Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g1p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASN 46.A OD1 no hydrogen 2.947 N/A THR 3.A N LYS 44.A O no hydrogen 2.964 N/A LEU 4.A N ILE 248.A O no hydrogen 2.899 N/A THR 5.A N VAL 42.A O no hydrogen 2.818 N/A LEU 6.A N MET 246.A O no hydrogen 2.887 N/A THR 7.A N SER 40.A O no hydrogen 2.970 N/A THR 7.A OG1 SER 40.A OG no hydrogen 2.796 N/A GLY 8.A N SER 40.A O no hydrogen 3.261 N/A THR 9.A OG1 ASP 244.A OD1 no hydrogen 2.686 N/A GLY 10.A N GLN 37.A O no hydrogen 2.769 N/A VAL 15.A N ARG 36.A O no hydrogen 3.368 N/A CYS 20.A N ALA 17.A O no hydrogen 2.988 N/A CYS 20.A SG HIS 224.A ND1 no hydrogen 3.496 N/A CYS 22.A SG HIS 224.A ND1 no hydrogen 3.697 N/A CYS 25.A SG HIS 224.A ND1 no hydrogen 3.472 N/A ALA 26.A N CYS 22.A O no hydrogen 2.824 N/A ARG 27.A N ALA 23.A O no hydrogen 3.082 N/A ALA 28.A N ALA 24.A O no hydrogen 2.985 N/A ARG 29.A N CYS 25.A O no hydrogen 3.000 N/A ARG 29.A N ALA 26.A O no hydrogen 3.192 N/A ARG 29.A NH1 CYS 20.A O no hydrogen 2.686 N/A ARG 29.A NH2 CYS 20.A O no hydrogen 2.799 N/A ARG 30.A N ALA 26.A O no hydrogen 3.092 N/A SER 31.A N ARG 27.A O no hydrogen 2.857 N/A GLN 33.A N GLN 33.A OE1 no hydrogen 2.748 N/A TYR 34.A N SER 31.A O no hydrogen 2.986 N/A ARG 35.A N PRO 32.A O no hydrogen 2.884 N/A ARG 36.A N VAL 15.A O no hydrogen 2.864 N/A ARG 36.A NE ASP 227.A OD1 no hydrogen 3.464 N/A ARG 36.A NE ASP 227.A OD2 no hydrogen 2.786 N/A ARG 36.A NH1 THR 9.A OG1 no hydrogen 2.811 N/A ARG 36.A NH1 GLY 242.A O no hydrogen 2.828 N/A ARG 36.A NH2 ASP 227.A OD1 no hydrogen 2.836 N/A GLN 37.A N ASP 244.A OD2 no hydrogen 2.826 N/A CYS 39.A N GLY 10.A O no hydrogen 2.943 N/A CYS 39.A SG SER 162.A OG no hydrogen 3.708 N/A SER 40.A N GLY 8.A O no hydrogen 3.086 N/A SER 40.A OG THR 7.A OG1 no hydrogen 2.796 N/A SER 40.A OG PRO 38.A O no hydrogen 3.033 N/A GLY 41.A N ILE 52.A O no hydrogen 2.898 N/A VAL 42.A N THR 5.A O no hydrogen 2.865 N/A VAL 43.A N THR 50.A O no hydrogen 2.829 N/A LYS 44.A N THR 3.A O no hydrogen 2.878 N/A PHE 45.A N ALA 48.A O no hydrogen 2.845 N/A ASN 46.A N SER 1.A O no hydrogen 2.900 N/A ALA 48.A N PHE 45.A O no hydrogen 2.931 N/A ILE 49.A N GLN 69.A OE1 no hydrogen 2.867 N/A THR 50.A N VAL 43.A O no hydrogen 2.887 N/A LEU 51.A N GLN 70.A O no hydrogen 3.031 N/A ILE 52.A N GLY 41.A O no hydrogen 2.812 N/A ASP 53.A N LEU 72.A O no hydrogen 2.892 N/A ALA 54.A N HIS 80.A O no hydrogen 2.766 N/A ASP 61.A N ASP 58.A O no hydrogen 3.006 N/A ARG 62.A N ASP 58.A O no hydrogen 3.171 N/A ARG 62.A NE ASP 58.A OD1 no hydrogen 2.990 N/A ARG 62.A NE ASP 58.A OD2 no hydrogen 3.502 N/A TRP 63.A N LEU 59.A O no hydrogen 2.956 N/A SER 64.A N SER 67.A OG no hydrogen 3.041 N/A SER 67.A N SER 64.A O no hydrogen 2.988 N/A SER 67.A OG SER 64.A O no hydrogen 2.703 N/A GLN 69.A N ILE 49.A O no hydrogen 2.831 N/A GLN 70.A NE2 THR 50.A OG1 no hydrogen 2.830 N/A GLN 70.A NE2 GLN 131.A OE1 no hydrogen 2.974 N/A PHE 71.A N PRO 96.A O no hydrogen 2.972 N/A LEU 72.A N LEU 51.A O no hydrogen 2.828 N/A LEU 73.A N TYR 98.A O no hydrogen 2.773 N/A THR 74.A N ASP 53.A OD1 no hydrogen 2.816 N/A THR 74.A OG1 ASP 53.A OD1 no hydrogen 3.352 N/A THR 74.A OG1 ASP 53.A OD2 no hydrogen 2.654 N/A THR 74.A OG1 HIS 75.A ND1 no hydrogen 2.886 N/A HIS 75.A ND1 THR 74.A OG1 no hydrogen 2.886 N/A HIS 77.A ND1 HIS 75.A NE2 no hydrogen 3.178 N/A HIS 80.A N HIS 77.A O no hydrogen 2.868 N/A HIS 80.A ND1 ASP 53.A OD2 no hydrogen 2.686 N/A VAL 81.A N MET 78.A O no hydrogen 3.165 N/A GLN 82.A N MET 78.A O no hydrogen 2.828 N/A GLN 82.A NE2 GLY 55.A O no hydrogen 2.882 N/A GLY 83.A N ALA 54.A O no hydrogen 2.636 N/A LEU 84.A N VAL 81.A O no hydrogen 2.919 N/A PHE 85.A N GLN 82.A O no hydrogen 3.348 N/A LEU 87.A N LEU 84.A O no hydrogen 3.022 N/A ARG 88.A N LEU 84.A O no hydrogen 3.149 N/A ARG 88.A NH1 ASP 108.A O no hydrogen 3.376 N/A ARG 88.A NH1 ASP 108.A OD1 no hydrogen 2.914 N/A ARG 88.A NH1 HIS 112.A O no hydrogen 2.881 N/A ARG 88.A NH2 ASP 108.A OD1 no hydrogen 2.856 N/A GLY 90.A N LEU 87.A O no hydrogen 2.947 N/A ILE 95.A N LEU 115.A O no hydrogen 2.767 N/A VAL 97.A N ASP 117.A O no hydrogen 2.864 N/A TYR 98.A N PHE 71.A O no hydrogen 2.860 N/A ASP 102.A N PRO 100.A O no hydrogen 2.795 N/A GLN 104.A N ASP 102.A OD1 no hydrogen 2.864 N/A GLY 105.A N ASP 102.A OD1 no hydrogen 2.859 N/A LEU 109.A N CYS 106.A O no hydrogen 3.150 N/A HIS 112.A N ASP 108.A O no hydrogen 2.921 N/A LEU 115.A N ARG 88.A O no hydrogen 2.940 N/A LEU 116.A N PRO 113.A O no hydrogen 2.943 N/A ASP 117.A N ILE 95.A O no hydrogen 2.890 N/A SER 119.A N ASP 117.A OD1 no hydrogen 2.988 N/A SER 119.A OG ASP 117.A OD1 no hydrogen 2.706 N/A VAL 122.A N GLY 99.A O no hydrogen 2.944 N/A PHE 125.A N PRO 137.A O no hydrogen 2.862 N/A VAL 126.A N GLU 123.A O no hydrogen 3.067 N/A PHE 128.A N VAL 135.A O no hydrogen 2.870 N/A LEU 130.A N LEU 133.A O no hydrogen 2.894 N/A GLN 131.A NE2 GLN 70.A OE1 no hydrogen 2.967 N/A GLY 132.A N ASP 129.A OD2 no hydrogen 2.845 N/A LEU 133.A N LEU 130.A O no hydrogen 2.895 N/A GLN 134.A N GLU 152.A O no hydrogen 3.014 N/A VAL 135.A N PHE 128.A O no hydrogen 2.810 N/A THR 136.A N LEU 150.A O no hydrogen 2.930 N/A LEU 138.A N GLY 148.A O no hydrogen 2.775 N/A LEU 140.A N THR 146.A O no hydrogen 2.982 N/A ASN 141.A N THR 164.A OG1 no hydrogen 2.971 N/A ASN 141.A ND2 ALA 165.A O no hydrogen 3.326 N/A HIS 142.A ND1 ASN 198.A O no hydrogen 2.988 N/A HIS 142.A NE2 HIS 77.A ND1 no hydrogen 3.211 N/A THR 146.A OG1 LYS 144.A O no hydrogen 2.751 N/A PHE 147.A N THR 74.A O no hydrogen 2.929 N/A GLY 148.A N LEU 138.A O no hydrogen 2.838 N/A TYR 149.A N TRP 160.A O no hydrogen 2.940 N/A TYR 149.A OH LEU 73.A O no hydrogen 2.675 N/A LEU 150.A N THR 136.A O no hydrogen 2.920 N/A LEU 151.A N VAL 158.A O no hydrogen 2.758 N/A GLU 152.A N GLN 134.A O no hydrogen 2.804 N/A THR 153.A N SER 156.A O no hydrogen 2.944 N/A SER 156.A N THR 153.A OG1 no hydrogen 3.142 N/A ARG 157.A N GLN 181.A OE1 no hydrogen 2.987 N/A ARG 157.A NE GLU 152.A OE1 no hydrogen 3.065 N/A ARG 157.A NH1 GLN 179.A O no hydrogen 2.868 N/A VAL 158.A N LEU 151.A O no hydrogen 2.865 N/A ALA 159.A N VAL 182.A O no hydrogen 2.924 N/A TRP 160.A N TYR 149.A O no hydrogen 2.827 N/A LEU 161.A N VAL 184.A O no hydrogen 2.763 N/A SER 162.A OG ASP 163.A OD1 no hydrogen 2.871 N/A THR 164.A N ASP 186.A OD2 no hydrogen 3.026 N/A THR 164.A OG1 ASN 141.A O no hydrogen 3.445 N/A THR 164.A OG1 GLY 166.A O no hydrogen 2.730 N/A ALA 165.A N ASN 141.A O no hydrogen 2.942 N/A THR 171.A OG1 PRO 139.A O no hydrogen 2.784 N/A LEU 172.A N PRO 168.A O no hydrogen 2.906 N/A LYS 173.A N GLU 169.A O no hydrogen 2.926 N/A PHE 174.A N LYS 170.A O no hydrogen 2.947 N/A LEU 175.A N THR 171.A O no hydrogen 2.959 N/A ARG 176.A N LEU 172.A O no hydrogen 2.945 N/A ASN 177.A N LYS 173.A O no hydrogen 2.945 N/A ASN 178.A N LEU 175.A O no hydrogen 3.282 N/A ASN 178.A ND2 PHE 174.A O no hydrogen 2.921 N/A GLN 181.A N ARG 157.A O no hydrogen 2.908 N/A GLN 181.A NE2 HIS 155.A O no hydrogen 2.990 N/A MET 183.A N ARG 216.A O no hydrogen 2.972 N/A VAL 184.A N ALA 159.A O no hydrogen 2.799 N/A MET 185.A N ILE 218.A O no hydrogen 2.936 N/A ASP 186.A N LEU 161.A O no hydrogen 2.964 N/A CYS 187.A N THR 220.A O no hydrogen 2.890 N/A CYS 187.A SG HIS 189.A O no hydrogen 3.827 N/A SER 188.A N CYS 200.A O no hydrogen 2.999 N/A SER 188.A OG ASP 186.A OD1 no hydrogen 2.880 N/A SER 188.A OG HIS 221.A ND1 no hydrogen 2.796 N/A SER 188.A OG HIS 221.A O no hydrogen 3.185 N/A HIS 189.A N CYS 200.A O no hydrogen 3.332 N/A ARG 192.A N ASP 201.A OD2 no hydrogen 2.830 N/A ASN 198.A ND2 HIS 142.A ND1 no hydrogen 3.498 N/A HIS 199.A ND1 ASP 186.A OD2 no hydrogen 2.564 N/A CYS 200.A N THR 164.A O no hydrogen 2.920 N/A CYS 200.A SG THR 164.A O no hydrogen 3.397 N/A LEU 202.A N HIS 189.A O no hydrogen 3.064 N/A ASN 203.A N ASP 201.A OD2 no hydrogen 3.005 N/A ASN 203.A ND2 ARG 192.A O no hydrogen 3.000 N/A THR 204.A N ASP 201.A OD1 no hydrogen 3.197 N/A THR 204.A OG1 ALA 195.A O no hydrogen 3.391 N/A THR 204.A OG1 ASP 201.A OD1 no hydrogen 2.773 N/A VAL 205.A N ASP 201.A O no hydrogen 3.168 N/A LEU 206.A N LEU 202.A O no hydrogen 2.942 N/A ALA 207.A N ASN 203.A O no hydrogen 2.916 N/A LEU 208.A N THR 204.A O no hydrogen 2.924 N/A ASN 209.A N VAL 205.A O no hydrogen 2.990 N/A ASN 209.A ND2 SER 214.A O no hydrogen 2.996 N/A GLN 210.A N LEU 206.A O no hydrogen 3.016 N/A VAL 211.A N LEU 208.A O no hydrogen 3.102 N/A ILE 212.A N LEU 208.A O no hydrogen 2.969 N/A ARG 213.A N ASN 209.A O no hydrogen 2.806 N/A SER 214.A N ASN 209.A OD1 no hydrogen 2.901 N/A SER 214.A OG PRO 180.A O no hydrogen 2.792 N/A SER 214.A OG ARG 216.A O no hydrogen 3.451 N/A ARG 216.A NE GLU 240.A OE2 no hydrogen 2.820 N/A ARG 216.A NH2 GLU 240.A OE1 no hydrogen 2.818 N/A ARG 216.A NH2 GLU 240.A OE2 no hydrogen 3.562 N/A VAL 217.A N GLY 238.A O no hydrogen 2.876 N/A ILE 218.A N MET 183.A O no hydrogen 2.836 N/A LEU 219.A N GLU 240.A O no hydrogen 2.823 N/A THR 220.A N MET 185.A O no hydrogen 2.889 N/A HIS 221.A N THR 220.A OG1 no hydrogen 2.785 N/A HIS 221.A ND1 SER 188.A OG no hydrogen 2.796 N/A ILE 222.A N THR 9.A O no hydrogen 2.874 N/A SER 223.A N SER 188.A O no hydrogen 3.077 N/A SER 223.A OG SER 188.A O no hydrogen 2.593 N/A SER 223.A OG GLN 225.A OE1 no hydrogen 3.161 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.920 N/A PHE 226.A N SER 223.A OG no hydrogen 3.206 N/A ASP 227.A N SER 223.A O no hydrogen 2.966 N/A ALA 228.A N HIS 224.A O no hydrogen 2.925 N/A TRP 229.A N GLN 225.A O no hydrogen 2.976 N/A LEU 230.A N PHE 226.A O no hydrogen 2.816 N/A MET 231.A N ASP 227.A O no hydrogen 3.093 N/A MET 231.A N ALA 228.A O no hydrogen 3.165 N/A GLU 232.A N TRP 229.A O no hydrogen 2.954 N/A ASN 233.A ND2 TRP 229.A O no hydrogen 2.852 N/A PHE 239.A N PRO 236.A O no hydrogen 3.197 N/A GLU 240.A N VAL 217.A O no hydrogen 2.904 N/A GLY 242.A N LEU 219.A O no hydrogen 2.841 N/A GLY 245.A N LEU 6.A O no hydrogen 2.704 N/A MET 246.A N PHE 243.A O no hydrogen 2.987 N/A ILE 248.A N LEU 4.A O no hydrogen 2.683 N/A