASN 422.A ND2 ASN 425.A OD1 no hydrogen 2.379 N/A LYS 426.A N ASN 422.A O no hydrogen 2.874 N/A LYS 426.A NZ PRO 423.A O no hydrogen 2.515 N/A LYS 426.A NZ ILE 424.A O no hydrogen 3.494 N/A LEU 428.A N PHE 439.A O no hydrogen 2.904 N/A TYR 429.A N GLU 420.A O no hydrogen 2.889 N/A PHE 430.A N GLN 437.A O no hydrogen 2.922 N/A HIS 432.A N ALA 435.A O no hydrogen 2.964 N/A HIS 432.A ND1 LEU 368.A O no hydrogen 3.062 N/A HIS 432.A NE2 ASN 342.A OD1 no hydrogen 2.713 N/A SER 434.A OG SER 434.A O no hydrogen 2.349 N/A SER 434.A OG THR 453.A OG1 no hydrogen 2.366 N/A VAL 436.A N GLN 450.A O no hydrogen 2.854 N/A GLN 437.A N PHE 430.A O no hydrogen 2.904 N/A GLN 437.A NE2 GLY 366.A O no hydrogen 2.396 N/A ILE 438.A N ASN 448.A O no hydrogen 2.869 N/A PHE 439.A N LEU 428.A O no hydrogen 2.979 N/A ASN 448.A N ILE 438.A O no hydrogen 3.087 N/A ASN 448.A ND2 THR 518.A O no hydrogen 2.954 N/A GLN 450.A N VAL 436.A O no hydrogen 2.950 N/A GLN 450.A NE2 TRP 520.A O no hydrogen 3.414 N/A LEU 452.A N SER 434.A O no hydrogen 3.017 N/A THR 453.A OG1 SER 434.A OG no hydrogen 2.366 N/A ASN 457.A ND2 SER 434.A OG no hydrogen 3.217 N/A ASN 457.A ND2 THR 453.A O no hydrogen 3.473 N/A ARG 464.A NE ILE 276.A O no hydrogen 2.911 N/A ARG 464.A NH1 ILE 276.A O no hydrogen 3.112 N/A ASN 468.A N PHE 465.A O no hydrogen 3.345 N/A ILE 473.A N ILE 491.A O no hydrogen 3.407 N/A THR 475.A N TYR 489.A O no hydrogen 3.163 N/A THR 475.A OG1 TYR 489.A O no hydrogen 3.272 N/A ASP 476.A N TYR 489.A O no hydrogen 3.052 N/A LYS 478.A N ILE 487.A O no hydrogen 2.853 N/A THR 480.A N TRP 485.A O no hydrogen 2.993 N/A THR 480.A OG1 ASP 482.A OD1 no hydrogen 2.468 N/A THR 480.A OG1 TRP 485.A O no hydrogen 3.357 N/A LYS 481.A NZ SER 542.A O no hydrogen 3.386 N/A ASP 482.A N SER 549.A OG no hydrogen 3.187 N/A GLY 483.A N THR 480.A O no hydrogen 2.851 N/A MET 486.A N TRP 511.A O no hydrogen 2.876 N/A ILE 487.A N LYS 478.A O no hydrogen 2.842 N/A THR 488.A N LYS 509.A O no hydrogen 2.928 N/A TYR 489.A N ASP 476.A O no hydrogen 2.733 N/A TYR 489.A OH HIS 506.A ND1 no hydrogen 2.384 N/A GLU 490.A N ILE 507.A O no hydrogen 2.967 N/A ILE 491.A N ILE 473.A O no hydrogen 3.335 N/A GLU 492.A N THR 505.A O no hydrogen 2.818 N/A LEU 498.A N SER 501.A OG no hydrogen 2.968 N/A SER 501.A N LEU 498.A O no hydrogen 3.206 N/A SER 501.A OG PRO 495.A O no hydrogen 3.274 N/A SER 501.A OG LEU 498.A O no hydrogen 2.341 N/A ASP 503.A N ASP 503.A OD1 no hydrogen 2.372 N/A THR 505.A N GLU 492.A O no hydrogen 2.945 N/A HIS 506.A ND1 TYR 489.A OH no hydrogen 2.384 N/A ILE 507.A N GLU 490.A O no hydrogen 2.977 N/A LEU 508.A N VAL 526.A O no hydrogen 2.924 N/A LYS 509.A N THR 488.A O no hydrogen 2.788 N/A LYS 509.A NZ LEU 452.A O no hydrogen 2.784 N/A LYS 509.A NZ GLU 490.A OE1 no hydrogen 3.217 N/A PHE 510.A N THR 524.A O no hydrogen 2.904 N/A TRP 511.A N MET 486.A O no hydrogen 2.911 N/A THR 512.A N ASN 521.A O no hydrogen 2.873 N/A THR 512.A OG1 GLN 484.A O no hydrogen 2.634 N/A LYS 513.A NZ GLU 517.A O no hydrogen 2.450 N/A GLU 517.A N GLU 517.A OE1 no hydrogen 2.637 N/A TRP 520.A N GLN 450.A OE1 no hydrogen 3.168 N/A TRP 520.A NE1 TYR 429.A OH no hydrogen 2.801 N/A ASN 521.A N THR 512.A O no hydrogen 2.900 N/A LYS 523.A N PHE 510.A O no hydrogen 2.916 N/A THR 524.A N PHE 510.A O no hydrogen 3.429 N/A VAL 526.A N LEU 508.A O no hydrogen 2.841 N/A ASN 528.A N HIS 506.A O no hydrogen 2.996 N/A HIS 530.A NE2 THR 554.A OG1 no hydrogen 2.424 N/A THR 537.A N ALA 555.A O no hydrogen 2.759 N/A LYS 538.A N ALA 555.A O no hydrogen 3.499 N/A LYS 538.A NZ ASP 687.A OD2 no hydrogen 2.638 N/A LEU 540.A N LEU 553.A O no hydrogen 2.933 N/A SER 542.A OG PRO 543.A O no hydrogen 2.568 N/A SER 545.A OG GLN 596.A O no hydrogen 3.544 N/A ASN 547.A ND2 PHE 566.A O no hydrogen 3.077 N/A SER 549.A OG ASP 482.A OD1 no hydrogen 3.418 N/A SER 549.A OG SER 549.A O no hydrogen 2.294 N/A CYS 552.A N TRP 564.A O no hydrogen 2.801 N/A CYS 552.A SG LEU 540.A O no hydrogen 3.264 N/A LEU 553.A N LEU 540.A O no hydrogen 2.860 N/A THR 554.A N LYS 562.A O no hydrogen 2.953 N/A THR 554.A OG1 HIS 530.A NE2 no hydrogen 2.424 N/A ALA 555.A N LYS 538.A O no hydrogen 2.925 N/A ASP 556.A N GLY 560.A O no hydrogen 2.905 N/A ASN 557.A N ASP 556.A OD1 no hydrogen 2.730 N/A LEU 561.A N SER 579.A O no hydrogen 2.880 N/A LYS 562.A N THR 554.A O no hydrogen 2.979 N/A PHE 563.A N LYS 577.A O no hydrogen 2.885 N/A TRP 564.A N CYS 552.A O no hydrogen 2.889 N/A TRP 564.A NE1 THR 554.A OG1 no hydrogen 3.254 N/A SER 565.A N CYS 574.A O no hydrogen 2.730 N/A PHE 566.A N GLN 550.A O no hydrogen 3.131 N/A ASP 567.A N ASN 572.A O no hydrogen 3.243 N/A SER 571.A OG SER 568.A O no hydrogen 3.104 N/A CYS 574.A N SER 565.A O no hydrogen 3.067 N/A CYS 574.A SG SER 565.A O no hydrogen 4.029 N/A CYS 574.A SG ASP 567.A OD1 no hydrogen 3.403 N/A CYS 574.A SG ASP 567.A OD2 no hydrogen 3.810 N/A LYS 576.A N PHE 563.A O no hydrogen 2.826 N/A LYS 577.A N PHE 563.A O no hydrogen 3.075 N/A LYS 577.A NZ PHE 614.A O no hydrogen 3.230 N/A SER 579.A N LEU 561.A O no hydrogen 2.897 N/A SER 587.A N ASN 557.A O no hydrogen 3.376 N/A SER 587.A OG PHE 586.A O no hydrogen 2.786 N/A SER 587.A OG ASP 606.A OD2 no hydrogen 3.075 N/A ASN 588.A ND2 ASN 683.A OD1 no hydrogen 3.044 N/A SER 589.A OG ILE 638.A O no hydrogen 2.322 N/A SER 591.A N GLY 604.A O no hydrogen 2.895 N/A ALA 593.A N PHE 602.A O no hydrogen 2.969 N/A SER 595.A N LEU 600.A O no hydrogen 2.991 N/A SER 595.A OG SER 599.A OG no hydrogen 2.998 N/A SER 595.A OG LEU 600.A O no hydrogen 2.485 N/A GLN 596.A N GLN 596.A OE1 no hydrogen 2.728 N/A GLN 596.A NE2 GLU 694.A OE1 no hydrogen 3.307 N/A GLY 598.A N SER 595.A O no hydrogen 2.655 N/A SER 599.A OG SER 595.A OG no hydrogen 2.998 N/A LEU 600.A N SER 595.A OG no hydrogen 2.596 N/A ILE 601.A N LEU 612.A O no hydrogen 2.871 N/A PHE 602.A N ALA 593.A O no hydrogen 2.883 N/A HIS 603.A N GLN 610.A O no hydrogen 2.915 N/A GLY 604.A N SER 591.A O no hydrogen 2.861 N/A PHE 605.A N HIS 603.A O no hydrogen 3.215 N/A PHE 605.A N LYS 608.A O no hydrogen 3.155 N/A LYS 608.A N PHE 605.A O no hydrogen 3.386 N/A GLN 610.A N HIS 603.A O no hydrogen 2.909 N/A GLN 610.A N LYS 608.A O no hydrogen 3.036 N/A LEU 612.A N ILE 601.A O no hydrogen 2.881 N/A ASP 613.A N LYS 618.A O no hydrogen 2.825 N/A THR 616.A N ASP 613.A OD1 no hydrogen 2.732 N/A THR 616.A OG1 THR 616.A O no hydrogen 2.511 N/A LYS 618.A N ASP 613.A OD1 no hydrogen 3.272 N/A LYS 618.A N ASP 613.A OD2 no hydrogen 3.349 N/A PHE 620.A N ILE 611.A O no hydrogen 2.955 N/A ASN 625.A N SER 622.A O no hydrogen 3.059 N/A THR 626.A OG1 GLU 624.A OE2 no hydrogen 3.279 N/A SER 630.A OG GLU 621.A OE2 no hydrogen 3.266 N/A THR 633.A N GLU 631.A OE1 no hydrogen 3.214 N/A THR 633.A OG1 ASP 607.A O no hydrogen 3.115 N/A THR 633.A OG1 GLU 631.A OE1 no hydrogen 3.224 N/A THR 633.A OG1 GLU 631.A OE2 no hydrogen 2.301 N/A SER 636.A OG THR 653.A OG1 no hydrogen 2.502 N/A SER 636.A OG THR 655.A OG1 no hydrogen 2.872 N/A GLN 639.A N ALA 652.A O no hydrogen 2.919 N/A GLN 639.A NE2 LYS 682.A O no hydrogen 3.650 N/A THR 640.A N ALA 652.A O no hydrogen 3.001 N/A LEU 649.A N ILE 660.A O no hydrogen 2.877 N/A ILE 650.A N LYS 642.A O no hydrogen 2.867 N/A VAL 651.A N ASN 658.A O no hydrogen 2.916 N/A ALA 652.A N THR 640.A O no hydrogen 2.839 N/A THR 653.A N THR 656.A O no hydrogen 3.015 N/A THR 653.A OG1 SER 636.A OG no hydrogen 2.502 N/A THR 653.A OG1 GLU 637.A O no hydrogen 2.511 N/A THR 655.A OG1 ASP 635.A OD2 no hydrogen 2.652 N/A THR 655.A OG1 SER 636.A OG no hydrogen 2.872 N/A THR 656.A OG1 SER 670.A OG no hydrogen 3.333 N/A THR 656.A OG1 PHE 671.A O no hydrogen 2.411 N/A LEU 657.A N THR 656.A OG1 no hydrogen 2.513 N/A LEU 657.A N PHE 671.A O no hydrogen 2.865 N/A ASN 658.A N VAL 651.A O no hydrogen 2.849 N/A ALA 659.A N ASN 669.A O no hydrogen 2.966 N/A ILE 660.A N LEU 649.A O no hydrogen 2.945 N/A ASN 661.A N GLN 666.A O no hydrogen 3.123 N/A LEU 662.A N THR 647.A O no hydrogen 3.075 N/A ARG 664.A NH1 VAL 667.A O no hydrogen 3.438 N/A GLN 666.A N ARG 664.A O no hydrogen 2.546 N/A ILE 668.A N ALA 659.A O no hydrogen 2.762 N/A SER 670.A OG THR 656.A OG1 no hydrogen 3.333 N/A PHE 671.A N LEU 657.A O no hydrogen 2.878 N/A LEU 673.A N THR 655.A O no hydrogen 2.677 N/A TYR 674.A N THR 655.A O no hydrogen 2.798 N/A PHE 676.A N LEU 673.A O no hydrogen 3.069 N/A VAL 677.A N LEU 673.A O no hydrogen 2.732 N/A LYS 682.A N ASP 414.A OD2 no hydrogen 3.310 N/A HIS 685.A N LYS 682.A O no hydrogen 3.142 N/A LEU 689.A N HIS 685.A O no hydrogen 2.985 N/A ILE 690.A N MET 686.A O no hydrogen 2.890 N/A THR 691.A N ILE 699.A O no hydrogen 3.444 N/A CYS 692.A N THR 691.A OG1 no hydrogen 2.576 N/A CYS 692.A SG LEU 643.A O no hydrogen 3.813 N/A CYS 692.A SG ASP 693.A O no hydrogen 3.221 N/A GLU 694.A N ASP 693.A OD1 no hydrogen 2.479 N/A ARG 695.A N ASP 693.A OD1 no hydrogen 3.317 N/A ASN 698.A N PHE 722.A O no hydrogen 2.870 N/A ILE 699.A N THR 691.A O no hydrogen 2.789 N/A ALA 700.A N ILE 720.A O no hydrogen 2.891 N/A VAL 702.A N ARG 718.A O no hydrogen 2.888 N/A ASN 704.A N LYS 716.A O no hydrogen 2.987 N/A GLN 705.A NE2 LEU 407.A O no hydrogen 3.430 N/A GLN 705.A NE2 THR 712.A O no hydrogen 2.600 N/A GLN 706.A N ASN 714.A O no hydrogen 2.920 N/A GLN 706.A NE2 GLU 73.A OE1 no hydrogen 3.304 N/A THR 708.A OG1 ASP 709.A OD1 no hydrogen 2.656 N/A ASP 709.A N THR 708.A OG1 no hydrogen 2.387 N/A THR 712.A N GLN 706.A O no hydrogen 3.405 N/A THR 712.A OG1 GLN 706.A O no hydrogen 2.463 N/A ASN 714.A ND2 GLU 73.A O no hydrogen 2.421 N/A ASN 714.A ND2 GLN 706.A OE1 no hydrogen 3.374 N/A LYS 716.A N ASN 704.A O no hydrogen 2.899 N/A SER 717.A N HIS 735.A O no hydrogen 2.965 N/A SER 717.A OG HIS 735.A O no hydrogen 3.132 N/A SER 717.A OG GLU 737.A O no hydrogen 3.495 N/A ARG 718.A N VAL 702.A O no hydrogen 2.933 N/A ILE 719.A N PHE 733.A O no hydrogen 2.885 N/A ILE 720.A N ALA 700.A O no hydrogen 2.960 N/A ILE 721.A N GLY 731.A O no hydrogen 2.874 N/A PHE 722.A N ASN 698.A O no hydrogen 2.926 N/A SER 727.A OG SER 724.A O no hydrogen 2.976 N/A SER 727.A OG ASP 725.A O no hydrogen 3.224 N/A LEU 730.A N THR 728.A O no hydrogen 3.079 N/A PHE 733.A N ILE 719.A O no hydrogen 2.929 N/A HIS 735.A N SER 717.A O no hydrogen 2.905 N/A HIS 735.A N SER 717.A OG no hydrogen 3.322 N/A TYR 738.A OH GLN 413.A O no hydrogen 2.618 N/A SER 740.A N LEU 753.A O no hydrogen 2.932 N/A SER 740.A OG PHE 415.A O no hydrogen 2.301 N/A GLY 743.A N ILE 751.A O no hydrogen 2.909 N/A ASP 747.A N ASN 745.A O no hydrogen 2.861 N/A THR 748.A OG1 ASP 747.A O no hydrogen 2.639 N/A PHE 750.A N VAL 762.A O no hydrogen 3.025 N/A ILE 751.A N GLY 743.A O no hydrogen 2.909 N/A PHE 752.A N GLY 760.A O no hydrogen 2.865 N/A LEU 753.A N TRP 741.A O no hydrogen 2.864 N/A ASP 754.A N THR 758.A O no hydrogen 3.198 N/A THR 758.A N GLU 756.A O no hydrogen 2.439 N/A THR 758.A OG1 ASP 754.A OD2 no hydrogen 3.360 N/A THR 758.A OG1 GLU 756.A O no hydrogen 3.198 N/A GLY 760.A N PHE 752.A O no hydrogen 2.923 N/A VAL 761.A N SER 5.A O no hydrogen 2.867 N/A VAL 762.A N PHE 750.A O no hydrogen 2.860 N/A GLY 763.A N LYS 3.A O no hydrogen 2.968 N/A PHE 769.A N ASN 765.A O no hydrogen 2.919 N/A ALA 770.A N SER 766.A O no hydrogen 2.915 N/A GLU 771.A N ASP 767.A O no hydrogen 2.922 N/A GLN 772.A N ILE 768.A O no hydrogen 2.983 N/A LEU 773.A N PHE 769.A O no hydrogen 2.914 N/A HIS 774.A N ALA 770.A O no hydrogen 2.966 N/A LYS 775.A N GLU 771.A O no hydrogen 2.900 N/A LEU 776.A N GLN 772.A O no hydrogen 2.895 N/A SER 777.A N LEU 773.A O no hydrogen 2.916 N/A ILE 783.A N ASP 779.A O no hydrogen 2.918 N/A ALA 784.A N GLU 780.A O no hydrogen 3.005 N/A LEU 785.A N GLU 781.A O no hydrogen 2.917 N/A GLU 786.A N ASP 782.A O no hydrogen 2.948 N/A PHE 787.A N ILE 783.A O no hydrogen 2.955 N/A ILE 788.A N ALA 784.A O no hydrogen 3.000 N/A GLY 790.A N GLU 786.A O no hydrogen 2.902 N/A LYS 792.A N GLU 791.A OE1 no hydrogen 2.604 N/A ASN 808.A N MET 805.A O no hydrogen 3.350 N/A THR 816.A N ASP 815.A OD1 no hydrogen 3.025 N/A THR 816.A OG1 GLN 813.A O no hydrogen 2.512 N/A PHE 817.A N GLN 813.A O no hydrogen 2.952 N/A PHE 818.A N MET 814.A O no hydrogen 2.917 N/A ASP 819.A N ASP 815.A O no hydrogen 3.012 N/A ARG 820.A N THR 816.A O no hydrogen 2.936 N/A VAL 821.A N PHE 817.A O no hydrogen 2.953 N/A MET 822.A N PHE 818.A O no hydrogen 2.965 N/A LYS 823.A N ASP 819.A O no hydrogen 3.007 N/A VAL 824.A N VAL 821.A O no hydrogen 3.085 N/A LEU 825.A N VAL 821.A O no hydrogen 3.008 N/A THR 826.A N MET 822.A O no hydrogen 2.971 N/A THR 826.A OG1 MET 822.A O no hydrogen 3.216 N/A