Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iec_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N TYR 5.A O no hydrogen 2.916 N/A TYR 5.A N ILE 2.A O no hydrogen 2.780 N/A TYR 5.A OH GLU 65.A OE1 no hydrogen 2.578 N/A ARG 6.A N ARG 19.A O no hydrogen 2.883 N/A LEU 8.A N LEU 17.A O no hydrogen 2.785 N/A ILE 11.A N VAL 15.A O no hydrogen 2.797 N/A VAL 15.A N GLY 12.A O no hydrogen 2.994 N/A LYS 16.A N VAL 29.A O no hydrogen 2.904 N/A LEU 17.A N LYS 9.A O no hydrogen 3.005 N/A ALA 18.A N VAL 27.A O no hydrogen 2.892 N/A ARG 19.A N ARG 6.A O no hydrogen 2.908 N/A HIS 20.A N LYS 25.A O no hydrogen 2.857 N/A HIS 20.A ND1 THR 23.A OG1 no hydrogen 2.782 N/A ILE 21.A N ASN 4.A O no hydrogen 2.790 N/A THR 23.A N HIS 20.A ND1 no hydrogen 3.223 N/A THR 23.A OG1 HIS 20.A ND1 no hydrogen 2.782 N/A LYS 25.A N THR 23.A OG1 no hydrogen 3.358 N/A VAL 27.A N ALA 18.A O no hydrogen 2.889 N/A ALA 28.A N MET 77.A O no hydrogen 2.824 N/A VAL 29.A N LYS 16.A O no hydrogen 2.805 N/A LYS 30.A N LEU 75.A O no hydrogen 2.777 N/A ILE 31.A N LYS 14.A O no hydrogen 2.855 N/A ILE 32.A N LEU 73.A O no hydrogen 2.971 N/A LYS 34.A N LYS 71.A O no hydrogen 2.890 N/A LYS 34.A NZ THR 69.A O no hydrogen 3.353 N/A THR 35.A OG1 ASP 33.A OD1 no hydrogen 2.647 N/A LEU 37.A N LYS 34.A O no hydrogen 2.740 N/A SER 41.A N ASN 38.A OD1 no hydrogen 2.726 N/A SER 41.A OG ASN 38.A OD1 no hydrogen 3.211 N/A LEU 42.A N ASN 38.A O no hydrogen 2.844 N/A GLN 43.A N SER 39.A O no hydrogen 2.833 N/A LYS 44.A N SER 40.A O no hydrogen 3.078 N/A LEU 45.A N SER 41.A O no hydrogen 2.900 N/A LEU 45.A N LEU 42.A O no hydrogen 3.067 N/A PHE 46.A N LEU 42.A O no hydrogen 3.044 N/A ARG 47.A N GLN 43.A O no hydrogen 3.103 N/A ARG 47.A NH1 SER 145.A O no hydrogen 3.351 N/A GLU 48.A N LYS 44.A O no hydrogen 2.843 N/A VAL 49.A N LEU 45.A O no hydrogen 3.037 N/A ARG 50.A N PHE 46.A O no hydrogen 2.908 N/A ARG 50.A NE GLU 147.A OE2 no hydrogen 3.196 N/A ARG 50.A NH2 GLU 147.A OE1 no hydrogen 3.104 N/A ILE 51.A N ARG 47.A O no hydrogen 2.961 N/A MET 52.A N GLU 48.A O no hydrogen 2.946 N/A LYS 53.A N VAL 49.A O no hydrogen 3.033 N/A VAL 54.A N ARG 50.A O no hydrogen 3.374 N/A VAL 54.A N ILE 51.A O no hydrogen 3.101 N/A LEU 55.A N MET 52.A O no hydrogen 3.379 N/A ASN 56.A N TYR 113.A OH no hydrogen 2.810 N/A HIS 57.A NE2 SER 109.A OG no hydrogen 2.893 N/A ASN 59.A N HIS 57.A ND1 no hydrogen 2.935 N/A ASN 59.A ND2 ILE 137.A O no hydrogen 2.974 N/A ILE 60.A N HIS 57.A O no hydrogen 3.082 N/A VAL 61.A N ILE 139.A O no hydrogen 2.918 N/A LYS 62.A N GLU 78.A OE1 no hydrogen 2.997 N/A LYS 62.A NZ LEU 63.A O no hydrogen 3.183 N/A LYS 62.A NZ TYR 299.A OH no hydrogen 3.421 N/A PHE 64.A N VAL 76.A O no hydrogen 2.710 N/A GLU 65.A N VAL 76.A O no hydrogen 3.458 N/A VAL 66.A N TYR 299.A O no hydrogen 2.995 N/A ILE 67.A N TYR 74.A O no hydrogen 2.875 N/A THR 69.A N THR 72.A O no hydrogen 2.927 N/A THR 69.A OG1 THR 72.A O no hydrogen 3.136 N/A THR 72.A N THR 69.A OG1 no hydrogen 3.080 N/A LEU 73.A N ILE 32.A O no hydrogen 2.963 N/A TYR 74.A N ILE 67.A O no hydrogen 2.776 N/A LEU 75.A N LYS 30.A O no hydrogen 2.967 N/A VAL 76.A N GLU 65.A O no hydrogen 2.882 N/A MET 77.A N ALA 28.A O no hydrogen 2.714 N/A GLU 78.A N LYS 62.A O no hydrogen 2.813 N/A GLY 82.A N LEU 131.A O no hydrogen 2.642 N/A GLY 83.A N ALA 80.A O no hydrogen 3.378 N/A VAL 85.A N LEU 129.A O no hydrogen 2.788 N/A PHE 86.A N ALA 126.A O no hydrogen 3.376 N/A TYR 88.A N GLU 84.A O no hydrogen 3.091 N/A TYR 88.A OH GLU 99.A OE2 no hydrogen 2.555 N/A LEU 89.A N VAL 85.A O no hydrogen 2.756 N/A VAL 90.A N PHE 86.A O no hydrogen 3.109 N/A ALA 91.A N ASP 87.A O no hydrogen 2.996 N/A HIS 92.A N TYR 88.A O no hydrogen 2.827 N/A GLY 93.A N LEU 89.A O no hydrogen 2.597 N/A TRP 94.A N HIS 92.A O no hydrogen 2.986 N/A MET 95.A N LEU 191.A O no hydrogen 2.871 N/A ALA 100.A N LYS 96.A O no hydrogen 2.825 N/A ARG 101.A N GLU 97.A O no hydrogen 2.769 N/A ARG 101.A NE TRP 251.A O no hydrogen 2.644 N/A ARG 101.A NH2 TRP 251.A O no hydrogen 3.377 N/A ALA 102.A N LYS 98.A O no hydrogen 3.197 N/A LYS 103.A N GLU 99.A O no hydrogen 3.097 N/A LYS 103.A NZ GLU 99.A OE2 no hydrogen 2.650 N/A PHE 104.A N ALA 100.A O no hydrogen 2.852 N/A ARG 105.A N ARG 101.A O no hydrogen 2.900 N/A ARG 105.A NH1 MET 252.A O no hydrogen 2.932 N/A ARG 105.A NH1 ASN 253.A OD1 no hydrogen 2.921 N/A ARG 105.A NH2 ASP 259.A O no hydrogen 3.009 N/A GLN 106.A NE2 ASN 136.A OD1 no hydrogen 2.919 N/A ILE 107.A N LYS 103.A O no hydrogen 2.864 N/A VAL 108.A N PHE 104.A O no hydrogen 2.865 N/A SER 109.A N ARG 105.A O no hydrogen 3.010 N/A SER 109.A OG HIS 57.A NE2 no hydrogen 2.893 N/A ALA 110.A N GLN 106.A O no hydrogen 3.071 N/A VAL 111.A N ILE 107.A O no hydrogen 2.954 N/A GLN 112.A N VAL 108.A O no hydrogen 2.870 N/A TYR 113.A N SER 109.A O no hydrogen 2.911 N/A CYS 114.A N ALA 110.A O no hydrogen 2.893 N/A CYS 114.A SG ALA 110.A O no hydrogen 3.522 N/A HIS 115.A N VAL 111.A O no hydrogen 2.998 N/A HIS 115.A NE2 ASP 180.A OD2 no hydrogen 2.858 N/A GLN 116.A N GLN 112.A O no hydrogen 2.925 N/A GLN 116.A NE2 GLN 112.A OE1 no hydrogen 2.953 N/A GLN 116.A NE2 TYR 264.A O no hydrogen 3.002 N/A LYS 117.A N TYR 113.A O no hydrogen 3.072 N/A LYS 117.A NZ GLU 266.A OE1 no hydrogen 3.279 N/A PHE 118.A N HIS 115.A O no hydrogen 2.961 N/A ILE 119.A N CYS 114.A O no hydrogen 2.879 N/A VAL 120.A N ASN 146.A O no hydrogen 2.925 N/A HIS 121.A N ASP 180.A OD2 no hydrogen 2.858 N/A HIS 121.A NE2 ALA 140.A O no hydrogen 2.995 N/A ARG 122.A N ASP 180.A OD1 no hydrogen 2.870 N/A ARG 122.A NE PHE 144.A O no hydrogen 2.796 N/A ARG 122.A NH1 TYR 174.A OH no hydrogen 2.789 N/A ARG 122.A NH2 PHE 144.A O no hydrogen 2.974 N/A ASP 123.A N HIS 121.A ND1 no hydrogen 2.895 N/A LYS 125.A NZ ASP 123.A OD2 no hydrogen 2.674 N/A ALA 126.A N TYR 163.A OH no hydrogen 3.231 N/A GLU 127.A N GLU 127.A OE2 no hydrogen 2.815 N/A ASN 128.A N LYS 125.A O no hydrogen 3.058 N/A LEU 129.A N ALA 126.A O no hydrogen 3.143 N/A LEU 130.A N LYS 138.A O no hydrogen 2.910 N/A LEU 131.A N GLY 83.A O no hydrogen 2.841 N/A ASP 132.A N ASN 136.A O no hydrogen 2.915 N/A MET 135.A N ASP 132.A O no hydrogen 3.044 N/A ASN 136.A N ASP 132.A OD1 no hydrogen 3.009 N/A ILE 137.A N GLN 106.A OE1 no hydrogen 2.999 N/A LYS 138.A N LEU 130.A O no hydrogen 2.753 N/A LYS 138.A NZ PRO 58.A O no hydrogen 2.776 N/A LYS 138.A NZ GLU 78.A OE2 no hydrogen 2.647 N/A ILE 139.A N ASN 59.A O no hydrogen 2.813 N/A ALA 140.A N ASN 128.A O no hydrogen 2.985 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 3.084 N/A SER 145.A N PHE 142.A O no hydrogen 3.027 N/A SER 145.A OG HIS 121.A O no hydrogen 3.028 N/A SER 145.A OG PHE 142.A O no hydrogen 3.107 N/A ASN 146.A N VAL 120.A O no hydrogen 3.116 N/A GLU 147.A N ASN 146.A OD1 no hydrogen 2.702 N/A PHE 148.A N PHE 118.A O no hydrogen 2.860 N/A ASN 152.A N THR 149.A O no hydrogen 3.236 N/A ASN 152.A ND2 THR 149.A OG1 no hydrogen 2.955 N/A LEU 154.A N TYR 174.A O no hydrogen 2.741 N/A SER 160.A OG ASP 123.A OD1 no hydrogen 2.552 N/A TYR 163.A N SER 160.A O no hydrogen 2.967 N/A ALA 164.A N PRO 161.A O no hydrogen 3.164 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.737 N/A LEU 168.A N ALA 165.A O no hydrogen 2.818 N/A GLN 170.A N PRO 166.A O no hydrogen 3.079 N/A LYS 172.A N GLU 167.A O no hydrogen 3.376 N/A TYR 174.A N LEU 154.A O no hydrogen 3.180 N/A TYR 174.A OH THR 156.A O no hydrogen 2.727 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.872 N/A VAL 179.A N GLY 176.A O no hydrogen 3.012 N/A VAL 181.A N PRO 177.A O no hydrogen 3.095 N/A TRP 182.A N GLU 178.A O no hydrogen 3.201 N/A SER 183.A N VAL 179.A O no hydrogen 3.261 N/A SER 183.A OG TYR 163.A O no hydrogen 2.695 N/A SER 183.A OG VAL 179.A O no hydrogen 3.341 N/A LEU 184.A N ASP 180.A O no hydrogen 2.954 N/A GLY 185.A N VAL 181.A O no hydrogen 3.234 N/A VAL 186.A N TRP 182.A O no hydrogen 3.135 N/A ILE 187.A N SER 183.A O no hydrogen 2.973 N/A LEU 188.A N LEU 184.A O no hydrogen 2.942 N/A TYR 189.A N GLY 185.A O no hydrogen 3.035 N/A TYR 189.A OH ARG 216.A O no hydrogen 2.497 N/A THR 190.A N VAL 186.A O no hydrogen 2.954 N/A THR 190.A OG1 ILE 187.A O no hydrogen 3.130 N/A LEU 191.A N ILE 187.A O no hydrogen 2.801 N/A VAL 192.A N LEU 188.A O no hydrogen 3.256 N/A SER 193.A N TYR 189.A O no hydrogen 3.073 N/A SER 193.A OG TYR 189.A O no hydrogen 2.771 N/A GLY 194.A N THR 190.A O no hydrogen 2.816 N/A SER 195.A N SER 193.A OG no hydrogen 3.140 N/A GLY 200.A N ASP 199.A OD1 no hydrogen 2.940 N/A GLN 201.A N GLU 205.A OE2 no hydrogen 3.106 N/A GLU 205.A N ASN 202.A OD1 no hydrogen 2.719 N/A LEU 206.A N ASN 202.A O no hydrogen 3.080 N/A ARG 207.A N LEU 203.A O no hydrogen 2.823 N/A ARG 207.A NH1 PHE 169.A O no hydrogen 2.981 N/A ARG 207.A NH2 PHE 169.A O no hydrogen 2.947 N/A GLU 208.A N LYS 204.A O no hydrogen 3.078 N/A ARG 209.A N GLU 205.A O no hydrogen 2.945 N/A ARG 209.A NH1 ASP 199.A O no hydrogen 2.523 N/A VAL 210.A N LEU 206.A O no hydrogen 2.857 N/A LEU 211.A N ARG 207.A O no hydrogen 2.956 N/A ARG 212.A N GLU 208.A O no hydrogen 2.897 N/A ARG 212.A NE GLU 208.A OE2 no hydrogen 2.813 N/A GLY 213.A N ARG 209.A O no hydrogen 2.957 N/A MET 221.A N PRO 218.A O no hydrogen 3.037 N/A SER 222.A N GLU 97.A OE2 no hydrogen 3.049 N/A SER 222.A OG GLU 97.A OE1 no hydrogen 2.683 N/A SER 222.A OG GLU 97.A OE2 no hydrogen 3.433 N/A CYS 225.A N SER 222.A OG no hydrogen 3.143 N/A GLU 226.A N SER 222.A O no hydrogen 2.965 N/A ASN 227.A N THR 223.A O no hydrogen 2.929 N/A LEU 228.A N ASP 224.A O no hydrogen 2.917 N/A LEU 229.A N CYS 225.A O no hydrogen 2.974 N/A LYS 230.A N GLU 226.A O no hydrogen 3.137 N/A LYS 231.A N LEU 228.A O no hydrogen 2.869 N/A LYS 231.A NZ ASP 249.A OD2 no hydrogen 2.704 N/A PHE 232.A N LEU 229.A O no hydrogen 2.988 N/A LEU 233.A N LEU 229.A O no hydrogen 2.917 N/A ILE 234.A N PHE 232.A O no hydrogen 2.916 N/A LYS 239.A N ASN 236.A O no hydrogen 3.201 N/A ARG 240.A N PRO 237.A O no hydrogen 3.256 N/A ARG 240.A NE GLU 178.A O no hydrogen 3.418 N/A ARG 240.A NH1 GLU 167.A OE1 no hydrogen 3.249 N/A ARG 240.A NH1 ILE 234.A O no hydrogen 2.958 N/A ARG 240.A NH2 GLU 167.A OE1 no hydrogen 3.524 N/A ARG 240.A NH2 GLU 167.A OE2 no hydrogen 2.535 N/A ARG 240.A NH2 GLU 178.A O no hydrogen 2.811 N/A GLY 241.A N LYS 231.A O no hydrogen 2.961 N/A THR 242.A N GLN 245.A OE1 no hydrogen 3.218 N/A ILE 246.A N THR 242.A O no hydrogen 2.869 N/A MET 247.A N LEU 243.A O no hydrogen 2.963 N/A LYS 248.A N GLN 245.A O no hydrogen 3.110 N/A ASP 249.A N ILE 246.A O no hydrogen 3.094 N/A TRP 251.A N ASP 249.A OD1 no hydrogen 3.126 N/A TRP 251.A NE1 GLU 97.A OE1 no hydrogen 2.726 N/A ASN 253.A N ARG 250.A O no hydrogen 3.022 N/A ASN 253.A ND2 MET 247.A O no hydrogen 2.826 N/A ASN 253.A ND2 ASP 249.A O no hydrogen 3.154 N/A VAL 254.A N TRP 251.A O no hydrogen 3.475 N/A HIS 256.A N ASN 253.A O no hydrogen 2.723 N/A HIS 256.A ND1 ASP 259.A OD2 no hydrogen 2.627 N/A ASP 259.A N HIS 256.A O no hydrogen 3.156 N/A LEU 261.A N ASN 253.A OD1 no hydrogen 2.909 N/A LYS 272.A N ASP 270.A OD1 no hydrogen 3.212 N/A ASP 273.A N TYR 306.A OH no hydrogen 3.039 N/A ARG 275.A NH2 LEU 309.A O no hydrogen 3.175 N/A ARG 276.A N ASP 273.A OD2 no hydrogen 3.238 N/A ARG 276.A NE ASP 273.A OD2 no hydrogen 3.002 N/A ARG 276.A NH1 TYR 306.A O no hydrogen 2.892 N/A THR 277.A N ASP 273.A O no hydrogen 3.092 N/A THR 277.A OG1 ASP 273.A O no hydrogen 2.651 N/A GLU 278.A N PRO 274.A O no hydrogen 2.974 N/A LEU 279.A N ARG 275.A O no hydrogen 3.181 N/A MET 280.A N ARG 276.A O no hydrogen 3.011 N/A VAL 281.A N THR 277.A O no hydrogen 2.873 N/A SER 282.A N GLU 278.A O no hydrogen 3.022 N/A SER 282.A OG LEU 279.A O no hydrogen 2.927 N/A MET 283.A N LEU 279.A O no hydrogen 3.051 N/A MET 283.A N MET 280.A O no hydrogen 2.935 N/A GLY 284.A N VAL 281.A O no hydrogen 2.912 N/A TYR 285.A N MET 280.A O no hydrogen 2.999 N/A THR 286.A N GLU 289.A OE2 no hydrogen 3.075 N/A GLU 288.A N GLU 288.A OE1 no hydrogen 2.834 N/A GLU 289.A N THR 286.A OG1 no hydrogen 3.281 N/A ILE 290.A N THR 286.A O no hydrogen 3.174 N/A GLN 291.A N ARG 287.A O no hydrogen 2.984 N/A ASP 292.A N GLU 288.A O no hydrogen 2.976 N/A SER 293.A N GLU 289.A O no hydrogen 2.966 N/A SER 293.A OG GLU 289.A O no hydrogen 2.684 N/A LEU 294.A N ILE 290.A O no hydrogen 2.964 N/A VAL 295.A N GLN 291.A O no hydrogen 2.771 N/A GLY 296.A N ASP 292.A O no hydrogen 2.820 N/A GLN 297.A N LEU 294.A O no hydrogen 3.027 N/A GLN 297.A NE2 LEU 294.A O no hydrogen 2.562 N/A ARG 298.A N SER 293.A O no hydrogen 3.018 N/A ARG 298.A NE ASP 292.A OD1 no hydrogen 2.945 N/A ARG 298.A NH2 ASP 292.A OD1 no hydrogen 2.755 N/A TYR 299.A OH LYS 53.A O no hydrogen 2.749 N/A ASN 300.A ND2 SER 293.A OG no hydrogen 2.927 N/A MET 303.A N ASN 300.A OD1 no hydrogen 3.002 N/A ALA 304.A N ASN 300.A O no hydrogen 2.984 N/A THR 305.A N GLU 301.A O no hydrogen 3.012 N/A THR 305.A OG1 TYR 285.A OH no hydrogen 2.947 N/A THR 305.A OG1 GLU 301.A O no hydrogen 3.153 N/A TYR 306.A N VAL 302.A O no hydrogen 3.067 N/A TYR 306.A OH ASP 270.A O no hydrogen 2.746 N/A LEU 307.A N MET 303.A O no hydrogen 2.972 N/A LEU 308.A N ALA 304.A O no hydrogen 2.860 N/A LEU 309.A N THR 305.A O no hydrogen 2.944 N/A GLY 310.A N LEU 307.A O no hydrogen 3.022 N/A