Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gpi_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N LEU 218.A O no hydrogen 3.230 N/A TYR 2.A N LEU 218.A O no hydrogen 2.907 N/A LEU 4.A N TYR 216.A O no hydrogen 2.897 N/A VAL 5.A N VAL 179.A O no hydrogen 3.209 N/A LEU 6.A N ILE 214.A O no hydrogen 2.753 N/A ILE 7.A N ILE 181.A O no hydrogen 2.847 N/A ARG 8.A NH1 LEU 208.A O no hydrogen 2.899 N/A HIS 9.A N ALA 183.A O no hydrogen 3.324 N/A HIS 9.A ND1 GLY 10.A O no hydrogen 2.715 N/A GLU 11.A N GLU 35.A OE1 no hydrogen 3.349 N/A SER 12.A OG GLU 17.A OE1 no hydrogen 2.832 N/A ALA 13.A N ASP 27.A O no hydrogen 2.930 N/A LEU 16.A N ALA 13.A O no hydrogen 3.082 N/A ASN 18.A N ASN 15.A O no hydrogen 2.820 N/A ASN 18.A ND2 ASN 15.A OD1 no hydrogen 2.853 N/A ARG 19.A N LEU 16.A O no hydrogen 2.862 N/A ARG 19.A NE GLY 95.A O no hydrogen 2.860 N/A ARG 19.A NH1 TRP 14.A O no hydrogen 2.896 N/A ARG 19.A NH2 GLY 95.A O no hydrogen 3.146 N/A SER 21.A N LEU 16.A O no hydrogen 3.025 N/A SER 21.A OG GLU 17.A OE1 no hydrogen 2.801 N/A SER 21.A OG GLU 17.A OE2 no hydrogen 3.382 N/A TRP 23.A NE1 GLU 87.A O no hydrogen 2.784 N/A TYR 24.A N SER 21.A O no hydrogen 2.970 N/A ALA 26.A N TYR 24.A O no hydrogen 2.853 N/A LEU 28.A N ASP 27.A OD1 no hydrogen 2.770 N/A SER 29.A N GLU 11.A O no hydrogen 2.891 N/A SER 29.A OG GLU 11.A O no hydrogen 3.302 N/A SER 29.A OG GLU 11.A OE2 no hydrogen 2.656 N/A GLY 32.A N SER 29.A OG no hydrogen 3.041 N/A HIS 33.A N SER 29.A O no hydrogen 2.805 N/A GLU 34.A N PRO 30.A O no hydrogen 2.862 N/A GLU 35.A N ALA 31.A O no hydrogen 2.847 N/A ALA 36.A N GLY 32.A O no hydrogen 3.149 N/A LYS 37.A N HIS 33.A O no hydrogen 3.114 N/A ARG 38.A N GLU 34.A O no hydrogen 3.014 N/A GLY 39.A N GLU 35.A O no hydrogen 2.975 N/A GLY 40.A N ALA 36.A O no hydrogen 2.829 N/A GLN 41.A N LYS 37.A O no hydrogen 2.849 N/A ALA 42.A N ARG 38.A O no hydrogen 2.931 N/A LEU 43.A N GLY 39.A O no hydrogen 3.146 N/A ARG 44.A N GLY 40.A O no hydrogen 2.935 N/A ARG 44.A NE ASP 45.A OD1 no hydrogen 3.349 N/A ARG 44.A NH2 ASP 45.A OD1 no hydrogen 3.193 N/A ASP 45.A N GLN 41.A O no hydrogen 2.884 N/A ALA 46.A N ALA 42.A O no hydrogen 3.109 N/A GLY 47.A N ARG 44.A O no hydrogen 2.969 N/A TYR 48.A N LEU 43.A O no hydrogen 3.059 N/A PHE 50.A N GLN 74.A OE1 no hydrogen 2.918 N/A ASP 51.A N ARG 178.A O no hydrogen 2.847 N/A CYS 53.A N PRO 78.A O no hydrogen 2.970 N/A PHE 54.A N LEU 180.A O no hydrogen 2.931 N/A THR 55.A N VAL 80.A O no hydrogen 2.852 N/A THR 55.A OG1 ALA 182.A O no hydrogen 2.790 N/A SER 56.A OG HIS 184.A NE2 no hydrogen 2.695 N/A VAL 57.A N ASN 86.A OD1 no hydrogen 3.242 N/A GLN 58.A N SER 56.A OG no hydrogen 3.128 N/A GLN 58.A NE2 GLY 22.A O no hydrogen 3.006 N/A LYS 59.A N ASP 25.A OD2 no hydrogen 2.726 N/A ARG 60.A NE HIS 9.A NE2 no hydrogen 3.092 N/A ARG 60.A NH1 TYR 24.A O no hydrogen 2.865 N/A ARG 60.A NH2 GLY 22.A O no hydrogen 2.884 N/A ALA 61.A N GLN 58.A O no hydrogen 3.046 N/A ILE 62.A N GLN 58.A O no hydrogen 3.084 N/A ARG 63.A N LYS 59.A O no hydrogen 2.746 N/A ARG 63.A NE ASP 27.A OD1 no hydrogen 2.795 N/A ARG 63.A NE ASP 27.A OD2 no hydrogen 3.362 N/A ARG 63.A NH2 ASP 27.A OD2 no hydrogen 2.930 N/A THR 64.A N ARG 60.A O no hydrogen 3.274 N/A THR 64.A OG1 ARG 60.A O no hydrogen 2.772 N/A LEU 65.A N ALA 61.A O no hydrogen 2.873 N/A TRP 66.A N ILE 62.A O no hydrogen 2.757 N/A THR 67.A N ARG 63.A O no hydrogen 2.860 N/A THR 67.A OG1 HIS 33.A NE2 no hydrogen 3.378 N/A THR 67.A OG1 ARG 63.A O no hydrogen 2.771 N/A VAL 68.A N THR 64.A O no hydrogen 3.055 N/A LEU 69.A N LEU 65.A O no hydrogen 2.932 N/A ASP 70.A N TRP 66.A O no hydrogen 3.021 N/A ALA 71.A N THR 67.A O no hydrogen 3.103 N/A ILE 72.A N VAL 68.A O no hydrogen 2.959 N/A ASP 73.A N ASP 70.A O no hydrogen 3.092 N/A GLN 74.A N LEU 69.A O no hydrogen 2.755 N/A GLN 74.A NE2 TYR 48.A O no hydrogen 2.939 N/A GLN 74.A NE2 ILE 72.A O no hydrogen 3.294 N/A LEU 77.A N GLN 74.A O no hydrogen 3.150 N/A VAL 80.A N CYS 53.A O no hydrogen 2.755 N/A THR 82.A N THR 55.A O no hydrogen 2.886 N/A ARG 84.A N THR 82.A OG1 no hydrogen 3.009 N/A ARG 84.A NH1 ARG 160.A O no hydrogen 2.935 N/A LEU 85.A N THR 82.A O no hydrogen 3.115 N/A ASN 86.A N TRP 83.A O no hydrogen 2.935 N/A ASN 86.A ND2 TYR 140.A OH no hydrogen 2.990 N/A GLU 87.A N GLN 58.A OE1 no hydrogen 2.753 N/A ARG 88.A N GLU 87.A OE1 no hydrogen 2.832 N/A ARG 88.A NE GLU 152.A O no hydrogen 2.730 N/A ARG 88.A NH2 GLU 152.A O no hydrogen 3.131 N/A HIS 89.A N GLU 152.A OE1 no hydrogen 2.919 N/A GLY 91.A N HIS 89.A ND1 no hydrogen 2.964 N/A GLY 92.A N PRO 122.A O no hydrogen 2.673 N/A LEU 93.A N TYR 90.A O no hydrogen 3.201 N/A THR 94.A N GLY 91.A O no hydrogen 2.980 N/A THR 94.A OG1 GLY 91.A O no hydrogen 2.656 N/A GLY 95.A N ARG 19.A O no hydrogen 2.732 N/A LEU 96.A N LEU 93.A O no hydrogen 3.053 N/A ASN 97.A N GLU 100.A OE1 no hydrogen 3.260 N/A GLU 100.A N ASN 97.A OD1 no hydrogen 2.723 N/A THR 101.A N ASN 97.A O no hydrogen 3.023 N/A THR 101.A OG1 LYS 98.A O no hydrogen 3.189 N/A ALA 102.A N LYS 98.A O no hydrogen 3.002 N/A ALA 103.A N ALA 99.A O no hydrogen 2.812 N/A LYS 104.A N GLU 100.A O no hydrogen 3.019 N/A LYS 104.A N THR 101.A O no hydrogen 3.228 N/A HIS 105.A N THR 101.A O no hydrogen 2.844 N/A GLY 106.A N ALA 102.A O no hydrogen 2.788 N/A VAL 110.A N GLY 106.A O no hydrogen 3.177 N/A LYS 111.A N GLU 107.A O no hydrogen 2.974 N/A ILE 112.A N ALA 108.A O no hydrogen 3.181 N/A TRP 113.A N GLN 109.A O no hydrogen 2.906 N/A ARG 114.A N VAL 110.A O no hydrogen 2.938 N/A ARG 115.A N LYS 111.A O no hydrogen 3.296 N/A SER 116.A N ILE 112.A O no hydrogen 3.052 N/A VAL 119.A N SER 116.A OG no hydrogen 2.876 N/A MET 124.A N SER 150.A O no hydrogen 2.797 N/A HIS 128.A N GLU 125.A O no hydrogen 2.721 N/A HIS 128.A NE2 THR 94.A O no hydrogen 2.973 N/A PHE 130.A N HIS 128.A ND1 no hydrogen 2.874 N/A TYR 131.A N HIS 128.A O no hydrogen 2.988 N/A ILE 134.A N PHE 130.A O no hydrogen 3.004 N/A SER 135.A N TYR 131.A O no hydrogen 2.882 N/A SER 135.A OG TYR 131.A O no hydrogen 2.646 N/A LYS 136.A N SER 132.A O no hydrogen 2.793 N/A LYS 136.A NZ SER 135.A OG no hydrogen 3.055 N/A ASP 137.A N ILE 134.A O no hydrogen 2.951 N/A ARG 139.A N ASP 137.A OD2 no hydrogen 2.763 N/A ARG 139.A NE ASP 137.A OD1 no hydrogen 3.146 N/A ARG 139.A NE ASP 137.A OD2 no hydrogen 2.875 N/A ARG 139.A NH1 ASP 25.A OD1 no hydrogen 2.845 N/A ARG 139.A NH1 VAL 57.A O no hydrogen 2.904 N/A ARG 139.A NH2 ASP 25.A OD1 no hydrogen 3.243 N/A ARG 139.A NH2 ASP 137.A OD1 no hydrogen 2.837 N/A TYR 140.A N ASP 137.A O no hydrogen 2.906 N/A ALA 141.A N ARG 138.A O no hydrogen 2.939 N/A LEU 143.A N TYR 140.A O no hydrogen 3.011 N/A THR 144.A N GLN 147.A OE1 no hydrogen 2.819 N/A GLN 147.A N THR 144.A O no hydrogen 2.814 N/A GLN 147.A N THR 144.A OG1 no hydrogen 3.236 N/A LEU 148.A N THR 144.A O no hydrogen 3.020 N/A CYS 151.A SG PRO 121.A O no hydrogen 3.591 N/A CYS 151.A SG SER 150.A OG no hydrogen 3.577 N/A SER 153.A N ASP 156.A OD2 no hydrogen 2.602 N/A SER 153.A OG ASP 156.A OD2 no hydrogen 2.627 N/A LYS 155.A N TYR 117.A O no hydrogen 2.960 N/A ASP 156.A N SER 153.A OG no hydrogen 3.153 N/A THR 157.A N SER 153.A O no hydrogen 3.047 N/A THR 157.A OG1 GLU 152.A OE1 no hydrogen 2.958 N/A ILE 158.A N LEU 154.A O no hydrogen 3.016 N/A ALA 159.A N LYS 155.A O no hydrogen 3.021 N/A ARG 160.A N ASP 156.A O no hydrogen 3.070 N/A ARG 160.A N THR 157.A O no hydrogen 3.303 N/A ARG 160.A NE GLU 152.A OE2 no hydrogen 2.785 N/A ARG 160.A NH1 ARG 84.A O no hydrogen 2.823 N/A ARG 160.A NH1 ASN 86.A O no hydrogen 2.880 N/A ARG 160.A NH2 ASN 86.A O no hydrogen 3.166 N/A ARG 160.A NH2 GLU 87.A O no hydrogen 2.785 N/A ARG 160.A NH2 GLU 152.A OE1 no hydrogen 2.824 N/A ARG 160.A NH2 GLU 152.A OE2 no hydrogen 3.500 N/A ALA 161.A N THR 157.A O no hydrogen 3.015 N/A LEU 162.A N ILE 158.A O no hydrogen 2.934 N/A TRP 165.A N ALA 161.A O no hydrogen 3.204 N/A ASN 166.A N LEU 162.A O no hydrogen 2.827 N/A GLU 167.A N PRO 163.A O no hydrogen 2.878 N/A GLU 168.A N PHE 164.A O no hydrogen 2.871 N/A ILE 169.A N PHE 164.A O no hydrogen 3.256 N/A ILE 169.A N TRP 165.A O no hydrogen 3.091 N/A VAL 170.A N TRP 165.A O no hydrogen 2.853 N/A ILE 173.A N ILE 169.A O no hydrogen 3.153 N/A LYS 174.A N VAL 170.A O no hydrogen 2.833 N/A GLU 175.A N PRO 171.A O no hydrogen 3.072 N/A GLU 175.A N GLN 172.A O no hydrogen 3.119 N/A GLY 176.A N ILE 173.A O no hydrogen 2.790 N/A LYS 177.A N GLN 172.A O no hydrogen 2.979 N/A LYS 177.A NZ GLN 172.A OE1 no hydrogen 2.670 N/A ARG 178.A N ASP 51.A OD2 no hydrogen 2.712 N/A ARG 178.A NE ASP 51.A OD2 no hydrogen 2.824 N/A ARG 178.A NH1 GLU 49.A OE1 no hydrogen 3.037 N/A ARG 178.A NH2 ASP 51.A OD1 no hydrogen 2.986 N/A ARG 178.A NH2 ASP 51.A OD2 no hydrogen 3.519 N/A LEU 180.A N ILE 52.A O no hydrogen 3.121 N/A ILE 181.A N VAL 5.A O no hydrogen 2.986 N/A ALA 182.A N PHE 54.A O no hydrogen 2.999 N/A ALA 183.A N ILE 7.A O no hydrogen 3.019 N/A HIS 184.A N SER 187.A OG no hydrogen 3.178 N/A HIS 184.A ND1 HIS 9.A NE2 no hydrogen 3.151 N/A HIS 184.A NE2 SER 56.A OG no hydrogen 2.695 N/A ASN 186.A N GLU 87.A OE1 no hydrogen 3.344 N/A ASN 186.A ND2 GLU 87.A OE1 no hydrogen 2.837 N/A ASN 186.A ND2 TYR 90.A OH no hydrogen 2.983 N/A SER 187.A OG LEU 85.A O no hydrogen 2.679 N/A SER 187.A OG HIS 184.A O no hydrogen 3.254 N/A LEU 188.A N HIS 184.A O no hydrogen 2.822 N/A ARG 189.A N GLY 185.A O no hydrogen 3.050 N/A ARG 189.A NE LEU 206.A O no hydrogen 2.894 N/A ARG 189.A NH2 LEU 206.A O no hydrogen 2.947 N/A ARG 189.A NH2 ASN 207.A OD1 no hydrogen 3.130 N/A GLY 190.A N ASN 186.A O no hydrogen 3.414 N/A VAL 192.A N LEU 188.A O no hydrogen 3.023 N/A LYS 193.A N ARG 189.A O no hydrogen 2.793 N/A HIS 194.A N GLY 190.A O no hydrogen 3.159 N/A LEU 195.A N ILE 191.A O no hydrogen 2.815 N/A GLU 196.A N VAL 192.A O no hydrogen 2.865 N/A GLY 197.A N LYS 193.A O no hydrogen 2.815 N/A LEU 198.A N LYS 193.A O no hydrogen 3.336 N/A ALA 202.A N SER 199.A OG no hydrogen 2.932 N/A ILE 203.A N SER 199.A O no hydrogen 2.960 N/A MET 204.A N GLU 200.A O no hydrogen 3.328 N/A GLU 205.A N ALA 202.A O no hydrogen 3.012 N/A LEU 206.A N ALA 202.A O no hydrogen 3.172 N/A LEU 206.A N ILE 203.A O no hydrogen 3.213 N/A THR 210.A OG1 GLU 35.A OE2 no hydrogen 2.939 N/A GLY 211.A N ARG 8.A O no hydrogen 2.902 N/A ILE 214.A N LEU 6.A O no hydrogen 2.612 N/A VAL 215.A N GLN 229.A O no hydrogen 2.783 N/A TYR 216.A N LEU 4.A O no hydrogen 2.732 N/A TYR 216.A OH GLU 196.A OE2 no hydrogen 2.657 N/A LEU 218.A N TYR 2.A O no hydrogen 2.737 N/A ASP 219.A N LYS 223.A O no hydrogen 2.828 N/A ASN 221.A N ASP 219.A OD2 no hydrogen 2.836 N/A LEU 222.A N ASP 219.A O no hydrogen 2.766 N/A LYS 223.A N ASP 219.A OD2 no hydrogen 2.981 N/A LYS 223.A NZ ASN 221.A O no hydrogen 3.555 N/A ILE 225.A N GLU 217.A O no hydrogen 2.894 N/A LYS 226.A NZ GLU 217.A OE2 no hydrogen 3.439 N/A GLN 229.A N VAL 215.A O no hydrogen 2.972 N/A LEU 231.A N PRO 213.A O no hydrogen 3.125 N/A GLU 235.A N GLU 235.A OE1 no hydrogen 2.650 N/A THR 236.A N ASP 233.A OD1 no hydrogen 2.923 N/A THR 236.A OG1 ASP 233.A OD1 no hydrogen 2.411 N/A VAL 237.A N ASP 233.A O no hydrogen 2.949 N/A ARG 238.A N GLU 234.A O no hydrogen 2.960 N/A LYS 239.A N THR 236.A O no hydrogen 3.300 N/A