Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xz9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLN 6.A OE1 no hydrogen 3.195 N/A THR 2.A OG1 GLU 5.A OE1 no hydrogen 2.256 N/A THR 3.A OG1 GLU 4.A OE1 no hydrogen 3.339 N/A GLU 4.A N GLU 4.A OE1 no hydrogen 2.551 N/A GLU 5.A N THR 2.A O no hydrogen 3.173 N/A GLN 6.A NE2 SER 1.A O no hydrogen 3.065 N/A ALA 7.A N THR 3.A O no hydrogen 2.899 N/A LYS 8.A N GLU 4.A O no hydrogen 2.861 N/A LYS 8.A NZ GLU 12.A OE2 no hydrogen 2.935 N/A THR 9.A N GLU 5.A O no hydrogen 2.927 N/A THR 9.A OG1 GLU 5.A O no hydrogen 2.792 N/A THR 9.A OG1 GLN 6.A O no hydrogen 2.793 N/A PHE 10.A N GLN 6.A O no hydrogen 3.036 N/A LEU 11.A N ALA 7.A O no hydrogen 2.826 N/A GLU 12.A N LYS 8.A O no hydrogen 2.845 N/A LYS 13.A N THR 9.A O no hydrogen 2.935 N/A PHE 14.A N PHE 10.A O no hydrogen 2.686 N/A ASN 15.A N LEU 11.A O no hydrogen 2.819 N/A ASN 15.A ND2 LEU 11.A O no hydrogen 2.384 N/A HIS 16.A N GLU 12.A O no hydrogen 2.986 N/A GLU 17.A N LYS 13.A O no hydrogen 2.987 N/A ALA 18.A N PHE 14.A O no hydrogen 2.801 N/A GLU 19.A N ASN 15.A O no hydrogen 2.839 N/A ASP 20.A N HIS 16.A O no hydrogen 3.034 N/A LEU 21.A N GLU 17.A O no hydrogen 2.954 N/A SER 22.A N ALA 18.A O no hydrogen 2.765 N/A SER 22.A OG TYR 371.A OH no hydrogen 3.176 N/A TYR 23.A N GLU 19.A O no hydrogen 2.875 N/A GLN 24.A N ASP 20.A O no hydrogen 3.024 N/A SER 25.A N LEU 21.A O no hydrogen 2.890 N/A SER 25.A OG LEU 21.A O no hydrogen 2.911 N/A SER 25.A OG SER 22.A O no hydrogen 3.059 N/A SER 26.A N SER 22.A O no hydrogen 2.811 N/A SER 26.A OG SER 22.A O no hydrogen 2.894 N/A LEU 27.A N TYR 23.A O no hydrogen 2.916 N/A ALA 28.A N GLN 24.A O no hydrogen 2.957 N/A SER 29.A N SER 25.A O no hydrogen 2.846 N/A TRP 30.A N SER 26.A O no hydrogen 2.871 N/A ASN 31.A N LEU 27.A O no hydrogen 2.929 N/A TYR 32.A N ALA 28.A O no hydrogen 2.866 N/A ASN 33.A N SER 29.A O no hydrogen 2.909 N/A THR 34.A N TRP 30.A O no hydrogen 2.936 N/A THR 34.A OG1 TRP 30.A O no hydrogen 2.892 N/A ASN 35.A N ASN 31.A O no hydrogen 2.810 N/A GLU 39.A N ASP 38.A OD1 no hydrogen 3.023 N/A VAL 41.A N THR 37.A O no hydrogen 2.918 N/A GLN 42.A N ASP 38.A O no hydrogen 2.902 N/A LYS 43.A N GLU 39.A O no hydrogen 3.001 N/A MET 44.A N ASN 40.A O no hydrogen 2.891 N/A ASN 45.A N VAL 41.A O no hydrogen 2.895 N/A GLU 46.A N GLN 42.A O no hydrogen 2.997 N/A ALA 47.A N LYS 43.A O no hydrogen 2.897 N/A ARG 48.A N MET 44.A O no hydrogen 2.925 N/A ALA 49.A N ASN 45.A O no hydrogen 2.883 N/A LYS 50.A N GLU 46.A O no hydrogen 2.950 N/A TRP 51.A N ALA 47.A O no hydrogen 2.909 N/A SER 52.A N ARG 48.A O no hydrogen 2.896 N/A SER 52.A OG ARG 48.A O no hydrogen 3.209 N/A SER 52.A OG ALA 49.A O no hydrogen 2.616 N/A ALA 53.A N ALA 49.A O no hydrogen 2.915 N/A PHE 54.A N LYS 50.A O no hydrogen 2.897 N/A TYR 55.A N TRP 51.A O no hydrogen 2.894 N/A GLU 56.A N SER 52.A O no hydrogen 2.909 N/A GLU 57.A N ALA 53.A O no hydrogen 2.910 N/A GLN 58.A N PHE 54.A O no hydrogen 2.907 N/A SER 59.A N TYR 55.A O no hydrogen 2.912 N/A SER 59.A OG TYR 55.A O no hydrogen 3.263 N/A SER 59.A OG GLU 56.A O no hydrogen 2.446 N/A ARG 60.A N GLU 56.A O no hydrogen 2.904 N/A ARG 60.A NH2 GLU 57.A OE2 no hydrogen 3.531 N/A MET 61.A N GLU 57.A O no hydrogen 2.961 N/A ALA 62.A N GLN 58.A O no hydrogen 2.889 N/A LYS 63.A N ARG 60.A O no hydrogen 3.397 N/A THR 64.A OG1 MET 61.A O no hydrogen 3.279 N/A TYR 65.A N ALA 62.A O no hydrogen 3.356 N/A TYR 65.A OH GLN 6.A O no hydrogen 3.362 N/A SER 66.A OG GLU 68.A OE1 no hydrogen 2.869 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.893 N/A ILE 70.A N GLU 68.A O no hydrogen 2.907 N/A GLN 71.A N GLN 71.A OE1 no hydrogen 2.896 N/A LYS 76.A N ASN 72.A O no hydrogen 2.864 N/A ARG 77.A N LEU 73.A O no hydrogen 2.945 N/A ARG 77.A NH2 GLU 189.A OE1 no hydrogen 2.987 N/A GLN 78.A N THR 74.A O no hydrogen 2.895 N/A LEU 79.A N LEU 75.A O no hydrogen 2.874 N/A LYS 80.A N LYS 76.A O no hydrogen 2.905 N/A ALA 81.A N ARG 77.A O no hydrogen 2.944 N/A LEU 82.A N GLN 78.A O no hydrogen 2.864 N/A GLN 83.A N LEU 79.A O no hydrogen 2.889 N/A SER 88.A OG SER 85.A O no hydrogen 2.617 N/A ALA 89.A N GLY 86.A O no hydrogen 3.392 N/A LEU 90.A N THR 87.A O no hydrogen 3.445 N/A SER 95.A N SER 91.A O no hydrogen 2.915 N/A SER 95.A OG ALA 92.A O no hydrogen 2.856 N/A LYS 96.A N ALA 92.A O no hydrogen 2.883 N/A LYS 96.A NZ ALA 92.A O no hydrogen 3.445 N/A LYS 96.A NZ GLU 93.A OE1 no hydrogen 3.303 N/A ARG 97.A N GLU 93.A O no hydrogen 2.929 N/A ARG 97.A NH2 GLU 163.A OE2 no hydrogen 3.001 N/A LEU 98.A N LYS 94.A O no hydrogen 2.910 N/A ASN 99.A N SER 95.A O no hydrogen 2.922 N/A THR 100.A N LYS 96.A O no hydrogen 2.910 N/A THR 100.A OG1 LYS 96.A O no hydrogen 2.604 N/A THR 100.A OG1 ASN 99.A OD1 no hydrogen 3.207 N/A ILE 101.A N ARG 97.A O no hydrogen 2.916 N/A LEU 102.A N LEU 98.A O no hydrogen 2.915 N/A ASN 103.A N ASN 99.A O no hydrogen 2.899 N/A LYS 104.A N THR 100.A O no hydrogen 2.907 N/A MET 105.A N ILE 101.A O no hydrogen 2.888 N/A SER 106.A N LEU 102.A O no hydrogen 2.919 N/A SER 106.A OG LEU 102.A O no hydrogen 3.521 N/A SER 106.A OG ASN 103.A O no hydrogen 2.695 N/A THR 107.A N ASN 103.A O no hydrogen 2.893 N/A THR 107.A OG1 ASN 103.A O no hydrogen 2.883 N/A THR 107.A OG1 LYS 104.A O no hydrogen 2.690 N/A ILE 108.A N LYS 104.A O no hydrogen 2.923 N/A TYR 109.A N MET 105.A O no hydrogen 2.928 N/A SER 110.A N SER 106.A O no hydrogen 2.900 N/A SER 110.A OG SER 106.A O no hydrogen 2.972 N/A SER 110.A OG THR 107.A O no hydrogen 2.802 N/A THR 111.A N THR 107.A O no hydrogen 2.909 N/A THR 111.A OG1 THR 107.A O no hydrogen 2.867 N/A ASN 118.A ND2 GLN 120.A OE1 no hydrogen 2.788 N/A GLN 120.A N ASN 118.A OD1 no hydrogen 3.352 N/A LEU 123.A N VAL 114.A O no hydrogen 3.369 N/A LEU 125.A N LEU 123.A O no hydrogen 3.001 N/A GLY 128.A N ASP 131.A OD2 no hydrogen 3.186 N/A ASP 130.A N GLU 126.A O no hydrogen 2.907 N/A ILE 132.A N GLY 128.A O no hydrogen 2.904 N/A MET 133.A N LEU 129.A O no hydrogen 2.887 N/A GLU 134.A N ASP 130.A O no hydrogen 2.882 N/A ASN 135.A N ASP 131.A O no hydrogen 2.912 N/A SER 136.A OG ILE 132.A O no hydrogen 2.343 N/A ARG 141.A N ASP 138.A OD2 no hydrogen 3.238 N/A ARG 142.A N ASP 138.A O no hydrogen 2.975 N/A LEU 143.A N TYR 139.A O no hydrogen 2.884 N/A TRP 144.A N ASN 140.A O no hydrogen 2.888 N/A TRP 144.A NE1 ASP 116.A OD1 no hydrogen 2.881 N/A ALA 145.A N ARG 141.A O no hydrogen 2.966 N/A TRP 146.A N ARG 142.A O no hydrogen 2.954 N/A GLU 147.A N LEU 143.A O no hydrogen 2.866 N/A GLY 148.A N TRP 144.A O no hydrogen 2.910 N/A TRP 149.A N ALA 145.A O no hydrogen 2.966 N/A ARG 150.A N TRP 146.A O no hydrogen 2.905 N/A ARG 150.A NE TRP 146.A O no hydrogen 3.244 N/A ALA 151.A N GLU 147.A O no hydrogen 2.872 N/A GLU 152.A N GLY 148.A O no hydrogen 2.975 N/A VAL 153.A N TRP 149.A O no hydrogen 2.896 N/A GLY 154.A N ARG 150.A O no hydrogen 2.893 N/A GLN 156.A N GLU 152.A O no hydrogen 2.992 N/A LEU 157.A N VAL 153.A O no hydrogen 2.856 N/A LEU 157.A N GLY 154.A O no hydrogen 3.132 N/A ARG 158.A NE GLU 476.A O no hydrogen 2.396 N/A ARG 158.A NH2 GLU 476.A O no hydrogen 2.759 N/A TYR 161.A N LEU 157.A O no hydrogen 2.922 N/A GLU 163.A N PRO 159.A O no hydrogen 2.959 N/A TYR 164.A N LEU 160.A O no hydrogen 2.838 N/A VAL 165.A N TYR 161.A O no hydrogen 2.893 N/A VAL 166.A N GLU 162.A O no hydrogen 3.004 N/A LEU 167.A N GLU 163.A O no hydrogen 2.903 N/A GLU 168.A N TYR 164.A O no hydrogen 2.819 N/A ASN 169.A N VAL 165.A O no hydrogen 2.936 N/A GLU 170.A N VAL 166.A O no hydrogen 2.993 N/A MET 171.A N LEU 167.A O no hydrogen 2.881 N/A ALA 172.A N GLU 168.A O no hydrogen 2.890 N/A ARG 173.A N ASN 169.A O no hydrogen 2.919 N/A ALA 174.A N GLU 170.A O no hydrogen 2.903 N/A ASN 175.A N MET 171.A O no hydrogen 2.879 N/A ASN 176.A N ARG 173.A O no hydrogen 2.839 N/A TYR 177.A N ALA 172.A O no hydrogen 2.582 N/A GLY 181.A N ASP 179.A OD2 no hydrogen 2.642 N/A ASP 182.A N ASP 179.A OD1 no hydrogen 3.321 N/A ASP 182.A N ASP 179.A OD2 no hydrogen 3.376 N/A TYR 183.A N ASP 179.A O no hydrogen 2.889 N/A TRP 184.A N TYR 180.A O no hydrogen 2.907 N/A ARG 185.A N GLY 181.A O no hydrogen 2.899 N/A ARG 185.A NH1 ARG 200.A O no hydrogen 2.394 N/A GLY 186.A N TYR 183.A O no hydrogen 3.281 N/A ASP 187.A N TRP 184.A O no hydrogen 3.122 N/A TYR 188.A N ARG 185.A O no hydrogen 2.727 N/A THR 191.A OG1 GLU 189.A OE2 no hydrogen 2.612 N/A ALA 193.A N ASP 197.A OD1 no hydrogen 3.168 N/A ALA 193.A N ASP 197.A OD2 no hydrogen 3.441 N/A TYR 196.A OH PRO 546.A O no hydrogen 3.307 N/A SER 199.A OG ASP 201.A OD1 no hydrogen 2.146 N/A LEU 203.A N ARG 200.A O no hydrogen 3.116 N/A LYS 205.A N ASP 201.A O no hydrogen 2.934 N/A LYS 205.A NZ GLN 202.A OE1 no hydrogen 3.083 N/A ASP 206.A N GLN 202.A O no hydrogen 2.881 N/A VAL 207.A N LEU 203.A O no hydrogen 2.884 N/A GLU 208.A N MET 204.A O no hydrogen 2.920 N/A ARG 209.A N LYS 205.A O no hydrogen 2.938 N/A ARG 209.A NE ASP 206.A OD1 no hydrogen 2.764 N/A ARG 209.A NH2 ASP 206.A OD1 no hydrogen 2.896 N/A ARG 209.A NH2 ASP 206.A OD2 no hydrogen 2.907 N/A THR 210.A N ASP 206.A O no hydrogen 2.915 N/A THR 210.A OG1 ASP 206.A O no hydrogen 3.093 N/A THR 210.A OG1 VAL 207.A O no hydrogen 2.570 N/A THR 210.A OG1 TYR 497.A OH no hydrogen 3.388 N/A PHE 211.A N VAL 207.A O no hydrogen 2.906 N/A ALA 212.A N GLU 208.A O no hydrogen 2.924 N/A GLU 213.A N ARG 209.A O no hydrogen 2.944 N/A ILE 214.A N THR 210.A O no hydrogen 2.902 N/A ILE 214.A N PHE 211.A O no hydrogen 3.257 N/A LYS 215.A N PHE 211.A O no hydrogen 2.925 N/A TYR 218.A N ILE 214.A O no hydrogen 2.806 N/A GLU 219.A N LYS 215.A O no hydrogen 2.916 N/A GLN 220.A N PRO 216.A O no hydrogen 2.895 N/A LEU 221.A N LEU 217.A O no hydrogen 2.951 N/A HIS 222.A N TYR 218.A O no hydrogen 2.895 N/A ALA 223.A N GLU 219.A O no hydrogen 2.889 N/A TYR 224.A N GLN 220.A O no hydrogen 2.940 N/A VAL 225.A N LEU 221.A O no hydrogen 2.911 N/A ARG 226.A N HIS 222.A O no hydrogen 2.900 N/A ALA 227.A N ALA 223.A O no hydrogen 2.885 N/A LYS 228.A N TYR 224.A O no hydrogen 2.914 N/A LYS 228.A NZ THR 263.A O no hydrogen 3.421 N/A LEU 229.A N VAL 225.A O no hydrogen 2.936 N/A MET 230.A N ARG 226.A O no hydrogen 2.860 N/A HIS 231.A N ALA 227.A O no hydrogen 2.920 N/A THR 232.A N LEU 229.A O no hydrogen 3.120 N/A THR 232.A OG1 LEU 229.A O no hydrogen 2.766 N/A TYR 233.A N LEU 229.A O no hydrogen 2.849 N/A SER 238.A OG CYS 242.A O no hydrogen 3.304 N/A CYS 242.A SG ARG 463.A O no hydrogen 3.756 N/A CYS 242.A SG SER 588.A O no hydrogen 3.114 N/A ALA 245.A N VAL 469.A O no hydrogen 2.284 N/A LEU 247.A N PRO 244.A O no hydrogen 2.985 N/A LEU 248.A N ALA 245.A O no hydrogen 3.327 N/A PHE 255.A N ASP 250.A OD2 no hydrogen 2.559 N/A LEU 259.A N TRP 256.A O no hydrogen 3.346 N/A TYR 260.A N ASN 258.A O no hydrogen 2.813 N/A THR 263.A OG1 LEU 259.A O no hydrogen 2.401 N/A LYS 269.A NZ ASP 412.A OD2 no hydrogen 2.347 N/A MET 278.A N VAL 274.A O no hydrogen 2.990 N/A GLU 279.A N THR 275.A O no hydrogen 2.918 N/A ASN 280.A N GLU 276.A O no hydrogen 2.888 N/A GLN 281.A N LYS 277.A O no hydrogen 2.925 N/A SER 282.A OG SER 282.A O no hydrogen 2.302 N/A TRP 283.A N MET 278.A O no hydrogen 3.271 N/A ARG 287.A NH2 SER 282.A O no hydrogen 2.284 N/A ILE 288.A N ASP 284.A O no hydrogen 2.894 N/A PHE 289.A N ALA 285.A O no hydrogen 2.897 N/A LYS 290.A N GLU 286.A O no hydrogen 2.902 N/A GLU 291.A N ARG 287.A O no hydrogen 2.864 N/A ALA 292.A N ILE 288.A O no hydrogen 2.888 N/A GLU 293.A N PHE 289.A O no hydrogen 2.922 N/A LYS 294.A N LYS 290.A O no hydrogen 2.873 N/A PHE 295.A N GLU 291.A O no hydrogen 2.884 N/A PHE 296.A N ALA 292.A O no hydrogen 2.910 N/A VAL 297.A N GLU 293.A O no hydrogen 2.868 N/A SER 298.A N LYS 294.A O no hydrogen 2.900 N/A SER 298.A OG PHE 295.A O no hydrogen 2.632 N/A SER 298.A OG SER 526.A OG no hydrogen 2.335 N/A ILE 299.A N PHE 295.A O no hydrogen 3.035 N/A SER 300.A N VAL 297.A O no hydrogen 2.785 N/A SER 300.A OG ILE 299.A O no hydrogen 2.676 N/A SER 300.A OG GLN 533.A OE1 no hydrogen 2.976 N/A LEU 301.A N PHE 296.A O no hydrogen 2.733 N/A PHE 308.A N THR 305.A O no hydrogen 3.107 N/A PHE 308.A N THR 305.A OG1 no hydrogen 3.260 N/A ASP 310.A N GLN 306.A O no hydrogen 2.923 N/A ASN 311.A N GLY 307.A O no hydrogen 2.896 N/A SER 312.A OG PHE 308.A O no hydrogen 2.859 N/A LYS 322.A NZ VAL 323.A O no hydrogen 3.086 N/A CYS 325.A SG VAL 323.A O no hydrogen 3.345 N/A THR 328.A OG1 PRO 327.A O no hydrogen 2.489 N/A ASP 331.A N ASP 363.A OD2 no hydrogen 3.012 N/A LEU 332.A N ASP 336.A O no hydrogen 2.756 N/A LYS 334.A NZ ASP 20.A OD1 no hydrogen 3.337 N/A LYS 340.A NZ ASN 33.A O no hydrogen 2.895 N/A THR 343.A OG1 LYS 344.A O no hydrogen 3.320 N/A LYS 344.A NZ GLU 316.A OE2 no hydrogen 3.189 N/A LYS 344.A NZ THR 343.A O no hydrogen 3.326 N/A THR 346.A OG1 ASP 349.A OD2 no hydrogen 2.296 N/A LEU 351.A N MET 347.A O no hydrogen 2.898 N/A THR 352.A N ASP 348.A O no hydrogen 2.919 N/A ALA 353.A N ASP 349.A O no hydrogen 2.893 N/A HIS 354.A N PHE 350.A O no hydrogen 2.918 N/A HIS 355.A N LEU 351.A O no hydrogen 2.922 N/A HIS 355.A NE2 GLU 383.A OE2 no hydrogen 3.230 N/A GLU 356.A N THR 352.A O no hydrogen 2.918 N/A MET 357.A N ALA 353.A O no hydrogen 2.860 N/A GLY 358.A N HIS 354.A O no hydrogen 2.924 N/A HIS 359.A N HIS 355.A O no hydrogen 2.954 N/A ILE 360.A N GLU 356.A O no hydrogen 2.840 N/A GLN 361.A N MET 357.A O no hydrogen 2.888 N/A TYR 362.A N GLY 358.A O no hydrogen 2.926 N/A ASP 363.A N HIS 359.A O no hydrogen 2.918 N/A MET 364.A N ILE 360.A O no hydrogen 2.866 N/A ALA 365.A N GLN 361.A O no hydrogen 2.924 N/A ALA 365.A N TYR 362.A O no hydrogen 3.140 N/A ALA 367.A N MET 364.A O no hydrogen 3.164 N/A GLN 369.A N TYR 366.A O no hydrogen 2.911 N/A TYR 371.A N ASN 15.A OD1 no hydrogen 2.443 N/A ARG 374.A N TYR 371.A O no hydrogen 2.907 N/A ARG 374.A NH2 ASP 331.A OD1 no hydrogen 2.913 N/A ASN 375.A N LEU 373.A O no hydrogen 2.718 N/A GLY 380.A N ASN 378.A OD1 no hydrogen 2.849 N/A HIS 382.A ND1 HIS 359.A NE2 no hydrogen 2.944 N/A ALA 384.A N GLY 380.A O no hydrogen 2.911 N/A VAL 385.A N PHE 381.A O no hydrogen 2.920 N/A GLY 386.A N HIS 382.A O no hydrogen 2.926 N/A GLU 387.A N GLU 383.A O no hydrogen 2.913 N/A ILE 388.A N ALA 384.A O no hydrogen 2.932 N/A MET 389.A N VAL 385.A O no hydrogen 2.938 N/A SER 390.A N GLY 386.A O no hydrogen 2.922 N/A SER 390.A OG LEU 351.A O no hydrogen 3.359 N/A SER 390.A OG GLY 386.A O no hydrogen 2.567 N/A LEU 391.A N GLU 387.A O no hydrogen 2.860 N/A SER 392.A N ILE 388.A O no hydrogen 2.887 N/A SER 392.A OG ILE 388.A O no hydrogen 3.430 N/A SER 392.A OG MET 389.A O no hydrogen 2.414 N/A ALA 393.A N MET 389.A O no hydrogen 2.944 N/A ALA 394.A N LEU 391.A O no hydrogen 2.925 N/A TYR 398.A N THR 395.A O no hydrogen 3.137 N/A TYR 398.A N THR 395.A OG1 no hydrogen 3.314 N/A TYR 398.A OH GLU 291.A OE1 no hydrogen 2.489 N/A LYS 400.A N PRO 396.A O no hydrogen 2.904 N/A LYS 400.A NZ PRO 407.A O no hydrogen 3.491 N/A ALA 401.A N HIS 397.A O no hydrogen 2.904 N/A LEU 402.A N TYR 398.A O no hydrogen 2.881 N/A GLY 403.A N LEU 399.A O no hydrogen 2.907 N/A ASP 408.A N ASP 408.A OD1 no hydrogen 2.487 N/A PHE 409.A N PRO 407.A O no hydrogen 2.781 N/A ASP 412.A N THR 415.A OG1 no hydrogen 3.171 N/A THR 415.A OG1 GLU 411.A OE2 no hydrogen 3.154 N/A THR 415.A OG1 ASP 412.A O no hydrogen 2.449 N/A GLU 416.A N ASP 412.A O no hydrogen 2.914 N/A ILE 417.A N ASN 413.A O no hydrogen 2.909 N/A ASN 418.A N GLU 414.A O no hydrogen 2.888 N/A PHE 419.A N THR 415.A O no hydrogen 2.930 N/A LEU 420.A N GLU 416.A O no hydrogen 2.923 N/A LEU 421.A N ILE 417.A O no hydrogen 2.842 N/A LYS 422.A N ASN 418.A O no hydrogen 2.946 N/A GLN 423.A N PHE 419.A O no hydrogen 2.944 N/A ALA 424.A N LEU 420.A O no hydrogen 2.839 N/A LEU 425.A N LEU 421.A O no hydrogen 2.858 N/A THR 426.A N LYS 422.A O no hydrogen 2.999 N/A ILE 427.A N ALA 424.A O no hydrogen 2.878 N/A VAL 428.A N ALA 424.A O no hydrogen 2.835 N/A THR 430.A N ILE 427.A O no hydrogen 3.290 N/A THR 430.A OG1 ARG 254.A O no hydrogen 3.164 N/A LEU 431.A N VAL 428.A O no hydrogen 3.058 N/A THR 434.A N THR 430.A O no hydrogen 2.890 N/A MET 436.A N PRO 432.A O no hydrogen 2.963 N/A LEU 437.A N PHE 433.A O no hydrogen 2.926 N/A GLU 438.A N THR 434.A O no hydrogen 2.893 N/A LYS 439.A N TYR 435.A O no hydrogen 2.842 N/A ARG 441.A N LEU 437.A O no hydrogen 2.930 N/A TRP 442.A N GLU 438.A O no hydrogen 2.882 N/A MET 443.A N LYS 439.A O no hydrogen 2.882 N/A VAL 444.A N TRP 440.A O no hydrogen 2.869 N/A PHE 445.A N ARG 441.A O no hydrogen 2.944 N/A LYS 446.A N MET 443.A O no hydrogen 3.267 N/A LYS 446.A NZ ASP 179.A OD1 no hydrogen 2.827 N/A LYS 446.A NZ ASP 179.A OD2 no hydrogen 3.207 N/A TRP 458.A N TRP 454.A O no hydrogen 2.850 N/A TRP 459.A N MET 455.A O no hydrogen 2.952 N/A GLU 460.A N GLU 456.A O no hydrogen 2.920 N/A MET 461.A N LYS 457.A O no hydrogen 2.841 N/A LYS 462.A N TRP 458.A O no hydrogen 2.995 N/A ARG 463.A N TRP 459.A O no hydrogen 2.942 N/A GLU 464.A N GLU 460.A O no hydrogen 2.934 N/A ILE 465.A N MET 461.A O no hydrogen 2.909 N/A VAL 466.A N LYS 462.A O no hydrogen 2.905 N/A GLY 467.A N LYS 462.A O no hydrogen 3.104 N/A GLY 467.A N ARG 463.A O no hydrogen 2.908 N/A VAL 469.A N LEU 243.A O no hydrogen 2.842 N/A HIS 474.A ND1 ASP 480.A OD2 no hydrogen 3.375 N/A THR 477.A N ASP 475.A OD1 no hydrogen 2.893 N/A CYS 479.A SG GLY 154.A O no hydrogen 3.249 N/A ALA 482.A N CYS 479.A O no hydrogen 2.778 N/A CYS 483.A SG CYS 479.A O no hydrogen 3.397 N/A CYS 483.A SG ASP 480.A O no hydrogen 3.259 N/A ALA 488.A N PHE 485.A O no hydrogen 3.250 N/A TYR 491.A N HIS 486.A O no hydrogen 3.346 N/A SER 492.A OG GLU 438.A OE1 no hydrogen 2.953 N/A SER 492.A OG GLU 438.A OE2 no hydrogen 3.077 N/A PHE 493.A N GLU 438.A OE1 no hydrogen 2.712 N/A ILE 494.A N SER 492.A OG no hydrogen 3.309 N/A TYR 497.A N PHE 493.A O no hydrogen 2.966 N/A TYR 497.A OH THR 210.A OG1 no hydrogen 3.388 N/A THR 498.A N ILE 494.A O no hydrogen 2.876 N/A ARG 499.A N ARG 495.A O no hydrogen 2.854 N/A THR 500.A N TYR 496.A O no hydrogen 2.920 N/A THR 500.A OG1 TYR 496.A O no hydrogen 2.931 N/A ILE 501.A N TYR 497.A O no hydrogen 3.014 N/A TYR 502.A N THR 498.A O no hydrogen 2.833 N/A GLN 503.A N ARG 499.A O no hydrogen 2.920 N/A GLN 505.A N ILE 501.A O no hydrogen 2.978 N/A PHE 506.A N TYR 502.A O no hydrogen 2.853 N/A HIS 507.A N GLN 503.A O no hydrogen 3.006 N/A GLU 508.A N PHE 504.A O no hydrogen 2.887 N/A ALA 509.A N GLN 505.A O no hydrogen 2.946 N/A LEU 510.A N PHE 506.A O no hydrogen 2.911 N/A CYS 511.A N HIS 507.A O no hydrogen 2.910 N/A CYS 511.A SG LEU 520.A O no hydrogen 3.578 N/A CYS 511.A SG CYS 523.A O no hydrogen 3.597 N/A LYS 512.A N GLU 508.A O no hydrogen 2.905 N/A THR 513.A N ALA 509.A O no hydrogen 2.925 N/A THR 513.A OG1 ALA 509.A O no hydrogen 2.658 N/A THR 513.A OG1 LEU 510.A O no hydrogen 3.263 N/A ALA 514.A N CYS 511.A O no hydrogen 3.328 N/A HIS 516.A ND1 CYS 511.A O no hydrogen 2.694 N/A HIS 516.A NE2 GLY 518.A O no hydrogen 3.149 N/A LYS 522.A NZ GLU 416.A OE1 no hydrogen 2.539 N/A CYS 523.A SG ALA 519.A O no hydrogen 3.395 N/A CYS 523.A SG PHE 521.A O no hydrogen 3.722 N/A ILE 525.A N ASP 524.A OD1 no hydrogen 2.501 N/A SER 526.A OG SER 298.A OG no hydrogen 2.335 N/A ASN 527.A N SER 298.A OG no hydrogen 2.954 N/A SER 528.A N SER 298.A O no hydrogen 3.139 N/A SER 528.A OG SER 528.A O no hydrogen 2.428 N/A GLY 532.A N SER 528.A O no hydrogen 2.908 N/A GLN 533.A N THR 529.A O no hydrogen 2.910 N/A ARG 534.A N GLU 530.A O no hydrogen 2.910 N/A ARG 534.A NH1 ILE 554.A O no hydrogen 2.291 N/A LEU 535.A N ALA 531.A O no hydrogen 2.890 N/A LEU 536.A N GLY 532.A O no hydrogen 2.909 N/A GLN 537.A N GLN 533.A O no hydrogen 2.941 N/A GLN 537.A NE2 GLN 533.A O no hydrogen 2.838 N/A MET 538.A N LEU 535.A O no hydrogen 3.105 N/A LEU 539.A N LEU 535.A O no hydrogen 2.865 N/A ARG 540.A N LEU 536.A O no hydrogen 2.951 N/A LEU 541.A N MET 538.A O no hydrogen 3.265 N/A SER 544.A OG LEU 541.A O no hydrogen 2.894 N/A SER 544.A OG GLU 545.A OE1 no hydrogen 2.726 N/A LEU 549.A N TYR 196.A OH no hydrogen 2.513 N/A LEU 551.A N TRP 547.A O no hydrogen 2.842 N/A GLU 552.A N THR 548.A O no hydrogen 2.897 N/A ASN 553.A N LEU 549.A O no hydrogen 2.938 N/A ILE 554.A N ALA 550.A O no hydrogen 2.884 N/A VAL 555.A N LEU 551.A O no hydrogen 2.877 N/A GLY 556.A N LEU 551.A O no hydrogen 3.484 N/A LYS 563.A N ASP 561.A OD1 no hydrogen 3.108 N/A ASN 567.A N LYS 563.A O no hydrogen 2.931 N/A GLU 570.A N GLU 570.A OE1 no hydrogen 2.668 N/A PHE 573.A N PHE 569.A O no hydrogen 2.903 N/A THR 574.A N GLU 570.A O no hydrogen 2.892 N/A THR 574.A OG1 GLU 570.A O no hydrogen 2.716 N/A THR 574.A OG1 PRO 571.A O no hydrogen 2.768 N/A TRP 575.A N PRO 571.A O no hydrogen 2.933 N/A LEU 576.A N LEU 572.A O no hydrogen 2.889 N/A LYS 577.A N PHE 573.A O no hydrogen 2.915 N/A ASN 580.A N LYS 577.A O no hydrogen 3.232 N/A SER 583.A N ASN 580.A O no hydrogen 3.203 N/A SER 583.A OG ASN 580.A O no hydrogen 3.399 N/A SER 583.A OG ASN 580.A OD1 no hydrogen 2.923 N/A THR 592.A OG1 GLU 470.A O no hydrogen 3.150 N/A SER 595.A N THR 592.A O no hydrogen 3.251 N/A SER 595.A OG THR 592.A O no hydrogen 3.112 N/A SER 595.A OG SER 595.A O no hydrogen 2.514 N/A