Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ig2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N ALA 246.A O no hydrogen 3.157 N/A GLY 6.A N GLY 30.A O no hydrogen 2.860 N/A LYS 7.A N PHE 4.A O no hydrogen 2.929 N/A LYS 7.A NZ.A GLU 3.A O no hydrogen 3.195 N/A VAL 8.A N HIS 85.A ND1 no hydrogen 3.021 N/A ALA 9.A N LYS 32.A O no hydrogen 2.780 N/A VAL 10.A N LEU 86.A O no hydrogen 2.763 N/A ILE 11.A N VAL 34.A O no hydrogen 2.906 N/A THR 12.A N PHE 88.A O no hydrogen 3.009 N/A THR 12.A OG1 PHE 88.A O no hydrogen 3.282 N/A ALA 14.A N ALA 36.A O no hydrogen 3.069 N/A GLY 15.A N ASP 37.A OD2 no hydrogen 2.846 N/A ARG 20.A N SER 16.A O no hydrogen 3.098 N/A ALA 21.A N GLY 17.A O no hydrogen 3.111 N/A PHE 22.A N PHE 18.A O no hydrogen 2.773 N/A ALA 23.A N GLY 19.A O no hydrogen 3.049 N/A GLU 24.A N ARG 20.A O no hydrogen 3.048 N/A LYS 25.A N ALA 21.A O no hydrogen 2.902 N/A GLY 26.A N PHE 22.A O no hydrogen 2.764 N/A ALA 27.A N ALA 23.A O no hydrogen 2.864 N/A SER 28.A N GLU 24.A O no hydrogen 3.081 N/A SER 28.A OG LYS 25.A O no hydrogen 2.710 N/A LEU 29.A N LYS 25.A O no hydrogen 3.211 N/A LEU 29.A N GLY 26.A O no hydrogen 2.982 N/A GLY 30.A N ALA 27.A O no hydrogen 3.006 N/A MET 31.A N GLY 26.A O no hydrogen 2.977 N/A LYS 32.A N LYS 7.A O no hydrogen 2.753 N/A LEU 33.A N GLU 56.A O no hydrogen 2.976 N/A VAL 34.A N ALA 9.A O no hydrogen 2.784 N/A LEU 35.A N ILE 58.A O no hydrogen 2.954 N/A ALA 36.A N ILE 11.A O no hydrogen 2.884 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.812 N/A ALA 42.A N ASP 39.A OD1 no hydrogen 3.230 N/A LEU 43.A N ASP 39.A O no hydrogen 2.935 N/A ALA 44.A N GLU 40.A O no hydrogen 2.943 N/A ARG 45.A N GLY 41.A O no hydrogen 2.977 N/A THR 46.A N ALA 42.A O no hydrogen 2.936 N/A THR 46.A OG1 ALA 14.A O no hydrogen 3.524 N/A THR 46.A OG1 GLY 15.A O no hydrogen 3.352 N/A THR 46.A OG1 ALA 42.A O no hydrogen 2.924 N/A VAL 47.A N LEU 43.A O no hydrogen 2.927 N/A ASP 48.A N ALA 44.A O no hydrogen 3.050 N/A THR 49.A N ARG 45.A O no hydrogen 2.910 N/A THR 49.A OG1 ARG 45.A O no hydrogen 3.032 N/A LEU 50.A N THR 46.A O no hydrogen 2.914 N/A ARG 51.A N VAL 47.A O no hydrogen 2.941 N/A ARG 51.A NH2 VAL 57.A O no hydrogen 2.893 N/A ALA 52.A N ASP 48.A O no hydrogen 2.936 N/A ALA 53.A N THR 49.A O no hydrogen 3.190 N/A ALA 53.A N LEU 50.A O no hydrogen 3.006 N/A GLY 54.A N ARG 51.A O no hydrogen 2.924 N/A ALA 55.A N LEU 50.A O no hydrogen 3.066 N/A ILE 58.A N LEU 33.A O no hydrogen 2.972 N/A VAL 60.A N LEU 35.A O no hydrogen 2.843 N/A THR 62.A N ASP 37.A O no hydrogen 2.919 N/A THR 62.A OG1 VAL 60.A O no hydrogen 2.858 N/A ASP 63.A N GLN 69.A OE1 no hydrogen 2.810 N/A SER 65.A N ASP 63.A OD1 no hydrogen 3.042 N/A SER 65.A OG ASP 63.A OD1 no hydrogen 2.715 N/A SER 65.A OG ASP 63.A OD2 no hydrogen 3.220 N/A ASN 66.A N ASP 63.A O no hydrogen 2.905 N/A GLN 69.A N ASN 66.A OD1 no hydrogen 2.956 N/A VAL 70.A N ASN 66.A O no hydrogen 3.027 N/A GLN 71.A N GLY 67.A O no hydrogen 2.921 N/A GLN 71.A NE2 ASP 75.A OD1 no hydrogen 2.896 N/A ALA 72.A N ALA 68.A O no hydrogen 2.897 N/A LEU 73.A N GLN 69.A O no hydrogen 2.883 N/A ALA 74.A N VAL 70.A O no hydrogen 3.098 N/A ASP 75.A N GLN 71.A O no hydrogen 2.932 N/A ALA 76.A N ALA 72.A O no hydrogen 2.877 N/A ALA 77.A N LEU 73.A O no hydrogen 2.926 N/A LEU 78.A N ALA 74.A O no hydrogen 2.972 N/A GLU 79.A N ASP 75.A O no hydrogen 3.017 N/A ALA 80.A N ALA 76.A O no hydrogen 3.041 N/A PHE 81.A N ALA 77.A O no hydrogen 2.938 N/A GLY 82.A N LEU 78.A O no hydrogen 2.762 N/A LYS 83.A NZ GLU 134.A OE1 no hydrogen 3.011 N/A VAL 84.A N GLN 132.A OE1 no hydrogen 2.959 N/A HIS 85.A N VAL 8.A O no hydrogen 2.904 N/A HIS 85.A NE2 GLU 134.A OE2 no hydrogen 2.882 N/A LEU 86.A N VAL 8.A O no hydrogen 2.985 N/A LEU 87.A N HIS 137.A O no hydrogen 3.102 N/A PHE 88.A N VAL 10.A O no hydrogen 2.855 N/A ASN 89.A N VAL 139.A O no hydrogen 2.898 N/A ASN 89.A ND2 ASN 140.A OD1 no hydrogen 2.863 N/A ASN 90.A N THR 12.A OG1 no hydrogen 2.843 N/A ASN 90.A ND2 THR 12.A O no hydrogen 3.052 N/A ALA 91.A N THR 12.A OG1 no hydrogen 2.938 N/A VAL 93.A N ASN 114.A OD1 no hydrogen 2.877 N/A GLY 97.A N SER 152.A O no hydrogen 2.778 N/A PHE 98.A N SER 215.A OG no hydrogen 2.963 N/A GLU 101.A N PHE 98.A O no hydrogen 2.926 N/A SER 102.A N LEU 99.A O no hydrogen 3.384 N/A SER 103.A N ASP 106.A OD2 no hydrogen 3.069 N/A SER 103.A OG ASN 208.A OD1 no hydrogen 2.617 N/A ASN 105.A ND2 ARG 207.A O no hydrogen 3.054 N/A ASP 106.A N SER 103.A OG no hydrogen 2.976 N/A TRP 107.A N SER 103.A O no hydrogen 3.289 N/A ALA 108.A N ALA 104.A O no hydrogen 2.965 N/A TRP 109.A N ASN 105.A O no hydrogen 2.781 N/A VAL 110.A N ASP 106.A O no hydrogen 3.019 N/A PHE 111.A N TRP 107.A O no hydrogen 3.000 N/A GLY 112.A N ALA 108.A O no hydrogen 2.868 N/A VAL 113.A N TRP 109.A O no hydrogen 3.141 N/A ASN 114.A N VAL 110.A O no hydrogen 2.808 N/A ASN 114.A ND2 VAL 93.A O no hydrogen 2.880 N/A ASN 114.A ND2 SER 159.A OG no hydrogen 3.061 N/A VAL 115.A N PHE 111.A O no hydrogen 3.058 N/A MET 116.A N PHE 111.A O no hydrogen 2.995 N/A GLY 117.A N GLY 112.A O no hydrogen 3.087 N/A ALA 119.A N VAL 115.A O no hydrogen 2.775 N/A HIS 120.A N MET 116.A O no hydrogen 2.732 N/A GLY 121.A N GLY 117.A O no hydrogen 3.067 N/A VAL 122.A N VAL 118.A O no hydrogen 2.970 N/A ARG 123.A N ALA 119.A O no hydrogen 2.858 N/A ARG 123.A NH2 HIS 120.A ND1 no hydrogen 3.049 N/A VAL 124.A N HIS 120.A O no hydrogen 2.846 N/A PHE 125.A N GLY 121.A O no hydrogen 2.881 N/A ALA 126.A N VAL 122.A O no hydrogen 2.976 N/A MET 129.A N PHE 125.A O no hydrogen 2.877 N/A LEU 130.A N ALA 126.A O no hydrogen 2.762 N/A GLY 131.A N PRO 127.A O no hydrogen 2.886 N/A GLN 132.A N MET 129.A O no hydrogen 3.171 N/A GLN 132.A NE2 VAL 84.A O no hydrogen 2.931 N/A ALA 136.A N GLU 180.A O no hydrogen 3.172 N/A HIS 137.A N HIS 85.A O no hydrogen 2.912 N/A HIS 137.A NE2 SER 184.A OG no hydrogen 2.761 N/A ILE 138.A N GLY 182.A O no hydrogen 2.932 N/A VAL 139.A N LEU 87.A O no hydrogen 2.743 N/A ASN 140.A N SER 184.A O no hydrogen 3.105 N/A ASN 140.A ND2 THR 167.A OG1 no hydrogen 2.817 N/A THR 141.A N ASN 89.A O no hydrogen 3.111 N/A THR 141.A OG1 ASN 90.A OD1 no hydrogen 2.841 N/A ALA 142.A N LEU 186.A O no hydrogen 2.734 N/A VAL 144.A N PRO 188.A O no hydrogen 2.937 N/A ALA 145.A N SER 143.A OG no hydrogen 2.861 N/A GLY 146.A N SER 143.A O no hydrogen 2.779 N/A LEU 147.A N VAL 144.A O no hydrogen 2.832 N/A ASN 157.A N MET 153.A O no hydrogen 2.756 N/A ASN 157.A ND2 PRO 150.A O no hydrogen 2.897 N/A ALA 158.A N GLY 154.A O no hydrogen 2.896 N/A SER 159.A N ILE 155.A O no hydrogen 2.995 N/A SER 159.A OG TYR 156.A O no hydrogen 2.681 N/A LYS 160.A N TYR 156.A O no hydrogen 2.954 N/A LYS 160.A NZ THR 141.A O no hydrogen 3.032 N/A LYS 160.A NZ ALA 142.A O no hydrogen 3.183 N/A HIS 161.A N ASN 157.A O no hydrogen 2.827 N/A HIS 161.A NE2 LEU 148.A O no hydrogen 2.760 N/A ALA 162.A N ALA 158.A O no hydrogen 3.008 N/A VAL 163.A N SER 159.A O no hydrogen 3.088 N/A VAL 164.A N LYS 160.A O no hydrogen 2.917 N/A SER 165.A N HIS 161.A O no hydrogen 3.016 N/A LEU 166.A N ALA 162.A O no hydrogen 2.904 N/A THR 167.A N VAL 163.A O no hydrogen 2.989 N/A THR 167.A OG1 VAL 163.A O no hydrogen 2.704 N/A GLU 168.A N VAL 164.A O no hydrogen 2.903 N/A THR 169.A N SER 165.A O no hydrogen 2.855 N/A THR 169.A OG1 SER 165.A O no hydrogen 2.899 N/A LEU 170.A N LEU 166.A O no hydrogen 2.834 N/A TYR 171.A N THR 167.A O no hydrogen 2.958 N/A HIS 172.A N GLU 168.A O no hydrogen 3.311 N/A ASP 173.A N THR 169.A O no hydrogen 2.814 N/A LEU 174.A N LEU 170.A O no hydrogen 2.818 N/A ARG 175.A N TYR 171.A O no hydrogen 3.343 N/A ASN 176.A N HIS 172.A O no hydrogen 2.881 N/A ALA 177.A N ASP 173.A O no hydrogen 2.830 N/A GLY 178.A N LEU 174.A O no hydrogen 3.001 N/A GLY 178.A N ARG 175.A O no hydrogen 3.019 N/A GLY 182.A N ALA 136.A O no hydrogen 3.001 N/A CYS 183.A SG THR 167.A O no hydrogen 3.756 N/A SER 184.A N ILE 138.A O no hydrogen 2.875 N/A SER 184.A OG HIS 137.A NE2 no hydrogen 2.761 N/A SER 184.A OG ARG 249.A O no hydrogen 2.656 N/A LEU 185.A N PHE 250.A O no hydrogen 2.748 N/A LEU 186.A N ASN 140.A O no hydrogen 2.966 N/A CYS 187.A N ILE 252.A O no hydrogen 2.892 N/A ALA 189.A N HIS 255.A ND1 no hydrogen 3.185 N/A ILE 195.A N THR 193.A OG1 no hydrogen 3.207 N/A ASP 197.A N GLY 194.A O no hydrogen 2.826 N/A ALA 198.A N ILE 195.A O no hydrogen 3.265 N/A ARG 200.A N ASP 197.A O no hydrogen 3.040 N/A ARG 200.A NH1 GLY 194.A O no hydrogen 2.878 N/A ARG 200.A NH1 ASP 197.A O no hydrogen 2.816 N/A VAL 201.A N ALA 198.A O no hydrogen 2.953 N/A ARG 202.A N GLU 199.A O no hydrogen 3.081 N/A ARG 202.A NE GLU 199.A OE1 no hydrogen 2.790 N/A ARG 202.A NH1 ASP 106.A OD1 no hydrogen 2.873 N/A ARG 202.A NH1 LEU 206.A O no hydrogen 3.010 N/A ARG 202.A NH2 ASP 106.A OD1 no hydrogen 2.852 N/A ARG 202.A NH2 GLU 199.A OE1 no hydrogen 3.506 N/A ARG 202.A NH2 GLU 199.A OE2 no hydrogen 2.732 N/A LEU 206.A N PRO 203.A O no hydrogen 2.965 N/A ARG 207.A N GLU 204.A O no hydrogen 3.101 N/A ASN 208.A ND2 ASP 106.A OD1 no hydrogen 2.785 N/A THR 213.A N GLN 216.A OE1 no hydrogen 2.911 N/A THR 213.A OG1 GLU 101.A OE1 no hydrogen 2.679 N/A SER 215.A OG GLU 101.A OE1 no hydrogen 2.459 N/A GLN 216.A N THR 213.A OG1 no hydrogen 3.264 N/A GLN 216.A NE2 GLU 101.A O no hydrogen 3.204 N/A LEU 217.A N THR 213.A O no hydrogen 2.910 N/A ALA 218.A N ARG 214.A O no hydrogen 2.990 N/A ALA 219.A N SER 215.A O no hydrogen 2.901 N/A ASP 220.A N GLN 216.A O no hydrogen 2.967 N/A ARG 221.A N LEU 217.A O no hydrogen 2.996 N/A GLN 222.A N ALA 218.A O no hydrogen 2.902 N/A LEU 223.A N ALA 219.A O no hydrogen 2.932 N/A GLN 224.A N ASP 220.A O no hydrogen 3.101 N/A GLN 224.A NE2 ASP 220.A O no hydrogen 3.480 N/A GLN 224.A NE2 ASP 220.A OD1 no hydrogen 3.096 N/A ARG 225.A N ARG 221.A O no hydrogen 3.187 N/A ARG 225.A NH1 GLN 222.A OE1 no hydrogen 3.508 N/A ALA 226.A N GLN 222.A O no hydrogen 2.969 N/A VAL 227.A N LEU 223.A O no hydrogen 2.792 N/A ARG 228.A N GLN 224.A O no hydrogen 2.892 N/A SER 229.A N ARG 225.A O no hydrogen 3.213 N/A SER 229.A N ALA 226.A O no hydrogen 3.311 N/A SER 229.A OG ARG 225.A O no hydrogen 2.846 N/A SER 229.A OG ALA 226.A O no hydrogen 3.176 N/A GLY 230.A N VAL 227.A O no hydrogen 3.274 N/A GLY 233.A N ASP 236.A OD2 no hydrogen 3.025 N/A VAL 237.A N GLY 233.A O no hydrogen 3.100 N/A ALA 238.A N ALA 234.A O no hydrogen 2.892 N/A THR 239.A N THR 235.A O no hydrogen 2.993 N/A THR 239.A OG1 THR 235.A O no hydrogen 3.107 N/A LEU 240.A N ASP 236.A O no hydrogen 2.940 N/A THR 241.A N VAL 237.A O no hydrogen 2.847 N/A THR 241.A OG1 VAL 237.A O no hydrogen 2.716 N/A PHE 242.A N ALA 238.A O no hydrogen 2.960 N/A GLU 243.A N THR 239.A O no hydrogen 3.043 N/A ALA 244.A N LEU 240.A O no hydrogen 3.082 N/A ILE 245.A N THR 241.A O no hydrogen 2.959 N/A ALA 246.A N PHE 242.A O no hydrogen 2.986 N/A GLU 247.A N GLU 243.A O no hydrogen 3.267 N/A ARG 248.A N ILE 245.A O no hydrogen 2.856 N/A ARG 249.A N ALA 244.A O no hydrogen 2.927 N/A TYR 251.A OH GLU 168.A OE1 no hydrogen 2.528 N/A ILE 252.A N LEU 185.A O no hydrogen 2.889 N/A THR 254.A OG1 HIS 255.A ND1 no hydrogen 2.610 N/A HIS 255.A ND1 THR 254.A OG1 no hydrogen 2.610 N/A ILE 258.A N HIS 255.A O no hydrogen 3.046 N/A LEU 259.A N PRO 256.A O no hydrogen 3.029 N/A VAL 262.A N ILE 258.A O no hydrogen 3.080 N/A ARG 263.A N LEU 259.A O no hydrogen 2.823 N/A ARG 263.A NH1 GLU 270.A OE1 no hydrogen 3.219 N/A ARG 263.A NH1 GLU 270.A OE2 no hydrogen 3.230 N/A ARG 263.A NH2 GLU 270.A OE2 no hydrogen 2.991 N/A LEU 264.A N ALA 260.A O no hydrogen 3.122 N/A ARG 265.A N THR 261.A O no hydrogen 3.209 N/A HIS 266.A N VAL 262.A O no hydrogen 2.954 N/A GLU 267.A N ARG 263.A O no hydrogen 2.807 N/A ASP 268.A N LEU 264.A O no hydrogen 2.968 N/A ILE 269.A N ARG 265.A O no hydrogen 3.138 N/A GLU 270.A N HIS 266.A O no hydrogen 2.910 N/A LEU 271.A N GLU 267.A O no hydrogen 2.896 N/A GLN 272.A N ILE 269.A O no hydrogen 2.986 N/A ARG 273.A N ASP 268.A O no hydrogen 2.886 N/A ARG 273.A NE ASP 268.A OD1 no hydrogen 2.901 N/A ARG 273.A NH1 GLU 267.A OE1 no hydrogen 3.338 N/A ARG 273.A NH2 GLU 267.A OE1 no hydrogen 2.789 N/A ARG 273.A NH2 ASP 268.A OD1 no hydrogen 2.713 N/A THR 276.A N ASP 268.A OD2 no hydrogen 2.803 N/A THR 276.A OG1 ASP 268.A OD1 no hydrogen 2.859 N/A