Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xgs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 7.A N THR 3.A O no hydrogen 2.713 N/A LYS 8.A N GLU 4.A O no hydrogen 2.810 N/A ALA 9.A N LYS 5.A O no hydrogen 2.780 N/A GLY 10.A N LEU 6.A O no hydrogen 2.969 N/A GLU 11.A N MET 7.A O no hydrogen 3.043 N/A ILE 12.A N LYS 8.A O no hydrogen 3.180 N/A ALA 13.A N ALA 9.A O no hydrogen 2.981 N/A LYS 14.A N GLY 10.A O no hydrogen 2.869 N/A LYS 15.A N GLU 11.A O no hydrogen 3.065 N/A LYS 15.A NZ GLU 11.A OE2 no hydrogen 3.470 N/A VAL 16.A N ILE 12.A O no hydrogen 3.018 N/A ARG 17.A N ALA 13.A O no hydrogen 2.799 N/A ARG 17.A NE GLU 18.A OE2 no hydrogen 2.931 N/A ARG 17.A NH1 THR 94.A OG1 no hydrogen 2.907 N/A ARG 17.A NH1 THR 294.A O no hydrogen 2.708 N/A ARG 17.A NH2 GLU 18.A OE2 no hydrogen 2.767 N/A ARG 17.A NH2 THR 294.A O no hydrogen 3.462 N/A GLU 18.A N LYS 14.A O no hydrogen 2.773 N/A LYS 19.A N LYS 15.A O no hydrogen 2.992 N/A ALA 20.A N VAL 16.A O no hydrogen 2.938 N/A ILE 21.A N ARG 17.A O no hydrogen 3.218 N/A LEU 23.A N LYS 19.A O no hydrogen 3.202 N/A ALA 24.A N ILE 21.A O no hydrogen 3.169 N/A ARG 25.A N LEU 23.A O no hydrogen 2.763 N/A GLY 27.A N LEU 73.A O no hydrogen 2.789 N/A MET 28.A N ARG 25.A O no hydrogen 3.234 N/A LEU 30.A N THR 71.A O no hydrogen 2.949 N/A LEU 33.A N LEU 29.A O no hydrogen 2.936 N/A ALA 34.A N LEU 30.A O no hydrogen 2.815 N/A GLU 35.A N LEU 31.A O no hydrogen 3.003 N/A SER 36.A N GLU 32.A O no hydrogen 3.015 N/A SER 36.A OG GLU 32.A O no hydrogen 2.836 N/A ILE 37.A N LEU 33.A O no hydrogen 3.093 N/A GLU 38.A N ALA 34.A O no hydrogen 2.993 N/A LYS 39.A N GLU 35.A O no hydrogen 3.004 N/A LYS 39.A NZ GLU 35.A O no hydrogen 2.903 N/A MET 40.A N SER 36.A O no hydrogen 2.929 N/A ILE 41.A N ILE 37.A O no hydrogen 3.017 N/A MET 42.A N GLU 38.A O no hydrogen 3.331 N/A GLU 43.A N LYS 39.A O no hydrogen 2.867 N/A LEU 44.A N MET 40.A O no hydrogen 2.920 N/A GLY 45.A N MET 42.A O no hydrogen 3.193 N/A GLY 46.A N ILE 41.A O no hydrogen 2.950 N/A LYS 47.A N HIS 86.A O no hydrogen 3.241 N/A ALA 49.A N GLY 84.A O no hydrogen 2.974 N/A VAL 52.A N GLU 38.A OE2 no hydrogen 2.928 N/A ASN 53.A N ASP 82.A O no hydrogen 3.141 N/A ASN 53.A ND2 PRO 51.A O no hydrogen 2.780 N/A LEU 54.A N TYR 63.A O no hydrogen 2.756 N/A SER 55.A N LYS 80.A O no hydrogen 2.941 N/A ASN 57.A N TYR 78.A O no hydrogen 2.889 N/A ASN 57.A ND2 ASP 77.A OD2 no hydrogen 3.374 N/A GLU 58.A N GLU 58.A OE2 no hydrogen 3.109 N/A ILE 59.A N ILE 56.A O no hydrogen 3.043 N/A ALA 60.A N LEU 268.A O no hydrogen 2.741 N/A ALA 61.A N LEU 268.A O no hydrogen 3.475 N/A HIS 62.A N ASN 53.A OD1 no hydrogen 2.893 N/A TYR 63.A OH ASP 69.A OD1 no hydrogen 2.649 N/A THR 64.A OG1 VAL 52.A O no hydrogen 2.552 N/A LYS 67.A N GLN 241.A OE1 no hydrogen 2.908 N/A ASP 69.A N TYR 66.A O no hydrogen 2.934 N/A THR 71.A N ASP 69.A OD2 no hydrogen 3.068 N/A THR 71.A OG1 ASP 69.A OD2 no hydrogen 2.888 N/A LEU 73.A N MET 28.A O no hydrogen 2.872 N/A LYS 74.A N ASP 77.A OD1 no hydrogen 2.991 N/A GLY 76.A N VAL 100.A O no hydrogen 2.868 N/A ASP 77.A N LYS 74.A O no hydrogen 3.167 N/A TYR 78.A N ASN 57.A OD1 no hydrogen 2.861 N/A TYR 78.A OH ASP 105.A OD2 no hydrogen 2.599 N/A LEU 79.A N VAL 98.A O no hydrogen 2.782 N/A LYS 80.A N SER 55.A O no hydrogen 2.803 N/A LYS 80.A NZ SER 55.A O no hydrogen 3.007 N/A LYS 80.A NZ ASN 57.A O no hydrogen 3.093 N/A LYS 80.A NZ ILE 59.A O no hydrogen 2.988 N/A LYS 80.A NZ TYR 78.A O no hydrogen 3.517 N/A LYS 80.A NZ VAL 276.A O no hydrogen 3.073 N/A ILE 81.A N VAL 96.A O no hydrogen 2.899 N/A ASP 82.A N ASN 53.A O no hydrogen 3.044 N/A VAL 83.A N THR 94.A O no hydrogen 2.790 N/A VAL 85.A N ALA 92.A O no hydrogen 2.927 N/A HIS 86.A N LYS 47.A O no hydrogen 2.866 N/A ILE 87.A N PHE 90.A O no hydrogen 2.873 N/A PHE 90.A N ILE 87.A O no hydrogen 3.189 N/A ALA 92.A N VAL 85.A O no hydrogen 2.867 N/A ASP 93.A N THR 282.A OG1 no hydrogen 2.759 N/A THR 94.A N VAL 83.A O no hydrogen 2.929 N/A THR 94.A OG1 GLU 280.A O no hydrogen 2.765 N/A ALA 95.A N GLU 280.A O no hydrogen 3.110 N/A VAL 96.A N ILE 81.A O no hydrogen 3.041 N/A THR 97.A OG1 GLN 278.A O no hydrogen 2.639 N/A VAL 98.A N LEU 79.A O no hydrogen 2.876 N/A ARG 99.A NE GLU 103.A O no hydrogen 2.969 N/A ARG 99.A NH2 GLU 103.A O no hydrogen 2.761 N/A VAL 100.A N ASP 77.A O no hydrogen 2.771 N/A MET 102.A N ARG 99.A O no hydrogen 2.729 N/A MET 108.A N ASP 105.A OD1 no hydrogen 3.153 N/A GLU 109.A N ASP 105.A O no hydrogen 2.900 N/A ALA 110.A N GLU 106.A O no hydrogen 2.912 N/A ALA 111.A N LEU 107.A O no hydrogen 3.329 N/A LYS 112.A N MET 108.A O no hydrogen 3.048 N/A LYS 112.A NZ GLU 104.A OE2 no hydrogen 3.420 N/A GLU 113.A N GLU 109.A O no hydrogen 2.822 N/A ALA 114.A N ALA 110.A O no hydrogen 2.822 N/A LEU 115.A N ALA 111.A O no hydrogen 3.101 N/A ASN 116.A N LYS 112.A O no hydrogen 3.022 N/A ALA 117.A N GLU 113.A O no hydrogen 2.876 N/A ALA 118.A N ALA 114.A O no hydrogen 3.074 N/A ILE 119.A N LEU 115.A O no hydrogen 3.074 N/A SER 120.A N ASN 116.A O no hydrogen 3.051 N/A SER 120.A OG ASN 116.A O no hydrogen 3.436 N/A SER 120.A OG ALA 117.A O no hydrogen 2.860 N/A VAL 121.A N ALA 118.A O no hydrogen 3.307 N/A ALA 122.A N ALA 118.A O no hydrogen 3.091 N/A ALA 122.A N ILE 119.A O no hydrogen 3.157 N/A ALA 124.A N GLU 286.A O no hydrogen 2.846 N/A GLY 125.A N LEU 178.A O no hydrogen 2.828 N/A VAL 126.A N ARG 123.A O no hydrogen 3.470 N/A ILE 128.A N TYR 176.A O no hydrogen 2.829 N/A LYS 129.A N ASP 174.A O no hydrogen 2.984 N/A LYS 129.A NZ GLU 127.A OE2 no hydrogen 2.745 N/A LYS 129.A NZ PRO 172.A O no hydrogen 2.904 N/A GLU 130.A N GLU 127.A O no hydrogen 3.072 N/A LEU 131.A N ILE 128.A O no hydrogen 2.852 N/A GLY 132.A N ILE 128.A O no hydrogen 3.143 N/A LYS 133.A N LYS 129.A O no hydrogen 2.866 N/A ALA 134.A N GLU 130.A O no hydrogen 3.255 N/A ILE 135.A N LEU 131.A O no hydrogen 2.951 N/A GLU 136.A N GLY 132.A O no hydrogen 2.925 N/A ASN 137.A N LYS 133.A O no hydrogen 2.833 N/A GLU 138.A N ALA 134.A O no hydrogen 3.329 N/A ILE 139.A N ILE 135.A O no hydrogen 3.170 N/A ARG 140.A N GLU 136.A O no hydrogen 2.920 N/A ARG 140.A NE GLU 136.A OE1 no hydrogen 2.846 N/A ARG 140.A NH1 GLU 136.A OE1 no hydrogen 3.219 N/A LYS 141.A N ASN 137.A O no hydrogen 2.976 N/A LYS 141.A NZ GLU 138.A OE1 no hydrogen 3.201 N/A LYS 141.A NZ GLU 138.A OE2 no hydrogen 2.882 N/A ARG 142.A N ILE 139.A O no hydrogen 3.331 N/A ARG 142.A NE GLU 109.A OE1 no hydrogen 3.228 N/A ARG 142.A NH1 GLU 138.A O no hydrogen 2.997 N/A ARG 142.A NH1 GLU 138.A OE2 no hydrogen 2.778 N/A GLY 143.A N ARG 140.A O no hydrogen 2.881 N/A PHE 144.A N ILE 139.A O no hydrogen 3.202 N/A LYS 145.A N THR 191.A O no hydrogen 2.993 N/A LYS 145.A NZ ILE 192.A O no hydrogen 3.228 N/A LYS 145.A NZ GLY 193.A O no hydrogen 2.648 N/A ILE 147.A N PHE 189.A O no hydrogen 3.088 N/A VAL 148.A N GLY 195.A O no hydrogen 2.955 N/A ASN 149.A ND2 VAL 197.A O no hydrogen 2.891 N/A GLY 152.A N ILE 166.A O no hydrogen 2.973 N/A HIS 153.A N ALA 185.A O no hydrogen 2.888 N/A HIS 153.A ND1 LEU 160.A O no hydrogen 2.703 N/A LYS 154.A N ILE 164.A O no hydrogen 2.788 N/A LYS 154.A NZ GLU 156.A OE1 no hydrogen 3.129 N/A ILE 155.A N VAL 183.A O no hydrogen 2.820 N/A GLU 156.A N LYS 159.A O no hydrogen 2.921 N/A ARG 157.A NE ASP 88.A O no hydrogen 2.910 N/A TYR 158.A N GLY 89.A O no hydrogen 2.865 N/A LYS 159.A N GLU 156.A O no hydrogen 2.869 N/A ALA 162.A N LYS 154.A O no hydrogen 2.828 N/A ILE 166.A N GLY 152.A O no hydrogen 3.041 N/A ASN 168.A ND2 GLU 187.A O no hydrogen 3.623 N/A TYR 170.A N GLU 136.A OE2 no hydrogen 2.848 N/A ARG 171.A NE ASP 174.A OD1 no hydrogen 3.266 N/A ARG 171.A NE ASP 174.A OD2 no hydrogen 3.000 N/A ARG 171.A NH2 ASP 174.A OD1 no hydrogen 2.820 N/A ASP 174.A N ARG 171.A O no hydrogen 3.104 N/A TYR 176.A OH ASP 182.A OD2 no hydrogen 2.570 N/A LEU 178.A N VAL 126.A O no hydrogen 2.848 N/A LYS 179.A N ASP 182.A OD2 no hydrogen 2.987 N/A LYS 179.A NZ VAL 177.A O no hydrogen 2.605 N/A GLY 181.A N VAL 285.A O no hydrogen 2.831 N/A ASP 182.A N LYS 179.A O no hydrogen 3.016 N/A PHE 184.A N ILE 283.A O no hydrogen 3.106 N/A ALA 185.A N HIS 153.A O no hydrogen 2.895 N/A ILE 186.A N HIS 281.A O no hydrogen 2.963 N/A PHE 189.A N ASN 168.A OD1 no hydrogen 3.397 N/A ALA 190.A N ALA 277.A O no hydrogen 2.894 N/A THR 191.A N LYS 145.A O no hydrogen 2.878 N/A THR 191.A OG1 ILE 275.A O no hydrogen 2.664 N/A GLY 193.A N THR 191.A OG1 no hydrogen 2.992 N/A GLY 195.A N GLU 270.A OE2 no hydrogen 2.843 N/A GLN 196.A N GLU 270.A OE2 no hydrogen 3.316 N/A VAL 197.A N ASN 149.A OD1 no hydrogen 2.986 N/A ILE 198.A N LYS 269.A O no hydrogen 2.861 N/A VAL 200.A N VAL 267.A O no hydrogen 2.854 N/A TYR 206.A N PHE 235.A O no hydrogen 2.868 N/A MET 207.A N TYR 263.A O no hydrogen 2.999 N/A VAL 209.A N ALA 261.A O no hydrogen 2.748 N/A ARG 210.A N ALA 261.A O no hydrogen 3.311 N/A ARG 215.A NH1 PRO 213.A O no hydrogen 3.148 N/A GLN 218.A NE2 GLN 218.A O no hydrogen 2.951 N/A ARG 220.A N VAL 216.A O no hydrogen 2.935 N/A ARG 220.A NH1 VAL 214.A O no hydrogen 2.967 N/A ARG 220.A NH1 ARG 215.A O no hydrogen 3.171 N/A PHE 221.A N ALA 217.A O no hydrogen 2.919 N/A LEU 222.A N GLN 218.A O no hydrogen 2.839 N/A LEU 223.A N ALA 219.A O no hydrogen 2.802 N/A ALA 224.A N ARG 220.A O no hydrogen 3.054 N/A LYS 225.A N PHE 221.A O no hydrogen 3.043 N/A LYS 225.A NZ GLU 229.A OE1 no hydrogen 3.174 N/A ILE 226.A N LEU 222.A O no hydrogen 2.948 N/A LYS 227.A N LEU 223.A O no hydrogen 2.925 N/A LYS 227.A NZ ASP 211.A OD2 no hydrogen 3.299 N/A ARG 228.A N ALA 224.A O no hydrogen 3.108 N/A GLU 229.A N LYS 225.A O no hydrogen 2.741 N/A TYR 230.A N ILE 226.A O no hydrogen 2.777 N/A GLY 231.A N ILE 226.A O no hydrogen 3.083 N/A THR 232.A OG1 TYR 158.A O no hydrogen 2.733 N/A LEU 233.A N TYR 230.A O no hydrogen 3.152 N/A PHE 235.A N TYR 206.A O no hydrogen 2.774 N/A TYR 237.A N LEU 204.A O no hydrogen 2.928 N/A ARG 238.A NE PRO 65.A O no hydrogen 2.779 N/A ARG 238.A NH1 GLU 35.A OE2 no hydrogen 3.013 N/A ARG 238.A NH1 GLU 38.A OE1 no hydrogen 2.888 N/A ARG 238.A NH2 GLU 38.A OE2 no hydrogen 2.885 N/A ARG 238.A NH2 THR 64.A OG1 no hydrogen 2.928 N/A TRP 239.A N ALA 236.A O no hydrogen 3.199 N/A TRP 239.A NE1 GLU 38.A OE1 no hydrogen 2.996 N/A LEU 240.A N TYR 237.A O no hydrogen 2.887 N/A GLN 241.A N ARG 238.A O no hydrogen 3.267 N/A GLN 241.A NE2 LYS 67.A O no hydrogen 3.474 N/A ASP 243.A N LEU 240.A O no hydrogen 3.168 N/A LEU 249.A N PRO 245.A O no hydrogen 2.941 N/A LYS 250.A N GLU 246.A O no hydrogen 2.771 N/A LYS 250.A NZ TYR 237.A OH no hydrogen 2.855 N/A LYS 250.A NZ GLU 246.A OE2 no hydrogen 3.328 N/A LEU 251.A N GLY 247.A O no hydrogen 3.259 N/A ALA 252.A N GLN 248.A O no hydrogen 2.993 N/A LEU 253.A N LEU 249.A O no hydrogen 2.954 N/A LYS 254.A N LYS 250.A O no hydrogen 2.927 N/A THR 255.A N LEU 251.A O no hydrogen 3.015 N/A THR 255.A OG1 LEU 251.A O no hydrogen 3.097 N/A LEU 256.A N ALA 252.A O no hydrogen 3.097 N/A GLU 257.A N LEU 253.A O no hydrogen 2.960 N/A LYS 258.A N LYS 254.A O no hydrogen 2.853 N/A ALA 259.A N THR 255.A O no hydrogen 2.910 N/A GLY 260.A N GLU 257.A O no hydrogen 2.889 N/A ALA 261.A N LEU 256.A O no hydrogen 2.905 N/A TYR 263.A N MET 207.A O no hydrogen 2.849 N/A TYR 265.A N ILE 205.A O no hydrogen 2.940 N/A VAL 267.A N PRO 202.A O no hydrogen 3.223 N/A LEU 268.A N ALA 61.A O no hydrogen 2.938 N/A LYS 269.A N ILE 198.A O no hydrogen 2.950 N/A LYS 269.A NZ GLU 270.A O no hydrogen 3.412 N/A LYS 269.A NZ ASN 273.A OD1 no hydrogen 3.108 N/A GLU 270.A N GLU 58.A O no hydrogen 2.830 N/A ILE 271.A N GLN 196.A O no hydrogen 2.794 N/A ARG 272.A N GLU 270.A OE1 no hydrogen 2.812 N/A ASN 273.A N GLU 270.A O no hydrogen 2.704 N/A GLY 274.A N GLU 270.A OE1 no hydrogen 2.952 N/A VAL 276.A N ASN 57.A O no hydrogen 2.942 N/A ALA 277.A N ALA 190.A O no hydrogen 2.923 N/A GLN 278.A N THR 97.A OG1 no hydrogen 2.793 N/A GLN 278.A NE2 ASP 82.A OD1 no hydrogen 2.928 N/A PHE 279.A N PRO 188.A O no hydrogen 3.430 N/A GLU 280.A N ALA 95.A O no hydrogen 2.970 N/A HIS 281.A N ILE 186.A O no hydrogen 3.359 N/A HIS 281.A ND1 THR 294.A OG1 no hydrogen 2.752 N/A THR 282.A N THR 294.A OG1 no hydrogen 3.023 N/A THR 282.A OG1 ASP 93.A O no hydrogen 2.632 N/A ILE 283.A N PHE 184.A O no hydrogen 2.825 N/A ILE 284.A N ILE 291.A O no hydrogen 2.889 N/A VAL 285.A N ASP 182.A O no hydrogen 2.836 N/A GLU 286.A N SER 289.A O no hydrogen 2.863 N/A SER 289.A OG VAL 290.A O no hydrogen 3.541 N/A ILE 291.A N ILE 284.A O no hydrogen 2.903 N/A THR 293.A N THR 282.A O no hydrogen 3.030 N/A THR 293.A OG1 THR 282.A O no hydrogen 3.530 N/A THR 294.A OG1 HIS 281.A ND1 no hydrogen 2.752 N/A