Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aju_CL.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A ND2 GLN 2.A OE1 no hydrogen 3.594 N/A HIS 7.A ND1 ARG 8.A O no hydrogen 3.324 N/A LYS 11.A NZ ASN 14.A O no hydrogen 3.067 N/A LYS 19.A N THR 15.A O no hydrogen 2.959 N/A LEU 20.A N ALA 16.A O no hydrogen 2.916 N/A HIS 21.A N LYS 17.A O no hydrogen 3.072 N/A THR 22.A N LYS 19.A O no hydrogen 3.476 N/A GLY 24.A N GLN 23.A OE1 no hydrogen 2.717 N/A LYS 28.A N ASN 26.A OD1 no hydrogen 3.017 N/A PHE 30.A N ASN 26.A O no hydrogen 3.074 N/A MET 38.A N ALA 34.A O no hydrogen 2.954 N/A ALA 39.A N PRO 35.A O no hydrogen 2.939 N/A ARG 40.A N GLY 36.A O no hydrogen 3.077 N/A THR 41.A N LYS 37.A O no hydrogen 2.985 N/A THR 41.A OG1 LYS 37.A O no hydrogen 2.915 N/A THR 41.A OG1 MET 38.A O no hydrogen 3.043 N/A MET 42.A N MET 38.A O no hydrogen 2.883 N/A GLN 43.A N ALA 39.A O no hydrogen 2.990 N/A ARG 44.A N ARG 40.A O no hydrogen 3.023 N/A SER 45.A N THR 41.A O no hydrogen 2.855 N/A SER 46.A N MET 42.A O no hydrogen 2.895 N/A SER 46.A OG MET 42.A O no hydrogen 3.015 N/A ASP 47.A N GLN 43.A O no hydrogen 3.075 N/A VAL 48.A N ARG 44.A O no hydrogen 3.004 N/A ASN 49.A N SER 45.A O no hydrogen 2.944 N/A GLU 50.A N SER 46.A O no hydrogen 2.996 N/A ARG 51.A N ASP 47.A O no hydrogen 2.946 N/A LYS 52.A N VAL 48.A O no hydrogen 3.069 N/A LYS 52.A N ASN 49.A O no hydrogen 2.931 N/A LEU 53.A N ASN 49.A O no hydrogen 3.161 N/A LEU 53.A N GLU 50.A O no hydrogen 3.030 N/A THR 61.A N ASP 59.A O no hydrogen 2.779 N/A GLU 63.A N GLU 63.A OE1 no hydrogen 2.538 N/A VAL 71.A N THR 115.A O no hydrogen 2.904 N/A ALA 72.A N LEU 136.A O no hydrogen 2.913 N/A VAL 73.A N LEU 117.A O no hydrogen 2.913 N/A VAL 74.A N LEU 138.A O no hydrogen 3.013 N/A THR 79.A OG1 PRO 76.A O no hydrogen 3.106 N/A LYS 81.A NZ GLY 75.A O no hydrogen 3.482 N/A LYS 81.A NZ PRO 76.A O no hydrogen 3.485 N/A LYS 81.A NZ CYS 119.A O no hydrogen 3.366 N/A THR 82.A OG1 GLU 118.A OE1 no hydrogen 3.289 N/A THR 82.A OG1 GLU 118.A OE2 no hydrogen 3.040 N/A THR 83.A OG1 GLY 80.A O no hydrogen 2.881 N/A LEU 84.A N GLY 80.A O no hydrogen 2.922 N/A ILE 85.A N LYS 81.A O no hydrogen 3.062 N/A ARG 86.A N THR 82.A O no hydrogen 2.931 N/A ARG 86.A NH1 LEU 97.A O no hydrogen 2.350 N/A SER 87.A N THR 83.A O no hydrogen 2.896 N/A SER 87.A OG THR 83.A O no hydrogen 3.048 N/A SER 87.A OG LEU 84.A O no hydrogen 2.882 N/A LEU 88.A N LEU 84.A O no hydrogen 2.952 N/A VAL 89.A N ILE 85.A O no hydrogen 2.917 N/A ARG 90.A N ARG 86.A O no hydrogen 2.909 N/A ARG 91.A N SER 87.A O no hydrogen 2.934 N/A ARG 91.A NH1 ARG 91.A O no hydrogen 2.987 N/A MET 92.A N LEU 88.A O no hydrogen 2.980 N/A THR 93.A N VAL 89.A O no hydrogen 2.909 N/A THR 93.A OG1 THR 93.A O no hydrogen 2.626 N/A LYS 94.A N ARG 90.A O no hydrogen 2.868 N/A GLN 101.A N SER 332.A OG no hydrogen 2.800 N/A ILE 104.A N PHE 116.A O no hydrogen 3.070 N/A THR 105.A N TYR 328.A O no hydrogen 2.948 N/A VAL 106.A N LEU 114.A O no hydrogen 2.890 N/A SER 108.A N ARG 112.A O no hydrogen 2.887 N/A ARG 112.A N SER 108.A O no hydrogen 2.990 N/A LEU 114.A N VAL 106.A O no hydrogen 2.891 N/A THR 115.A N PHE 69.A O no hydrogen 2.872 N/A THR 115.A OG1 PHE 69.A O no hydrogen 3.166 N/A PHE 116.A N ILE 104.A O no hydrogen 2.878 N/A LEU 117.A N VAL 71.A O no hydrogen 3.031 N/A CYS 119.A N VAL 73.A O no hydrogen 3.020 N/A CYS 119.A SG VAL 73.A O no hydrogen 3.747 N/A CYS 119.A SG PRO 120.A O no hydrogen 3.509 N/A ALA 126.A N ASN 125.A OD1 no hydrogen 2.559 N/A MET 127.A N ASP 123.A O no hydrogen 2.972 N/A ILE 128.A N LEU 124.A O no hydrogen 2.898 N/A ASP 129.A N ASN 125.A O no hydrogen 3.007 N/A ILE 130.A N ALA 126.A O no hydrogen 2.996 N/A ALA 131.A N MET 127.A O no hydrogen 2.955 N/A LYS 132.A N ILE 128.A O no hydrogen 2.950 N/A LYS 132.A NZ SER 520.A OG no hydrogen 2.672 N/A ILE 133.A N ASP 129.A O no hydrogen 3.079 N/A ALA 134.A N ILE 130.A O no hydrogen 2.884 N/A ASP 135.A N ILE 70.A O no hydrogen 3.145 N/A LEU 136.A N ILE 70.A O no hydrogen 2.992 N/A VAL 137.A N ARG 165.A O no hydrogen 2.937 N/A LEU 138.A N ALA 72.A O no hydrogen 2.911 N/A LEU 139.A N LEU 167.A O no hydrogen 2.983 N/A LEU 140.A N VAL 74.A O no hydrogen 2.964 N/A ILE 141.A N VAL 169.A O no hydrogen 2.870 N/A ASN 144.A ND2 HIS 172.A O no hydrogen 2.935 N/A GLY 146.A N ASP 142.A O no hydrogen 3.374 N/A GLU 150.A N GLU 150.A OE2 no hydrogen 2.691 N/A MET 152.A N GLU 148.A O no hydrogen 3.010 N/A GLU 153.A N MET 149.A O no hydrogen 2.863 N/A PHE 154.A N GLU 150.A O no hydrogen 2.948 N/A LEU 155.A N THR 151.A O no hydrogen 2.935 N/A ASN 156.A N MET 152.A O no hydrogen 3.007 N/A ILE 157.A N GLU 153.A O no hydrogen 3.014 N/A ALA 158.A N PHE 154.A O no hydrogen 2.969 N/A GLN 159.A N LEU 155.A O no hydrogen 2.912 N/A HIS 160.A N ASN 156.A O no hydrogen 3.028 N/A HIS 160.A N ILE 157.A O no hydrogen 3.204 N/A HIS 161.A N ILE 157.A O no hydrogen 2.996 N/A HIS 161.A N ALA 158.A O no hydrogen 3.104 N/A ARG 165.A N ASP 135.A O no hydrogen 2.929 N/A ARG 165.A NH1 LYS 230.A O no hydrogen 2.553 N/A LEU 167.A N VAL 137.A O no hydrogen 2.938 N/A VAL 169.A N LEU 139.A O no hydrogen 2.890 N/A ALA 170.A N PHE 204.A O no hydrogen 2.853 N/A THR 171.A N ILE 141.A O no hydrogen 2.924 N/A THR 171.A OG1 ILE 141.A O no hydrogen 3.440 N/A THR 171.A OG1 HIS 172.A ND1 no hydrogen 3.025 N/A HIS 172.A ND1 THR 171.A OG1 no hydrogen 3.025 N/A LEU 175.A N HIS 172.A O no hydrogen 3.472 N/A THR 181.A OG1 SER 178.A O no hydrogen 2.918 N/A LEU 182.A N SER 178.A O no hydrogen 2.981 N/A ARG 183.A N GLN 179.A O no hydrogen 2.945 N/A ALA 184.A N SER 180.A O no hydrogen 2.990 N/A SER 185.A N THR 181.A O no hydrogen 2.877 N/A SER 185.A OG THR 181.A O no hydrogen 3.176 N/A LYS 186.A N LEU 182.A O no hydrogen 2.935 N/A LYS 187.A N ARG 183.A O no hydrogen 3.043 N/A ARG 188.A N ALA 184.A O no hydrogen 2.982 N/A LEU 189.A N SER 185.A O no hydrogen 2.931 N/A LYS 190.A N LYS 186.A O no hydrogen 2.880 N/A HIS 191.A N LYS 187.A O no hydrogen 2.968 N/A ARG 192.A N ARG 188.A O no hydrogen 2.993 N/A ARG 192.A NH2 ARG 192.A O no hydrogen 3.337 N/A ARG 192.A NH2 GLU 196.A OE2 no hydrogen 2.268 N/A PHE 193.A N LEU 189.A O no hydrogen 2.865 N/A TRP 194.A N LYS 190.A O no hydrogen 2.826 N/A THR 195.A N HIS 191.A O no hydrogen 2.970 N/A GLU 196.A N ARG 192.A O no hydrogen 3.091 N/A VAL 197.A N PHE 193.A O no hydrogen 2.904 N/A PHE 204.A N GLY 168.A O no hydrogen 2.899 N/A LEU 206.A N ALA 170.A O no hydrogen 2.931 N/A ILE 210.A N ARG 213.A O no hydrogen 3.208 N/A TYR 214.A OH GLY 80.A O no hydrogen 3.400 N/A ILE 219.A N PRO 215.A O no hydrogen 3.086 N/A LEU 220.A N ASP 216.A O no hydrogen 2.799 N/A ASN 221.A N ARG 217.A O no hydrogen 3.021 N/A ASN 221.A ND2 ARG 217.A O no hydrogen 3.278 N/A LEU 222.A N GLU 218.A O no hydrogen 2.984 N/A SER 223.A N ILE 219.A O no hydrogen 2.842 N/A SER 223.A OG ILE 219.A O no hydrogen 2.604 N/A ARG 224.A N LEU 220.A O no hydrogen 3.024 N/A PHE 225.A N ASN 221.A O no hydrogen 3.050 N/A ILE 226.A N LEU 222.A O no hydrogen 2.988 N/A SER 227.A N ARG 224.A O no hydrogen 3.056 N/A VAL 228.A N ARG 224.A O no hydrogen 3.045 N/A VAL 228.A N PHE 225.A O no hydrogen 2.891 N/A ARG 237.A NH1 LYS 132.A O no hydrogen 3.371 N/A ASN 238.A N LEU 234.A O no hydrogen 2.984 N/A ASN 238.A ND2 LEU 234.A O no hydrogen 3.206 N/A GLU 239.A N TRP 236.A O no hydrogen 3.023 N/A HIS 240.A N TRP 236.A O no hydrogen 3.039 N/A HIS 240.A ND1 GLY 486.A O no hydrogen 3.316 N/A TYR 242.A N HIS 275.A O no hydrogen 3.134 N/A MET 243.A N MET 484.A O no hydrogen 2.928 N/A ALA 245.A N ILE 482.A O no hydrogen 3.008 N/A ASP 246.A N TYR 271.A O no hydrogen 2.430 N/A ARG 247.A N TYR 271.A O no hydrogen 2.967 N/A THR 249.A N ALA 269.A O no hydrogen 2.950 N/A LEU 251.A N LYS 267.A O no hydrogen 2.826 N/A ILE 257.A N HIS 253.A O no hydrogen 2.912 N/A GLU 258.A N PRO 254.A O no hydrogen 2.914 N/A THR 259.A N GLU 255.A O no hydrogen 2.877 N/A THR 259.A OG1 GLU 255.A O no hydrogen 3.027 N/A THR 259.A OG1 LEU 256.A O no hydrogen 2.683 N/A GLN 260.A N LEU 256.A O no hydrogen 2.923 N/A GLN 260.A NE2 LEU 256.A O no hydrogen 3.631 N/A GLN 260.A NE2 THR 259.A OG1 no hydrogen 2.792 N/A GLY 261.A N ILE 257.A O no hydrogen 2.886 N/A LEU 262.A N ILE 257.A O no hydrogen 3.211 N/A VAL 268.A N PHE 465.A O no hydrogen 2.912 N/A ALA 269.A N THR 249.A O no hydrogen 2.826 N/A ILE 270.A N ILE 463.A O no hydrogen 2.819 N/A TYR 271.A N ARG 247.A O no hydrogen 2.912 N/A GLY 272.A N VAL 461.A O no hydrogen 3.008 N/A THR 277.A N HIS 275.A O no hydrogen 3.074 N/A THR 277.A OG1 HIS 240.A O no hydrogen 2.642 N/A LEU 279.A N PHE 455.A O no hydrogen 3.130 N/A ARG 286.A NH1 ASP 294.A O no hydrogen 3.162 N/A ARG 286.A NH2 ASP 294.A O no hydrogen 3.336 N/A VAL 287.A N PHE 295.A O no hydrogen 3.246 N/A HIS 288.A N GLY 485.A O no hydrogen 2.918 N/A ILE 289.A N GLY 293.A O no hydrogen 3.100 N/A ALA 290.A N VAL 483.A O no hydrogen 2.943 N/A VAL 292.A N ILE 289.A O no hydrogen 2.922 N/A GLY 293.A N ILE 289.A O no hydrogen 3.224 N/A PHE 295.A N VAL 287.A O no hydrogen 3.042 N/A SER 296.A OG THR 285.A O no hydrogen 3.133 N/A VAL 297.A N THR 285.A O no hydrogen 2.856 N/A ALA 298.A N VAL 464.A O no hydrogen 2.941 N/A GLN 299.A N VAL 464.A O no hydrogen 3.022 N/A GLU 301.A N ARG 462.A O no hydrogen 2.975 N/A LEU 303.A N TYR 460.A O no hydrogen 2.911 N/A CYS 307.A SG TYR 273.A OH no hydrogen 3.491 N/A THR 309.A OG1 LYS 110.A O no hydrogen 2.344 N/A GLN 313.A N THR 309.A O no hydrogen 2.879 N/A GLN 314.A N PRO 310.A O no hydrogen 2.861 N/A GLN 314.A NE2 PHE 311.A O no hydrogen 3.607 N/A LYS 315.A N PHE 311.A O no hydrogen 2.922 N/A LEU 316.A N TYR 312.A O no hydrogen 2.865 N/A ASP 317.A N GLN 313.A O no hydrogen 2.882 N/A ASP 318.A N GLN 314.A O no hydrogen 2.849 N/A PHE 319.A N LYS 315.A O no hydrogen 2.950 N/A GLU 320.A N LEU 316.A O no hydrogen 2.912 N/A ARG 321.A N ASP 317.A O no hydrogen 2.941 N/A TYR 328.A OH TYR 460.A OH no hydrogen 2.518 N/A SER 332.A N ALA 329.A O no hydrogen 2.949 N/A SER 332.A OG ASP 99.A O no hydrogen 3.118 N/A SER 332.A OG GLN 101.A O no hydrogen 2.823 N/A LEU 339.A N ASN 335.A O no hydrogen 2.969 N/A ILE 340.A N ILE 336.A O no hydrogen 2.757 N/A TYR 341.A N GLY 337.A O no hydrogen 3.055 N/A TYR 341.A N LYS 338.A O no hydrogen 3.212 N/A MET 342.A N LYS 338.A O no hydrogen 2.915 N/A ILE 345.A N MET 342.A O no hydrogen 3.463 N/A GLU 348.A N SER 346.A OG no hydrogen 3.119 N/A CYS 350.A N SER 346.A O no hydrogen 2.879 N/A CYS 350.A SG LEU 339.A O no hydrogen 3.156 N/A CYS 350.A SG SER 346.A O no hydrogen 3.215 N/A ILE 351.A N PRO 347.A O no hydrogen 2.922 N/A ARG 352.A N GLU 348.A O no hydrogen 2.905 N/A ARG 352.A NH1 GLU 349.A OE2 no hydrogen 3.235 N/A ARG 353.A N GLU 349.A O no hydrogen 2.961 N/A TRP 354.A N CYS 350.A O no hydrogen 2.938 N/A ARG 355.A N ILE 351.A O no hydrogen 2.851 N/A GLY 356.A N ARG 352.A O no hydrogen 2.574 N/A LYS 361.A NZ VAL 363.A O no hydrogen 2.175 N/A GLU 370.A N GLU 370.A OE1 no hydrogen 2.239 N/A LYS 371.A N THR 368.A OG1 no hydrogen 3.340 N/A LEU 372.A N THR 368.A O no hydrogen 2.964 N/A ALA 373.A N PHE 369.A O no hydrogen 2.889 N/A LYS 374.A N GLU 370.A O no hydrogen 2.952 N/A LYS 375.A N LYS 371.A O no hydrogen 2.858 N/A TRP 376.A N LEU 372.A O no hydrogen 2.951 N/A ILE 382.A N VAL 379.A O no hydrogen 2.927 N/A LYS 383.A N VAL 379.A O no hydrogen 2.998 N/A GLU 384.A N GLU 384.A OE2 no hydrogen 2.349 N/A PHE 386.A N ILE 382.A O no hydrogen 3.008 N/A GLU 389.A N GLU 389.A OE2 no hydrogen 2.507 N/A ALA 392.A N ARG 388.A O no hydrogen 2.907 N/A ALA 393.A N GLU 389.A O no hydrogen 2.902 N/A LYS 394.A N MET 390.A O no hydrogen 2.875 N/A LYS 395.A N ASN 391.A O no hydrogen 2.893 N/A GLU 396.A N ALA 392.A O no hydrogen 2.928 N/A LYS 397.A N ALA 393.A O no hydrogen 2.903 N/A LEU 398.A N LYS 394.A O no hydrogen 2.880 N/A ARG 399.A N LYS 395.A O no hydrogen 2.889 N/A ARG 399.A NE ARG 399.A O no hydrogen 2.845 N/A ALA 400.A N GLU 396.A O no hydrogen 2.926 N/A GLN 401.A N LYS 397.A O no hydrogen 2.889 N/A PHE 402.A N LEU 398.A O no hydrogen 2.887 N/A GLU 403.A N ARG 399.A O no hydrogen 2.850 N/A ILE 404.A N ALA 400.A O no hydrogen 2.932 N/A GLU 405.A N GLN 401.A O no hydrogen 2.883 N/A GLU 406.A N PHE 402.A O no hydrogen 2.887 N/A ASN 409.A N GLY 407.A O no hydrogen 2.774 N/A PHE 410.A N ASN 409.A OD1 no hydrogen 2.509 N/A GLU 412.A N PHE 410.A O no hydrogen 2.833 N/A GLU 418.A N ASP 414.A O no hydrogen 2.829 N/A GLU 418.A N GLU 415.A O no hydrogen 2.847 N/A ASP 420.A N GLU 415.A O no hydrogen 2.896 N/A THR 421.A OG1 TYR 419.A O no hydrogen 2.948 N/A THR 421.A OG1 ASP 420.A O no hydrogen 2.586 N/A LEU 425.A N THR 421.A O no hydrogen 2.935 N/A GLN 426.A N TRP 422.A O no hydrogen 3.000 N/A LYS 427.A N TYR 423.A O no hydrogen 2.957 N/A ALA 428.A N GLU 424.A O no hydrogen 2.848 N/A LYS 429.A N LEU 425.A O no hydrogen 3.030 N/A ILE 430.A N GLN 426.A O no hydrogen 3.047 N/A SER 431.A N LYS 427.A O no hydrogen 2.953 N/A SER 431.A OG LYS 427.A O no hydrogen 3.161 N/A LYS 432.A N ALA 428.A O no hydrogen 2.920 N/A GLN 433.A N LYS 429.A O no hydrogen 3.012 N/A LEU 434.A N ILE 430.A O no hydrogen 2.959 N/A GLU 435.A N SER 431.A O no hydrogen 2.976 N/A ILE 436.A N LYS 432.A O no hydrogen 2.987 N/A ASN 437.A N GLN 433.A O no hydrogen 2.988 N/A ASN 438.A N LEU 434.A O no hydrogen 2.944 N/A ILE 439.A N GLU 435.A O no hydrogen 2.985 N/A GLU 440.A N ILE 436.A O no hydrogen 3.014 N/A TYR 441.A N ASN 437.A O no hydrogen 2.946 N/A GLN 442.A N ASN 438.A O no hydrogen 2.925 N/A GLU 443.A N GLU 440.A O no hydrogen 3.188 N/A ARG 449.A NH2 GLU 453.A OE2 no hydrogen 2.610 N/A GLN 450.A N PRO 446.A O no hydrogen 3.251 N/A ILE 452.A N GLU 447.A O no hydrogen 2.908 N/A PHE 455.A N LEU 279.A O no hydrogen 3.186 N/A LYS 456.A NZ ASP 64.A OD2 no hydrogen 3.502 N/A GLY 458.A N LEU 274.A O no hydrogen 3.034 N/A TYR 460.A OH TYR 328.A OH no hydrogen 2.518 N/A VAL 461.A N GLY 272.A O no hydrogen 2.886 N/A ARG 462.A N GLU 301.A O no hydrogen 2.846 N/A ARG 462.A NE TYR 271.A OH no hydrogen 3.133 N/A ILE 463.A N ILE 270.A O no hydrogen 2.954 N/A VAL 464.A N GLN 299.A O no hydrogen 2.906 N/A PHE 465.A N VAL 268.A O no hydrogen 2.915 N/A GLU 471.A N GLU 471.A OE2 no hydrogen 2.312 N/A VAL 473.A N PRO 469.A O no hydrogen 3.132 N/A LYS 474.A N MET 470.A O no hydrogen 2.818 N/A ASN 475.A N GLU 471.A O no hydrogen 2.919 N/A PHE 476.A N PHE 472.A O no hydrogen 2.965 N/A LYS 479.A NZ GLN 101.A OE1 no hydrogen 3.108 N/A MET 484.A N MET 243.A O no hydrogen 2.907 N/A GLY 485.A N HIS 288.A O no hydrogen 2.968 N/A GLY 486.A N PRO 241.A O no hydrogen 2.869 N/A LEU 487.A N ARG 286.A O no hydrogen 2.971 N/A GLU 491.A N LEU 488.A O no hydrogen 2.537 N/A ILE 492.A N PRO 489.A O no hydrogen 3.029 N/A LYS 493.A N PRO 489.A O no hydrogen 3.092 N/A GLY 495.A N GLY 559.A O no hydrogen 3.473 N/A ILE 496.A N ASP 595.A O no hydrogen 2.859 N/A VAL 497.A N PHE 557.A O no hydrogen 2.894 N/A LYS 498.A N GLU 593.A O no hydrogen 2.870 N/A ALA 499.A N ALA 555.A O no hydrogen 2.928 N/A ARG 500.A N ILE 590.A O no hydrogen 2.977 N/A ARG 500.A NE GLU 592.A OE2 no hydrogen 2.618 N/A LEU 501.A N CYS 553.A O no hydrogen 2.946 N/A ARG 502.A N THR 588.A O no hydrogen 2.974 N/A ARG 503.A NE GLU 549.A O no hydrogen 2.960 N/A ARG 503.A NH1 GLU 549.A O no hydrogen 3.078 N/A HIS 504.A N ALA 586.A O no hydrogen 2.620 N/A HIS 507.A N HIS 504.A O no hydrogen 2.767 N/A ASN 514.A N PRO 530.A O no hydrogen 3.016 N/A LEU 517.A N THR 528.A O no hydrogen 2.889 N/A VAL 518.A N VAL 571.A O no hydrogen 2.934 N/A LEU 519.A N PHE 526.A O no hydrogen 2.881 N/A SER 520.A N CYS 569.A O no hydrogen 2.871 N/A LEU 521.A N ARG 524.A O no hydrogen 3.170 N/A ARG 524.A N LEU 521.A O no hydrogen 3.242 N/A ARG 524.A NH1 GLU 491.A O no hydrogen 3.541 N/A ARG 524.A NH2 ASP 294.A OD2 no hydrogen 3.421 N/A ARG 524.A NH2 GLU 491.A O no hydrogen 2.497 N/A PHE 526.A N LEU 519.A O no hydrogen 3.012 N/A GLN 527.A NE2 LEU 704.A O no hydrogen 2.838 N/A THR 528.A N LEU 517.A O no hydrogen 2.985 N/A THR 528.A OG1 LEU 517.A O no hydrogen 3.451 N/A ILE 531.A N ALA 556.A O no hydrogen 2.885 N/A THR 533.A N ASN 554.A O no hydrogen 2.757 N/A THR 534.A N ARG 542.A O no hydrogen 2.708 N/A ASP 536.A N ARG 540.A O no hydrogen 3.271 N/A THR 541.A OG1 GLU 599.A O no hydrogen 2.724 N/A ARG 542.A N THR 534.A O no hydrogen 2.716 N/A ARG 542.A NE ASP 536.A OD2 no hydrogen 2.697 N/A ARG 542.A NH2 ASP 536.A OD1 no hydrogen 2.947 N/A MET 543.A N VAL 601.A O no hydrogen 2.931 N/A LEU 544.A N TYR 532.A O no hydrogen 2.808 N/A THR 547.A OG1 LEU 511.A O no hydrogen 2.558 N/A CYS 553.A N LEU 501.A O no hydrogen 2.898 N/A CYS 553.A SG LEU 501.A O no hydrogen 3.775 N/A CYS 553.A SG ASN 554.A O no hydrogen 3.488 N/A ALA 555.A N ALA 499.A O no hydrogen 2.893 N/A ALA 556.A N ILE 531.A O no hydrogen 2.726 N/A PHE 557.A N VAL 497.A O no hydrogen 3.029 N/A GLY 559.A N GLY 495.A O no hydrogen 3.188 N/A LEU 561.A N LYS 493.A O no hydrogen 3.220 N/A CYS 562.A SG LEU 561.A O no hydrogen 3.404 N/A THR 566.A N VAL 591.A O no hydrogen 3.212 N/A THR 566.A OG1 SER 563.A O no hydrogen 2.735 N/A THR 566.A OG1 PRO 564.A O no hydrogen 3.421 N/A PHE 568.A N GLY 589.A O no hydrogen 2.930 N/A CYS 569.A N SER 520.A O no hydrogen 3.087 N/A CYS 569.A SG HIS 161.A NE2 no hydrogen 3.024 N/A GLY 570.A N ALA 587.A O no hydrogen 2.828 N/A VAL 571.A N VAL 518.A O no hydrogen 2.850 N/A THR 579.A OG1 ASN 576.A O no hydrogen 3.517 N/A ARG 584.A N GLU 153.A OE2 no hydrogen 3.235 N/A ALA 586.A N GLY 570.A O no hydrogen 3.081 N/A ALA 587.A N GLY 570.A O no hydrogen 2.907 N/A THR 588.A N ARG 502.A O no hydrogen 3.278 N/A GLY 589.A N PHE 568.A O no hydrogen 3.028 N/A ILE 590.A N ARG 500.A O no hydrogen 2.980 N/A VAL 591.A N THR 566.A O no hydrogen 2.889 N/A GLU 592.A N LYS 498.A O no hydrogen 2.934 N/A GLU 593.A N LYS 498.A O no hydrogen 3.034 N/A ASP 595.A N ILE 496.A O no hydrogen 2.989 N/A ASN 597.A N ASP 595.A OD2 no hydrogen 3.031 N/A VAL 601.A N THR 541.A O no hydrogen 2.837 N/A LYS 602.A N TYR 679.A O no hydrogen 2.824 N/A LEU 604.A N SER 677.A O no hydrogen 2.863 N/A LEU 606.A N LEU 675.A O no hydrogen 2.993 N/A GLY 608.A N VAL 673.A O no hydrogen 2.686 N/A PHE 609.A N LYS 621.A O no hydrogen 2.970 N/A TYR 611.A N PHE 619.A O no hydrogen 2.918 N/A TYR 611.A OH HIS 658.A ND1 no hydrogen 3.083 N/A PHE 614.A N THR 617.A O no hydrogen 2.902 N/A ALA 618.A N ALA 661.A O no hydrogen 2.913 N/A PHE 619.A N LYS 612.A O no hydrogen 2.782 N/A ILE 620.A N TYR 659.A O no hydrogen 2.853 N/A LYS 621.A N PHE 609.A O no hydrogen 2.631 N/A SER 625.A N GLU 629.A OE1 no hydrogen 2.501 N/A SER 625.A OG GLU 629.A OE1 no hydrogen 2.705 N/A SER 626.A OG GLU 656.A OE2 no hydrogen 3.402 N/A MET 628.A N SER 626.A OG no hydrogen 3.285 N/A VAL 630.A N SER 626.A O no hydrogen 2.998 N/A ALA 631.A N ALA 627.A O no hydrogen 2.864 N/A ARG 632.A N MET 628.A O no hydrogen 2.927 N/A PHE 633.A N GLU 629.A O no hydrogen 3.052 N/A PHE 633.A N VAL 630.A O no hydrogen 2.703 N/A GLU 634.A N ALA 631.A O no hydrogen 3.507 N/A GLY 635.A N ILE 648.A O no hydrogen 2.847 N/A LYS 639.A N ILE 674.A O no hydrogen 3.305 N/A LYS 639.A NZ THR 640.A O no hydrogen 3.437 N/A THR 640.A N ILE 644.A O no hydrogen 3.302 N/A THR 640.A OG1 ILE 672.A O no hydrogen 2.485 N/A VAL 641.A N ILE 672.A O no hydrogen 3.016 N/A SER 642.A OG ASP 671.A OD1 no hydrogen 2.310 N/A SER 642.A OG ASP 671.A OD2 no hydrogen 3.108 N/A GLY 643.A N THR 640.A O no hydrogen 2.911 N/A ARG 645.A NH2 GLU 664.A OE1 no hydrogen 3.479 N/A LYS 649.A N ARG 660.A O no hydrogen 2.969 N/A ALA 651.A N GLU 634.A OE2 no hydrogen 2.796 N/A LEU 652.A N HIS 658.A O no hydrogen 3.030 N/A HIS 658.A ND1 TYR 611.A OH no hydrogen 3.083 N/A TYR 659.A N ILE 620.A O no hydrogen 2.971 N/A ARG 660.A N ARG 650.A O no hydrogen 3.335 N/A ALA 661.A N ALA 618.A O no hydrogen 2.888 N/A PHE 663.A N ASN 616.A O no hydrogen 2.879 N/A LYS 666.A N ASP 665.A OD1 no hydrogen 2.339 N/A VAL 673.A N GLY 608.A O no hydrogen 3.135 N/A ILE 674.A N LYS 639.A O no hydrogen 2.978 N/A LEU 675.A N LEU 606.A O no hydrogen 2.911 N/A SER 677.A N LEU 604.A O no hydrogen 3.072 N/A SER 677.A OG LEU 604.A O no hydrogen 2.817 N/A TYR 679.A N LYS 602.A O no hydrogen 2.771 N/A VAL 681.A N ILE 600.A O no hydrogen 2.971 N/A ASN 688.A N GLN 527.A O no hydrogen 3.384 N/A ASN 688.A ND2 GLN 527.A OE1 no hydrogen 3.390 N/A VAL 690.A N ARG 525.A O no hydrogen 3.138 N/A LEU 695.A N THR 691.A O no hydrogen 3.048 N/A LYS 696.A NZ GLU 697.A OE2 no hydrogen 2.788 N/A LYS 698.A NZ LEU 693.A O no hydrogen 2.929 N/A LEU 704.A N GLN 527.A OE1 no hydrogen 3.028 N/A LEU 706.A N GLN 709.A OE1 no hydrogen 3.299 N/A THR 707.A OG1 ASP 515.A OD1 no hydrogen 2.389 N/A THR 707.A OG1 ASP 515.A OD2 no hydrogen 3.389 N/A ILE 710.A N LEU 706.A O no hydrogen 2.930 N/A ARG 711.A N THR 707.A O no hydrogen 2.914 N/A ALA 712.A N GLY 708.A O no hydrogen 2.951 N/A ALA 713.A N GLN 709.A O no hydrogen 2.905 N/A MET 714.A N ILE 710.A O no hydrogen 2.852 N/A ASN 715.A N ALA 712.A O no hydrogen 3.052 N/A LEU 716.A N ARG 711.A O no hydrogen 3.053 N/A SER 724.A N ASN 721.A O no hydrogen 3.197 N/A GLN 746.A N PRO 742.A O no hydrogen 2.899 N/A LYS 747.A N LYS 743.A O no hydrogen 2.884 N/A GLU 748.A N ALA 744.A O no hydrogen 2.979 N/A GLN 754.A N LYS 752.A O no hydrogen 2.393 N/A LYS 768.A NZ LEU 763.A O no hydrogen 2.708 N/A LYS 769.A N GLY 765.A O no hydrogen 3.040 N/A ALA 770.A N ASP 766.A O no hydrogen 2.887 N/A ARG 771.A N GLU 767.A O no hydrogen 2.951 N/A SER 772.A N LYS 768.A O no hydrogen 2.951 N/A SER 772.A OG LYS 769.A O no hydrogen 2.452 N/A PHE 773.A N LYS 769.A O no hydrogen 2.958 N/A ILE 774.A N ALA 770.A O no hydrogen 2.911 N/A GLN 775.A N ARG 771.A O no hydrogen 2.966 N/A LYS 776.A N SER 772.A O no hydrogen 3.026 N/A VAL 777.A N PHE 773.A O no hydrogen 2.918 N/A LEU 778.A N ILE 774.A O no hydrogen 2.952 N/A THR 779.A N GLN 775.A O no hydrogen 2.976 N/A THR 779.A OG1 GLN 775.A O no hydrogen 2.950 N/A ILE 780.A N LYS 776.A O no hydrogen 2.915 N/A SER 781.A N VAL 777.A O no hydrogen 2.932 N/A LYS 782.A N LEU 778.A O no hydrogen 2.880 N/A ALA 783.A N THR 779.A O no hydrogen 2.925 N/A LYS 784.A N ILE 780.A O no hydrogen 2.913 N/A ASP 785.A N SER 781.A O no hydrogen 2.939 N/A SER 786.A N LYS 782.A O no hydrogen 2.858 N/A SER 786.A OG ALA 783.A O no hydrogen 2.617 N/A LYS 787.A N ALA 783.A O no hydrogen 2.944 N/A ARG 788.A N LYS 784.A O no hydrogen 2.957 N/A LYS 789.A N ASP 785.A O no hydrogen 2.823 N/A GLU 790.A N SER 786.A O no hydrogen 2.928 N/A GLN 791.A N LYS 787.A O no hydrogen 2.891 N/A LYS 792.A N ARG 788.A O no hydrogen 2.898 N/A ALA 793.A N LYS 789.A O no hydrogen 2.894 N/A SER 794.A N GLU 790.A O no hydrogen 2.912 N/A GLN 795.A N GLN 791.A O no hydrogen 2.935 N/A ARG 796.A N LYS 792.A O no hydrogen 2.831 N/A LYS 797.A N ALA 793.A O no hydrogen 2.892 N/A GLU 798.A N SER 794.A O no hydrogen 2.931 N/A ARG 799.A N GLN 795.A O no hydrogen 2.873 N/A LEU 800.A N ARG 796.A O no hydrogen 2.842 N/A LYS 801.A N LYS 797.A O no hydrogen 2.878 N/A LYS 802.A N GLU 798.A O no hydrogen 2.895 N/A LEU 803.A N ARG 799.A O no hydrogen 2.816 N/A ALA 804.A N LEU 800.A O no hydrogen 2.880 N/A LYS 805.A N LYS 801.A O no hydrogen 2.931 N/A MET 806.A N LYS 802.A O no hydrogen 2.852 N/A GLU 807.A N LEU 803.A O no hydrogen 2.921 N/A GLU 808.A N ALA 804.A O no hydrogen 2.940 N/A