Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3d1r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ASP 78.A OD2 no hydrogen 3.043 N/A ARG 2.A NH2 ASP 108.A OD1 no hydrogen 2.857 N/A LEU 5.A N ARG 2.A O no hydrogen 2.957 N/A ALA 6.A N ARG 3.A O no hydrogen 3.133 N/A PHE 9.A N LEU 5.A O no hydrogen 2.889 N/A SER 10.A N ALA 6.A O no hydrogen 3.032 N/A SER 10.A OG ILE 7.A O no hydrogen 2.734 N/A ARG 11.A N ILE 7.A O no hydrogen 3.094 N/A VAL 12.A N GLU 8.A O no hydrogen 3.278 N/A THR 13.A N PHE 9.A O no hydrogen 3.332 N/A THR 13.A OG1 SER 10.A O no hydrogen 3.269 N/A THR 13.A OG1 SER 280.A OG no hydrogen 2.825 N/A THR 13.A OG1 THR 282.A OG1 no hydrogen 2.677 N/A GLU 14.A N SER 10.A O no hydrogen 3.034 N/A SER 15.A N ARG 11.A O no hydrogen 2.996 N/A SER 15.A OG.A ARG 11.A O no hydrogen 3.211 N/A ALA 16.A N VAL 12.A O no hydrogen 3.104 N/A ALA 17.A N THR 13.A O no hydrogen 2.901 N/A LEU 18.A N GLU 14.A O no hydrogen 2.983 N/A ALA 19.A N SER 15.A O no hydrogen 2.943 N/A GLY 20.A N ALA 16.A O no hydrogen 2.968 N/A TYR 21.A N ALA 17.A O no hydrogen 2.848 N/A LYS 22.A N LEU 18.A O no hydrogen 3.329 N/A TRP 23.A N GLY 20.A O no hydrogen 2.898 N/A LEU 24.A N TYR 21.A O no hydrogen 2.971 N/A GLY 25.A N THR 93.A O no hydrogen 2.953 N/A ARG 26.A N TRP 23.A O no hydrogen 3.111 N/A ARG 26.A NE LYS 22.A O no hydrogen 3.425 N/A GLY 27.A N ALA 94.A O no hydrogen 2.978 N/A THR 31.A N ASP 28.A OD1 no hydrogen 2.926 N/A THR 31.A OG1 ASP 28.A OD2 no hydrogen 2.623 N/A ALA 32.A N ASP 28.A O no hydrogen 3.184 N/A ASP 33.A N LYS 29.A O no hydrogen 2.981 N/A GLY 34.A N ASN 30.A O.A no hydrogen 2.863 N/A GLY 34.A N ASN 30.A O.B no hydrogen 2.938 N/A ALA 35.A N THR 31.A O no hydrogen 3.001 N/A ALA 36.A N ALA 32.A O no hydrogen 3.101 N/A VAL 37.A N ASP 33.A O no hydrogen 2.777 N/A ASN 38.A N GLY 34.A O no hydrogen 2.967 N/A ALA 39.A N ALA 35.A O no hydrogen 3.020 N/A MET 40.A N ALA 36.A O no hydrogen 2.820 N/A ARG 41.A N VAL 37.A O no hydrogen 2.926 N/A ARG 41.A NE GLU 70.A OE1 no hydrogen 2.610 N/A ARG 41.A NH1 GLU 70.A OE1 no hydrogen 3.175 N/A ILE 42.A N ASN 38.A O no hydrogen 2.979 N/A MET 43.A N ALA 39.A O no hydrogen 3.076 N/A LEU 44.A N MET 40.A O no hydrogen 2.841 N/A ASN 45.A N ARG 41.A O no hydrogen 2.910 N/A GLN 46.A N MET 43.A O no hydrogen 3.001 N/A VAL 47.A N LEU 44.A O no hydrogen 3.090 N/A ASN 48.A ND2 THR 74.A OG1 no hydrogen 2.654 N/A ILE 49.A N VAL 47.A O no hydrogen 2.883 N/A ASP 50.A N ASP 78.A O no hydrogen 2.873 N/A GLY 51.A N VAL 72.A O no hydrogen 2.824 N/A THR 52.A N VAL 80.A O no hydrogen 3.022 N/A ILE 53.A N GLU 70.A O no hydrogen 2.845 N/A VAL 54.A N ILE 82.A O no hydrogen 2.776 N/A ILE 55.A N ILE 82.A O no hydrogen 3.400 N/A GLU 57.A N LEU 66.A O no hydrogen 2.848 N/A GLU 59.A N GLU 62.A OE1 no hydrogen 3.075 N/A GLU 62.A N GLU 59.A O no hydrogen 2.891 N/A ALA 63.A N GLU 59.A O no hydrogen 2.894 N/A ILE 68.A N.A GLY 58.A O no hydrogen 2.792 N/A ILE 68.A N.B GLY 58.A O no hydrogen 2.774 N/A GLY 69.A N ILE 53.A O no hydrogen 2.747 N/A GLU 70.A N TYR 67.A O no hydrogen 3.015 N/A LYS 71.A NZ ASP 50.A OD1 no hydrogen 2.794 N/A VAL 72.A N GLY 51.A O no hydrogen 2.866 N/A GLY 73.A N ASN 45.A OD1 no hydrogen 2.805 N/A THR 74.A N VAL 47.A O no hydrogen 2.917 N/A THR 74.A OG1 VAL 47.A O no hydrogen 3.496 N/A GLY 75.A N ILE 49.A O no hydrogen 2.941 N/A ARG 76.A N THR 74.A OG1 no hydrogen 3.194 N/A VAL 80.A N ASP 50.A O no hydrogen 3.069 N/A ASP 81.A N GLY 107.A O no hydrogen 2.866 N/A ILE 82.A N THR 52.A O no hydrogen 2.887 N/A ALA 83.A N ALA 105.A O no hydrogen 2.867 N/A VAL 84.A N ILE 55.A O no hydrogen 2.982 N/A ASP 85.A N VAL 103.A O no hydrogen 2.901 N/A GLU 88.A N LEU 101.A O no hydrogen 2.681 N/A ARG 91.A NE ASP 186.A OD2 no hydrogen 3.317 N/A ARG 91.A NH1 GLN 97.A OE1 no hydrogen 2.801 N/A ARG 91.A NH2 ASP 186.A OD2 no hydrogen 3.008 N/A THR 93.A N GLY 89.A O no hydrogen 2.805 N/A THR 93.A OG1 GLY 89.A O no hydrogen 2.893 N/A ALA 94.A N THR 90.A O no hydrogen 2.909 N/A MET 95.A N ARG 91.A O no hydrogen 2.860 N/A GLY 96.A N THR 93.A O no hydrogen 3.099 N/A GLN 97.A N MET 92.A O no hydrogen 2.804 N/A ASN 99.A N LYS 286.A O no hydrogen 2.992 N/A ALA 100.A N THR 285.A OG1 no hydrogen 3.036 N/A LEU 101.A N GLU 88.A O no hydrogen 3.119 N/A ALA 102.A N THR 282.A O no hydrogen 2.913 N/A VAL 103.A N ASP 85.A O no hydrogen 2.936 N/A LEU 104.A N SER 280.A O no hydrogen 2.968 N/A ALA 105.A N ALA 83.A O no hydrogen 2.774 N/A VAL 106.A N ILE 278.A O no hydrogen 2.798 N/A GLY 107.A N ASP 81.A O no hydrogen 2.908 N/A GLY 110.A N ASP 81.A OD2 no hydrogen 2.582 N/A CYS 111.A N.A ASP 108.A O no hydrogen 2.987 N/A CYS 111.A N.B ASP 108.A O no hydrogen 2.973 N/A CYS 111.A SG.A ASP 108.A O no hydrogen 3.076 N/A CYS 111.A SG.B SER 274.A O no hydrogen 3.948 N/A LEU 113.A N MET 271.A O no hydrogen 2.904 N/A ASN 114.A ND2.A MET 258.A O no hydrogen 3.471 N/A MET 118.A N PRO 116.A O no hydrogen 2.803 N/A MET 120.A N GLY 209.A O no hydrogen 2.848 N/A GLU 121.A N ARG 231.A O no hydrogen 2.833 N/A LYS 122.A N GLY 207.A O no hydrogen 2.882 N/A LYS 122.A NZ ASP 188.A OD1 no hydrogen 2.720 N/A LYS 122.A NZ ASP 188.A OD2 no hydrogen 3.330 N/A LYS 122.A NZ GLY 210.A O no hydrogen 2.806 N/A LEU 123.A N ASN 229.A O no hydrogen 2.945 N/A ILE 124.A N LEU 205.A O no hydrogen 2.897 N/A VAL 125.A N ASP 227.A O no hydrogen 2.919 N/A ALA 129.A N GLY 126.A O no hydrogen 3.012 N/A LYS 130.A N PRO 127.A O no hydrogen 3.251 N/A LYS 130.A NZ ASP 225.A OD1 no hydrogen 2.756 N/A GLY 131.A N ASP 227.A OD2 no hydrogen 2.930 N/A THR 132.A N ALA 129.A O no hydrogen 3.180 N/A THR 132.A OG1 ALA 129.A O no hydrogen 2.693 N/A ASP 134.A N ASN 142.A OD1 no hydrogen 2.843 N/A LEU 135.A N ASN 229.A OD1 no hydrogen 2.947 N/A ASN 136.A N ASP 134.A OD1 no hydrogen 2.904 N/A LEU 137.A N ASP 134.A O no hydrogen 2.811 N/A ASN 142.A N PRO 138.A O no hydrogen 3.129 N/A ASN 142.A ND2 ASP 134.A O no hydrogen 2.922 N/A ASN 142.A ND2 PRO 138.A O no hydrogen 3.358 N/A LEU 143.A N LEU 139.A O no hydrogen 2.942 N/A ARG 144.A N ALA 140.A O no hydrogen 3.019 N/A ASN 145.A N ASP 141.A O no hydrogen 2.919 N/A VAL 146.A N ASN 142.A O no hydrogen 2.835 N/A ALA 147.A N LEU 143.A O no hydrogen 2.982 N/A ALA 148.A N ARG 144.A O no hydrogen 3.122 N/A ALA 149.A N ASN 145.A O no hydrogen 3.032 N/A LEU 150.A N VAL 146.A O no hydrogen 2.883 N/A GLY 151.A N ALA 148.A O no hydrogen 2.979 N/A LYS 152.A N ALA 147.A O no hydrogen 2.966 N/A LYS 152.A NZ ASP 203.A OD1 no hydrogen 3.135 N/A LYS 152.A NZ ASP 203.A OD2 no hydrogen 2.782 N/A GLU 156.A N PRO 153.A O no hydrogen 2.998 N/A LEU 157.A N LEU 154.A O no hydrogen 2.933 N/A THR 158.A N ASP 203.A OD2 no hydrogen 2.862 N/A THR 158.A OG1 GLU 156.A O no hydrogen 3.538 N/A VAL 159.A N ARG 180.A O no hydrogen 2.836 N/A THR 160.A N VAL 204.A O no hydrogen 2.787 N/A THR 160.A OG1 PHE 182.A O no hydrogen 2.792 N/A ILE 161.A N PHE 182.A O no hydrogen 3.177 N/A ALA 163.A N ILE 184.A O no hydrogen 2.728 N/A LYS 164.A N LEU 162.A O no hydrogen 2.995 N/A LYS 164.A NZ ASP 186.A OD1 no hydrogen 2.964 N/A ARG 166.A NE ILE 208.A O no hydrogen 2.921 N/A ARG 166.A NH2 ILE 208.A O no hydrogen 2.801 N/A HIS 167.A N LYS 164.A O no hydrogen 2.885 N/A HIS 167.A ND1 LEU 162.A O no hydrogen 2.749 N/A ASP 168.A N PRO 165.A O no hydrogen 3.105 N/A ILE 171.A N HIS 167.A O no hydrogen 2.938 N/A ALA 172.A N ASP 168.A O no hydrogen 3.075 N/A GLU 173.A N ALA 169.A O no hydrogen 2.813 N/A MET 174.A N VAL 170.A O no hydrogen 2.909 N/A GLN 175.A N ILE 171.A O no hydrogen 2.929 N/A GLN 176.A N ALA 172.A O no hydrogen 2.933 N/A LEU 177.A N GLU 173.A O no hydrogen 2.965 N/A GLY 178.A N GLN 175.A O no hydrogen 2.831 N/A VAL 179.A N MET 174.A O no hydrogen 3.190 N/A ARG 180.A N LEU 157.A O no hydrogen 2.909 N/A ARG 180.A NH1 GLU 201.A OE1 no hydrogen 3.000 N/A ARG 180.A NH2 THR 158.A OG1 no hydrogen 2.764 N/A ARG 180.A NH2 GLU 201.A OE1 no hydrogen 2.959 N/A PHE 182.A N VAL 159.A O no hydrogen 2.844 N/A ILE 184.A N ILE 161.A O no hydrogen 2.844 N/A ALA 191.A N GLY 187.A O no hydrogen 3.198 N/A SER 192.A N ASP 188.A O no hydrogen 3.027 N/A SER 192.A OG VAL 189.A O no hydrogen 2.555 N/A SER 192.A OG SER 217.A OG no hydrogen 2.825 N/A ILE 193.A N ALA 190.A O no hydrogen 3.183 N/A LEU 194.A N ALA 191.A O no hydrogen 3.107 N/A THR 195.A N SER 192.A O no hydrogen 3.350 N/A THR 195.A OG1 SER 192.A O no hydrogen 2.852 N/A CYS 196.A N ILE 193.A O no hydrogen 2.847 N/A CYS 196.A SG THR 195.A OG1 no hydrogen 3.637 N/A MET 197.A N LEU 194.A O no hydrogen 3.050 N/A SER 200.A N MET 197.A O no hydrogen 2.996 N/A VAL 202.A N SER 200.A OG no hydrogen 3.264 N/A ASP 203.A N THR 158.A O no hydrogen 2.914 N/A VAL 204.A N THR 158.A O no hydrogen 3.090 N/A LEU 205.A N ILE 124.A O no hydrogen 2.981 N/A TYR 206.A N THR 160.A O no hydrogen 3.026 N/A TYR 206.A OH GLU 121.A OE2 no hydrogen 2.452 N/A GLY 207.A N LYS 122.A O no hydrogen 2.991 N/A ILE 208.A N HIS 167.A NE2 no hydrogen 2.796 N/A GLY 209.A N MET 120.A O no hydrogen 2.951 N/A ALA 211.A N MET 118.A O no hydrogen 2.775 N/A GLY 214.A N GLY 210.A O no hydrogen 2.953 N/A VAL 215.A N ALA 211.A O no hydrogen 2.954 N/A VAL 216.A N PRO 212.A O no hydrogen 3.062 N/A SER 217.A N GLU 213.A O no hydrogen 2.952 N/A SER 217.A OG SER 192.A OG no hydrogen 2.825 N/A SER 217.A OG GLU 213.A O no hydrogen 3.425 N/A ALA 218.A N GLY 214.A O no hydrogen 2.865 N/A ALA 219.A N VAL 215.A O no hydrogen 3.061 N/A VAL 220.A N VAL 216.A O no hydrogen 3.051 N/A ILE 221.A N SER 217.A O no hydrogen 2.820 N/A ARG 222.A N ALA 218.A O no hydrogen 2.861 N/A ARG 222.A NE ASP 275.A OD1 no hydrogen 2.727 N/A ARG 222.A NH1 ALA 272.A O no hydrogen 2.793 N/A ARG 222.A NH2 ASP 275.A OD1 no hydrogen 3.382 N/A ALA 223.A N ALA 219.A O no hydrogen 3.108 N/A LEU 224.A N VAL 220.A O no hydrogen 2.909 N/A ASP 225.A N ARG 222.A O no hydrogen 3.040 N/A GLY 226.A N ILE 221.A O no hydrogen 2.882 N/A ASP 227.A N VAL 125.A O no hydrogen 2.988 N/A MET 228.A N ASP 227.A OD1 no hydrogen 2.941 N/A ASN 229.A N LEU 123.A O no hydrogen 2.928 N/A ASN 229.A ND2 MET 228.A O no hydrogen 2.951 N/A GLY 230.A N LEU 266.A O no hydrogen 2.913 N/A ARG 231.A N GLU 121.A O no hydrogen 2.938 N/A ARG 231.A NE GLU 121.A OE1 no hydrogen 3.067 N/A ARG 231.A NH2 GLY 263.A O no hydrogen 2.856 N/A LEU 233.A N TYR 119.A O no hydrogen 3.062 N/A ARG 235.A N GLU 251.A OE1 no hydrogen 2.810 N/A ARG 235.A NE ASN 244.A OD1 no hydrogen 3.453 N/A ASP 237.A N ALA 234.A O no hydrogen 2.830 N/A VAL 238.A N ARG 235.A O no hydrogen 2.898 N/A LYS 239.A N ARG 235.A O no hydrogen 2.873 N/A GLY 240.A N HIS 236.A O no hydrogen 3.130 N/A ASN 244.A ND2 GLY 240.A O no hydrogen 2.996 N/A ARG 245.A NH1 GLU 249.A OE2 no hydrogen 3.067 N/A ARG 245.A NH2 ASP 241.A OD1 no hydrogen 2.659 N/A ARG 245.A NH2 ASP 241.A OD2 no hydrogen 3.207 N/A ILE 247.A N GLU 243.A O no hydrogen 3.096 N/A GLY 248.A N ASN 244.A O no hydrogen 2.630 N/A GLU 249.A N ARG 245.A O no hydrogen 2.957 N/A GLN 250.A N ARG 246.A O no hydrogen 3.311 N/A GLU 251.A N ILE 247.A O no hydrogen 3.057 N/A LEU 252.A N GLY 248.A O no hydrogen 3.014 N/A ALA 253.A N GLU 249.A O no hydrogen 2.964 N/A ARG 254.A N GLN 250.A O no hydrogen 2.927 N/A CYS 255.A N GLU 251.A O no hydrogen 2.899 N/A CYS 255.A SG GLU 251.A O no hydrogen 3.495 N/A LYS 256.A N LEU 252.A O no hydrogen 3.147 N/A ALA 257.A N ALA 253.A O no hydrogen 2.979 N/A MET 258.A N ARG 254.A O no hydrogen 2.866 N/A GLY 259.A N LYS 256.A O no hydrogen 2.800 N/A ILE 260.A N CYS 255.A O no hydrogen 2.635 N/A GLY 263.A N LEU 232.A O no hydrogen 2.941 N/A LEU 266.A N GLY 230.A O no hydrogen 2.677 N/A ARG 267.A N ASP 270.A OD2 no hydrogen 2.827 N/A ARG 267.A NH1 ASP 134.A OD1 no hydrogen 2.868 N/A ARG 267.A NH1 ASN 229.A OD1 no hydrogen 3.190 N/A ASP 270.A N ARG 267.A O no hydrogen 2.854 N/A MET 271.A N LEU 268.A O no hydrogen 3.029 N/A ALA 272.A N LEU 268.A O no hydrogen 3.037 N/A ARG 273.A N CYS 111.A O.A no hydrogen 2.871 N/A ARG 273.A N CYS 111.A O.B no hydrogen 2.817 N/A ARG 273.A NH1 GLY 110.A O no hydrogen 2.822 N/A ARG 273.A NH2 ASN 114.A OD1.A no hydrogen 3.262 N/A SER 274.A OG ASP 108.A OD2 no hydrogen 3.035 N/A ASN 276.A N SER 274.A OG no hydrogen 3.359 N/A ASN 276.A ND2 ASP 108.A OD2 no hydrogen 2.578 N/A VAL 277.A N ASP 275.A O no hydrogen 2.854 N/A ILE 278.A N VAL 106.A O no hydrogen 2.834 N/A PHE 279.A N ILE 307.A O no hydrogen 2.843 N/A SER 280.A N LEU 104.A O no hydrogen 2.910 N/A SER 280.A OG THR 13.A OG1 no hydrogen 2.825 N/A ALA 281.A N LEU 305.A O no hydrogen 2.962 N/A THR 282.A N ALA 102.A O no hydrogen 2.927 N/A THR 282.A OG1 THR 13.A OG1 no hydrogen 2.677 N/A THR 282.A OG1 THR 304.A OG1 no hydrogen 2.603 N/A GLY 283.A N GLU 303.A O no hydrogen 3.058 N/A ILE 284.A N ALA 100.A O no hydrogen 2.814 N/A THR 285.A N ALA 100.A O no hydrogen 3.217 N/A THR 285.A OG1 GLN 97.A O no hydrogen 2.644 N/A GLY 287.A N LEU 290.A O no hydrogen 2.876 N/A ASP 288.A N ASN 99.A OD1 no hydrogen 3.164 N/A GLU 291.A N GLU 303.A OE1 no hydrogen 2.788 N/A ILE 293.A N ILE 284.A O no hydrogen 3.066 N/A SER 294.A OG THR 301.A OG1 no hydrogen 2.689 N/A LYS 296.A N ILE 299.A O no hydrogen 2.922 N/A ILE 299.A N LYS 296.A O no hydrogen 3.217 N/A ALA 300.A N HIS 320.A O no hydrogen 2.960 N/A THR 301.A N SER 294.A O no hydrogen 2.968 N/A THR 301.A OG1 SER 294.A OG no hydrogen 2.689 N/A THR 302.A N SER 318.A O no hydrogen 3.055 N/A THR 302.A OG1 SER 318.A OG.A no hydrogen 2.493 N/A THR 302.A OG1 HIS 320.A NE2 no hydrogen 2.783 N/A THR 304.A N ILE 316.A O no hydrogen 2.882 N/A THR 304.A OG1 THR 282.A OG1 no hydrogen 2.603 N/A LEU 305.A N ALA 281.A O no hydrogen 2.814 N/A LEU 306.A N ARG 314.A O no hydrogen 2.820 N/A ILE 307.A N PHE 279.A O no hydrogen 2.913 N/A GLY 309.A N VAL 277.A O no hydrogen 2.832 N/A LYS 310.A NZ ASN 276.A OD1 no hydrogen 2.963 N/A SER 311.A OG THR 312.A O no hydrogen 3.562 N/A ARG 314.A N LEU 306.A O no hydrogen 3.003 N/A ARG 315.A NH1 LEU 289.A O no hydrogen 2.843 N/A ARG 315.A NH1 GLU 303.A OE2 no hydrogen 3.115 N/A ARG 315.A NH2 LEU 289.A O no hydrogen 3.037 N/A ILE 316.A N THR 304.A O no hydrogen 2.712 N/A GLN 317.A NE2 GLU 303.A OE2 no hydrogen 3.017 N/A SER 318.A N THR 302.A O no hydrogen 2.970 N/A SER 318.A OG.A GLU 14.A OE1 no hydrogen 3.465 N/A SER 318.A OG.A THR 302.A OG1 no hydrogen 2.493 N/A SER 318.A OG.A HIS 320.A NE2 no hydrogen 2.524 N/A SER 318.A OG.B GLU 14.A OE1 no hydrogen 2.902 N/A HIS 320.A N ALA 300.A O no hydrogen 2.716 N/A HIS 320.A NE2 THR 302.A OG1 no hydrogen 2.783 N/A