Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hkd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N VAL 15.A O no hydrogen 2.790 N/A VAL 5.A N VAL 13.A O no hydrogen 2.788 N/A LEU 7.A N MET 11.A O no hydrogen 2.869 N/A LYS 12.A NZ ASP 6.A OD1 no hydrogen 3.345 N/A VAL 13.A N VAL 5.A O no hydrogen 2.980 N/A LEU 14.A N ILE 28.A O no hydrogen 2.902 N/A VAL 15.A N VAL 3.A O no hydrogen 2.904 N/A SER 16.A N ASP 26.A O no hydrogen 2.920 N/A SER 16.A OG SER 18.A O no hydrogen 2.759 N/A LYS 17.A N ASN 1.A O no hydrogen 2.601 N/A SER 19.A OG LYS 24.A O no hydrogen 3.401 N/A ASN 20.A ND2 ASP 22.A O no hydrogen 3.282 N/A LYS 24.A N ALA 21.A O no hydrogen 2.511 N/A TYR 25.A N SER 40.A O no hydrogen 2.799 N/A ASP 26.A N SER 16.A OG no hydrogen 2.966 N/A LEU 27.A N GLY 38.A O no hydrogen 2.884 N/A ILE 28.A N LEU 14.A O no hydrogen 3.088 N/A ALA 29.A N LEU 36.A O no hydrogen 3.013 N/A VAL 31.A N LEU 34.A O no hydrogen 2.996 N/A LEU 34.A N VAL 31.A O no hydrogen 2.965 N/A LEU 36.A N ALA 29.A O no hydrogen 2.700 N/A SER 37.A N GLU 50.A O no hydrogen 3.025 N/A GLY 38.A N LEU 27.A O no hydrogen 2.924 N/A SER 40.A N TYR 25.A O no hydrogen 2.950 N/A SER 40.A OG.A LYS 42.A O no hydrogen 2.654 N/A SER 40.A OG.A SER 46.A O no hydrogen 3.333 N/A SER 40.A OG.B LYS 42.A O no hydrogen 3.387 N/A SER 40.A OG.B SER 46.A O no hydrogen 3.215 N/A LYS 42.A N SER 40.A OG.B no hydrogen 2.980 N/A ASN 44.A ND2 ASP 65.A O no hydrogen 2.937 N/A SER 46.A N ASN 44.A OD1 no hydrogen 3.165 N/A SER 46.A OG ASN 44.A OD1 no hydrogen 2.929 N/A GLY 47.A N ILE 63.A O no hydrogen 3.105 N/A LEU 49.A N LEU 61.A O no hydrogen 2.877 N/A GLU 50.A N SER 37.A O no hydrogen 2.895 N/A GLY 51.A N VAL 59.A O no hydrogen 2.879 N/A LYS 53.A N SER 57.A O no hydrogen 2.871 N/A ALA 56.A N LYS 53.A O no hydrogen 2.929 N/A SER 57.A N ASP 55.A OD1 no hydrogen 2.987 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.632 N/A SER 57.A OG ASP 55.A OD2 no hydrogen 3.364 N/A LYS 58.A N PHE 75.A O no hydrogen 3.028 N/A VAL 59.A N GLY 51.A O no hydrogen 2.902 N/A LYS 60.A N GLU 73.A O no hydrogen 2.839 N/A LEU 61.A N LEU 49.A O no hydrogen 2.797 N/A THR 62.A N THR 71.A O no hydrogen 2.766 N/A ILE 63.A N GLY 47.A O no hydrogen 2.889 N/A SER 64.A N GLN 69.A O no hydrogen 3.004 N/A SER 64.A OG ASP 66.A OD1 no hydrogen 3.201 N/A SER 64.A OG GLN 69.A O no hydrogen 3.434 N/A LEU 67.A N SER 64.A O no hydrogen 2.842 N/A GLY 68.A N ASP 66.A OD1 no hydrogen 3.295 N/A GLN 69.A N SER 64.A OG no hydrogen 2.990 N/A THR 70.A N THR 88.A O no hydrogen 2.857 N/A THR 70.A OG1 PRO 8.A O no hydrogen 2.794 N/A THR 71.A N THR 62.A O no hydrogen 2.876 N/A LEU 72.A N LYS 86.A O no hydrogen 2.875 N/A GLU 73.A N LYS 60.A O no hydrogen 2.873 N/A VAL 74.A N SER 84.A O no hydrogen 3.067 N/A PHE 75.A N LYS 58.A O no hydrogen 2.835 N/A LYS 76.A N THR 81.A O no hydrogen 2.881 N/A LYS 76.A NZ GLU 101.A O no hydrogen 3.506 N/A LYS 76.A NZ GLU 101.A OE1 no hydrogen 3.410 N/A LYS 76.A NZ GLU 101.A OE2 no hydrogen 3.330 N/A GLY 79.A N LYS 76.A O no hydrogen 2.933 N/A SER 80.A N ASP 78.A OD2 no hydrogen 2.903 N/A THR 81.A N ASP 78.A OD2 no hydrogen 2.847 N/A THR 81.A OG1 ASP 78.A OD1 no hydrogen 2.649 N/A THR 81.A OG1 ASP 78.A OD2 no hydrogen 3.510 N/A VAL 83.A N VAL 74.A O no hydrogen 2.735 N/A SER 84.A N VAL 74.A O no hydrogen 3.251 N/A LYS 85.A N GLU 97.A O no hydrogen 3.020 N/A LYS 86.A N LEU 72.A O no hydrogen 2.887 N/A LYS 86.A NZ.A THR 88.A OG1 no hydrogen 3.021 N/A VAL 87.A N THR 95.A O no hydrogen 2.887 N/A THR 88.A N THR 70.A O no hydrogen 2.868 N/A SER 89.A N SER 93.A O no hydrogen 2.936 N/A LYS 90.A N GLY 68.A O no hydrogen 2.966 N/A LYS 92.A N SER 89.A O no hydrogen 3.010 N/A SER 93.A N ASP 91.A OD1 no hydrogen 2.890 N/A SER 94.A N THR 111.A O no hydrogen 2.953 N/A THR 95.A N VAL 87.A O no hydrogen 2.819 N/A GLU 96.A N LYS 109.A O no hydrogen 2.791 N/A GLU 97.A N LYS 85.A O no hydrogen 2.788 N/A LYS 98.A N GLU 107.A O no hydrogen 2.963 N/A PHE 99.A N VAL 83.A O no hydrogen 3.158 N/A ASN 100.A N GLU 104.A O no hydrogen 2.809 N/A ASN 100.A ND2 GLU 104.A OE2 no hydrogen 3.440 N/A LYS 102.A N ASN 100.A OD1 no hydrogen 3.026 N/A GLY 103.A N ASN 100.A O no hydrogen 2.899 N/A GLU 104.A N ASN 100.A OD1 no hydrogen 2.960 N/A SER 106.A N LYS 98.A O no hydrogen 2.913 N/A GLU 107.A N LYS 98.A O no hydrogen 3.240 N/A LYS 108.A N GLU 120.A O no hydrogen 2.860 N/A LYS 109.A N GLU 96.A O no hydrogen 2.829 N/A ILE 110.A N THR 118.A O no hydrogen 2.823 N/A THR 111.A N SER 94.A O no hydrogen 2.865 N/A ARG 112.A N SER 116.A O no hydrogen 2.751 N/A ARG 112.A NH1 SER 116.A OG no hydrogen 3.063 N/A LYS 115.A N ARG 112.A O no hydrogen 2.865 N/A SER 116.A N ASP 114.A OD2 no hydrogen 2.976 N/A SER 116.A OG ASP 114.A OD2 no hydrogen 2.639 N/A SER 117.A N THR 134.A O no hydrogen 2.916 N/A THR 118.A N ILE 110.A O no hydrogen 2.986 N/A GLU 119.A N LYS 132.A O no hydrogen 2.839 N/A GLU 120.A N LYS 108.A O no hydrogen 2.864 N/A LYS 121.A N GLU 130.A O no hydrogen 3.000 N/A PHE 122.A N SER 106.A O no hydrogen 2.809 N/A ASN 123.A N GLU 127.A O no hydrogen 2.738 N/A ASN 123.A ND2 GLU 127.A OE2 no hydrogen 3.269 N/A GLY 126.A N ASN 123.A O no hydrogen 2.747 N/A GLU 127.A N ASN 123.A OD1 no hydrogen 2.829 N/A SER 129.A N LYS 121.A O no hydrogen 2.891 N/A SER 129.A OG LYS 121.A O no hydrogen 3.260 N/A GLU 130.A N LYS 121.A O no hydrogen 3.502 N/A LYS 131.A N GLU 143.A O no hydrogen 2.889 N/A LYS 132.A N GLU 119.A O no hydrogen 2.872 N/A ILE 133.A N THR 141.A O no hydrogen 2.925 N/A THR 134.A N SER 117.A O no hydrogen 2.869 N/A ARG 135.A N SER 139.A O no hydrogen 2.858 N/A ARG 135.A NH1 SER 139.A OG no hydrogen 3.021 N/A LYS 138.A N ARG 135.A O no hydrogen 2.984 N/A SER 139.A N ASP 137.A OD2 no hydrogen 3.025 N/A SER 139.A OG ASP 137.A OD2 no hydrogen 2.551 N/A SER 140.A N THR 157.A O no hydrogen 2.905 N/A THR 141.A N ILE 133.A O no hydrogen 2.919 N/A GLU 142.A N LYS 155.A O no hydrogen 2.809 N/A GLU 143.A N LYS 131.A O no hydrogen 2.820 N/A LYS 144.A N GLU 153.A O no hydrogen 3.011 N/A PHE 145.A N SER 129.A O no hydrogen 2.899 N/A ASN 146.A N GLU 150.A O no hydrogen 2.903 N/A ASN 146.A ND2 GLU 150.A OE2 no hydrogen 3.544 N/A LYS 148.A N ASN 146.A OD1 no hydrogen 2.834 N/A LYS 148.A NZ GLU 150.A OE2 no hydrogen 2.688 N/A GLY 149.A N ASN 146.A O no hydrogen 2.994 N/A GLU 150.A N ASN 146.A OD1 no hydrogen 3.105 N/A SER 152.A N LYS 144.A O no hydrogen 2.789 N/A GLU 153.A N LYS 144.A O no hydrogen 3.424 N/A LYS 154.A N GLU 166.A O no hydrogen 2.886 N/A LYS 155.A N GLU 142.A O no hydrogen 2.923 N/A ILE 156.A N THR 164.A O no hydrogen 2.966 N/A THR 157.A N SER 140.A O no hydrogen 2.915 N/A ARG 158.A N SER 162.A O no hydrogen 2.864 N/A ARG 158.A NE SER 162.A OG no hydrogen 2.719 N/A ARG 158.A NH2 THR 164.A OG1 no hydrogen 3.037 N/A LYS 161.A N ARG 158.A O no hydrogen 2.976 N/A SER 162.A N ASP 160.A OD1 no hydrogen 3.024 N/A SER 162.A OG ASP 160.A OD1 no hydrogen 2.618 N/A SER 163.A N THR 180.A O no hydrogen 2.925 N/A THR 164.A N ILE 156.A O no hydrogen 2.952 N/A GLU 165.A N ILE 178.A O no hydrogen 2.849 N/A GLU 166.A N LYS 154.A O no hydrogen 2.832 N/A LYS 167.A N GLU 176.A O no hydrogen 2.990 N/A PHE 168.A N SER 152.A O no hydrogen 3.011 N/A ASN 169.A N GLU 173.A O no hydrogen 2.905 N/A ASN 169.A ND2 GLU 173.A OE1 no hydrogen 3.138 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.701 N/A LYS 171.A N ASN 169.A OD1 no hydrogen 2.997 N/A GLY 172.A N ASN 169.A O no hydrogen 2.888 N/A GLU 173.A N ASN 169.A OD1 no hydrogen 3.079 N/A SER 175.A N LYS 167.A O no hydrogen 2.873 N/A SER 175.A OG LYS 167.A O no hydrogen 3.226 N/A GLU 176.A N LYS 167.A O no hydrogen 3.478 N/A LYS 177.A N TYR 189.A O no hydrogen 2.989 N/A ILE 178.A N GLU 165.A O no hydrogen 2.773 N/A ILE 179.A N LEU 187.A O no hydrogen 2.799 N/A THR 180.A N SER 163.A O no hydrogen 2.875 N/A ARG 181.A N THR 185.A O no hydrogen 2.859 N/A ARG 181.A NE THR 185.A OG1 no hydrogen 2.693 N/A GLY 184.A N ARG 181.A O no hydrogen 2.999 N/A THR 185.A N ASP 183.A OD1 no hydrogen 3.025 N/A THR 185.A OG1 ASP 183.A OD1 no hydrogen 2.640 N/A ARG 186.A N VAL 203.A O no hydrogen 3.152 N/A ARG 186.A NE GLU 188.A OE2 no hydrogen 3.125 N/A ARG 186.A NH2 GLU 188.A OE2 no hydrogen 3.270 N/A LEU 187.A N ILE 179.A O no hydrogen 2.773 N/A GLU 188.A N LYS 201.A O no hydrogen 2.813 N/A TYR 189.A N LYS 177.A O no hydrogen 2.856 N/A TYR 189.A OH THR 218.A OG1 no hydrogen 2.662 N/A THR 190.A N LYS 199.A O no hydrogen 3.121 N/A ILE 192.A N SER 175.A O no hydrogen 3.099 N/A LYS 193.A N SER 197.A O no hydrogen 2.678 N/A SER 194.A OG.B GLU 173.A OE1 no hydrogen 3.476 N/A SER 194.A OG.B GLU 173.A OE2 no hydrogen 2.989 N/A GLY 196.A N LYS 193.A O no hydrogen 3.093 N/A SER 197.A N ASP 195.A OD2 no hydrogen 3.135 N/A SER 197.A OG ASP 195.A OD1 no hydrogen 3.275 N/A SER 197.A OG ASP 195.A OD2 no hydrogen 2.606 N/A GLY 198.A N LEU 213.A O no hydrogen 3.003 N/A LYS 199.A N THR 190.A O no hydrogen 3.106 N/A LYS 199.A NZ GLY 211.A O no hydrogen 2.834 N/A ALA 200.A N GLY 211.A O no hydrogen 2.991 N/A LYS 201.A N GLU 188.A O no hydrogen 2.931 N/A LYS 201.A NZ GLU 210.A OE1 no hydrogen 2.618 N/A GLU 202.A N LEU 209.A O no hydrogen 2.788 N/A VAL 203.A N ARG 186.A O no hydrogen 2.818 N/A LEU 204.A N TYR 207.A O no hydrogen 2.949 N/A LEU 209.A N GLU 202.A O no hydrogen 2.929 N/A GLY 211.A N ALA 200.A O no hydrogen 2.899 N/A THR 212.A N THR 219.A O no hydrogen 2.876 N/A LEU 213.A N GLY 198.A O no hydrogen 2.812 N/A THR 214.A N LYS 217.A O no hydrogen 2.997 N/A THR 214.A OG1 GLU 216.A OE2.B no hydrogen 2.800 N/A THR 214.A OG1 LYS 217.A O no hydrogen 3.134 N/A GLU 216.A N THR 214.A OG1 no hydrogen 3.028 N/A LYS 217.A N THR 214.A OG1 no hydrogen 3.068 N/A THR 218.A N ILE 233.A O no hydrogen 2.994 N/A THR 218.A OG1 TYR 189.A OH no hydrogen 2.662 N/A THR 219.A N THR 212.A O no hydrogen 2.882 N/A THR 219.A OG1 ASN 232.A OD1 no hydrogen 2.868 N/A LEU 220.A N LYS 231.A O no hydrogen 2.904 N/A VAL 221.A N GLU 210.A O no hydrogen 2.960 N/A VAL 222.A N LEU 229.A O no hydrogen 2.976 N/A GLU 224.A N VAL 227.A O no hydrogen 2.970 N/A THR 226.A OG1 ASP 245.A OD2 no hydrogen 2.636 N/A VAL 227.A N GLU 224.A O no hydrogen 3.005 N/A THR 228.A N ASN 244.A O no hydrogen 2.814 N/A LEU 229.A N VAL 222.A O no hydrogen 2.790 N/A SER 230.A N GLU 242.A O no hydrogen 2.846 N/A LYS 231.A N LEU 220.A O no hydrogen 2.816 N/A LYS 231.A NZ GLU 202.A OE1 no hydrogen 3.238 N/A LYS 231.A NZ GLU 202.A OE2 no hydrogen 2.687 N/A ASN 232.A N SER 240.A O no hydrogen 2.730 N/A ASN 232.A ND2 GLU 242.A OE1 no hydrogen 2.879 N/A ILE 233.A N THR 218.A O no hydrogen 2.802 N/A SER 234.A N GLU 238.A O no hydrogen 2.915 N/A SER 234.A OG SER 236.A OG no hydrogen 3.063 N/A SER 236.A OG SER 234.A OG no hydrogen 3.063 N/A GLY 237.A N SER 234.A O no hydrogen 2.932 N/A GLU 238.A N SER 234.A OG no hydrogen 3.116 N/A SER 240.A N ASN 232.A O no hydrogen 2.934 N/A GLU 242.A N SER 230.A O no hydrogen 2.922 N/A ASN 244.A N THR 228.A O no hydrogen 3.002 N/A THR 246.A N THR 226.A O no hydrogen 3.160 N/A ASP 247.A N ASP 245.A OD2 no hydrogen 3.056 N/A SER 249.A N ASP 247.A OD2 no hydrogen 3.277 N/A THR 252.A N SER 249.A O no hydrogen 3.055 N/A THR 252.A OG1 ASP 247.A OD1 no hydrogen 2.405 N/A LYS 253.A N SER 249.A O no hydrogen 2.924 N/A LYS 254.A N ASP 245.A OD1 no hydrogen 2.949 N/A LYS 254.A NZ LYS 315.A OXT.A no hydrogen 2.726 N/A LYS 254.A NZ LYS 315.A OXT.B no hydrogen 2.755 N/A THR 255.A N THR 268.A O no hydrogen 2.992 N/A ALA 257.A N THR 266.A O no hydrogen 3.049 N/A ASN 259.A N THR 264.A O no hydrogen 3.024 N/A GLY 261.A N ASN 259.A OD1 no hydrogen 2.845 N/A THR 262.A N ASN 259.A O no hydrogen 3.332 N/A THR 262.A N ASN 259.A OD1 no hydrogen 3.160 N/A THR 262.A OG1 ASN 259.A O no hydrogen 3.431 N/A SER 263.A OG.B PHE 279.A O no hydrogen 2.687 N/A THR 264.A N ASN 259.A O no hydrogen 3.269 N/A THR 264.A OG1 THR 262.A O no hydrogen 2.909 N/A THR 264.A OG1 THR 262.A OG1 no hydrogen 3.243 N/A LEU 265.A N LEU 277.A O no hydrogen 2.806 N/A THR 266.A N ALA 257.A O no hydrogen 2.912 N/A THR 266.A OG1 ASP 276.A OD1 no hydrogen 2.693 N/A ILE 267.A N LYS 275.A O no hydrogen 2.830 N/A THR 268.A N THR 255.A O no hydrogen 2.812 N/A VAL 269.A N LYS 272.A O no hydrogen 2.989 N/A LYS 272.A N VAL 269.A O no hydrogen 3.032 N/A LYS 272.A NZ SER 292.A O no hydrogen 3.358 N/A THR 274.A N ILE 267.A O no hydrogen 2.859 N/A THR 274.A OG1 ILE 267.A O no hydrogen 3.301 N/A ASP 276.A N GLN 288.A O no hydrogen 2.912 N/A LEU 277.A N LEU 265.A O no hydrogen 2.809 N/A VAL 278.A N THR 286.A O no hydrogen 2.921 N/A PHE 279.A N SER 263.A O no hydrogen 2.916 N/A THR 280.A N THR 284.A O no hydrogen 2.958 N/A THR 280.A OG1 THR 284.A O no hydrogen 3.406 N/A THR 280.A OG1 THR 284.A OG1 no hydrogen 2.693 N/A ASN 283.A N THR 280.A O no hydrogen 2.994 N/A ASN 283.A ND2.A ASP 183.A OD2 no hydrogen 2.568 N/A ASN 283.A ND2.B GLU 202.A OE1 no hydrogen 2.892 N/A THR 284.A N THR 280.A OG1 no hydrogen 3.040 N/A THR 284.A OG1 THR 280.A OG1 no hydrogen 2.693 N/A THR 284.A OG1 GLU 303.A OE1.B no hydrogen 2.680 N/A THR 284.A OG1 GLU 303.A OE2.B no hydrogen 3.129 N/A THR 286.A N VAL 278.A O no hydrogen 2.976 N/A VAL 287.A N VAL 302.A O no hydrogen 2.871 N/A GLN 288.A N ASP 276.A O no hydrogen 3.071 N/A TYR 290.A N THR 274.A O no hydrogen 2.966 N/A TYR 290.A OH ASP 276.A OD1 no hydrogen 2.733 N/A TYR 290.A OH ASP 276.A OD2 no hydrogen 3.253 N/A ASP 291.A N SER 296.A O no hydrogen 2.846 N/A ASN 293.A N ASP 291.A OD1 no hydrogen 2.976 N/A GLY 294.A N ASP 291.A O no hydrogen 3.007 N/A GLY 294.A N ASP 291.A OD1 no hydrogen 3.216 N/A GLU 298.A N GLN 289.A O no hydrogen 2.873 N/A VAL 302.A N VAL 287.A O no hydrogen 2.785 N/A GLU 303.A N GLU 303.A OE1.A no hydrogen 2.832 N/A ILE 304.A N ILE 285.A O no hydrogen 2.843 N/A THR 305.A N GLU 309.A OE2 no hydrogen 2.697 N/A THR 305.A OG1 GLU 309.A OE2 no hydrogen 3.492 N/A LYS 306.A N GLU 309.A OE2 no hydrogen 3.192 N/A GLU 309.A N LYS 306.A O no hydrogen 3.051 N/A ILE 310.A N LEU 307.A O no hydrogen 3.037 N/A LYS 311.A N LEU 307.A O no hydrogen 3.221 N/A ASN 312.A N ASP 308.A O no hydrogen 2.862 N/A ALA 313.A N GLU 309.A O no hydrogen 3.127 N/A LEU 314.A N LYS 311.A O no hydrogen 2.946 N/A LYS 315.A N ASN 312.A O no hydrogen 3.246 N/A LYS 315.A NZ.A ASN 312.A OD1.A no hydrogen 3.028 N/A LYS 315.A NZ.A ASN 312.A OD1.B no hydrogen 3.305 N/A LYS 315.A NZ.B GLU 224.A OE1 no hydrogen 2.763 N/A