Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r8t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 ASP 77.A OD2 no hydrogen 3.315 N/A ARG 1.A NH2 ASP 107.A OD1 no hydrogen 3.068 N/A LEU 4.A N ARG 1.A O no hydrogen 2.987 N/A ALA 5.A N ARG 2.A O no hydrogen 3.427 N/A PHE 8.A N LEU 4.A O no hydrogen 2.935 N/A SER 9.A N ALA 5.A O no hydrogen 3.140 N/A SER 9.A OG ILE 6.A O no hydrogen 2.701 N/A ARG 10.A N ILE 6.A O no hydrogen 3.062 N/A VAL 11.A N GLU 7.A O no hydrogen 3.182 N/A THR 12.A N PHE 8.A O no hydrogen 3.334 N/A THR 12.A OG1 SER 9.A O no hydrogen 3.222 N/A THR 12.A OG1 SER 276.A OG no hydrogen 2.879 N/A THR 12.A OG1 THR 278.A OG1 no hydrogen 2.662 N/A GLU 13.A N SER 9.A O no hydrogen 2.959 N/A SER 14.A N ARG 10.A O no hydrogen 3.026 N/A ALA 15.A N VAL 11.A O no hydrogen 3.087 N/A ALA 16.A N THR 12.A O no hydrogen 2.821 N/A LEU 17.A N GLU 13.A O no hydrogen 2.938 N/A ALA 18.A N SER 14.A O no hydrogen 3.106 N/A GLY 19.A N ALA 15.A O no hydrogen 2.922 N/A TYR 20.A N ALA 16.A O no hydrogen 2.831 N/A TRP 22.A N GLY 19.A O no hydrogen 3.122 N/A LEU 23.A N TYR 20.A O no hydrogen 3.089 N/A GLY 24.A N THR 92.A O no hydrogen 2.920 N/A ARG 25.A N TRP 22.A O no hydrogen 3.273 N/A GLY 26.A N ALA 93.A O no hydrogen 2.943 N/A THR 30.A N ASP 27.A OD2 no hydrogen 3.122 N/A THR 30.A OG1 ASP 27.A OD1 no hydrogen 2.752 N/A ALA 31.A N ASP 27.A O no hydrogen 3.323 N/A ASP 32.A N LYS 28.A O no hydrogen 3.126 N/A GLY 33.A N ASN 29.A O no hydrogen 2.888 N/A ALA 34.A N THR 30.A O no hydrogen 2.984 N/A ALA 35.A N ALA 31.A O no hydrogen 3.154 N/A VAL 36.A N ASP 32.A O no hydrogen 2.882 N/A ASN 37.A N GLY 33.A O no hydrogen 3.129 N/A ALA 38.A N ALA 34.A O no hydrogen 3.078 N/A MET 39.A N ALA 35.A O no hydrogen 2.819 N/A ARG 40.A N VAL 36.A O no hydrogen 2.898 N/A ARG 40.A NE GLU 69.A OE1 no hydrogen 2.797 N/A ARG 40.A NH1 GLU 69.A OE1 no hydrogen 3.309 N/A ILE 41.A N ASN 37.A O no hydrogen 3.063 N/A MET 42.A N ALA 38.A O no hydrogen 3.070 N/A LEU 43.A N MET 39.A O no hydrogen 2.906 N/A ASN 44.A N ARG 40.A O no hydrogen 2.921 N/A GLN 45.A N MET 42.A O no hydrogen 3.171 N/A VAL 46.A N LEU 43.A O no hydrogen 3.160 N/A ASN 47.A ND2 THR 73.A OG1 no hydrogen 2.481 N/A ILE 48.A N VAL 46.A O no hydrogen 2.965 N/A ASP 49.A N ASP 77.A O no hydrogen 2.766 N/A GLY 50.A N VAL 71.A O no hydrogen 2.817 N/A THR 51.A N VAL 79.A O no hydrogen 3.004 N/A ILE 52.A N GLU 69.A O no hydrogen 2.891 N/A VAL 53.A N ILE 81.A O no hydrogen 2.767 N/A ILE 54.A N ILE 81.A O no hydrogen 3.224 N/A GLU 56.A N LEU 65.A O no hydrogen 2.880 N/A GLU 61.A N GLU 58.A O no hydrogen 2.959 N/A ALA 62.A N GLU 58.A O no hydrogen 2.942 N/A ILE 67.A N GLY 57.A O no hydrogen 2.904 N/A GLY 68.A N ILE 52.A O no hydrogen 2.702 N/A GLU 69.A N TYR 66.A O no hydrogen 3.113 N/A LYS 70.A NZ ASP 49.A OD1 no hydrogen 2.572 N/A VAL 71.A N GLY 50.A O no hydrogen 2.744 N/A GLY 72.A N ASN 44.A OD1 no hydrogen 2.885 N/A THR 73.A N VAL 46.A O no hydrogen 2.902 N/A THR 73.A OG1 VAL 46.A O no hydrogen 3.538 N/A GLY 74.A N ILE 48.A O no hydrogen 2.903 N/A ARG 75.A N THR 73.A OG1 no hydrogen 3.165 N/A VAL 79.A N ASP 49.A O no hydrogen 3.139 N/A ASP 80.A N GLY 106.A O no hydrogen 2.808 N/A ILE 81.A N THR 51.A O no hydrogen 2.815 N/A ALA 82.A N ALA 104.A O no hydrogen 2.932 N/A VAL 83.A N ILE 54.A O no hydrogen 2.872 N/A ASP 84.A N VAL 102.A O no hydrogen 2.761 N/A GLU 87.A N LEU 100.A O no hydrogen 2.696 N/A THR 89.A OG1.A ILE 86.A O no hydrogen 3.496 N/A ARG 90.A NE ASP 185.A OD2 no hydrogen 3.263 N/A ARG 90.A NH1 GLN 96.A OE1 no hydrogen 2.950 N/A ARG 90.A NH2 ASP 185.A OD2 no hydrogen 2.995 N/A THR 92.A N GLY 88.A O no hydrogen 2.934 N/A THR 92.A OG1 GLY 88.A O no hydrogen 2.809 N/A ALA 93.A N THR 89.A O.A no hydrogen 2.992 N/A ALA 93.A N THR 89.A O.B no hydrogen 2.958 N/A MET 94.A N ARG 90.A O no hydrogen 2.899 N/A GLY 95.A N THR 92.A O no hydrogen 3.263 N/A GLN 96.A N MET 91.A O no hydrogen 2.730 N/A ASN 98.A N LYS 282.A O no hydrogen 2.872 N/A ALA 99.A N THR 281.A OG1 no hydrogen 3.080 N/A LEU 100.A N GLU 87.A O no hydrogen 3.039 N/A ALA 101.A N THR 278.A O no hydrogen 2.899 N/A VAL 102.A N ASP 84.A O no hydrogen 2.846 N/A LEU 103.A N SER 276.A O no hydrogen 2.932 N/A ALA 104.A N ALA 82.A O no hydrogen 2.972 N/A VAL 105.A N ILE 274.A O no hydrogen 2.810 N/A GLY 106.A N ASP 80.A O no hydrogen 2.998 N/A GLY 109.A N ASP 80.A OD1 no hydrogen 3.290 N/A CYS 110.A N ASP 107.A O no hydrogen 3.034 N/A LEU 112.A N MET 267.A O no hydrogen 2.987 N/A MET 119.A N GLY 208.A O no hydrogen 2.797 N/A GLU 120.A N ARG 230.A O no hydrogen 2.800 N/A LYS 121.A N GLY 206.A O no hydrogen 2.860 N/A LYS 121.A NZ ASP 187.A OD1 no hydrogen 3.289 N/A LYS 121.A NZ ASP 187.A OD2 no hydrogen 2.851 N/A LYS 121.A NZ GLY 209.A O no hydrogen 2.722 N/A LEU 122.A N ASN 228.A O no hydrogen 2.954 N/A ILE 123.A N LEU 204.A O no hydrogen 2.857 N/A VAL 124.A N ASP 226.A O no hydrogen 3.006 N/A ALA 128.A N GLY 125.A O no hydrogen 3.054 N/A LYS 129.A N PRO 126.A O no hydrogen 3.377 N/A LYS 129.A NZ ASP 224.A OD1 no hydrogen 2.780 N/A LYS 129.A NZ GLY 225.A O no hydrogen 3.153 N/A GLY 130.A N ASP 226.A OD2 no hydrogen 2.917 N/A THR 131.A N ALA 128.A O no hydrogen 3.246 N/A THR 131.A OG1 ALA 128.A O no hydrogen 2.710 N/A ASP 133.A N ASN 141.A OD1 no hydrogen 2.925 N/A LEU 134.A N ASN 228.A OD1 no hydrogen 2.855 N/A ASN 135.A N ASP 133.A OD1 no hydrogen 2.814 N/A LEU 136.A N ASP 133.A O no hydrogen 3.150 N/A ASN 141.A N PRO 137.A O no hydrogen 3.067 N/A ASN 141.A ND2 ASP 133.A O no hydrogen 2.871 N/A LEU 142.A N LEU 138.A O no hydrogen 2.857 N/A ARG 143.A N ALA 139.A O no hydrogen 3.033 N/A ASN 144.A N ASP 140.A O no hydrogen 2.996 N/A VAL 145.A N ASN 141.A O no hydrogen 2.827 N/A ALA 146.A N LEU 142.A O no hydrogen 2.856 N/A ALA 147.A N ARG 143.A O no hydrogen 2.912 N/A ALA 148.A N ASN 144.A O no hydrogen 2.926 N/A LEU 149.A N VAL 145.A O no hydrogen 2.729 N/A GLY 150.A N ALA 146.A O no hydrogen 2.728 N/A GLY 150.A N ALA 147.A O no hydrogen 3.062 N/A LYS 151.A N ALA 146.A O no hydrogen 3.123 N/A LYS 151.A NZ ASP 202.A OD1 no hydrogen 3.091 N/A LYS 151.A NZ ASP 202.A OD2 no hydrogen 3.551 N/A GLU 155.A N.A PRO 152.A O no hydrogen 2.859 N/A GLU 155.A N.B PRO 152.A O no hydrogen 2.900 N/A LEU 156.A N LEU 153.A O no hydrogen 2.763 N/A THR 157.A N ASP 202.A OD2 no hydrogen 2.720 N/A THR 157.A OG1 GLU 155.A O.A no hydrogen 3.563 N/A THR 157.A OG1 GLU 200.A O no hydrogen 3.174 N/A VAL 158.A N ARG 179.A O no hydrogen 2.830 N/A THR 159.A N VAL 203.A O no hydrogen 2.889 N/A THR 159.A OG1 PHE 181.A O no hydrogen 2.819 N/A ILE 160.A N PHE 181.A O no hydrogen 3.024 N/A ALA 162.A N ILE 183.A O no hydrogen 2.649 N/A LYS 163.A NZ ASP 185.A OD1 no hydrogen 3.224 N/A ARG 165.A NE ILE 207.A O no hydrogen 2.915 N/A ARG 165.A NH1 ILE 207.A O no hydrogen 2.738 N/A HIS 166.A N LYS 163.A O no hydrogen 2.807 N/A HIS 166.A ND1 LEU 161.A O no hydrogen 2.879 N/A ASP 167.A N PRO 164.A O no hydrogen 3.248 N/A ILE 170.A N HIS 166.A O no hydrogen 2.894 N/A ALA 171.A N ASP 167.A O no hydrogen 3.053 N/A GLU 172.A N ALA 168.A O no hydrogen 3.144 N/A MET 173.A N VAL 169.A O no hydrogen 3.194 N/A GLN 174.A N ILE 170.A O no hydrogen 2.953 N/A GLN 175.A N ALA 171.A O no hydrogen 2.800 N/A LEU 176.A N GLU 172.A O no hydrogen 3.053 N/A GLY 177.A N GLN 174.A O no hydrogen 2.657 N/A VAL 178.A N MET 173.A O no hydrogen 3.014 N/A ARG 179.A N LEU 156.A O no hydrogen 2.945 N/A ARG 179.A NH1 THR 157.A OG1 no hydrogen 2.861 N/A ARG 179.A NH1 GLU 200.A OE1 no hydrogen 3.085 N/A ARG 179.A NH2 GLU 200.A OE1 no hydrogen 2.866 N/A PHE 181.A N VAL 158.A O no hydrogen 2.739 N/A ILE 183.A N ILE 160.A O no hydrogen 2.887 N/A VAL 188.A N GLU 87.A OE2 no hydrogen 3.452 N/A ALA 190.A N GLY 186.A O no hydrogen 3.227 N/A SER 191.A N ASP 187.A O no hydrogen 3.033 N/A SER 191.A N VAL 188.A O no hydrogen 3.249 N/A SER 191.A OG ASP 187.A O no hydrogen 3.240 N/A SER 191.A OG VAL 188.A O no hydrogen 2.711 N/A SER 191.A OG SER 216.A OG no hydrogen 2.916 N/A ILE 192.A N ALA 189.A O no hydrogen 3.190 N/A LEU 193.A N ALA 190.A O no hydrogen 3.091 N/A THR 194.A N SER 191.A O no hydrogen 3.288 N/A THR 194.A OG1 SER 191.A O no hydrogen 2.823 N/A CYS 195.A N ILE 192.A O no hydrogen 2.890 N/A CYS 195.A SG THR 194.A OG1 no hydrogen 3.666 N/A MET 196.A N LEU 193.A O no hydrogen 2.889 N/A SER 199.A N MET 196.A O no hydrogen 2.956 N/A VAL 201.A N SER 199.A OG no hydrogen 3.385 N/A ASP 202.A N THR 157.A O no hydrogen 2.874 N/A VAL 203.A N THR 157.A O no hydrogen 3.157 N/A LEU 204.A N ILE 123.A O no hydrogen 2.867 N/A TYR 205.A N THR 159.A O no hydrogen 3.151 N/A TYR 205.A OH GLU 120.A OE2 no hydrogen 2.475 N/A GLY 206.A N LYS 121.A O no hydrogen 3.000 N/A ILE 207.A N HIS 166.A NE2 no hydrogen 2.813 N/A GLY 208.A N MET 119.A O no hydrogen 3.096 N/A ALA 210.A N MET 117.A O no hydrogen 2.698 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.950 N/A GLY 213.A N GLY 209.A O no hydrogen 3.099 N/A VAL 214.A N ALA 210.A O no hydrogen 3.102 N/A VAL 215.A N PRO 211.A O no hydrogen 2.964 N/A SER 216.A N GLU 212.A O no hydrogen 2.756 N/A SER 216.A OG SER 191.A OG no hydrogen 2.916 N/A SER 216.A OG GLU 212.A O no hydrogen 3.194 N/A ALA 217.A N GLY 213.A O no hydrogen 2.661 N/A ALA 218.A N VAL 214.A O no hydrogen 3.030 N/A VAL 219.A N VAL 215.A O no hydrogen 3.092 N/A ILE 220.A N SER 216.A O no hydrogen 2.722 N/A ARG 221.A N ALA 217.A O no hydrogen 2.841 N/A ARG 221.A NE ASP 271.A OD1 no hydrogen 2.806 N/A ARG 221.A NH1 ALA 268.A O no hydrogen 2.768 N/A ARG 221.A NH2 ASP 271.A OD1 no hydrogen 3.495 N/A ALA 222.A N ALA 218.A O no hydrogen 3.001 N/A LEU 223.A N VAL 219.A O no hydrogen 2.826 N/A ASP 224.A N ARG 221.A O no hydrogen 2.938 N/A GLY 225.A N ILE 220.A O no hydrogen 2.994 N/A ASP 226.A N VAL 124.A O no hydrogen 2.994 N/A MET 227.A N ASP 226.A OD1 no hydrogen 2.961 N/A ASN 228.A N LEU 122.A O no hydrogen 2.939 N/A ASN 228.A ND2 MET 227.A O no hydrogen 2.844 N/A GLY 229.A N LEU 262.A O no hydrogen 3.030 N/A ARG 230.A NE GLU 120.A OE1 no hydrogen 2.956 N/A ARG 230.A NH2 GLY 259.A O no hydrogen 2.770 N/A LEU 232.A N TYR 118.A O no hydrogen 3.090 N/A ARG 234.A N GLU 247.A OE1 no hydrogen 3.058 N/A ASP 236.A N ALA 233.A O no hydrogen 2.876 N/A VAL 237.A N ARG 234.A O no hydrogen 2.828 N/A LYS 238.A N ARG 234.A O no hydrogen 2.834 N/A LYS 238.A NZ TYR 118.A OH no hydrogen 3.266 N/A GLY 244.A N ASN 240.A O no hydrogen 2.622 N/A GLU 245.A N ARG 241.A O no hydrogen 3.155 N/A GLU 245.A N ARG 242.A O no hydrogen 3.276 N/A GLU 247.A N ILE 243.A O no hydrogen 3.142 N/A LEU 248.A N GLY 244.A O no hydrogen 3.311 N/A ALA 249.A N GLU 245.A O no hydrogen 2.925 N/A ARG 250.A N GLN 246.A O no hydrogen 2.648 N/A CYS 251.A N GLU 247.A O no hydrogen 2.937 N/A CYS 251.A SG GLU 247.A O no hydrogen 3.515 N/A LYS 252.A N LEU 248.A O no hydrogen 3.049 N/A ALA 253.A N ALA 249.A O no hydrogen 3.219 N/A MET 254.A N CYS 251.A O no hydrogen 3.015 N/A ILE 256.A N CYS 251.A O no hydrogen 2.735 N/A GLY 259.A N LEU 231.A O no hydrogen 3.038 N/A LEU 262.A N GLY 229.A O no hydrogen 2.725 N/A ARG 263.A N ASP 266.A OD2 no hydrogen 2.779 N/A ARG 263.A NH1 ASP 133.A OD1 no hydrogen 2.877 N/A ARG 263.A NH2 ASP 133.A OD1 no hydrogen 3.390 N/A ASP 266.A N ARG 263.A O no hydrogen 2.986 N/A MET 267.A N LEU 264.A O no hydrogen 3.007 N/A ALA 268.A N LEU 264.A O no hydrogen 3.085 N/A ARG 269.A N CYS 110.A O no hydrogen 2.803 N/A ARG 269.A NH2 GLY 109.A O no hydrogen 2.767 N/A SER 270.A OG ASP 107.A OD2 no hydrogen 2.879 N/A ASN 272.A N SER 270.A OG no hydrogen 3.248 N/A VAL 273.A N ASP 271.A O no hydrogen 2.876 N/A ILE 274.A N VAL 105.A O no hydrogen 2.874 N/A PHE 275.A N ILE 303.A O no hydrogen 2.660 N/A SER 276.A N LEU 103.A O no hydrogen 2.894 N/A SER 276.A OG THR 12.A OG1 no hydrogen 2.879 N/A ALA 277.A N LEU 301.A O no hydrogen 2.984 N/A THR 278.A N ALA 101.A O no hydrogen 2.993 N/A THR 278.A OG1 THR 12.A OG1 no hydrogen 2.662 N/A THR 278.A OG1 THR 300.A OG1 no hydrogen 2.908 N/A GLY 279.A N GLU 299.A O no hydrogen 3.168 N/A ILE 280.A N ALA 99.A O no hydrogen 2.810 N/A THR 281.A N ALA 99.A O no hydrogen 3.275 N/A THR 281.A OG1 GLN 96.A O no hydrogen 2.542 N/A GLY 283.A N LEU 286.A O no hydrogen 2.954 N/A GLU 287.A N.A GLU 299.A OE1 no hydrogen 2.749 N/A GLU 287.A N.B GLU 299.A OE1 no hydrogen 2.719 N/A GLY 288.A N GLU 287.A OE1.A no hydrogen 2.929 N/A ILE 289.A N ILE 280.A O no hydrogen 2.902 N/A SER 290.A N THR 297.A O no hydrogen 3.404 N/A SER 290.A OG THR 297.A OG1 no hydrogen 2.949 N/A ARG 291.A NE GLY 293.A O no hydrogen 2.854 N/A ALA 296.A N HIS 317.A O no hydrogen 2.797 N/A THR 297.A N SER 290.A O no hydrogen 2.853 N/A THR 297.A OG1 SER 290.A OG no hydrogen 2.949 N/A THR 298.A N SER 315.A O no hydrogen 3.049 N/A THR 298.A OG1 GLU 13.A OE1 no hydrogen 3.491 N/A THR 298.A OG1 HIS 317.A NE2 no hydrogen 2.753 N/A THR 300.A N ILE 313.A O no hydrogen 2.952 N/A THR 300.A OG1 GLU 13.A OE1 no hydrogen 3.503 N/A THR 300.A OG1 THR 278.A OG1 no hydrogen 2.908 N/A LEU 301.A N ALA 277.A O no hydrogen 2.832 N/A LEU 302.A N ARG 311.A O no hydrogen 2.788 N/A ILE 303.A N PHE 275.A O no hydrogen 2.904 N/A GLY 305.A N VAL 273.A O no hydrogen 2.792 N/A SER 307.A N ARG 304.A O no hydrogen 3.234 N/A ARG 311.A N LEU 302.A O no hydrogen 3.085 N/A ARG 312.A NH1 LEU 285.A O no hydrogen 2.571 N/A ARG 312.A NH1 GLU 299.A OE2 no hydrogen 3.553 N/A ARG 312.A NH2 LEU 285.A O no hydrogen 3.093 N/A ILE 313.A N THR 300.A O no hydrogen 2.678 N/A GLN 314.A NE2 GLU 299.A OE2 no hydrogen 2.899 N/A SER 315.A N THR 298.A O no hydrogen 2.870 N/A SER 315.A OG GLU 13.A OE1 no hydrogen 2.849 N/A HIS 317.A N ALA 296.A O no hydrogen 2.693 N/A HIS 317.A NE2 THR 298.A OG1 no hydrogen 2.753 N/A LEU 319.A N ASN 294.A O no hydrogen 2.725 N/A