Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kk0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 ALA 4.A O no hydrogen 3.114 N/A GLN 3.A NE2 TYR 269.A O no hydrogen 2.757 N/A GLU 5.A N ARG 77.A O no hydrogen 2.972 N/A ASN 7.A N ASP 98.A OD2 no hydrogen 2.786 N/A ASN 7.A ND2 LEU 97.A O no hydrogen 2.873 N/A ILE 8.A N SER 79.A O no hydrogen 2.729 N/A GLY 9.A N GLY 99.A O no hydrogen 2.918 N/A HIS 15.A N HIS 12.A O no hydrogen 3.094 N/A HIS 15.A NE2 GLU 108.A OE2 no hydrogen 2.910 N/A LEU 20.A N GLY 16.A O no hydrogen 2.583 N/A THR 21.A N LYS 17.A O no hydrogen 2.979 N/A THR 21.A OG1 LYS 17.A O no hydrogen 2.774 N/A LYS 22.A N THR 18.A O no hydrogen 3.048 N/A ALA 23.A N THR 19.A O no hydrogen 2.975 N/A LEU 24.A N LEU 20.A O no hydrogen 2.984 N/A THR 25.A N THR 21.A O no hydrogen 2.850 N/A THR 25.A OG1 THR 21.A O no hydrogen 3.126 N/A THR 25.A OG1 LYS 22.A O no hydrogen 3.526 N/A GLY 26.A N LYS 22.A O no hydrogen 2.675 N/A VAL 27.A N THR 25.A OG1 no hydrogen 3.393 N/A ARG 36.A N GLU 33.A O no hydrogen 2.758 N/A ARG 37.A NE GLU 34.A OE1 no hydrogen 2.986 N/A ARG 37.A NH1 LYS 42.A O no hydrogen 3.008 N/A ARG 37.A NH1 ASP 82.A O no hydrogen 3.269 N/A ARG 37.A NH1 ASP 82.A OD1 no hydrogen 3.461 N/A ARG 37.A NH2 GLU 34.A OE1 no hydrogen 3.376 N/A ARG 37.A NH2 GLU 34.A OE2 no hydrogen 3.028 N/A ARG 37.A NH2 ASP 82.A OD1 no hydrogen 3.490 N/A GLY 38.A N ILE 43.A O no hydrogen 2.991 N/A THR 40.A OG1 THR 341.A O no hydrogen 2.504 N/A ILE 41.A N THR 40.A OG1 no hydrogen 2.789 N/A GLY 44.A N ASP 82.A O no hydrogen 2.784 N/A ALA 46.A N PHE 80.A O no hydrogen 2.888 N/A ALA 48.A N VAL 78.A O no hydrogen 2.894 N/A ILE 50.A N ARG 76.A O no hydrogen 2.667 N/A ARG 51.A N SER 60.A O no hydrogen 2.817 N/A ARG 51.A NE THR 72.A O no hydrogen 3.402 N/A ARG 51.A NE THR 72.A OG1 no hydrogen 2.713 N/A ARG 51.A NH2 THR 72.A O no hydrogen 2.842 N/A ARG 52.A N GLU 73.A O no hydrogen 2.850 N/A CYS 53.A N ARG 58.A O no hydrogen 3.053 N/A GLY 57.A N CYS 53.A O no hydrogen 2.793 N/A ARG 58.A NE ASP 177.A OD2 no hydrogen 2.848 N/A ARG 58.A NH2 ASP 177.A OD2 no hydrogen 3.112 N/A SER 60.A N ARG 51.A O no hydrogen 3.059 N/A SER 60.A OG SER 62.A O no hydrogen 3.565 N/A THR 61.A OG1 LEU 24.A O no hydrogen 2.691 N/A SER 62.A OG VAL 64.A O no hydrogen 3.161 N/A VAL 64.A N SER 62.A OG no hydrogen 3.215 N/A CYS 65.A N HIS 70.A O no hydrogen 2.756 N/A CYS 68.A SG ASN 55.A OD1 no hydrogen 3.506 N/A CYS 68.A SG HIS 70.A ND1 no hydrogen 3.748 N/A GLY 69.A N CYS 65.A O no hydrogen 2.922 N/A THR 72.A N PRO 63.A O no hydrogen 2.955 N/A THR 72.A OG1 SER 62.A O no hydrogen 2.687 N/A GLU 73.A N ARG 52.A O no hydrogen 2.791 N/A VAL 75.A N ILE 50.A O no hydrogen 2.960 N/A ARG 76.A N ILE 50.A O no hydrogen 3.132 N/A ARG 76.A NE GLU 184.A OE2 no hydrogen 2.855 N/A ARG 76.A NH1 ILE 187.A O no hydrogen 2.947 N/A ARG 76.A NH1 THR 189.A OG1 no hydrogen 3.041 N/A ARG 76.A NH2 ILE 183.A O no hydrogen 3.193 N/A ARG 76.A NH2 GLU 184.A OE2 no hydrogen 3.033 N/A ARG 76.A NH2 ILE 187.A O no hydrogen 2.920 N/A ARG 77.A NE ASP 47.A OD2 no hydrogen 2.820 N/A ARG 77.A NH1 GLU 49.A OE2 no hydrogen 2.970 N/A ARG 77.A NH2 ASP 47.A OD2 no hydrogen 3.242 N/A VAL 78.A N ALA 48.A O no hydrogen 2.879 N/A SER 79.A N VAL 6.A O no hydrogen 2.940 N/A SER 79.A OG ASP 47.A OD1 no hydrogen 2.854 N/A PHE 80.A N ALA 46.A O no hydrogen 2.885 N/A ILE 81.A N ILE 8.A O no hydrogen 2.948 N/A ASP 82.A N GLY 44.A O no hydrogen 3.037 N/A HIS 86.A ND1 HIS 118.A NE2 no hydrogen 3.045 N/A HIS 86.A NE2 GLU 117.A OE1 no hydrogen 2.542 N/A LEU 89.A N GLY 85.A O no hydrogen 3.106 N/A THR 90.A OG1 GLU 87.A O no hydrogen 2.924 N/A THR 91.A N ALA 88.A O no hydrogen 2.889 N/A THR 91.A OG1 ALA 88.A O no hydrogen 2.929 N/A ALA 93.A N THR 90.A O no hydrogen 2.906 N/A GLY 94.A N THR 91.A O no hydrogen 2.750 N/A LEU 97.A N GLY 94.A O no hydrogen 2.898 N/A ALA 100.A N ASN 128.A O no hydrogen 3.018 N/A ILE 101.A N GLY 9.A O no hydrogen 2.821 N/A LEU 102.A N ILE 130.A O no hydrogen 2.793 N/A VAL 103.A N VAL 10.A O no hydrogen 2.833 N/A ILE 104.A N ALA 132.A O no hydrogen 2.923 N/A ALA 105.A N HIS 15.A ND1 no hydrogen 3.249 N/A ALA 106.A N ASN 134.A O no hydrogen 3.010 N/A ASN 107.A ND2 ASN 107.A O no hydrogen 2.632 N/A GLU 108.A N ALA 105.A O no hydrogen 3.220 N/A ARG 112.A NE GLN 114.A OE1 no hydrogen 2.800 N/A ARG 112.A NH1 ASP 14.A OD1 no hydrogen 3.557 N/A ARG 112.A NH1 HIS 15.A NE2 no hydrogen 3.178 N/A ARG 116.A N ARG 112.A O no hydrogen 3.048 N/A ARG 116.A NE PRO 111.A O no hydrogen 3.429 N/A GLU 117.A N PRO 113.A O no hydrogen 3.121 N/A HIS 118.A N GLN 114.A O no hydrogen 2.828 N/A LEU 119.A N THR 115.A O no hydrogen 3.150 N/A LEU 121.A N HIS 118.A O no hydrogen 3.144 N/A GLN 122.A N LEU 119.A O no hydrogen 2.972 N/A ILE 124.A N ALA 120.A O no hydrogen 3.064 N/A GLY 125.A N GLN 122.A O no hydrogen 3.126 N/A GLN 126.A N LEU 121.A O no hydrogen 3.052 N/A ASN 128.A N GLN 126.A OE1 no hydrogen 2.874 N/A ASN 128.A ND2 ASP 98.A O no hydrogen 2.941 N/A ASN 128.A ND2 GLN 126.A OE1 no hydrogen 3.321 N/A ILE 129.A N LYS 127.A O no hydrogen 2.753 N/A ILE 130.A N ALA 100.A O no hydrogen 2.984 N/A ILE 131.A N PRO 164.A O no hydrogen 2.870 N/A ALA 132.A N LEU 102.A O no hydrogen 2.841 N/A GLN 133.A N ILE 166.A O no hydrogen 2.891 N/A ASN 134.A N ILE 104.A O no hydrogen 2.960 N/A ASN 134.A ND2 ILE 168.A O no hydrogen 3.390 N/A LYS 135.A NZ ASP 14.A O no hydrogen 3.206 N/A ILE 136.A N ILE 168.A O no hydrogen 3.320 N/A LEU 138.A N LYS 135.A O no hydrogen 3.168 N/A LYS 143.A N ASP 140.A OD2 no hydrogen 3.235 N/A ALA 144.A N ASP 140.A O no hydrogen 3.126 N/A LEU 145.A N LYS 141.A O no hydrogen 3.348 N/A GLU 146.A N GLU 142.A O no hydrogen 3.078 N/A ASN 147.A N LYS 143.A O no hydrogen 2.961 N/A ASN 147.A ND2 GLN 133.A OE1 no hydrogen 2.810 N/A TYR 148.A N ALA 144.A O no hydrogen 3.065 N/A ARG 149.A N LEU 145.A O no hydrogen 3.139 N/A GLN 150.A N GLU 146.A O no hydrogen 3.090 N/A GLN 150.A NE2 PRO 109.A O no hydrogen 2.410 N/A ILE 151.A N ASN 147.A O no hydrogen 2.977 N/A LYS 152.A N TYR 148.A O no hydrogen 3.023 N/A GLU 153.A N ARG 149.A O no hydrogen 3.076 N/A PHE 154.A N GLN 150.A O no hydrogen 2.855 N/A ILE 155.A N ILE 151.A O no hydrogen 2.965 N/A GLY 157.A N GLU 161.A OE2 no hydrogen 3.036 N/A THR 158.A N ILE 155.A O no hydrogen 3.074 N/A THR 158.A OG1 ILE 155.A O no hydrogen 2.672 N/A VAL 159.A N GLN 122.A OE1 no hydrogen 2.811 N/A ALA 160.A N THR 158.A OG1 no hydrogen 3.115 N/A GLU 161.A N THR 158.A O no hydrogen 3.022 N/A ALA 163.A N ALA 160.A O no hydrogen 2.924 N/A ILE 166.A N ILE 131.A O no hydrogen 2.809 N/A ILE 168.A N GLN 133.A O no hydrogen 2.910 N/A SER 169.A N ALA 174.A O no hydrogen 3.243 N/A SER 169.A OG GLU 137.A OE1 no hydrogen 2.555 N/A HIS 172.A N SER 169.A OG no hydrogen 3.238 N/A GLY 173.A N SER 169.A O no hydrogen 2.650 N/A ALA 174.A N SER 169.A O no hydrogen 3.064 N/A LEU 179.A N ASN 175.A O no hydrogen 3.096 N/A VAL 180.A N ILE 176.A O no hydrogen 2.869 N/A LYS 181.A N ASP 177.A O no hydrogen 3.062 N/A ALA 182.A N VAL 178.A O no hydrogen 2.988 N/A ILE 183.A N LEU 179.A O no hydrogen 2.947 N/A GLU 184.A N VAL 180.A O no hydrogen 3.222 N/A ASP 185.A N LYS 181.A O no hydrogen 2.891 N/A PHE 186.A N ALA 182.A O no hydrogen 2.669 N/A ILE 187.A N ILE 183.A O no hydrogen 3.039 N/A THR 189.A OG1 GLU 5.A OE1 no hydrogen 2.575 N/A ARG 192.A N PRO 190.A O no hydrogen 2.907 N/A ARG 192.A NH1 GLU 5.A O no hydrogen 2.942 N/A ARG 192.A NH2 GLU 5.A O no hydrogen 2.891 N/A ARG 192.A NH2 ASP 98.A OD1 no hydrogen 3.262 N/A ASN 195.A N ASP 193.A OD1 no hydrogen 2.972 N/A LYS 196.A N ASP 193.A O no hydrogen 3.290 N/A LYS 199.A N GLN 223.A O no hydrogen 3.092 N/A VAL 201.A N ASN 292.A O no hydrogen 2.947 N/A LEU 202.A N GLY 218.A O no hydrogen 2.716 N/A ARG 203.A N GLY 218.A O no hydrogen 2.929 N/A ARG 203.A NE ASP 288.A OD1 no hydrogen 2.665 N/A ARG 203.A NE ASP 288.A OD2 no hydrogen 3.199 N/A ARG 203.A NH1 LEU 35.A O no hydrogen 3.118 N/A ARG 203.A NH1 ARG 37.A O no hydrogen 2.800 N/A ARG 203.A NH2 ASP 288.A OD2 no hydrogen 3.199 N/A SER 204.A N ASP 288.A OD1 no hydrogen 3.023 N/A SER 204.A OG THR 285.A O no hydrogen 2.666 N/A PHE 205.A N VAL 216.A O no hydrogen 2.916 N/A ASN 208.A N ASP 206.A OD1 no hydrogen 2.794 N/A ASN 208.A ND2 VAL 213.A O no hydrogen 2.895 N/A VAL 213.A N ASN 208.A OD1 no hydrogen 2.629 N/A GLY 215.A N LEU 280.A O no hydrogen 2.767 N/A VAL 216.A N PHE 205.A O no hydrogen 3.130 N/A LEU 217.A N VAL 276.A O no hydrogen 2.908 N/A GLY 218.A N ARG 203.A O no hydrogen 2.765 N/A GLY 219.A N VAL 274.A O no hydrogen 3.049 N/A SER 220.A N LEU 200.A O no hydrogen 3.019 N/A VAL 222.A N LYS 199.A O no hydrogen 2.925 N/A GLN 223.A NE2 PRO 197.A O no hydrogen 2.640 N/A LYS 225.A NZ GLU 267.A OE2 no hydrogen 2.774 N/A LEU 226.A N ALA 268.A O no hydrogen 3.052 N/A LYS 227.A N ASP 230.A OD2 no hydrogen 2.650 N/A VAL 228.A N GLU 266.A O no hydrogen 3.029 N/A GLY 229.A N ILE 255.A O no hydrogen 2.781 N/A ASP 230.A N LYS 227.A O no hydrogen 2.944 N/A ILE 232.A N THR 253.A O no hydrogen 2.953 N/A GLU 233.A N GLY 295.A O no hydrogen 2.839 N/A ILE 234.A N ILE 251.A O no hydrogen 2.700 N/A ARG 235.A N VAL 293.A O no hydrogen 3.115 N/A ARG 235.A NE GLU 233.A OE1 no hydrogen 2.911 N/A ARG 235.A NH1 PRO 301.A O no hydrogen 3.018 N/A ARG 235.A NH2 GLU 233.A OE1 no hydrogen 3.318 N/A GLY 237.A N ASN 292.A OD1 no hydrogen 2.948 N/A VAL 238.A N GLU 249.A O no hydrogen 3.038 N/A TYR 240.A N LYS 247.A O no hydrogen 2.867 N/A GLU 242.A N ARG 245.A O no hydrogen 2.730 N/A GLY 244.A N GLU 241.A OE2 no hydrogen 2.846 N/A ARG 245.A N GLU 242.A O no hydrogen 2.963 N/A LYS 247.A N TYR 240.A O no hydrogen 2.810 N/A LYS 247.A NZ GLU 242.A OE1 no hydrogen 2.711 N/A GLU 249.A N VAL 238.A O no hydrogen 2.883 N/A ILE 251.A N ILE 234.A O no hydrogen 3.073 N/A THR 253.A N ILE 232.A O no hydrogen 2.940 N/A GLU 254.A N THR 253.A OG1 no hydrogen 2.633 N/A ILE 255.A N ASP 230.A O no hydrogen 2.981 N/A VAL 256.A N GLY 277.A O no hydrogen 2.657 N/A SER 257.A N GLY 277.A O no hydrogen 3.255 N/A GLN 259.A N GLY 275.A O no hydrogen 2.919 N/A ALA 260.A N GLN 263.A O no hydrogen 2.914 N/A GLN 263.A N ALA 260.A O no hydrogen 3.091 N/A VAL 265.A N LEU 258.A O no hydrogen 2.795 N/A ALA 268.A N LEU 226.A O no hydrogen 2.894 N/A TYR 269.A N GLN 3.A OE1 no hydrogen 2.936 N/A GLY 272.A N ASN 7.A OD1 no hydrogen 2.750 N/A VAL 274.A N GLY 219.A O no hydrogen 2.791 N/A GLY 275.A N GLN 259.A O no hydrogen 2.692 N/A VAL 276.A N LEU 217.A O no hydrogen 2.705 N/A GLY 277.A N SER 257.A O no hydrogen 2.748 N/A THR 278.A N GLY 215.A O no hydrogen 3.073 N/A THR 278.A OG1 GLY 215.A O no hydrogen 2.798 N/A LYS 279.A N THR 253.A OG1 no hydrogen 3.203 N/A LYS 279.A NZ GLU 254.A OE1 no hydrogen 2.519 N/A LEU 280.A N THR 278.A OG1 no hydrogen 3.094 N/A TYR 283.A N ASP 281.A OD2 no hydrogen 3.060 N/A LEU 284.A N ASP 281.A O no hydrogen 2.788 N/A THR 285.A N PRO 282.A O no hydrogen 3.215 N/A THR 285.A OG1 PHE 205.A O no hydrogen 2.841 N/A THR 285.A OG1 PRO 282.A O no hydrogen 3.361 N/A LYS 286.A N PRO 282.A O no hydrogen 2.966 N/A ASP 288.A N SER 204.A O no hydrogen 2.931 N/A GLY 291.A N VAL 201.A O no hydrogen 2.760 N/A VAL 293.A N ARG 235.A O no hydrogen 2.820 N/A GLY 295.A N GLU 233.A O no hydrogen 3.150 N/A GLY 298.A N GLU 233.A OE2 no hydrogen 3.202 N/A LYS 299.A N LYS 296.A O no hydrogen 2.866 N/A TRP 304.A N VAL 363.A O no hydrogen 2.808 N/A TRP 304.A NE1 ALA 365.A O no hydrogen 2.816 N/A LEU 307.A N VAL 357.A O no hydrogen 2.930 N/A ARG 308.A NE GLU 356.A OE1 no hydrogen 3.378 N/A LEU 309.A N ILE 355.A O no hydrogen 2.814 N/A GLU 310.A N ILE 388.A O no hydrogen 3.030 N/A VAL 311.A N ASP 353.A O no hydrogen 2.846 N/A HIS 312.A N TYR 386.A O no hydrogen 2.935 N/A HIS 312.A NE2 GLU 310.A OE1 no hydrogen 2.942 N/A LEU 314.A N ILE 384.A O no hydrogen 2.844 N/A ARG 316.A NE GLU 117.A OE1 no hydrogen 3.452 N/A ARG 316.A NE GLU 117.A OE2 no hydrogen 3.012 N/A ARG 316.A NH1 GLU 87.A OE1 no hydrogen 3.312 N/A ARG 316.A NH1 GLU 87.A OE2 no hydrogen 3.178 N/A ARG 316.A NH1 LEU 383.A O no hydrogen 3.067 N/A ARG 316.A NH2 GLU 87.A OE1 no hydrogen 2.904 N/A ARG 316.A NH2 GLU 117.A OE1 no hydrogen 2.800 N/A VAL 317.A N GLU 117.A OE2 no hydrogen 2.964 N/A VAL 318.A N GLU 117.A OE2 no hydrogen 3.199 N/A THR 320.A N GLU 323.A OE2 no hydrogen 2.824 N/A LYS 325.A N GLN 322.A O no hydrogen 2.766 N/A LYS 330.A N GLU 333.A OE1 no hydrogen 2.741 N/A LYS 332.A N VAL 347.A O no hydrogen 2.790 N/A GLU 333.A N LYS 330.A O no hydrogen 3.224 N/A LEU 335.A N GLY 345.A O no hydrogen 2.697 N/A LEU 336.A N SER 374.A O no hydrogen 2.961 N/A LEU 337.A N THR 344.A O no hydrogen 2.847 N/A ASN 338.A N ALA 372.A O no hydrogen 3.140 N/A VAL 339.A N ALA 342.A O no hydrogen 2.988 N/A GLY 340.A N ALA 93.A O no hydrogen 2.960 N/A THR 341.A OG1 VAL 201.A O no hydrogen 2.798 N/A ALA 342.A N VAL 339.A O no hydrogen 2.905 N/A THR 344.A N LEU 337.A O no hydrogen 2.949 N/A THR 344.A OG1 ILE 361.A O no hydrogen 3.439 N/A LEU 346.A N LYS 358.A O no hydrogen 2.904 N/A VAL 347.A N GLU 333.A O no hydrogen 2.885 N/A THR 348.A N GLU 356.A O no hydrogen 2.802 N/A THR 348.A OG1 GLU 356.A O no hydrogen 3.348 N/A GLY 349.A N GLU 356.A O no hydrogen 3.357 N/A GLY 351.A N GLU 354.A O no hydrogen 2.838 N/A GLU 354.A N GLY 351.A O no hydrogen 3.381 N/A ILE 355.A N LEU 309.A O no hydrogen 2.974 N/A GLU 356.A N GLY 349.A O no hydrogen 2.829 N/A VAL 357.A N LEU 307.A O no hydrogen 2.855 N/A LYS 358.A N LEU 346.A O no hydrogen 2.816 N/A LEU 359.A N ASP 305.A O no hydrogen 2.958 N/A ILE 361.A N THR 344.A OG1 no hydrogen 2.915 N/A VAL 363.A N TRP 304.A O no hydrogen 3.143 N/A CYS 364.A SG PRO 301.A O no hydrogen 3.198 N/A CYS 364.A SG PRO 302.A O no hydrogen 3.897 N/A ALA 365.A N PRO 302.A O no hydrogen 3.113 N/A GLU 366.A N ASP 369.A OD2 no hydrogen 2.827 N/A GLY 368.A N ILE 389.A O no hydrogen 2.781 N/A ASP 369.A N GLU 366.A O no hydrogen 3.031 N/A VAL 371.A N GLY 387.A O no hydrogen 2.809 N/A ALA 372.A N ASN 338.A O no hydrogen 2.839 N/A ILE 373.A N GLY 385.A O no hydrogen 2.924 N/A SER 374.A N LEU 336.A O no hydrogen 2.851 N/A ARG 375.A N ARG 382.A O no hydrogen 2.866 N/A ARG 375.A NE GLU 333.A OE2 no hydrogen 3.005 N/A ARG 375.A NH1 GLU 327.A O no hydrogen 2.882 N/A ARG 375.A NH2 GLU 327.A O no hydrogen 2.960 N/A ARG 375.A NH2 GLU 333.A OE1 no hydrogen 3.134 N/A ARG 375.A NH2 GLU 333.A OE2 no hydrogen 3.472 N/A ARG 382.A N ARG 375.A O no hydrogen 2.807 N/A ARG 382.A NE GLU 323.A O no hydrogen 3.194 N/A ARG 382.A NH1 VAL 318.A O no hydrogen 3.292 N/A ARG 382.A NH2 VAL 318.A O no hydrogen 2.657 N/A LEU 383.A N GLU 87.A OE2 no hydrogen 3.219 N/A ILE 384.A N ILE 373.A O no hydrogen 2.993 N/A GLY 385.A N ILE 373.A O no hydrogen 3.365 N/A TYR 386.A N HIS 312.A O no hydrogen 3.076 N/A GLY 387.A N VAL 371.A O no hydrogen 2.749 N/A ILE 388.A N GLU 310.A O no hydrogen 2.874 N/A ILE 389.A N ASP 369.A O no hydrogen 2.950 N/A LYS 390.A N ARG 308.A O no hydrogen 2.812 N/A LYS 390.A NZ GLU 354.A OE2 no hydrogen 2.767 N/A