Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ie4_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N PHE 1.A O no hydrogen 3.012 N/A ASP 6.A N THR 2.A O no hydrogen 3.058 N/A GLN 7.A N LYS 3.A O no hydrogen 3.206 N/A TRP 8.A N GLU 4.A O no hydrogen 2.950 N/A ILE 9.A N LEU 5.A O no hydrogen 2.913 N/A GLU 10.A N ASP 6.A O no hydrogen 2.926 N/A GLN 11.A N GLN 7.A O no hydrogen 2.842 N/A GLN 11.A NE2 GLN 7.A OE1 no hydrogen 3.034 N/A LEU 12.A N TRP 8.A O no hydrogen 2.762 N/A ASN 13.A N ILE 9.A O no hydrogen 3.009 N/A ASN 13.A ND2 ILE 9.A O no hydrogen 2.850 N/A GLU 14.A N GLN 11.A O no hydrogen 2.740 N/A CYS 15.A N LEU 12.A O no hydrogen 2.790 N/A LYS 16.A N GLN 11.A O no hydrogen 3.459 N/A LYS 16.A NZ GLU 14.A OE2 no hydrogen 2.660 N/A GLN 17.A NE2 LYS 131.A O no hydrogen 2.884 N/A SER 19.A N GLN 22.A OE1 no hydrogen 2.829 N/A GLN 22.A N SER 19.A OG no hydrogen 3.224 N/A VAL 23.A N SER 19.A O no hydrogen 2.858 N/A LYS 24.A N GLU 20.A O no hydrogen 2.913 N/A SER 25.A N SER 21.A O no hydrogen 3.243 N/A SER 25.A OG SER 21.A O no hydrogen 3.491 N/A LEU 26.A N GLN 22.A O no hydrogen 2.670 N/A CYS 27.A N VAL 23.A O no hydrogen 2.930 N/A CYS 27.A SG VAL 23.A O no hydrogen 3.579 N/A CYS 27.A SG TYR 140.A O no hydrogen 3.591 N/A GLU 28.A N LYS 24.A O no hydrogen 3.104 N/A LYS 29.A N SER 25.A O no hydrogen 3.122 N/A ALA 30.A N LEU 26.A O no hydrogen 2.940 N/A LYS 31.A N CYS 27.A O no hydrogen 2.994 N/A GLU 32.A N GLU 28.A O no hydrogen 3.297 N/A ILE 33.A N LYS 29.A O no hydrogen 2.973 N/A LEU 34.A N ALA 30.A O no hydrogen 2.837 N/A THR 35.A N LYS 31.A O no hydrogen 2.774 N/A THR 35.A OG1 LYS 31.A O no hydrogen 2.296 N/A THR 35.A OG1 GLU 32.A O no hydrogen 3.498 N/A GLU 37.A N LEU 34.A O no hydrogen 3.231 N/A SER 38.A N GLN 41.A OE1 no hydrogen 3.355 N/A ASN 39.A ND2 ILE 175.A O no hydrogen 3.071 N/A ASN 39.A ND2 LEU 178.A O no hydrogen 2.577 N/A VAL 40.A N SER 38.A OG no hydrogen 2.748 N/A GLN 41.A N THR 151.A O no hydrogen 2.809 N/A GLN 41.A NE2 GLU 42.A O no hydrogen 3.357 N/A VAL 43.A N LEU 153.A O no hydrogen 2.955 N/A CYS 45.A SG ASP 155.A OD1 no hydrogen 3.662 N/A CYS 45.A SG ASP 274.A O no hydrogen 3.415 N/A CYS 45.A SG ASP 275.A O no hydrogen 3.354 N/A VAL 47.A N LEU 273.A O no hydrogen 3.070 N/A THR 48.A N ASN 74.A O no hydrogen 2.765 N/A VAL 49.A N MET 271.A O no hydrogen 2.756 N/A CYS 50.A N LEU 76.A O no hydrogen 2.813 N/A CYS 50.A SG THR 48.A O no hydrogen 4.015 N/A GLY 51.A N SER 256.A OG no hydrogen 2.851 N/A VAL 53.A N ASP 80.A O no hydrogen 3.216 N/A HIS 54.A N ASP 80.A O no hydrogen 2.862 N/A HIS 54.A ND1 VAL 82.A O no hydrogen 2.621 N/A GLY 55.A N TYR 81.A O no hydrogen 2.713 N/A GLN 56.A N VAL 53.A O no hydrogen 2.918 N/A GLN 56.A NE2 ASP 59.A OD2 no hydrogen 2.681 N/A GLN 56.A NE2 PRO 258.A O no hydrogen 2.836 N/A ASP 59.A N GLN 56.A O no hydrogen 2.820 N/A LEU 60.A N GLN 56.A O no hydrogen 3.100 N/A MET 61.A N PHE 57.A O no hydrogen 3.043 N/A GLU 62.A N HIS 58.A O no hydrogen 3.174 N/A LEU 63.A N ASP 59.A O no hydrogen 2.798 N/A PHE 64.A N LEU 60.A O no hydrogen 2.983 N/A ARG 65.A N MET 61.A O no hydrogen 3.096 N/A ARG 65.A NE GLU 62.A OE1 no hydrogen 2.967 N/A ARG 65.A NH2 GLU 62.A OE1 no hydrogen 2.873 N/A ILE 66.A N GLU 62.A O no hydrogen 3.213 N/A ILE 66.A N LEU 63.A O no hydrogen 3.032 N/A GLY 67.A N LEU 63.A O no hydrogen 2.897 N/A GLY 68.A N PHE 64.A O no hydrogen 2.941 N/A THR 73.A N LYS 69.A O no hydrogen 2.899 N/A THR 73.A OG1 GLY 67.A O no hydrogen 2.569 N/A ASN 74.A ND2 PRO 46.A O no hydrogen 3.234 N/A TYR 75.A N ARG 105.A O no hydrogen 2.859 N/A TYR 75.A OH GLY 68.A O no hydrogen 2.783 N/A LEU 76.A N THR 48.A O no hydrogen 2.800 N/A PHE 77.A N THR 107.A O no hydrogen 2.799 N/A MET 78.A N CYS 50.A O no hydrogen 3.034 N/A ASP 80.A N GLU 114.A OE1 no hydrogen 2.629 N/A TYR 81.A N GLU 114.A OE2 no hydrogen 2.788 N/A TYR 81.A OH PHE 77.A O no hydrogen 3.331 N/A TYR 81.A OH LEU 109.A O no hydrogen 2.514 N/A ASP 83.A N SER 88.A OG no hydrogen 2.864 N/A ARG 84.A N TYR 122.A O no hydrogen 3.095 N/A GLY 85.A N ASP 83.A O no hydrogen 2.719 N/A TYR 86.A N TYR 262.A OH no hydrogen 2.721 N/A TYR 87.A N GLY 55.A O no hydrogen 2.953 N/A SER 88.A N GLU 127.A OE1 no hydrogen 2.643 N/A VAL 89.A N GLU 127.A OE2 no hydrogen 2.687 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.600 N/A THR 91.A N TYR 87.A O no hydrogen 3.100 N/A THR 91.A OG1 TYR 87.A O no hydrogen 2.986 N/A VAL 92.A N SER 88.A O no hydrogen 3.108 N/A THR 93.A N VAL 89.A O no hydrogen 3.161 N/A THR 93.A OG1 VAL 89.A O no hydrogen 2.595 N/A LEU 94.A N GLU 90.A O no hydrogen 3.086 N/A LEU 95.A N THR 91.A O no hydrogen 3.215 N/A VAL 96.A N VAL 92.A O no hydrogen 2.912 N/A ALA 97.A N THR 93.A O no hydrogen 2.854 N/A LEU 98.A N LEU 94.A O no hydrogen 2.741 N/A LEU 98.A N LEU 95.A O no hydrogen 3.132 N/A LYS 99.A N LEU 95.A O no hydrogen 3.039 N/A LYS 99.A NZ GLU 37.A OE2 no hydrogen 2.820 N/A LYS 99.A NZ ARG 103.A O no hydrogen 2.865 N/A LYS 99.A NZ ILE 106.A O no hydrogen 2.632 N/A VAL 100.A N VAL 96.A O no hydrogen 3.086 N/A ARG 101.A N ALA 97.A O no hydrogen 3.237 N/A ARG 101.A NE ASP 6.A OD2 no hydrogen 2.812 N/A ARG 101.A NH1 ARG 101.A O no hydrogen 3.069 N/A TYR 102.A N LEU 98.A O no hydrogen 2.868 N/A ARG 105.A N TYR 102.A O no hydrogen 2.881 N/A ARG 105.A NH1 ASN 74.A OD1 no hydrogen 2.738 N/A ILE 106.A N TYR 102.A O no hydrogen 3.319 N/A THR 107.A N TYR 75.A O no hydrogen 2.937 N/A LEU 109.A N PHE 77.A O no hydrogen 2.786 N/A ARG 110.A N PRO 149.A O no hydrogen 2.986 N/A ARG 110.A NE GLU 114.A O no hydrogen 3.010 N/A ARG 110.A NH1 GLN 182.A O no hydrogen 2.961 N/A ARG 110.A NH2 GLU 114.A O no hydrogen 3.314 N/A ARG 110.A NH2 ASP 146.A OD1 no hydrogen 3.137 N/A ARG 110.A NH2 GLN 182.A O no hydrogen 3.377 N/A GLY 111.A N GLU 114.A OE1 no hydrogen 2.775 N/A HIS 113.A N ASP 80.A OD1 no hydrogen 3.191 N/A HIS 113.A ND1 ASP 83.A OD2 no hydrogen 2.582 N/A GLU 114.A N GLY 111.A O no hydrogen 3.253 N/A ARG 116.A N GLU 183.A OE1 no hydrogen 2.719 N/A ARG 116.A NH1 ASP 146.A OD1 no hydrogen 3.106 N/A ARG 116.A NH1 ASP 146.A OD2 no hydrogen 3.527 N/A ARG 116.A NH1 GLU 183.A OE1 no hydrogen 3.086 N/A ARG 116.A NH2 ASP 143.A OD1 no hydrogen 2.780 N/A ARG 116.A NH2 ASP 146.A OD2 no hydrogen 3.390 N/A GLN 117.A N GLU 183.A OE2 no hydrogen 3.337 N/A THR 119.A OG1 SER 115.A O no hydrogen 2.846 N/A THR 119.A OG1 ARG 116.A O no hydrogen 3.316 N/A GLN 120.A N GLN 117.A O no hydrogen 3.147 N/A GLN 120.A NE2 ARG 116.A O no hydrogen 3.380 N/A VAL 121.A N ILE 118.A O no hydrogen 3.129 N/A TYR 122.A N ILE 118.A O no hydrogen 3.100 N/A PHE 124.A N ASP 83.A OD1 no hydrogen 3.028 N/A TYR 125.A N THR 119.A O no hydrogen 2.942 N/A GLU 127.A N GLY 123.A O no hydrogen 2.924 N/A CYS 128.A N PHE 124.A O no hydrogen 3.017 N/A CYS 128.A SG PHE 124.A O no hydrogen 3.576 N/A LEU 129.A N TYR 125.A O no hydrogen 3.189 N/A ARG 130.A N ASP 126.A O no hydrogen 2.945 N/A LYS 131.A N CYS 128.A O no hydrogen 3.266 N/A LYS 131.A NZ GLU 90.A OE1 no hydrogen 2.924 N/A LYS 131.A NZ GLU 90.A OE2 no hydrogen 3.061 N/A LYS 131.A NZ GLU 127.A OE2 no hydrogen 2.901 N/A TYR 132.A N CYS 128.A O no hydrogen 2.894 N/A TYR 132.A OH LEU 18.A O no hydrogen 2.642 N/A ASN 134.A ND2 GLU 20.A OE1 no hydrogen 3.339 N/A ASN 136.A N ASN 134.A OD1 no hydrogen 3.023 N/A ASN 136.A ND2 GLU 20.A OE2 no hydrogen 2.785 N/A TRP 138.A NE1 THR 119.A OG1 no hydrogen 2.939 N/A LYS 139.A N ALA 135.A O no hydrogen 3.000 N/A LYS 139.A NZ ASP 143.A OD1 no hydrogen 2.458 N/A TYR 140.A N ASN 136.A O no hydrogen 2.871 N/A PHE 141.A N VAL 137.A O no hydrogen 3.025 N/A THR 142.A N TRP 138.A O no hydrogen 2.976 N/A THR 142.A OG1 TRP 138.A O no hydrogen 2.698 N/A THR 142.A OG1 LYS 139.A O no hydrogen 3.397 N/A ASP 143.A N LYS 139.A O no hydrogen 2.975 N/A LEU 144.A N TYR 140.A O no hydrogen 3.099 N/A PHE 145.A N PHE 141.A O no hydrogen 2.975 N/A ASP 146.A N ASP 143.A O no hydrogen 3.239 N/A TYR 147.A N LEU 144.A O no hydrogen 2.687 N/A LEU 148.A N PHE 145.A O no hydrogen 3.424 N/A THR 151.A OG1 LEU 150.A O no hydrogen 3.287 N/A THR 151.A OG1 CYS 160.A O no hydrogen 3.262 N/A ALA 152.A N CYS 160.A O no hydrogen 2.743 N/A LEU 153.A N GLN 41.A O no hydrogen 2.739 N/A VAL 154.A N ILE 158.A O no hydrogen 2.708 N/A ASP 155.A N VAL 43.A O no hydrogen 3.030 N/A GLN 157.A N VAL 154.A O no hydrogen 3.005 N/A ILE 158.A N VAL 154.A O no hydrogen 3.071 N/A PHE 159.A N LEU 231.A O no hydrogen 3.057 N/A CYS 160.A N ALA 152.A O no hydrogen 2.558 N/A LEU 161.A N SER 233.A O no hydrogen 3.173 N/A HIS 162.A ND1 MET 78.A O no hydrogen 2.922 N/A HIS 162.A NE2 HIS 236.A ND1 no hydrogen 2.802 N/A GLY 163.A N LEU 193.A O no hydrogen 2.957 N/A GLY 164.A N LEU 193.A O no hydrogen 3.110 N/A SER 166.A OG ASP 192.A OD2 no hydrogen 3.236 N/A SER 168.A N SER 166.A OG no hydrogen 2.930 N/A SER 168.A OG SER 166.A OG no hydrogen 3.093 N/A ILE 169.A N SER 166.A O no hydrogen 3.135 N/A LEU 172.A N ASN 227.A OD1 no hydrogen 2.937 N/A ARG 176.A N LEU 172.A O no hydrogen 3.077 N/A ARG 176.A NH1 ASP 173.A OD1 no hydrogen 3.330 N/A ALA 177.A N ASP 173.A O no hydrogen 3.094 N/A ALA 177.A N HIS 174.A O no hydrogen 3.333 N/A LEU 178.A N ILE 175.A O no hydrogen 3.033 N/A ARG 180.A NE TYR 147.A O no hydrogen 2.922 N/A ARG 180.A NH1 GLU 37.A O no hydrogen 3.235 N/A ARG 180.A NH1 ASN 39.A OD1 no hydrogen 2.650 N/A ARG 180.A NH2 GLU 37.A O no hydrogen 2.937 N/A ARG 180.A NH2 TYR 147.A O no hydrogen 3.146 N/A LEU 181.A N ASP 179.A OD1 no hydrogen 3.187 N/A GLN 182.A NE2 GLU 183.A O no hydrogen 3.347 N/A ASP 192.A N GLY 188.A O no hydrogen 2.972 N/A LEU 193.A N PRO 189.A O no hydrogen 2.942 N/A LEU 194.A N CYS 191.A O no hydrogen 2.927 N/A TRP 195.A N ASP 192.A O no hydrogen 3.117 N/A SER 196.A N ASP 192.A O no hydrogen 2.963 N/A SER 196.A OG LEU 165.A O no hydrogen 3.158 N/A SER 196.A OG ASP 192.A O no hydrogen 3.208 N/A SER 196.A OG TYR 213.A O no hydrogen 3.131 N/A ASP 197.A N TYR 213.A O no hydrogen 3.038 N/A ASP 199.A N PHE 215.A O no hydrogen 2.827 N/A ASP 200.A N ASP 199.A OD1 no hydrogen 2.830 N/A GLY 203.A N ASP 218.A OD1 no hydrogen 2.724 N/A GLY 205.A N THR 214.A O no hydrogen 2.895 N/A SER 207.A OG ALA 211.A O no hydrogen 3.194 N/A ARG 209.A N SER 207.A OG no hydrogen 2.723 N/A ARG 209.A NE ASP 197.A OD2 no hydrogen 2.494 N/A ARG 209.A NH2 ASP 197.A OD1 no hydrogen 3.111 N/A ARG 209.A NH2 HIS 236.A O no hydrogen 3.032 N/A GLY 210.A N SER 207.A O no hydrogen 3.405 N/A TYR 213.A N SER 196.A OG no hydrogen 2.839 N/A THR 214.A N GLY 205.A O no hydrogen 3.146 N/A THR 214.A OG1 ASP 199.A OD2 no hydrogen 3.022 N/A PHE 215.A N ASP 197.A O no hydrogen 3.184 N/A GLY 216.A N GLY 203.A O no hydrogen 2.943 N/A GLN 217.A NE2 GLU 221.A OE1 no hydrogen 2.965 N/A ILE 219.A N GLY 216.A O no hydrogen 2.953 N/A SER 220.A N GLY 216.A O no hydrogen 3.207 N/A GLU 221.A N GLN 217.A O no hydrogen 2.879 N/A THR 222.A N ASP 218.A O no hydrogen 3.208 N/A THR 222.A OG1 ASP 218.A O no hydrogen 2.925 N/A PHE 223.A N ILE 219.A O no hydrogen 3.018 N/A ASN 224.A N SER 220.A O no hydrogen 2.731 N/A ASN 224.A ND2 ASN 250.A O no hydrogen 3.317 N/A ASN 224.A ND2 ASN 250.A OD1 no hydrogen 2.843 N/A HIS 225.A N GLU 221.A O no hydrogen 2.959 N/A ALA 226.A N THR 222.A O no hydrogen 2.824 N/A ASN 227.A N PHE 223.A O no hydrogen 3.222 N/A ASN 227.A ND2 ASP 170.A O no hydrogen 2.996 N/A ASN 227.A ND2 PHE 223.A O no hydrogen 2.605 N/A GLY 228.A N HIS 225.A O no hydrogen 3.347 N/A LEU 229.A N ASN 224.A O no hydrogen 2.907 N/A THR 230.A N GLN 157.A O no hydrogen 2.719 N/A THR 230.A OG1 GLN 157.A OE1 no hydrogen 2.823 N/A VAL 232.A N ASN 250.A O no hydrogen 2.732 N/A SER 233.A N PHE 159.A O no hydrogen 2.877 N/A ARG 234.A N VAL 252.A O no hydrogen 3.153 N/A ARG 234.A NE GLY 163.A O no hydrogen 2.936 N/A ARG 234.A NH1 GLN 237.A OE1 no hydrogen 2.906 N/A ARG 234.A NH1 THR 253.A OG1 no hydrogen 2.690 N/A ARG 234.A NH2 GLY 163.A O no hydrogen 3.451 N/A ARG 234.A NH2 SER 196.A O no hydrogen 3.462 N/A ARG 234.A NH2 ASP 197.A OD1 no hydrogen 2.652 N/A ALA 235.A N HIS 162.A O no hydrogen 3.012 N/A HIS 236.A N ASP 52.A OD1 no hydrogen 3.138 N/A HIS 236.A ND1 HIS 162.A NE2 no hydrogen 2.802 N/A GLN 237.A N ALA 235.A O no hydrogen 2.603 N/A GLY 242.A N VAL 239.A O no hydrogen 2.680 N/A ASN 244.A N THR 253.A O no hydrogen 2.836 N/A CYS 246.A N VAL 251.A O no hydrogen 2.812 N/A CYS 246.A SG VAL 251.A O no hydrogen 4.048 N/A HIS 247.A NE2 PHE 215.A O no hydrogen 3.110 N/A ASN 250.A N HIS 247.A O no hydrogen 3.004 N/A ASN 250.A ND2 HIS 247.A O no hydrogen 2.696 N/A VAL 251.A N CYS 246.A O no hydrogen 3.335 N/A VAL 252.A N VAL 232.A O no hydrogen 2.988 N/A THR 253.A N ASN 244.A O no hydrogen 2.716 N/A ILE 254.A N ARG 234.A O no hydrogen 2.849 N/A PHE 255.A N GLY 242.A O no hydrogen 2.857 N/A SER 256.A OG ALA 269.A O no hydrogen 2.844 N/A ASN 259.A N ASN 266.A O no hydrogen 2.767 N/A TYR 260.A N ASN 266.A OD1 no hydrogen 2.809 N/A TYR 262.A N ASN 259.A O no hydrogen 2.802 N/A ARG 263.A N TYR 260.A O no hydrogen 2.951 N/A CYS 264.A N TYR 260.A O no hydrogen 3.074 N/A CYS 264.A SG TYR 260.A O no hydrogen 3.492 N/A ASN 266.A ND2 ALA 257.A O no hydrogen 2.831 N/A ASN 266.A ND2 GLN 267.A O no hydrogen 2.828 N/A GLN 267.A N MET 240.A O no hydrogen 2.746 N/A ALA 268.A N PHE 284.A O no hydrogen 2.884 N/A ALA 269.A N PHE 255.A O no hydrogen 2.985 N/A ILE 270.A N LEU 282.A O no hydrogen 3.020 N/A MET 271.A N VAL 49.A O no hydrogen 2.815 N/A GLU 272.A N SER 280.A O no hydrogen 2.823 N/A LEU 273.A N VAL 47.A O no hydrogen 2.875 N/A ASP 274.A N LYS 278.A O no hydrogen 2.950 N/A THR 276.A N ASP 274.A OD1 no hydrogen 2.687 N/A LEU 277.A N ASP 274.A O no hydrogen 2.968 N/A LYS 278.A N ASP 274.A OD1 no hydrogen 3.081 N/A SER 280.A N GLU 272.A O no hydrogen 2.933 N/A LEU 282.A N ILE 270.A O no hydrogen 2.971 N/A GLN 283.A NE2 GLU 241.A O no hydrogen 2.535 N/A PHE 284.A N ALA 268.A O no hydrogen 2.775 N/A ALA 287.A N ASP 59.A OD1 no hydrogen 3.309 N/A