Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nfe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N SER 125.A O no hydrogen 2.789 N/A ILE 1.A N ASP 178.A OD2 no hydrogen 2.684 N/A VAL 2.A N ASP 173.A O no hydrogen 2.839 N/A TRP 5.A N CYS 139.A O no hydrogen 2.812 N/A CYS 7.A N LEU 137.A O no hydrogen 2.885 N/A CYS 7.A SG LEU 137.A O no hydrogen 3.487 N/A SER 11.A N GLU 8.A O no hydrogen 3.036 N/A SER 11.A OG GLU 8.A O no hydrogen 2.657 N/A GLN 12.A NE2 SER 11.A OG no hydrogen 2.966 N/A GLN 15.A N GLN 12.A O no hydrogen 2.923 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 2.952 N/A VAL 16.A N GLY 28.A O no hydrogen 2.904 N/A ALA 17.A N TRP 50.A O no hydrogen 3.020 N/A VAL 18.A N CYS 26.A O no hydrogen 2.717 N/A TYR 19.A N GLN 48.A O no hydrogen 2.804 N/A SER 20.A N TRP 23.A O no hydrogen 3.178 N/A TRP 23.A N SER 20.A O no hydrogen 3.165 N/A HIS 25.A N VAL 18.A O no hydrogen 2.749 N/A HIS 25.A ND1 TRP 23.A O no hydrogen 2.858 N/A CYS 26.A N VAL 18.A O no hydrogen 3.315 N/A GLY 27.A N SER 179.A O no hydrogen 2.826 N/A GLY 28.A N VAL 16.A O no hydrogen 3.021 N/A VAL 29.A N LEU 37.A O no hydrogen 2.864 N/A LEU 30.A N TRP 14.A O no hydrogen 2.853 N/A VAL 31.A N TRP 35.A O no hydrogen 3.066 N/A GLN 34.A N HIS 32.A ND1 no hydrogen 3.017 N/A GLN 34.A NE2 LEU 92.A O no hydrogen 2.826 N/A TRP 35.A N HIS 32.A O no hydrogen 3.016 N/A VAL 36.A N LEU 90.A O no hydrogen 2.939 N/A LEU 37.A N VAL 29.A O no hydrogen 2.830 N/A THR 38.A N MET 88.A O no hydrogen 2.865 N/A THR 38.A OG1 GLY 27.A O no hydrogen 2.829 N/A ALA 39.A N THR 38.A OG1 no hydrogen 2.839 N/A HIS 41.A N ASP 86.A OD1 no hydrogen 2.914 N/A HIS 41.A ND1 ASP 86.A OD2 no hydrogen 2.707 N/A CYS 42.A N ALA 39.A O no hydrogen 3.010 N/A CYS 42.A SG SER 179.A O no hydrogen 4.027 N/A LEU 43.A N ALA 40.A O no hydrogen 2.979 N/A SER 47.A OG LYS 44.A O no hydrogen 2.880 N/A GLN 48.A N TYR 19.A O no hydrogen 2.859 N/A VAL 49.A N VAL 66.A O no hydrogen 2.806 N/A TRP 50.A N ALA 17.A O no hydrogen 2.965 N/A LEU 51.A N GLN 64.A O no hydrogen 2.818 N/A ARG 53.A NE GLU 60.A OE1 no hydrogen 2.714 N/A ARG 53.A NH2 ASN 55.A O no hydrogen 2.978 N/A HIS 54.A N GLU 60.A OE1 no hydrogen 2.782 N/A HIS 54.A NE2 GLU 6.A OE2 no hydrogen 2.713 N/A ASN 55.A N GLU 60.A OE2 no hydrogen 2.818 N/A LEU 56.A N ARG 135.A O no hydrogen 3.053 N/A PHE 57.A N ASN 55.A OD1 no hydrogen 2.831 N/A THR 62.A OG1 GLY 52.A O no hydrogen 2.857 N/A GLY 63.A N GLU 60.A O no hydrogen 2.884 N/A GLN 64.A N LEU 51.A O no hydrogen 2.843 N/A GLN 64.A NE2 LYS 97.A O no hydrogen 2.803 N/A VAL 66.A N VAL 49.A O no hydrogen 2.879 N/A VAL 68.A N SER 47.A O no hydrogen 3.023 N/A SER 69.A N ARG 91.A O no hydrogen 2.729 N/A HIS 70.A N ARG 91.A O no hydrogen 3.409 N/A PHE 72.A N LEU 89.A O no hydrogen 2.700 N/A HIS 74.A N LEU 87.A O no hydrogen 2.864 N/A LEU 76.A N HIS 74.A ND1 no hydrogen 3.148 N/A TYR 77.A N HIS 74.A O no hydrogen 2.954 N/A SER 84.A N ASP 82.A OD1 no hydrogen 3.026 N/A SER 84.A OG ASP 82.A OD1 no hydrogen 2.721 N/A SER 84.A OG THR 159.A OG1 no hydrogen 2.857 N/A HIS 85.A ND1 TYR 215.A OH no hydrogen 2.858 N/A MET 88.A N THR 38.A O no hydrogen 2.832 N/A LEU 89.A N PHE 72.A O no hydrogen 3.024 N/A LEU 90.A N VAL 36.A O no hydrogen 2.760 N/A ARG 91.A N HIS 70.A O no hydrogen 2.865 N/A ARG 91.A NE PRO 227A.A OXT no hydrogen 3.427 N/A ARG 91.A NH2 PRO 227A.A OXT no hydrogen 2.894 N/A LEU 92.A N GLN 34.A O no hydrogen 2.863 N/A SER 93.A N PRO 67.A O no hydrogen 2.976 N/A SER 93.A OG PRO 67.A O no hydrogen 3.474 N/A ALA 96.A N PRO 33.A O no hydrogen 2.878 N/A LYS 97.A N GLN 64.A OE1 no hydrogen 2.908 N/A THR 99.A N VAL 102.A O no hydrogen 2.961 N/A VAL 101.A N THR 99.A OG1 no hydrogen 3.102 N/A VAL 102.A N THR 99.A OG1 no hydrogen 3.204 N/A LYS 103.A N PRO 13.A O no hydrogen 3.222 N/A LEU 105.A N LEU 30.A O no hydrogen 2.886 N/A GLY 115.A N LEU 144.A O no hydrogen 2.765 N/A THR 116.A N ALA 113.A O no hydrogen 3.186 N/A THR 116.A OG1 ALA 113.A O no hydrogen 2.580 N/A CYS 118.A N LEU 142.A O no hydrogen 2.727 N/A TYR 119.A N VAL 184.A O no hydrogen 2.787 N/A ALA 120.A N VAL 140.A O no hydrogen 2.968 N/A SER 121.A OG GLN 15.A OE1 no hydrogen 2.628 N/A GLY 122.A N GLN 138.A O no hydrogen 3.024 N/A TRP 123.A NE1 HIS 54.A O no hydrogen 2.891 N/A GLY 124.A N ASP 178.A OD1 no hydrogen 2.771 N/A SER 125.A N GLY 176.A O no hydrogen 2.893 N/A SER 125.A OG GLU 127.A O no hydrogen 2.766 N/A SER 125.A OG GLU 130.A O no hydrogen 3.291 N/A ILE 126.A N LEU 132.A O no hydrogen 3.036 N/A GLU 127.A N SER 125.A OG no hydrogen 2.991 N/A LEU 132.A N SER 125.A OG no hydrogen 2.832 N/A ARG 133.A NH1 TRP 123.A O no hydrogen 2.975 N/A ARG 133.A NH2 ALA 24.A O no hydrogen 2.918 N/A LEU 137.A N HIS 54.A O no hydrogen 2.943 N/A GLN 138.A N GLY 122.A O no hydrogen 3.103 N/A GLN 138.A NE2 SER 136.A O no hydrogen 3.267 N/A CYS 139.A N TRP 5.A O no hydrogen 2.780 N/A VAL 140.A N ALA 120.A O no hydrogen 3.024 N/A LEU 142.A N CYS 118.A O no hydrogen 2.811 N/A HIS 143.A N GLY 166.A O no hydrogen 2.828 N/A LEU 144.A N THR 116.A O no hydrogen 2.820 N/A LEU 145.A N CYS 164.A O no hydrogen 2.795 N/A ASN 147.A ND2 MET 162.A O no hydrogen 2.983 N/A ASP 148.A N SER 146.A OG no hydrogen 3.117 N/A MET 149.A N SER 146.A O no hydrogen 2.965 N/A CYS 150.A SG ALA 207.A O no hydrogen 3.821 N/A ALA 151.A N ASN 147.A O no hydrogen 2.871 N/A ARG 152.A N ASP 148.A O no hydrogen 3.097 N/A ALA 153.A N CYS 150.A O no hydrogen 3.155 N/A TYR 154.A OH PRO 206.A O no hydrogen 2.620 N/A THR 159.A OG1 SER 84.A OG no hydrogen 2.857 N/A PHE 161.A N THR 159.A OG1 no hydrogen 3.218 N/A MET 162.A N THR 159.A O no hydrogen 3.094 N/A LEU 163.A N TYR 209.A O no hydrogen 2.718 N/A CYS 164.A SG SER 146.A O no hydrogen 3.726 N/A ALA 165.A N ALA 207.A O no hydrogen 3.013 N/A GLY 166.A N HIS 143.A O no hydrogen 3.060 N/A GLY 171.A N ALA 201.A O no hydrogen 2.755 N/A LYS 172.A NZ GLY 3.A O no hydrogen 2.658 N/A ASP 173.A N VAL 2.A O no hydrogen 2.990 N/A THR 174.A OG1 ASP 173.A OD1 no hydrogen 3.504 N/A THR 174.A OG1 TYR 209.A OH no hydrogen 2.795 N/A CYS 175.A N ASP 178.A OD2 no hydrogen 2.897 N/A CYS 175.A SG GLU 127.A O no hydrogen 3.827 N/A ASP 178.A N CYS 175.A O no hydrogen 2.987 N/A SER 179.A OG HIS 41.A NE2 no hydrogen 3.233 N/A SER 179.A OG SER 194.A O no hydrogen 3.437 N/A GLY 180.A N THR 193.A O no hydrogen 2.855 N/A GLY 181.A N ASP 178.A O no hydrogen 3.008 N/A LEU 183.A N GLY 191.A O no hydrogen 2.885 N/A VAL 184.A N TYR 119.A O no hydrogen 2.734 N/A CYS 185.A N VAL 188.A O no hydrogen 3.143 N/A VAL 188.A N CYS 185.A O no hydrogen 3.182 N/A LEU 189.A N GLY 106.A O no hydrogen 2.898 N/A GLN 190.A N LEU 183.A O no hydrogen 2.861 N/A GLN 190.A NE2 CYS 185.A O no hydrogen 3.493 N/A GLY 191.A N LEU 183.A O no hydrogen 3.060 N/A ILE 192.A N THR 210.A O no hydrogen 3.189 N/A THR 193.A N GLY 181.A O no hydrogen 2.977 N/A THR 193.A OG1 GLY 181.A O no hydrogen 3.398 N/A SER 194.A N VAL 208.A O no hydrogen 3.098 N/A SER 194.A OG ASP 86.A OD2 no hydrogen 2.569 N/A TRP 195.A N VAL 208.A O no hydrogen 3.299 N/A CYS 200.A N PRO 128.A O no hydrogen 3.024 N/A CYS 200.A SG THR 174.A O no hydrogen 3.925 N/A CYS 200.A SG PRO 197.A O no hydrogen 3.825 N/A ALA 201.A N ASP 173.A OD2 no hydrogen 2.908 N/A LYS 205.A NZ ALA 153.A O no hydrogen 2.970 N/A ALA 207.A N ALA 165.A O no hydrogen 3.008 N/A VAL 208.A N TRP 195.A O no hydrogen 2.854 N/A TYR 209.A N LEU 163.A O no hydrogen 2.981 N/A TYR 209.A OH THR 174.A OG1 no hydrogen 2.795 N/A THR 210.A N ILE 192.A O no hydrogen 2.805 N/A THR 210.A OG1 ASP 86.A O no hydrogen 2.651 N/A LYS 211.A N PHE 161.A O no hydrogen 2.971 N/A LYS 211.A NZ GLU 111.A OE1 no hydrogen 2.765 N/A VAL 212.A N GLN 190.A O no hydrogen 3.047 N/A HIS 214.A N LYS 211.A O no hydrogen 3.211 N/A TYR 215.A N VAL 212.A O no hydrogen 2.883 N/A TYR 215.A OH HIS 85.A ND1 no hydrogen 2.858 N/A ARG 216.A NH1 PRO 108.A O no hydrogen 2.876 N/A ILE 219.A N TYR 215.A O no hydrogen 2.862 N/A LYS 220.A N ARG 216.A O no hydrogen 2.989 N/A ASP 221.A N LYS 217.A O no hydrogen 2.924 N/A THR 222.A N TRP 218.A O no hydrogen 2.985 N/A THR 222.A OG1 TRP 218.A O no hydrogen 2.684 N/A ILE 223.A N ILE 219.A O no hydrogen 3.101 N/A ALA 224.A N LYS 220.A O no hydrogen 3.093 N/A ALA 225.A N ASP 221.A O no hydrogen 2.636 N/A ASN 226.A N THR 222.A O no hydrogen 3.085 N/A ASN 226.A ND2 THR 222.A O no hydrogen 3.009 N/A GLU 204A.A N TRP 168.A O no hydrogen 2.981 N/A SER 80B.A N ASN 78.A OD1 no hydrogen 3.304 N/A SER 80B.A OG ASN 78.A OD1 no hydrogen 2.937 N/A GLY 170B.A N LEU 167.A O no hydrogen 2.772 N/A LEU 81C.A N ASN 78.A O no hydrogen 3.088 N/A