Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gj2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N SER 1.A O no hydrogen 2.736 N/A LEU 6.A N GLY 3.A O no hydrogen 3.102 N/A PHE 7.A N GLU 4.A O no hydrogen 2.997 N/A THR 8.A OG1 GLU 5.A O no hydrogen 3.372 N/A VAL 11.A N GLY 34.A O no hydrogen 2.850 N/A ILE 13.A N GLY 32.A O no hydrogen 2.950 N/A LEU 14.A N LEU 115.A O no hydrogen 2.967 N/A VAL 15.A N GLY 30.A O no hydrogen 2.877 N/A GLU 16.A N ASN 117.A O no hydrogen 3.036 N/A LEU 17.A N VAL 28.A O no hydrogen 2.833 N/A ASP 18.A N ILE 119.A O no hydrogen 3.059 N/A GLY 19.A N PHE 26.A O no hydrogen 2.820 N/A ASP 20.A N LEU 121.A O no hydrogen 3.062 N/A VAL 21.A N HIS 24.A O no hydrogen 3.019 N/A ASN 22.A N GLY 123.A O no hydrogen 2.900 N/A ASN 22.A ND2 PHE 126.A O no hydrogen 2.961 N/A GLY 23.A N ASP 20.A OD1 no hydrogen 2.804 N/A HIS 24.A N VAL 21.A O no hydrogen 2.830 N/A LYS 25.A NZ ASP 20.A OD2 no hydrogen 2.918 N/A PHE 26.A N GLY 19.A O no hydrogen 3.084 N/A SER 27.A N THR 49.A OG1 no hydrogen 3.417 N/A SER 27.A OG ASP 18.A OD1 no hydrogen 2.574 N/A VAL 28.A N LEU 17.A O no hydrogen 2.902 N/A SER 29.A N ILE 46.A O no hydrogen 3.063 N/A SER 29.A OG GLU 16.A OE1 no hydrogen 2.849 N/A SER 29.A OG GLU 16.A OE2 no hydrogen 3.447 N/A GLY 30.A N VAL 15.A O no hydrogen 2.717 N/A GLU 31.A N LYS 44.A O no hydrogen 2.992 N/A GLY 32.A N ILE 13.A O no hydrogen 3.270 N/A GLU 33.A N THR 42.A O no hydrogen 2.986 N/A GLY 34.A N VAL 11.A O no hydrogen 2.851 N/A ASP 35.A N LYS 40.A O no hydrogen 2.837 N/A THR 37.A N ASP 35.A OD1 no hydrogen 3.054 N/A THR 37.A OG1.A THR 8.A O no hydrogen 3.156 N/A THR 37.A OG1.B ASP 35.A OD1 no hydrogen 2.391 N/A TYR 38.A N ASP 35.A O no hydrogen 3.119 N/A LYS 40.A N ASP 35.A O no hydrogen 2.962 N/A LEU 41.A N GLU 218.A O no hydrogen 2.884 N/A THR 42.A N GLU 33.A O no hydrogen 3.001 N/A LEU 43.A N LEU 216.A O no hydrogen 2.884 N/A LYS 44.A N GLU 31.A O no hydrogen 2.818 N/A LYS 44.A NZ ASP 206.A OD2 no hydrogen 2.720 N/A LYS 44.A NZ GLU 209.A OE1 no hydrogen 2.791 N/A PHE 45.A N MET 214.A O no hydrogen 2.708 N/A ILE 46.A N SER 29.A O no hydrogen 2.758 N/A CYS 47.A N ASP 212.A O no hydrogen 2.891 N/A CYS 47.A SG SER 27.A O no hydrogen 3.670 N/A CYS 47.A SG THR 49.A OG1 no hydrogen 3.452 N/A CYS 47.A SG GLY 50.A O no hydrogen 3.143 N/A THR 48.A N SER 27.A O no hydrogen 3.176 N/A THR 48.A OG1 SER 27.A O no hydrogen 3.502 N/A LEU 52.A N ASP 212.A OD2 no hydrogen 2.807 N/A TRP 56.A NE1 ASP 212.A OD1 no hydrogen 2.899 N/A THR 58.A N PRO 55.A O no hydrogen 2.920 N/A THR 58.A OG1 PRO 55.A O no hydrogen 2.772 N/A THR 58.A OG1 TYR 102.A OH no hydrogen 2.714 N/A LEU 59.A N TRP 56.A O no hydrogen 3.023 N/A VAL 60.A N PRO 57.A O no hydrogen 3.202 N/A THR 61.A OG1 HIS 177.A NE2 no hydrogen 2.706 N/A PHE 63.A N LEU 59.A O no hydrogen 2.955 N/A GLN 65.A NE2 HIS 199.A NE2 no hydrogen 3.165 N/A PHE 67.A N VAL 64.A O no hydrogen 2.968 N/A SER 68.A N GLN 65.A O no hydrogen 3.113 N/A SER 68.A OG GLN 65.A O no hydrogen 2.798 N/A ARG 69.A N VAL 220.A O no hydrogen 2.942 N/A TYR 70.A OH HIS 195.A NE2 no hydrogen 2.726 N/A HIS 73.A NE2 ILE 225.A O no hydrogen 2.582 N/A MET 74.A N PRO 71.A O no hydrogen 2.885 N/A LYS 75.A N ASP 72.A O no hydrogen 3.279 N/A LYS 75.A NZ TYR 70.A O no hydrogen 2.931 N/A LYS 75.A NZ ASP 72.A OD2 no hydrogen 3.425 N/A HIS 77.A N MET 74.A O no hydrogen 2.845 N/A ASP 78.A N LYS 75.A O no hydrogen 3.200 N/A PHE 79.A N HIS 77.A O no hydrogen 3.105 N/A LYS 81.A N ASP 78.A OD1 no hydrogen 3.128 N/A LYS 81.A NZ CYS 66.A O no hydrogen 2.874 N/A LYS 81.A NZ SER 68.A O no hydrogen 2.898 N/A LYS 81.A NZ ASP 78.A OD2 no hydrogen 2.847 N/A SER 82.A N ASP 78.A O no hydrogen 3.374 N/A SER 82.A OG PHE 79.A O no hydrogen 2.698 N/A ALA 83.A N PHE 79.A O no hydrogen 3.076 N/A MET 84.A N LYS 81.A O no hydrogen 3.109 N/A GLY 87.A N ALA 83.A O no hydrogen 2.745 N/A TYR 88.A N VAL 108.A O no hydrogen 2.790 N/A VAL 89.A N THR 182.A O no hydrogen 2.809 N/A GLN 90.A N ALA 106.A O no hydrogen 2.793 N/A GLU 91.A N GLN 180.A O no hydrogen 2.878 N/A ARG 92.A N THR 104.A O no hydrogen 2.894 N/A ARG 92.A N THR 104.A OG1 no hydrogen 3.263 N/A ARG 92.A NE GLN 179.A OE1 no hydrogen 2.819 N/A ARG 92.A NH1 THR 61.A O no hydrogen 2.949 N/A ARG 92.A NH2 GLN 179.A OE1 no hydrogen 2.778 N/A THR 93.A N TYR 178.A O no hydrogen 3.021 N/A ILE 94.A N TYR 102.A O no hydrogen 2.818 N/A SER 95.A N ASP 176.A O no hydrogen 2.821 N/A PHE 96.A N GLY 100.A O no hydrogen 2.986 N/A LYS 97.A N LEU 174.A O no hydrogen 2.870 N/A ASP 99.A N PHE 96.A O no hydrogen 2.862 N/A GLY 100.A N ASP 99.A OD1 no hydrogen 2.733 N/A ASN 101.A N ILE 124.A O no hydrogen 3.074 N/A TYR 102.A N ILE 94.A O no hydrogen 2.790 N/A TYR 102.A OH THR 58.A OG1 no hydrogen 2.714 N/A LYS 103.A N LYS 122.A O no hydrogen 2.768 N/A LYS 103.A NZ ASN 101.A OD1 no hydrogen 2.706 N/A THR 104.A N ARG 92.A O no hydrogen 2.921 N/A ARG 105.A N GLU 120.A O no hydrogen 2.973 N/A ARG 105.A NH1 GLU 107.A OE2 no hydrogen 3.340 N/A ARG 105.A NH2 GLU 107.A OE2 no hydrogen 3.269 N/A ALA 106.A N GLN 90.A O no hydrogen 2.893 N/A GLU 107.A N ARG 118.A O no hydrogen 2.965 N/A VAL 108.A N TYR 88.A O no hydrogen 2.905 N/A LYS 109.A N VAL 116.A O no hydrogen 3.160 N/A LYS 109.A NZ GLU 107.A OE1 no hydrogen 2.724 N/A PHE 110.A N PRO 85.A O no hydrogen 3.252 N/A GLU 111.A N THR 114.A O no hydrogen 2.908 N/A THR 114.A OG1 ASP 113.A OD1 no hydrogen 2.635 N/A LEU 115.A N PRO 12.A O no hydrogen 3.022 N/A VAL 116.A N LYS 109.A O no hydrogen 2.891 N/A ASN 117.A N LEU 14.A O no hydrogen 2.892 N/A ASN 117.A ND2 THR 62.A O no hydrogen 3.351 N/A ASN 117.A ND2 PHE 63.A O no hydrogen 3.059 N/A ARG 118.A N GLU 107.A O no hydrogen 3.067 N/A ARG 118.A NE GLU 111.A OE1 no hydrogen 2.836 N/A ARG 118.A NH2 GLU 111.A OE2 no hydrogen 2.927 N/A ILE 119.A N GLU 16.A O no hydrogen 2.738 N/A GLU 120.A N ARG 105.A O no hydrogen 2.797 N/A LEU 121.A N ASP 18.A O no hydrogen 2.885 N/A LYS 122.A N LYS 103.A O no hydrogen 2.998 N/A GLY 123.A N ASP 20.A O no hydrogen 2.757 N/A ILE 124.A N ASN 101.A O no hydrogen 3.005 N/A PHE 126.A N ASN 22.A OD1 no hydrogen 3.283 N/A LYS 127.A N ASP 99.A OD1 no hydrogen 2.960 N/A LYS 127.A NZ ASP 98.A O no hydrogen 2.981 N/A GLY 130.A N LYS 127.A O no hydrogen 3.121 N/A ASN 131.A ND2 GLN 173.A OE1 no hydrogen 3.263 N/A GLY 134.A N GLY 130.A O no hydrogen 2.751 N/A HIS 135.A N ILE 132.A O no hydrogen 3.200 N/A LYS 136.A N ASN 131.A O no hydrogen 3.047 N/A LYS 136.A NZ ASP 129.A O no hydrogen 2.871 N/A GLU 138.A N ASN 166.A O no hydrogen 2.959 N/A TYR 139.A OH SER 204.A O no hydrogen 2.564 N/A ASN 140.A ND2 GLU 138.A OE1 no hydrogen 3.092 N/A ASN 142.A ND2 ARG 164.A O no hydrogen 2.927 N/A ASN 142.A ND2 ASN 166.A OD1 no hydrogen 3.139 N/A HIS 144.A N HIS 199.A O no hydrogen 2.966 N/A ASN 145.A ND2 TYR 147.A OH no hydrogen 3.275 N/A VAL 146.A N LEU 197.A O no hydrogen 2.784 N/A TYR 147.A N ASN 160.A O no hydrogen 3.501 N/A ILE 148.A N HIS 195.A O no hydrogen 2.849 N/A THR 149.A N LYS 158.A O no hydrogen 3.039 N/A THR 149.A OG1 ASN 194.A OD1 no hydrogen 2.977 N/A ASP 151.A N GLY 156.A O no hydrogen 2.857 N/A LYS 154.A N ASP 151.A O no hydrogen 3.066 N/A ASN 155.A N LYS 152.A O no hydrogen 2.925 N/A ASN 155.A ND2 GLY 187.A O no hydrogen 3.446 N/A GLY 156.A N ASP 151.A O no hydrogen 3.076 N/A ILE 157.A N ASN 181.A O no hydrogen 3.076 N/A LYS 158.A N THR 149.A O no hydrogen 2.945 N/A ALA 159.A N GLN 179.A O no hydrogen 2.895 N/A ASN 160.A N TYR 147.A O no hydrogen 3.386 N/A PHE 161.A N HIS 177.A O no hydrogen 3.187 N/A LYS 162.A NZ ASP 176.A OD1 no hydrogen 2.607 N/A ILE 163.A N ALA 175.A O no hydrogen 2.852 N/A ARG 164.A N HIS 144.A NE2 no hydrogen 2.933 N/A ARG 164.A NH2.A SER 143.A O no hydrogen 2.567 N/A HIS 165.A N GLN 173.A O no hydrogen 2.850 N/A ILE 167.A N SER 171.A O no hydrogen 2.792 N/A GLU 168.A N LYS 136.A O no hydrogen 3.024 N/A GLY 170.A N ILE 167.A O no hydrogen 2.748 N/A SER 171.A N ASP 169.A OD1 no hydrogen 2.818 N/A SER 171.A OG ASP 169.A OD1 no hydrogen 2.632 N/A GLN 173.A N HIS 165.A O no hydrogen 2.647 N/A GLN 173.A NE2 LYS 97.A O no hydrogen 3.073 N/A GLN 173.A NE2 LEU 174.A O no hydrogen 2.806 N/A ALA 175.A N ILE 163.A O no hydrogen 2.868 N/A ASP 176.A N SER 95.A O no hydrogen 2.914 N/A HIS 177.A N PHE 161.A O no hydrogen 2.812 N/A HIS 177.A ND1 ALA 175.A O no hydrogen 2.981 N/A HIS 177.A NE2 THR 61.A OG1 no hydrogen 2.706 N/A TYR 178.A N THR 93.A O no hydrogen 2.885 N/A GLN 179.A N ALA 159.A O no hydrogen 2.879 N/A GLN 179.A NE2 GLN 65.A OE1 no hydrogen 3.069 N/A GLN 179.A NE2 ASN 181.A OD1 no hydrogen 2.928 N/A GLN 180.A N GLU 91.A O no hydrogen 2.988 N/A ASN 181.A N ILE 157.A O no hydrogen 2.897 N/A ASN 181.A ND2 GLN 90.A OE1 no hydrogen 2.897 N/A THR 182.A N VAL 89.A O no hydrogen 2.981 N/A ILE 184.A N GLY 87.A O no hydrogen 2.981 N/A LEU 190.A N SER 82.A OG no hydrogen 2.863 N/A ASP 193.A N HIS 77.A ND1 no hydrogen 2.993 N/A HIS 195.A N ILE 148.A O no hydrogen 3.241 N/A HIS 195.A ND1 ASP 193.A O no hydrogen 2.942 N/A HIS 195.A NE2 TYR 70.A OH no hydrogen 2.726 N/A TYR 196.A N ALA 223.A O no hydrogen 2.934 N/A LEU 197.A N VAL 146.A O no hydrogen 2.873 N/A SER 198.A N THR 221.A O no hydrogen 2.818 N/A HIS 199.A N HIS 144.A O no hydrogen 2.898 N/A GLN 200.A N PHE 219.A O no hydrogen 2.871 N/A ALA 202.A N LEU 217.A O no hydrogen 2.713 N/A SER 204.A N VAL 215.A O no hydrogen 2.954 N/A LYS 205.A NZ HIS 213.A O no hydrogen 2.676 N/A ASP 206.A N HIS 213.A NE2 no hydrogen 2.946 N/A ASN 208.A N ASP 206.A OD1 no hydrogen 3.115 N/A GLU 209.A N ASP 206.A O no hydrogen 2.888 N/A ARG 211.A N GLU 209.A OE2 no hydrogen 2.890 N/A ARG 211.A NE GLU 209.A OE2 no hydrogen 2.694 N/A ARG 211.A NH1 GLU 209.A OE1 no hydrogen 2.522 N/A ARG 211.A NH1 GLU 209.A OE2 no hydrogen 3.309 N/A HIS 213.A ND1 ARG 211.A O no hydrogen 2.706 N/A MET 214.A N PHE 45.A O no hydrogen 2.934 N/A VAL 215.A N SER 204.A O no hydrogen 3.072 N/A LEU 216.A N LEU 43.A O no hydrogen 2.807 N/A LEU 217.A N ALA 202.A O no hydrogen 3.083 N/A GLU 218.A N LEU 41.A O no hydrogen 3.046 N/A PHE 219.A N GLN 200.A O no hydrogen 3.117 N/A VAL 220.A N GLY 39.A O no hydrogen 2.837 N/A THR 221.A N SER 198.A O no hydrogen 3.053 N/A ALA 222.A N ARG 69.A O no hydrogen 2.815 N/A ALA 223.A N TYR 196.A O no hydrogen 2.917 N/A