Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yi4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.526 N/A SER 4.A N LEU 2.A O no hydrogen 2.522 N/A GLN 5.A N LEU 2.A O no hydrogen 3.227 N/A GLN 7.A N ILE 24.A O no hydrogen 2.848 N/A GLY 9.A N SER 22.A O no hydrogen 2.598 N/A LEU 12.A N VAL 20.A O no hydrogen 2.827 N/A SER 14.A OG GLY 18.A O no hydrogen 3.153 N/A GLY 15.A N GLY 18.A O no hydrogen 2.866 N/A PHE 17.A N GLY 15.A O no hydrogen 2.600 N/A GLY 18.A N GLY 15.A O no hydrogen 2.951 N/A SER 19.A N HIS 36.A O no hydrogen 3.307 N/A VAL 20.A N GLY 13.A O no hydrogen 2.986 N/A TYR 21.A N ILE 34.A O no hydrogen 2.710 N/A SER 22.A N PRO 10.A O no hydrogen 2.809 N/A GLY 23.A N VAL 32.A O no hydrogen 2.867 N/A ILE 24.A N GLN 7.A O no hydrogen 3.213 N/A ARG 25.A N LEU 30.A O no hydrogen 2.872 N/A ARG 25.A NH1 ASP 28.A OD2 no hydrogen 2.692 N/A ASP 28.A N ARG 25.A O no hydrogen 3.195 N/A LEU 30.A N ASP 28.A OD1 no hydrogen 2.949 N/A VAL 32.A N GLY 23.A O no hydrogen 2.820 N/A ALA 33.A N LEU 84.A O no hydrogen 2.796 N/A ILE 34.A N TYR 21.A O no hydrogen 2.756 N/A LYS 35.A N LEU 82.A O no hydrogen 2.891 N/A LYS 35.A NZ GLU 53.A OE1 no hydrogen 2.717 N/A LYS 35.A NZ ASP 149.A OD1 no hydrogen 3.279 N/A HIS 36.A N SER 19.A O no hydrogen 2.924 N/A VAL 37.A N PHE 80.A O no hydrogen 3.089 N/A LYS 39.A N ASP 78.A O no hydrogen 2.978 N/A LYS 39.A NZ GLU 75.A OE2 no hydrogen 3.085 N/A LYS 39.A NZ ARG 76.A O no hydrogen 2.995 N/A LYS 39.A NZ PRO 77.A O no hydrogen 2.900 N/A ARG 41.A N GLU 38.A O no hydrogen 2.958 N/A ILE 42.A N LYS 39.A O no hydrogen 3.245 N/A GLY 46.A N VAL 50.A O no hydrogen 2.881 N/A VAL 50.A N GLY 46.A O no hydrogen 3.068 N/A MET 52.A N ASP 44.A O no hydrogen 2.903 N/A VAL 54.A N PRO 51.A O no hydrogen 2.884 N/A VAL 55.A N PRO 51.A O no hydrogen 3.419 N/A LEU 56.A N MET 52.A O no hydrogen 2.821 N/A LEU 57.A N GLU 53.A O no hydrogen 2.931 N/A LYS 58.A N VAL 54.A O no hydrogen 2.942 N/A LYS 59.A N VAL 55.A O no hydrogen 3.258 N/A VAL 60.A N LEU 56.A O no hydrogen 3.215 N/A VAL 60.A N LEU 57.A O no hydrogen 3.148 N/A SER 61.A N LYS 58.A O no hydrogen 3.378 N/A SER 61.A OG LEU 57.A O no hydrogen 2.581 N/A ILE 68.A N LEU 147.A O no hydrogen 3.061 N/A ARG 69.A N GLU 85.A OE1 no hydrogen 3.182 N/A LEU 70.A N SER 61.A OG no hydrogen 2.801 N/A LEU 71.A N ILE 83.A O no hydrogen 2.721 N/A ASP 72.A N ILE 83.A O no hydrogen 3.370 N/A TRP 73.A N ASP 72.A OD2 no hydrogen 2.466 N/A PHE 74.A N VAL 81.A O no hydrogen 2.848 N/A ARG 76.A N SER 79.A O no hydrogen 2.730 N/A ARG 76.A NH2 GLU 3.A OE2 no hydrogen 3.552 N/A SER 79.A N ARG 76.A O no hydrogen 3.314 N/A PHE 80.A N VAL 37.A O no hydrogen 2.899 N/A VAL 81.A N PHE 74.A O no hydrogen 2.829 N/A LEU 82.A N LYS 35.A O no hydrogen 2.816 N/A ILE 83.A N ASP 72.A O no hydrogen 2.828 N/A LEU 84.A N ALA 33.A O no hydrogen 2.738 N/A GLU 85.A N ARG 69.A O no hydrogen 3.220 N/A ARG 86.A NE VAL 32.A O no hydrogen 2.764 N/A ARG 86.A NH2 GLY 23.A O no hydrogen 2.779 N/A GLN 91.A N ILE 138.A O no hydrogen 3.133 N/A LEU 93.A N ILE 136.A O no hydrogen 2.853 N/A ASP 95.A N ASP 92.A OD2 no hydrogen 2.617 N/A PHE 96.A N ASP 92.A O no hydrogen 2.998 N/A ILE 97.A N LEU 93.A O no hydrogen 2.855 N/A THR 98.A N PHE 94.A O no hydrogen 2.897 N/A THR 98.A OG1 PHE 94.A O no hydrogen 2.843 N/A GLU 99.A N ASP 95.A O no hydrogen 2.939 N/A ARG 100.A N PHE 96.A O no hydrogen 2.983 N/A ARG 100.A NH1 HIS 265.A O no hydrogen 2.789 N/A ARG 100.A NH2 HIS 265.A O no hydrogen 2.439 N/A GLY 101.A N ILE 97.A O no hydrogen 2.613 N/A LEU 103.A N MET 198.A O no hydrogen 2.907 N/A ALA 108.A N GLN 104.A O no hydrogen 2.986 N/A ARG 109.A N GLU 105.A O no hydrogen 2.744 N/A ARG 109.A NH1 TRP 251.A O no hydrogen 2.974 N/A SER 110.A N GLU 106.A O no hydrogen 3.221 N/A SER 110.A OG THR 261.A OG1 no hydrogen 2.716 N/A PHE 111.A N LEU 107.A O no hydrogen 2.945 N/A PHE 112.A N ALA 108.A O no hydrogen 2.799 N/A TRP 113.A N ARG 109.A O no hydrogen 2.877 N/A GLN 114.A N SER 110.A O no hydrogen 3.040 N/A GLN 114.A NE2 GLY 143.A O no hydrogen 2.929 N/A VAL 115.A N PHE 111.A O no hydrogen 2.980 N/A LEU 116.A N PHE 112.A O no hydrogen 2.878 N/A GLU 117.A N TRP 113.A O no hydrogen 2.994 N/A ALA 118.A N GLN 114.A O no hydrogen 3.017 N/A VAL 119.A N VAL 115.A O no hydrogen 2.855 N/A ARG 120.A N LEU 116.A O no hydrogen 2.943 N/A ARG 120.A NH1 GLN 247.A OE1 no hydrogen 2.877 N/A HIS 121.A N GLU 117.A O no hydrogen 3.010 N/A HIS 121.A NE2 VAL 60.A O no hydrogen 2.984 N/A CYS 122.A N ALA 118.A O no hydrogen 3.053 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.383 N/A HIS 123.A N VAL 119.A O no hydrogen 2.963 N/A ASN 124.A N ARG 120.A O no hydrogen 2.807 N/A VAL 126.A N CYS 122.A O no hydrogen 2.738 N/A LEU 127.A N ALA 154.A O no hydrogen 2.934 N/A HIS 128.A NE2 ILE 148.A O no hydrogen 2.891 N/A ARG 129.A NH1 SER 152.A O no hydrogen 2.971 N/A ARG 129.A NH1 GLY 153.A O no hydrogen 2.889 N/A ARG 129.A NH2 ASP 163.A OD1 no hydrogen 3.064 N/A ARG 129.A NH2 ASP 163.A OD2 no hydrogen 2.996 N/A ARG 129.A NH2 TYR 181.A OH no hydrogen 3.295 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 2.849 N/A LYS 132.A NZ GLU 134.A OE1 no hydrogen 3.060 N/A LYS 132.A NZ THR 167.A OG1 no hydrogen 2.984 N/A GLU 134.A N ASP 133.A OD1 no hydrogen 2.615 N/A ASN 135.A N LYS 132.A O no hydrogen 2.962 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.747 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 2.933 N/A ILE 136.A N ASP 133.A O no hydrogen 3.073 N/A LEU 137.A N LYS 146.A O no hydrogen 2.887 N/A ILE 138.A N GLN 91.A O no hydrogen 2.738 N/A ASP 139.A N GLU 144.A O no hydrogen 2.868 N/A ASN 141.A N ASP 139.A OD2 no hydrogen 3.143 N/A ARG 142.A N ASP 139.A OD2 no hydrogen 3.144 N/A GLY 143.A N ASP 139.A O no hydrogen 2.825 N/A LEU 145.A N GLN 114.A OE1 no hydrogen 2.885 N/A LYS 146.A N LEU 137.A O no hydrogen 2.848 N/A LYS 146.A NZ SER 65.A O no hydrogen 2.432 N/A LEU 147.A N GLY 66.A O no hydrogen 2.887 N/A ILE 148.A N ASN 135.A O no hydrogen 2.856 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 3.350 N/A SER 152.A OG ASP 165.A O no hydrogen 3.517 N/A GLY 153.A N PHE 150.A O no hydrogen 2.965 N/A ALA 154.A N LEU 127.A O no hydrogen 3.050 N/A LEU 156.A N GLY 125.A O no hydrogen 2.611 N/A LYS 157.A N TYR 161.A OH no hydrogen 3.154 N/A LYS 157.A NZ VAL 160.A O no hydrogen 3.248 N/A TYR 161.A N TYR 181.A O no hydrogen 2.822 N/A TYR 161.A OH LEU 155.A O no hydrogen 2.730 N/A THR 167.A OG1 ASP 130.A OD1 no hydrogen 2.641 N/A ARG 168.A NE ASP 208.A OD1 no hydrogen 3.023 N/A ARG 168.A NE ASP 208.A OD2 no hydrogen 3.179 N/A ARG 168.A NH2 ASP 208.A OD2 no hydrogen 2.677 N/A TYR 170.A N THR 167.A O no hydrogen 2.943 N/A SER 171.A N ARG 168.A O no hydrogen 2.679 N/A SER 171.A OG ARG 168.A O no hydrogen 2.605 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.510 N/A TRP 175.A N PRO 172.A O no hydrogen 3.072 N/A ILE 176.A N PRO 172.A O no hydrogen 3.276 N/A ARG 177.A N PRO 173.A O no hydrogen 2.845 N/A TYR 178.A N GLU 174.A O no hydrogen 3.049 N/A HIS 179.A N TRP 175.A O no hydrogen 2.940 N/A ARG 180.A N GLU 174.A O no hydrogen 3.476 N/A TYR 181.A N TYR 161.A O no hydrogen 3.274 N/A TYR 181.A OH ASP 163.A O no hydrogen 2.668 N/A ARG 184.A NH1 ASP 158.A OD2 no hydrogen 2.991 N/A ARG 184.A NH2 ASP 158.A OD2 no hydrogen 3.277 N/A ALA 186.A N HIS 182.A O no hydrogen 3.026 N/A ALA 187.A N GLY 183.A O no hydrogen 2.935 N/A VAL 188.A N ARG 184.A O no hydrogen 3.084 N/A TRP 189.A N SER 185.A O no hydrogen 3.208 N/A SER 190.A N ALA 186.A O no hydrogen 3.169 N/A SER 190.A OG ALA 187.A O no hydrogen 2.787 N/A LEU 191.A N ALA 187.A O no hydrogen 2.989 N/A GLY 192.A N VAL 188.A O no hydrogen 2.956 N/A ILE 193.A N TRP 189.A O no hydrogen 3.088 N/A LEU 194.A N SER 190.A O no hydrogen 2.876 N/A LEU 195.A N LEU 191.A O no hydrogen 3.032 N/A TYR 196.A N GLY 192.A O no hydrogen 3.157 N/A TYR 196.A OH PHE 217.A O no hydrogen 2.640 N/A ASP 197.A N ILE 193.A O no hydrogen 2.845 N/A MET 198.A N LEU 194.A O no hydrogen 2.900 N/A VAL 199.A N LEU 195.A O no hydrogen 3.084 N/A CYS 200.A N TYR 196.A O no hydrogen 2.893 N/A GLY 201.A N ASP 197.A O no hydrogen 2.804 N/A ILE 203.A N ASP 202.A OD2 no hydrogen 2.948 N/A GLU 206.A N GLU 210.A OE1 no hydrogen 2.894 N/A HIS 207.A N GLU 210.A OE1 no hydrogen 2.644 N/A GLU 210.A N HIS 207.A O no hydrogen 2.773 N/A ILE 211.A N HIS 207.A O no hydrogen 3.120 N/A ILE 212.A N ASP 208.A O no hydrogen 2.954 N/A ARG 213.A N GLU 209.A O no hydrogen 2.836 N/A GLY 214.A N GLU 210.A O no hydrogen 3.129 N/A ARG 219.A NE TYR 196.A OH no hydrogen 3.407 N/A SER 223.A N GLU 105.A OE1 no hydrogen 2.758 N/A SER 223.A OG GLU 105.A OE1 no hydrogen 3.290 N/A SER 223.A OG GLU 105.A OE2 no hydrogen 2.582 N/A CYS 225.A N SER 223.A OG no hydrogen 3.387 N/A GLN 226.A N SER 223.A O no hydrogen 2.940 N/A GLN 226.A NE2 VAL 222.A O no hydrogen 3.505 N/A HIS 227.A ND1 HIS 249.A NE2 no hydrogen 2.760 N/A LEU 228.A N GLU 224.A O no hydrogen 3.029 N/A ILE 229.A N CYS 225.A O no hydrogen 2.900 N/A ARG 230.A N GLN 226.A O no hydrogen 2.912 N/A ARG 230.A NH1 GLN 226.A OE1 no hydrogen 2.727 N/A ARG 230.A NH2 VAL 216.A O no hydrogen 3.103 N/A TRP 231.A N HIS 227.A O no hydrogen 2.915 N/A CYS 232.A N LEU 228.A O no hydrogen 2.883 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.639 N/A LEU 233.A N ILE 229.A O no hydrogen 2.907 N/A ALA 234.A N TRP 231.A O no hydrogen 2.992 N/A ASP 239.A N ARG 236.A O no hydrogen 2.782 N/A ARG 240.A N PRO 237.A O no hydrogen 3.152 N/A ARG 240.A NE ALA 234.A O no hydrogen 2.932 N/A ARG 240.A NH1 GLU 174.A OE2 no hydrogen 2.626 N/A ARG 240.A NH1 SER 185.A O no hydrogen 2.895 N/A ARG 240.A NH2 GLU 174.A OE1 no hydrogen 2.758 N/A ARG 240.A NH2 GLU 174.A OE2 no hydrogen 3.058 N/A ARG 240.A NH2 ALA 234.A O no hydrogen 3.430 N/A ARG 240.A NH2 LEU 235.A O no hydrogen 3.530 N/A THR 242.A N GLU 245.A OE1 no hydrogen 2.973 N/A THR 242.A OG1 GLU 245.A OE1 no hydrogen 3.441 N/A GLU 245.A N THR 242.A OG1 no hydrogen 3.077 N/A ILE 246.A N THR 242.A O no hydrogen 2.985 N/A GLN 247.A N PHE 243.A O no hydrogen 2.924 N/A GLN 247.A NE2 GLU 117.A OE1 no hydrogen 2.983 N/A ASN 248.A N GLU 244.A O no hydrogen 2.960 N/A HIS 249.A N ILE 246.A O no hydrogen 2.974 N/A HIS 249.A NE2 HIS 227.A ND1 no hydrogen 2.760 N/A TRP 251.A N HIS 249.A ND1 no hydrogen 2.996 N/A TRP 251.A NE1 GLU 105.A OE2 no hydrogen 2.770 N/A MET 252.A N HIS 249.A O no hydrogen 2.872 N/A GLN 253.A N PRO 250.A O no hydrogen 3.349 N/A GLN 253.A NE2 GLN 247.A O no hydrogen 3.191 N/A GLN 253.A NE2 HIS 249.A O no hydrogen 2.880 N/A LEU 257.A N GLU 260.A OE2 no hydrogen 3.144 N/A GLN 259.A NE2 ASN 141.A O no hydrogen 2.838 N/A THR 261.A N LEU 257.A O no hydrogen 2.878 N/A THR 261.A OG1 SER 110.A OG no hydrogen 2.716 N/A THR 261.A OG1 LEU 257.A O no hydrogen 2.801 N/A ALA 262.A N PRO 258.A O no hydrogen 2.967 N/A GLU 263.A N GLN 259.A O no hydrogen 2.965 N/A ILE 264.A N GLU 260.A O no hydrogen 3.049 N/A HIS 265.A N THR 261.A O no hydrogen 2.906 N/A HIS 265.A NE2 GLU 106.A OE2 no hydrogen 2.820 N/A LEU 266.A N ALA 262.A O no hydrogen 2.780 N/A HIS 267.A N ALA 262.A O no hydrogen 2.577 N/A