Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ed8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N LYS 2.A O no hydrogen 3.190 N/A LEU 6.A N GLY 3.A O no hydrogen 2.860 N/A PHE 7.A N GLU 4.A O no hydrogen 3.071 N/A THR 8.A OG1 GLU 5.A O no hydrogen 3.442 N/A VAL 11.A N GLY 34.A O no hydrogen 2.759 N/A ILE 13.A N GLY 32.A O no hydrogen 2.825 N/A LEU 14.A N LEU 115.A O no hydrogen 3.062 N/A VAL 15.A N GLY 30.A O no hydrogen 2.737 N/A GLU 16.A N ASN 117.A O no hydrogen 2.880 N/A LEU 17.A N VAL 28.A O no hydrogen 2.926 N/A ASP 18.A N ILE 119.A O no hydrogen 2.882 N/A GLY 19.A N PHE 26.A O no hydrogen 2.821 N/A ASP 20.A N LEU 121.A O no hydrogen 2.890 N/A VAL 21.A N HIS 24.A O no hydrogen 3.015 N/A ASN 22.A N GLY 123.A O no hydrogen 2.678 N/A HIS 24.A N VAL 21.A O no hydrogen 2.829 N/A PHE 26.A N GLY 19.A O no hydrogen 2.971 N/A SER 27.A N THR 49.A OG1 no hydrogen 2.962 N/A SER 27.A OG ASP 18.A OD1 no hydrogen 2.661 N/A VAL 28.A N LEU 17.A O no hydrogen 2.805 N/A ARG 29.A N ILE 46.A O no hydrogen 3.014 N/A ARG 29.A NH1 LEU 17.A O no hydrogen 3.073 N/A ARG 29.A NH1 ASP 18.A OD1 no hydrogen 3.337 N/A ARG 29.A NH1 VAL 28.A O no hydrogen 2.858 N/A ARG 29.A NH2 ASP 18.A OD1 no hydrogen 3.147 N/A GLY 30.A N VAL 15.A O no hydrogen 2.883 N/A GLU 31.A N LYS 44.A O no hydrogen 3.286 N/A GLY 32.A N ILE 13.A O no hydrogen 3.001 N/A GLU 33.A N THR 42.A O no hydrogen 3.048 N/A GLY 34.A N VAL 11.A O no hydrogen 2.881 N/A ASP 35.A N LYS 40.A O no hydrogen 2.893 N/A THR 37.A N ASP 35.A OD1 no hydrogen 3.238 N/A THR 37.A OG1 ASP 35.A OD1 no hydrogen 2.738 N/A ILE 38.A N ASP 35.A O no hydrogen 3.095 N/A LYS 40.A N ASP 35.A O no hydrogen 3.208 N/A LEU 41.A N GLU 220.A O no hydrogen 2.972 N/A THR 42.A N GLU 33.A O no hydrogen 3.029 N/A LEU 43.A N LEU 218.A O no hydrogen 3.121 N/A LYS 44.A N GLU 31.A O no hydrogen 2.992 N/A LYS 44.A NZ ASP 208.A OD2 no hydrogen 3.069 N/A LYS 44.A NZ GLU 211.A OE1 no hydrogen 2.743 N/A PHE 45.A N MET 216.A O no hydrogen 2.774 N/A ILE 46.A N ARG 29.A O no hydrogen 2.908 N/A CYS 47.A SG SER 27.A O no hydrogen 3.688 N/A CYS 47.A SG THR 49.A OG1 no hydrogen 3.747 N/A CYS 47.A SG GLY 50.A O no hydrogen 3.437 N/A THR 48.A N SER 27.A O no hydrogen 2.846 N/A TRP 56.A NE1 ASP 214.A OD1 no hydrogen 3.174 N/A THR 58.A N PRO 55.A O no hydrogen 2.933 N/A THR 58.A OG1 PRO 55.A O no hydrogen 3.002 N/A THR 58.A OG1 TYR 102.A OH no hydrogen 2.643 N/A LEU 59.A N TRP 56.A O no hydrogen 2.901 N/A VAL 60.A N PRO 57.A O no hydrogen 3.239 N/A THR 61.A OG1 HIS 179.A NE2 no hydrogen 2.755 N/A THR 62.A N LEU 59.A O no hydrogen 2.865 N/A LEU 63.A N LEU 59.A O no hydrogen 2.918 N/A CYS 66.A SG TYR 88.A OH no hydrogen 3.858 N/A PHE 67.A N LEU 64.A O no hydrogen 2.967 N/A ALA 68.A N GLN 65.A O no hydrogen 2.997 N/A ARG 69.A N VAL 222.A O no hydrogen 2.950 N/A TYR 70.A OH HIS 197.A NE2 no hydrogen 2.888 N/A HIS 73.A NE2 ILE 227.A O no hydrogen 2.945 N/A MET 74.A N PRO 71.A O no hydrogen 2.857 N/A LYS 75.A N ASP 72.A O no hydrogen 3.335 N/A LYS 75.A NZ TYR 70.A O no hydrogen 2.962 N/A GLN 76.A N GLN 76.A OE1 no hydrogen 2.951 N/A HIS 77.A N MET 74.A O no hydrogen 2.842 N/A ASP 78.A N LYS 75.A O no hydrogen 3.453 N/A LYS 81.A N ASP 78.A OD1 no hydrogen 3.252 N/A LYS 81.A NZ CYS 66.A O no hydrogen 2.787 N/A LYS 81.A NZ ALA 68.A O no hydrogen 2.986 N/A LYS 81.A NZ ASP 78.A OD2 no hydrogen 2.768 N/A SER 82.A N ASP 78.A O no hydrogen 3.436 N/A SER 82.A OG ASP 78.A O no hydrogen 3.450 N/A SER 82.A OG PHE 79.A O no hydrogen 2.808 N/A ALA 83.A N PHE 80.A O no hydrogen 3.351 N/A MET 84.A N LYS 81.A O no hydrogen 2.961 N/A GLY 87.A N ALA 83.A O no hydrogen 3.051 N/A TYR 88.A N VAL 108.A O no hydrogen 2.991 N/A VAL 89.A N THR 184.A O no hydrogen 2.761 N/A GLN 90.A N ALA 106.A O no hydrogen 2.948 N/A GLU 91.A N GLN 182.A O no hydrogen 2.809 N/A ARG 92.A N THR 104.A O no hydrogen 2.950 N/A ARG 92.A NE GLN 181.A OE1 no hydrogen 2.878 N/A ARG 92.A NH1 THR 61.A O no hydrogen 2.717 N/A ARG 92.A NH2 GLN 181.A OE1 no hydrogen 2.713 N/A THR 93.A N TYR 180.A O no hydrogen 3.099 N/A ILE 94.A N TYR 102.A O no hydrogen 2.894 N/A SER 95.A N ASP 178.A O no hydrogen 2.852 N/A PHE 96.A N GLY 100.A O no hydrogen 3.169 N/A LYS 97.A N LEU 176.A O no hydrogen 3.002 N/A ASP 99.A N PHE 96.A O no hydrogen 2.914 N/A GLY 100.A N ASP 99.A OD1 no hydrogen 3.003 N/A LYS 101.A N THR 124.A O no hydrogen 3.013 N/A TYR 102.A N ILE 94.A O no hydrogen 2.856 N/A TYR 102.A OH THR 58.A OG1 no hydrogen 2.643 N/A LYS 103.A N LYS 122.A O no hydrogen 2.838 N/A THR 104.A N ARG 92.A O no hydrogen 2.852 N/A ARG 105.A N GLU 120.A O no hydrogen 3.116 N/A ALA 106.A N GLN 90.A O no hydrogen 2.931 N/A VAL 107.A N ARG 118.A O no hydrogen 2.888 N/A VAL 108.A N TYR 88.A O no hydrogen 3.012 N/A LYS 109.A N VAL 116.A O no hydrogen 3.136 N/A LYS 109.A NZ GLU 111.A OE2 no hydrogen 3.469 N/A PHE 110.A N PRO 85.A O no hydrogen 2.881 N/A GLU 111.A N THR 114.A O no hydrogen 2.762 N/A THR 114.A N GLU 111.A O no hydrogen 3.061 N/A THR 114.A OG1 ASP 113.A OD1 no hydrogen 3.151 N/A LEU 115.A N PRO 12.A O no hydrogen 3.014 N/A VAL 116.A N LYS 109.A O no hydrogen 2.733 N/A ASN 117.A N LEU 14.A O no hydrogen 2.998 N/A ASN 117.A ND2 THR 62.A O no hydrogen 3.589 N/A ASN 117.A ND2 LEU 63.A O no hydrogen 3.157 N/A ARG 118.A N VAL 107.A O no hydrogen 3.090 N/A ARG 118.A NE GLU 16.A OE1 no hydrogen 3.135 N/A ARG 118.A NH1 GLU 111.A OE2 no hydrogen 2.729 N/A ARG 118.A NH2 GLU 111.A OE1 no hydrogen 3.213 N/A ARG 118.A NH2 GLU 111.A OE2 no hydrogen 3.420 N/A ILE 119.A N GLU 16.A O no hydrogen 2.737 N/A GLU 120.A N ARG 105.A O no hydrogen 2.960 N/A LEU 121.A N ASP 18.A O no hydrogen 2.977 N/A LYS 122.A N LYS 103.A O no hydrogen 2.977 N/A GLY 123.A N ASP 20.A O no hydrogen 2.630 N/A THR 124.A N LYS 101.A O no hydrogen 2.990 N/A THR 124.A OG1 ASP 125.A OD2 no hydrogen 3.463 N/A LYS 127.A N ASP 99.A OD1 no hydrogen 2.652 N/A LYS 127.A NZ ASP 98.A O no hydrogen 2.500 N/A GLY 130.A N LYS 127.A O no hydrogen 3.209 N/A ASN 131.A ND2 GLN 175.A OE1 no hydrogen 2.911 N/A GLY 134.A N GLY 130.A O no hydrogen 3.078 N/A HIS 135.A N ILE 132.A O no hydrogen 2.824 N/A LYS 136.A N ASN 131.A O no hydrogen 2.931 N/A LYS 136.A NZ ASP 129.A O no hydrogen 2.737 N/A LYS 136.A NZ ASP 129.A OD2.A no hydrogen 3.194 N/A GLU 138.A N ASN 168.A O no hydrogen 2.766 N/A TYR 139.A OH SER 206.A O no hydrogen 2.731 N/A ASN 140.A N GLU 138.A O no hydrogen 3.002 N/A ASN 140.A ND2 GLU 138.A OE1 no hydrogen 3.067 N/A ASN 142.A ND2 ARG 166.A O no hydrogen 2.712 N/A SER 143.A OG TYR 201.A O no hydrogen 3.233 N/A HIS 144.A N TYR 201.A O no hydrogen 3.329 N/A VAL 146.A N LEU 199.A O no hydrogen 2.817 N/A TYR 147.A N ASN 162.A O no hydrogen 3.231 N/A ILE 148.A N HIS 197.A O no hydrogen 2.934 N/A THR 149.A N LYS 160.A O no hydrogen 2.806 N/A THR 151.A N GLY 158.A O no hydrogen 2.819 N/A THR 151.A OG1 GLY 158.A O no hydrogen 3.450 N/A LYS 156.A NZ PRO 185.A O no hydrogen 3.236 N/A LYS 156.A NZ ILE 186.A O no hydrogen 3.455 N/A LYS 156.A NZ GLY 187.A O no hydrogen 2.773 N/A LYS 156.A NZ ASP 188.A OD1 no hydrogen 3.422 N/A GLY 158.A N THR 151.A O no hydrogen 2.877 N/A ILE 159.A N ASN 183.A O no hydrogen 3.000 N/A LYS 160.A N THR 149.A O no hydrogen 2.807 N/A ALA 161.A N GLN 181.A O no hydrogen 3.107 N/A ASN 162.A N TYR 147.A O no hydrogen 3.019 N/A PHE 163.A N HIS 179.A O no hydrogen 3.097 N/A THR 164.A OG1 ASP 178.A OD1 no hydrogen 2.818 N/A VAL 165.A N ALA 177.A O no hydrogen 2.579 N/A ARG 166.A N HIS 144.A NE2 no hydrogen 3.027 N/A HIS 167.A N GLN 175.A O no hydrogen 2.856 N/A VAL 169.A N SER 173.A O no hydrogen 2.801 N/A GLU 170.A N LYS 136.A O no hydrogen 2.839 N/A GLY 172.A N VAL 169.A O no hydrogen 3.053 N/A SER 173.A N ASP 171.A OD1 no hydrogen 2.863 N/A SER 173.A OG ASP 171.A OD1 no hydrogen 2.781 N/A GLN 175.A N HIS 167.A O no hydrogen 2.788 N/A GLN 175.A NE2 LEU 176.A O no hydrogen 2.766 N/A ALA 177.A N VAL 165.A O no hydrogen 2.871 N/A ASP 178.A N SER 95.A O no hydrogen 2.825 N/A HIS 179.A N PHE 163.A O no hydrogen 2.698 N/A HIS 179.A ND1 ALA 177.A O no hydrogen 3.071 N/A HIS 179.A NE2 THR 61.A OG1 no hydrogen 2.755 N/A TYR 180.A N THR 93.A O no hydrogen 2.942 N/A GLN 181.A N ALA 161.A O no hydrogen 2.848 N/A GLN 181.A NE2 ASN 183.A OD1 no hydrogen 2.824 N/A GLN 182.A N GLU 91.A O no hydrogen 2.783 N/A ASN 183.A N ILE 159.A O no hydrogen 2.994 N/A THR 184.A N VAL 89.A O no hydrogen 3.134 N/A ILE 186.A N GLY 87.A O no hydrogen 2.743 N/A LEU 192.A N SER 82.A OG no hydrogen 2.831 N/A ASP 195.A N HIS 77.A ND1 no hydrogen 2.949 N/A HIS 197.A N ILE 148.A O no hydrogen 3.323 N/A HIS 197.A ND1 ASP 195.A O no hydrogen 2.938 N/A HIS 197.A NE2 TYR 70.A OH no hydrogen 2.888 N/A TYR 198.A N ALA 225.A O no hydrogen 2.999 N/A LEU 199.A N VAL 146.A O no hydrogen 2.943 N/A SER 200.A N THR 223.A O no hydrogen 2.909 N/A TYR 201.A N HIS 144.A O no hydrogen 2.890 N/A GLN 202.A N PHE 221.A O no hydrogen 3.042 N/A VAL 204.A N LEU 219.A O no hydrogen 2.879 N/A SER 206.A N VAL 217.A O no hydrogen 2.935 N/A LYS 207.A NZ HIS 215.A O no hydrogen 2.991 N/A ASP 208.A N HIS 215.A NE2 no hydrogen 2.849 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 2.920 N/A GLU 211.A N ASP 208.A O no hydrogen 3.192 N/A ARG 213.A N GLU 211.A OE2 no hydrogen 2.873 N/A ARG 213.A NE GLU 211.A OE2 no hydrogen 2.773 N/A ARG 213.A NH2 GLU 211.A OE1 no hydrogen 2.996 N/A HIS 215.A ND1 ARG 213.A O no hydrogen 2.714 N/A MET 216.A N PHE 45.A O no hydrogen 3.024 N/A VAL 217.A N SER 206.A O no hydrogen 3.004 N/A LEU 218.A N LEU 43.A O no hydrogen 2.970 N/A LEU 219.A N VAL 204.A O no hydrogen 3.042 N/A GLU 220.A N LEU 41.A O no hydrogen 3.170 N/A PHE 221.A N GLN 202.A O no hydrogen 2.774 N/A VAL 222.A N GLY 39.A O no hydrogen 2.775 N/A THR 223.A N SER 200.A O no hydrogen 3.246 N/A ALA 224.A N ARG 69.A O no hydrogen 2.772 N/A ALA 225.A N TYR 198.A O no hydrogen 2.859 N/A