Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i0i_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 8.A N LYS 5.A O no hydrogen 3.184 N/A ARG 11.A NE ASP 13.A OD2 no hydrogen 2.756 N/A ARG 11.A NH1 GLU 27.A O no hydrogen 2.879 N/A ARG 11.A NH2 ASP 13.A OD1 no hydrogen 2.864 N/A ARG 11.A NH2 ASP 13.A OD2 no hydrogen 3.320 N/A ARG 11.A NH2 VAL 262.A O no hydrogen 2.930 N/A THR 18.A N ALA 22.A O no hydrogen 2.776 N/A THR 18.A OG1 ALA 22.A O no hydrogen 3.509 N/A TRP 20.A N THR 18.A OG1 no hydrogen 3.193 N/A TRP 20.A NE1 PRO 242.A O no hydrogen 2.707 N/A LEU 21.A N THR 18.A O no hydrogen 2.837 N/A ALA 22.A N THR 18.A OG1 no hydrogen 3.002 N/A ILE 24.A N VAL 16.A O no hydrogen 2.807 N/A VAL 25.A N VAL 245.A O no hydrogen 2.887 N/A TRP 26.A NE1 LEU 15.A O no hydrogen 3.049 N/A GLU 27.A N GLU 249.A OE1 no hydrogen 2.743 N/A GLU 27.A N GLU 249.A OE2 no hydrogen 3.139 N/A THR 29.A N TRP 26.A O no hydrogen 3.047 N/A THR 29.A OG1 TRP 26.A O no hydrogen 2.660 N/A ASP 33.A N ASN 31.A OD1 no hydrogen 2.817 N/A ILE 34.A N ASN 31.A OD1 no hydrogen 3.174 N/A LEU 35.A N ASN 31.A O no hydrogen 3.383 N/A ASN 36.A N ILE 32.A O no hydrogen 2.807 N/A GLU 37.A N ASP 33.A O no hydrogen 3.144 N/A GLN 38.A N ILE 34.A O no hydrogen 3.075 N/A PHE 39.A N LEU 35.A O no hydrogen 2.934 N/A ARG 40.A N ASN 36.A O no hydrogen 2.857 N/A ARG 40.A NH2 ASN 43.A OD1 no hydrogen 2.995 N/A LEU 41.A N GLU 37.A O no hydrogen 2.945 N/A GLN 42.A N PHE 39.A O no hydrogen 3.178 N/A ASN 43.A N ARG 40.A O no hydrogen 2.763 N/A THR 44.A N PHE 39.A O no hydrogen 3.346 N/A THR 44.A OG1 PHE 39.A O no hydrogen 2.849 N/A THR 45.A N ASP 132.A OD2 no hydrogen 2.891 N/A ILE 46.A N ARG 76.A O no hydrogen 2.855 N/A GLY 47.A N TYR 133.A O no hydrogen 2.784 N/A LEU 48.A N HIS 78.A O no hydrogen 2.884 N/A THR 49.A N VAL 135.A O no hydrogen 2.759 N/A THR 49.A OG1 VAL 135.A O no hydrogen 3.466 N/A VAL 50.A N TYR 80.A O no hydrogen 3.027 N/A ALA 52.A N PHE 82.A O no hydrogen 2.882 N/A LYS 54.A N ASP 84.A OD1 no hydrogen 2.976 N/A LYS 54.A N ASP 84.A OD2 no hydrogen 3.158 N/A TYR 56.A N ILE 53.A O no hydrogen 3.010 N/A VAL 57.A N LYS 54.A O no hydrogen 3.414 N/A ALA 58.A N LYS 55.A O no hydrogen 3.084 N/A PHE 59.A N TYR 56.A O no hydrogen 3.051 N/A LEU 60.A N VAL 57.A O no hydrogen 3.108 N/A LYS 61.A NZ GLU 65.A OE2 no hydrogen 2.679 N/A PHE 63.A N PHE 59.A O no hydrogen 3.145 N/A LEU 64.A N LEU 60.A O no hydrogen 2.905 N/A GLU 65.A N LYS 61.A O no hydrogen 2.982 N/A THR 66.A N LEU 62.A O no hydrogen 2.930 N/A THR 66.A OG1 LEU 62.A O no hydrogen 2.888 N/A THR 66.A OG1 PHE 63.A O no hydrogen 3.210 N/A ALA 67.A N PHE 63.A O no hydrogen 2.838 N/A GLU 68.A N LEU 64.A O no hydrogen 2.966 N/A LYS 69.A N THR 66.A O no hydrogen 3.082 N/A HIS 70.A N THR 66.A O no hydrogen 3.052 N/A HIS 70.A N ALA 67.A O no hydrogen 3.164 N/A PHE 71.A N ALA 67.A O no hydrogen 2.756 N/A MET 72.A N VAL 147.A O no hydrogen 2.863 N/A HIS 75.A N MET 72.A O no hydrogen 3.037 N/A HIS 75.A NE2 ASN 36.A OD1 no hydrogen 2.862 N/A VAL 77.A N GLY 97.A O no hydrogen 3.105 N/A HIS 78.A N ILE 46.A O no hydrogen 2.949 N/A HIS 78.A NE2 SER 101.A OG no hydrogen 2.634 N/A TYR 79.A N GLN 99.A O no hydrogen 2.705 N/A TYR 79.A OH GLU 68.A OE2 no hydrogen 2.571 N/A TYR 80.A N LEU 48.A O no hydrogen 2.730 N/A TYR 80.A OH GLU 130.A OE2 no hydrogen 2.572 N/A VAL 81.A N SER 101.A O no hydrogen 2.856 N/A PHE 82.A N VAL 50.A O no hydrogen 2.908 N/A THR 83.A N LEU 103.A O no hydrogen 2.957 N/A THR 83.A OG1 ALA 52.A O no hydrogen 2.645 N/A GLN 85.A N THR 83.A OG1 no hydrogen 3.025 N/A ALA 88.A N GLN 85.A O no hydrogen 2.981 N/A VAL 89.A N PRO 86.A O no hydrogen 3.281 N/A GLY 95.A N GLU 68.A OE1 no hydrogen 2.797 N/A ARG 98.A N GLY 95.A O no hydrogen 3.280 N/A ARG 98.A NE GLU 68.A OE2 no hydrogen 2.760 N/A ARG 98.A NH1 GLU 68.A OE2 no hydrogen 3.527 N/A ARG 98.A NH1 PHE 71.A O no hydrogen 2.795 N/A ARG 98.A NH1 TYR 79.A OH no hydrogen 2.983 N/A ARG 98.A NH2 PHE 71.A O no hydrogen 2.914 N/A ARG 98.A NH2 MET 72.A O no hydrogen 3.349 N/A GLN 99.A N VAL 77.A O no hydrogen 2.866 N/A SER 101.A N TYR 79.A O no hydrogen 2.809 N/A SER 101.A OG HIS 78.A NE2 no hydrogen 2.634 N/A LEU 103.A N VAL 81.A O no hydrogen 2.651 N/A VAL 105.A N THR 83.A O no hydrogen 2.786 N/A GLN 109.A N GLN 109.A OE1 no hydrogen 2.865 N/A ASP 110.A N ARG 107.A O no hydrogen 3.126 N/A VAL 111.A N ARG 107.A O no hydrogen 3.284 N/A SER 112.A N TRP 108.A O no hydrogen 2.879 N/A SER 112.A OG GLU 224.A OE1 no hydrogen 2.473 N/A MET 113.A N GLN 109.A O no hydrogen 3.172 N/A ARG 114.A N VAL 111.A O no hydrogen 3.307 N/A ARG 115.A NE ASP 229.A OD2 no hydrogen 2.760 N/A ARG 115.A NH1 ASP 138.A OD1 no hydrogen 2.996 N/A ARG 115.A NH2 ASP 229.A OD1 no hydrogen 2.604 N/A ARG 115.A NH2 ASP 229.A OD2 no hydrogen 3.125 N/A GLU 117.A N MET 113.A O no hydrogen 2.949 N/A MET 118.A N ARG 114.A O no hydrogen 2.782 N/A ILE 119.A N ARG 115.A O no hydrogen 2.824 N/A SER 120.A N MET 116.A O no hydrogen 3.021 N/A ASP 121.A N GLU 117.A O no hydrogen 2.966 N/A PHE 122.A N MET 118.A O no hydrogen 3.011 N/A SER 123.A N ILE 119.A O no hydrogen 2.665 N/A SER 123.A OG ILE 119.A O no hydrogen 3.119 N/A SER 123.A OG SER 120.A O no hydrogen 2.872 N/A GLU 124.A N SER 120.A O no hydrogen 3.247 N/A GLU 124.A N ASP 121.A O no hydrogen 3.247 N/A ARG 125.A N PHE 122.A O no hydrogen 3.174 N/A PHE 127.A N PHE 122.A O no hydrogen 3.042 N/A SER 129.A N ARG 126.A O no hydrogen 3.367 N/A SER 129.A OG ARG 126.A O no hydrogen 3.017 N/A GLU 130.A N PHE 127.A O no hydrogen 2.857 N/A VAL 131.A N PHE 127.A O no hydrogen 2.987 N/A ASP 132.A N THR 45.A O no hydrogen 2.787 N/A TYR 133.A N THR 45.A O no hydrogen 3.337 N/A LEU 134.A N GLY 199.A O no hydrogen 2.919 N/A VAL 135.A N GLY 47.A O no hydrogen 2.836 N/A SER 136.A N PHE 197.A O no hydrogen 2.823 N/A VAL 137.A N THR 49.A O no hydrogen 3.218 N/A ASP 138.A N ALA 195.A O no hydrogen 3.242 N/A MET 141.A N VAL 139.A O no hydrogen 2.819 N/A GLU 142.A N THR 269.A O no hydrogen 2.839 N/A PHE 143.A N THR 66.A OG1 no hydrogen 2.867 N/A ARG 144.A N ARG 267.A O no hydrogen 2.787 N/A ARG 144.A NE THR 269.A OG1 no hydrogen 3.076 N/A ASP 145.A N ARG 267.A O no hydrogen 3.308 N/A HIS 146.A N ASP 145.A OD1 no hydrogen 2.734 N/A HIS 146.A NE2 GLU 150.A OE2 no hydrogen 2.658 N/A VAL 147.A N HIS 70.A O no hydrogen 2.957 N/A GLY 148.A N GLU 150.A OE1 no hydrogen 2.821 N/A GLU 150.A N GLU 150.A OE2 no hydrogen 2.815 N/A ILE 151.A N GLY 148.A O no hydrogen 3.066 N/A LEU 152.A N VAL 149.A O no hydrogen 3.021 N/A THR 153.A OG1 THR 243.A OG1 no hydrogen 2.632 N/A LEU 155.A N THR 243.A OG1 no hydrogen 3.015 N/A PHE 156.A N GLY 198.A O no hydrogen 2.860 N/A THR 158.A OG1 PHE 196.A O no hydrogen 2.791 N/A LEU 159.A N LEU 246.A O no hydrogen 3.044 N/A HIS 160.A N TYR 191.A O no hydrogen 2.990 N/A SER 162.A N HIS 160.A ND1 no hydrogen 3.070 N/A PHE 163.A N HIS 160.A O no hydrogen 3.137 N/A SER 166.A N PHE 163.A O no hydrogen 2.942 N/A SER 166.A OG PHE 163.A O no hydrogen 3.503 N/A ARG 168.A NE GLY 188.A O no hydrogen 2.930 N/A ARG 168.A NH1 GLY 188.A O no hydrogen 2.896 N/A GLU 169.A N GLU 169.A OE2 no hydrogen 2.793 N/A ALA 170.A N SER 167.A O no hydrogen 2.902 N/A PHE 171.A N ARG 168.A O no hydrogen 2.883 N/A THR 172.A OG1 TYR 191.A OH no hydrogen 3.224 N/A TYR 173.A OH PHE 190.A O no hydrogen 2.665 N/A ARG 175.A NH1 ILE 183.A O no hydrogen 2.779 N/A ARG 175.A NH2 PHE 171.A O no hydrogen 3.170 N/A ARG 176.A N GLU 174.A OE2 no hydrogen 2.647 N/A ARG 176.A NE GLU 174.A OE2 no hydrogen 2.846 N/A ARG 176.A NH2 GLU 174.A OE1 no hydrogen 2.780 N/A ARG 176.A NH2 GLU 224.A O no hydrogen 2.908 N/A SER 179.A N ARG 176.A O no hydrogen 2.935 N/A SER 179.A OG ASP 218.A OD1 no hydrogen 3.482 N/A SER 179.A OG ASP 218.A OD2 no hydrogen 2.678 N/A GLN 180.A N ASP 218.A OD1 no hydrogen 2.895 N/A ALA 181.A N SER 179.A OG no hydrogen 3.102 N/A TYR 182.A N SER 179.A O no hydrogen 2.987 N/A ILE 183.A N GLU 174.A O no hydrogen 3.005 N/A LYS 185.A NZ TYR 182.A OH no hydrogen 3.275 N/A GLU 187.A N PRO 184.A O no hydrogen 3.133 N/A TYR 191.A OH GLU 230.A OE2 no hydrogen 2.588 N/A TYR 192.A N ASN 234.A OD1 no hydrogen 2.774 N/A MET 193.A N THR 158.A O no hydrogen 3.029 N/A GLY 194.A N GLU 230.A OE1 no hydrogen 2.790 N/A PHE 197.A N SER 136.A O no hydrogen 3.222 N/A GLY 198.A N PHE 156.A O no hydrogen 3.203 N/A GLY 199.A N LEU 134.A O no hydrogen 2.950 N/A SER 200.A N PRO 154.A O no hydrogen 2.830 N/A VAL 201.A N ASP 132.A O no hydrogen 3.240 N/A GLU 203.A N SER 200.A OG no hydrogen 3.170 N/A VAL 204.A N SER 200.A O no hydrogen 2.927 N/A GLN 205.A N VAL 201.A O no hydrogen 2.822 N/A GLN 205.A NE2 SER 123.A O no hydrogen 3.131 N/A ARG 206.A N GLN 202.A O no hydrogen 2.995 N/A ARG 206.A NH1 GLU 203.A OE2 no hydrogen 2.968 N/A LEU 207.A N GLU 203.A O no hydrogen 2.902 N/A THR 208.A N VAL 204.A O no hydrogen 2.946 N/A THR 208.A OG1 VAL 204.A O no hydrogen 2.925 N/A THR 208.A OG1 GLN 205.A O no hydrogen 3.427 N/A ARG 209.A N GLN 205.A O no hydrogen 2.979 N/A ALA 210.A N ARG 206.A O no hydrogen 2.943 N/A CYS 211.A N LEU 207.A O no hydrogen 2.928 N/A CYS 211.A SG LEU 207.A O no hydrogen 3.459 N/A HIS 212.A N THR 208.A O no hydrogen 2.788 N/A GLN 213.A N ARG 209.A O no hydrogen 2.902 N/A ALA 214.A N ALA 210.A O no hydrogen 2.896 N/A MET 215.A N CYS 211.A O no hydrogen 2.901 N/A MET 216.A N HIS 212.A O no hydrogen 3.160 N/A VAL 217.A N GLN 213.A O no hydrogen 3.216 N/A ASP 218.A N ALA 214.A O no hydrogen 2.974 N/A GLN 219.A N MET 215.A O no hydrogen 2.845 N/A ALA 220.A N MET 216.A O no hydrogen 2.906 N/A ASN 221.A N VAL 217.A O no hydrogen 3.062 N/A GLY 222.A N GLN 219.A O no hydrogen 2.722 N/A ILE 223.A N ASP 218.A O no hydrogen 3.016 N/A VAL 226.A N GLU 174.A OE1 no hydrogen 2.833 N/A TRP 227.A N SER 231.A OG no hydrogen 2.892 N/A HIS 228.A N ALA 225.A O no hydrogen 2.968 N/A LEU 233.A N ASP 229.A O no hydrogen 2.860 N/A ASN 234.A N GLU 230.A O no hydrogen 2.963 N/A ASN 234.A ND2 TYR 192.A O no hydrogen 2.766 N/A ASN 234.A ND2 GLU 230.A O no hydrogen 3.089 N/A LYS 235.A N SER 231.A O no hydrogen 3.107 N/A LYS 235.A NZ GLN 180.A O no hydrogen 2.912 N/A LYS 235.A NZ TYR 182.A O no hydrogen 2.615 N/A TYR 236.A N HIS 232.A O no hydrogen 2.864 N/A LEU 237.A N LEU 233.A O no hydrogen 2.895 N/A LEU 238.A N ASN 234.A O no hydrogen 3.065 N/A ARG 239.A N LYS 235.A O no hydrogen 3.214 N/A HIS 240.A N TYR 236.A O no hydrogen 2.780 N/A HIS 240.A ND1 TYR 236.A O no hydrogen 3.207 N/A LYS 241.A NZ ASP 189.A OD2 no hydrogen 2.688 N/A LYS 241.A NZ LEU 238.A O no hydrogen 2.713 N/A THR 243.A N LEU 155.A O no hydrogen 2.754 N/A THR 243.A OG1 THR 153.A OG1 no hydrogen 2.632 N/A THR 243.A OG1 LEU 155.A O no hydrogen 3.180 N/A LYS 244.A N LEU 155.A O no hydrogen 3.362 N/A LYS 244.A NZ GLU 150.A O no hydrogen 2.712 N/A LYS 244.A NZ LEU 152.A O no hydrogen 2.790 N/A VAL 245.A N PRO 23.A O no hydrogen 2.880 N/A LEU 246.A N GLY 157.A O no hydrogen 2.860 N/A SER 247.A N VAL 25.A O no hydrogen 3.133 N/A SER 247.A OG VAL 25.A O no hydrogen 2.661 N/A TYR 250.A N SER 247.A O no hydrogen 2.985 N/A TYR 250.A OH GLU 150.A OE1 no hydrogen 2.765 N/A LEU 251.A N PRO 248.A O no hydrogen 3.069 N/A TRP 252.A N PHE 268.A O no hydrogen 3.084 N/A TRP 252.A NE1 GLY 258.A O no hydrogen 2.716 N/A LEU 256.A N ASP 253.A OD1 no hydrogen 3.148 N/A LEU 257.A N ASP 253.A O no hydrogen 2.883 N/A GLY 258.A N GLN 254.A O no hydrogen 2.723 N/A TRP 259.A NE1 LEU 263.A O no hydrogen 2.754 N/A LEU 263.A N PRO 260.A O no hydrogen 3.109 N/A LYS 265.A NZ ASP 145.A OD1 no hydrogen 3.254 N/A ARG 267.A N GLU 249.A O no hydrogen 2.832 N/A ARG 267.A NE GLU 249.A OE2 no hydrogen 2.852 N/A ARG 267.A NH1 HIS 146.A O no hydrogen 2.916 N/A ARG 267.A NH2 GLU 27.A OE2 no hydrogen 2.781 N/A ARG 267.A NH2 GLU 249.A OE2 no hydrogen 2.992 N/A THR 269.A N GLU 142.A O no hydrogen 2.883 N/A THR 269.A OG1 GLU 142.A O no hydrogen 3.568 N/A ALA 270.A N TRP 252.A O no hydrogen 2.889 N/A VAL 271.A N ASP 140.A O no hydrogen 3.293 N/A