Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fpk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 89.A O no hydrogen 2.768 N/A GLY 6.A N VAL 87.A O no hydrogen 2.772 N/A LYS 7.A N HIS 24.A O no hydrogen 2.884 N/A VAL 8.A N ASP 85.A O no hydrogen 2.835 N/A THR 9.A N THR 22.A O no hydrogen 2.829 N/A THR 9.A OG1 THR 22.A O no hydrogen 3.257 N/A LYS 10.A N THR 22.A O no hydrogen 3.340 N/A LYS 10.A NZ GLN 12.A OE1 no hydrogen 3.157 N/A GLN 12.A N SER 20.A O no hydrogen 2.879 N/A TRP 14.A N LEU 18.A O no hydrogen 2.841 N/A TRP 14.A NE1 SER 20.A OG no hydrogen 2.813 N/A THR 15.A N LEU 18.A O no hydrogen 3.235 N/A ALA 17.A N THR 15.A OG1 no hydrogen 3.169 N/A LEU 18.A N THR 15.A OG1 no hydrogen 2.871 N/A PHE 19.A N LEU 66.A O no hydrogen 3.022 N/A SER 20.A N GLN 12.A O no hydrogen 2.782 N/A SER 20.A OG TYR 150.A OH no hydrogen 2.695 N/A LEU 21.A N PHE 64.A O no hydrogen 2.912 N/A THR 22.A N LYS 10.A O no hydrogen 2.884 N/A VAL 23.A N LEU 62.A O no hydrogen 2.829 N/A HIS 24.A N LYS 7.A O no hydrogen 2.867 N/A HIS 24.A NE2 ASN 61.A OD1 no hydrogen 2.796 N/A ILE 27.A N ALA 25.A O no hydrogen 2.863 N/A ASN 28.A N SER 91.A O.A no hydrogen 2.892 N/A ASN 28.A N SER 91.A O.B no hydrogen 3.282 N/A THR 31.A N GLN 34.A OE1 no hydrogen 2.990 N/A GLN 34.A N THR 31.A O no hydrogen 2.965 N/A GLN 34.A NE2 GLY 95.A O no hydrogen 3.051 N/A PHE 35.A N SER 94.A O no hydrogen 2.916 N/A THR 36.A N TYR 51.A O no hydrogen 3.017 N/A THR 36.A OG1 VAL 90.A O no hydrogen 2.705 N/A LEU 38.A N ARG 49.A O no hydrogen 3.024 N/A GLY 39.A N GLN 88.A O no hydrogen 2.919 N/A LEU 40.A N VAL 47.A O no hydrogen 3.009 N/A ILE 42.A N GLU 45.A O.A no hydrogen 2.769 N/A ILE 42.A N GLU 45.A O.B no hydrogen 2.774 N/A GLU 45.A N.A ILE 42.A O no hydrogen 3.004 N/A GLU 45.A N.B ILE 42.A O no hydrogen 3.013 N/A VAL 47.A N LEU 40.A O no hydrogen 2.877 N/A ARG 49.A N LEU 38.A O no hydrogen 3.050 N/A ARG 49.A NH1 GLN 48.A O no hydrogen 3.010 N/A TYR 51.A N THR 36.A O no hydrogen 2.888 N/A SER 52.A OG TYR 246.A OH no hydrogen 2.714 N/A TYR 53.A N GLN 34.A O no hydrogen 3.230 N/A VAL 54.A N GLU 63.A O no hydrogen 2.842 N/A ASN 55.A ND2 ALA 56.A O no hydrogen 3.180 N/A ASN 55.A ND2 ASN 59.A O no hydrogen 2.909 N/A ASN 59.A N ALA 56.A O no hydrogen 2.956 N/A ASN 61.A N ASN 59.A OD1 no hydrogen 2.984 N/A LEU 62.A N VAL 23.A O no hydrogen 3.118 N/A GLU 63.A N ASN 55.A OD1 no hydrogen 2.952 N/A PHE 64.A N LEU 21.A O no hydrogen 2.996 N/A TYR 65.A OH SER 149.A OG no hydrogen 2.629 N/A LEU 66.A N PHE 19.A O no hydrogen 2.878 N/A THR 68.A N ALA 17.A O no hydrogen 2.766 N/A THR 68.A OG1 ALA 17.A O no hydrogen 3.300 N/A VAL 69.A N SER 75.A OG no hydrogen 2.932 N/A GLY 72.A N VAL 69.A O no hydrogen 2.831 N/A ARG 77.A NH2 GLU 41.A O no hydrogen 2.966 N/A LEU 78.A N LEU 74.A O no hydrogen 2.970 N/A ALA 79.A N SER 75.A O no hydrogen 2.871 N/A ALA 80.A N ARG 77.A O no hydrogen 3.150 N/A LEU 81.A N LEU 78.A O no hydrogen 3.086 N/A LYS 82.A N ASP 85.A OD2 no hydrogen 2.829 N/A GLY 84.A N VAL 8.A O no hydrogen 2.665 N/A ASP 85.A N LYS 82.A O no hydrogen 2.921 N/A VAL 87.A N GLY 6.A O no hydrogen 2.997 N/A GLN 88.A N GLY 39.A O no hydrogen 2.946 N/A VAL 89.A N VAL 4.A O no hydrogen 2.888 N/A VAL 90.A N LYS 37.A O no hydrogen 3.018 N/A SER 91.A N.A ASP 2.A O.A no hydrogen 3.157 N/A SER 91.A N.A ASP 2.A O.B no hydrogen 3.126 N/A SER 91.A N.B ASP 2.A O.A no hydrogen 3.094 N/A SER 91.A N.B ASP 2.A O.B no hydrogen 3.063 N/A SER 91.A OG.A ASP 2.A O.A no hydrogen 3.484 N/A SER 91.A OG.A ASP 2.A O.B no hydrogen 3.444 N/A SER 91.A OG.B ASP 2.A O.A no hydrogen 3.269 N/A SER 91.A OG.B ASP 2.A O.B no hydrogen 3.230 N/A SER 94.A N PHE 35.A O no hydrogen 2.867 N/A GLU 101.A N VAL 98.A O no hydrogen 2.884 N/A VAL 102.A N LEU 99.A O no hydrogen 2.932 N/A CYS 105.A SG PRO 103.A O no hydrogen 3.972 N/A THR 107.A N THR 205.A O no hydrogen 2.735 N/A THR 107.A OG1 ASN 135.A OD1 no hydrogen 3.004 N/A LEU 108.A N ASN 135.A O no hydrogen 3.032 N/A TRP 109.A N HIS 207.A O no hydrogen 2.898 N/A TRP 109.A NE1 PRO 200.A O no hydrogen 3.267 N/A MET 110.A N VAL 137.A O no hydrogen 2.718 N/A LEU 111.A N MET 209.A O no hydrogen 2.922 N/A ALA 112.A N VAL 139.A O no hydrogen 3.008 N/A THR 113.A N CYS 211.A O no hydrogen 3.269 N/A GLY 114.A N ALA 141.A O no hydrogen 2.763 N/A ALA 116.A N THR 113.A O no hydrogen 2.930 N/A GLY 118.A N THR 115.A O no hydrogen 3.475 N/A TYR 120.A OH LEU 111.A O no hydrogen 2.825 N/A LEU 121.A N ILE 117.A O no hydrogen 3.204 N/A SER 122.A N GLY 118.A O no hydrogen 2.993 N/A SER 122.A OG ASN 55.A O no hydrogen 2.722 N/A ILE 123.A N PRO 119.A O no hydrogen 3.051 N/A LEU 124.A N TYR 120.A O no hydrogen 2.808 N/A GLN 125.A N LEU 121.A O no hydrogen 2.821 N/A TYR 126.A N SER 122.A O no hydrogen 2.976 N/A GLY 127.A N ILE 123.A O no hydrogen 2.938 N/A ARG 132.A NE ASP 129.A O no hydrogen 3.368 N/A ARG 132.A NE ASP 129.A OD2 no hydrogen 3.336 N/A ARG 132.A NH1 VAL 102.A O no hydrogen 2.932 N/A ARG 132.A NH1 ASP 104.A OD1 no hydrogen 2.734 N/A ARG 132.A NH2 VAL 102.A O no hydrogen 3.138 N/A ARG 132.A NH2 ASP 129.A OD2 no hydrogen 3.034 N/A PHE 133.A N VAL 130.A O no hydrogen 3.135 N/A ASN 135.A N GLU 106.A O no hydrogen 2.902 N/A LEU 136.A N LYS 164.A O no hydrogen 3.113 N/A VAL 137.A N LEU 108.A O no hydrogen 2.822 N/A LEU 138.A N ARG 166.A O no hydrogen 2.831 N/A VAL 139.A N MET 110.A O no hydrogen 2.755 N/A HIS 140.A N GLN 168.A O no hydrogen 2.999 N/A HIS 140.A NE2 GLY 114.A O no hydrogen 2.856 N/A ALA 141.A N ALA 112.A O no hydrogen 2.899 N/A ALA 142.A N VAL 170.A O no hydrogen 3.009 N/A PHE 144.A N ASP 147.A OD2 no hydrogen 2.930 N/A ALA 145.A N GLU 174.A OE2 no hydrogen 2.776 N/A ASP 147.A N PHE 144.A O no hydrogen 2.925 N/A LEU 148.A N ALA 145.A O no hydrogen 3.115 N/A SER 149.A OG TYR 65.A OH no hydrogen 2.629 N/A SER 149.A OG ASP 147.A O no hydrogen 3.437 N/A TYR 150.A OH SER 20.A OG no hydrogen 2.695 N/A TYR 150.A OH GLU 63.A OE2 no hydrogen 2.568 N/A MET 154.A N TYR 150.A O no hydrogen 2.835 N/A LEU 155.A N LEU 151.A O no hydrogen 2.896 N/A GLU 156.A N PRO 152.A O no hydrogen 3.136 N/A LEU 157.A N LEU 153.A O no hydrogen 2.892 N/A GLN 158.A N MET 154.A O no hydrogen 2.811 N/A GLN 159.A N LEU 155.A O no hydrogen 3.183 N/A ARG 160.A N GLU 156.A O no hydrogen 2.989 N/A ARG 160.A NH1 GLN 125.A O no hydrogen 3.019 N/A ARG 160.A NH2 GLN 125.A O no hydrogen 2.745 N/A TYR 161.A N LEU 157.A O no hydrogen 3.008 N/A TYR 161.A OH LEU 124.A O no hydrogen 2.728 N/A GLU 162.A N GLN 159.A O no hydrogen 3.071 N/A LYS 164.A N TYR 161.A O no hydrogen 3.022 N/A LYS 164.A NZ VAL 130.A O no hydrogen 2.872 N/A LYS 164.A NZ PHE 133.A O no hydrogen 2.997 N/A ARG 166.A N LEU 136.A O no hydrogen 2.886 N/A ARG 166.A NH1 VAL 197.A O no hydrogen 2.994 N/A GLN 168.A N LEU 138.A O no hydrogen 2.835 N/A GLN 168.A NE2 THR 169.A O no hydrogen 3.120 N/A GLN 168.A NE2 GLY 178.A O no hydrogen 3.310 N/A THR 169.A OG1 SER 179.A OG no hydrogen 2.784 N/A VAL 170.A N HIS 140.A O no hydrogen 2.815 N/A VAL 171.A N LEU 180.A O no hydrogen 2.847 N/A SER 172.A N ARG 143.A O no hydrogen 3.024 N/A SER 179.A N VAL 176.A O no hydrogen 3.021 N/A SER 179.A OG THR 169.A OG1 no hydrogen 2.784 N/A LEU 180.A N THR 169.A O no hydrogen 3.017 N/A THR 181.A OG1 GLU 174.A O no hydrogen 2.722 N/A GLY 182.A N VAL 171.A O no hydrogen 2.777 N/A ARG 183.A NH2.A ASP 219.A OD2 no hydrogen 2.496 N/A LEU 187.A N ARG 183.A O.A no hydrogen 2.896 N/A LEU 187.A N ARG 183.A O.B no hydrogen 2.911 N/A ILE 188.A N VAL 184.A O no hydrogen 2.945 N/A GLU 189.A N PRO 185.A O no hydrogen 2.921 N/A ASN 190.A N ALA 186.A O no hydrogen 2.997 N/A ASN 190.A ND2 GLU 192.A OE1 no hydrogen 3.219 N/A GLY 191.A N ILE 188.A O no hydrogen 3.152 N/A GLU 192.A N ASN 190.A OD1 no hydrogen 2.953 N/A LEU 193.A N LEU 187.A O no hydrogen 2.977 N/A LYS 195.A N GLY 191.A O no hydrogen 3.023 N/A ALA 196.A N GLU 192.A O no hydrogen 2.891 N/A VAL 197.A N LEU 193.A O no hydrogen 2.948 N/A GLY 198.A N GLU 194.A O no hydrogen 2.786 N/A MET 201.A N GLU 194.A OE2 no hydrogen 2.860 N/A ASP 202.A N SER 206.A OG no hydrogen 3.139 N/A LYS 203.A NZ.B GLU 204.A OE2 no hydrogen 2.926 N/A THR 205.A N ASP 202.A OD1 no hydrogen 2.904 N/A THR 205.A OG1 ASP 202.A OD1 no hydrogen 2.594 N/A THR 205.A OG1 SER 206.A OG no hydrogen 2.968 N/A SER 206.A N ASP 202.A O no hydrogen 3.055 N/A SER 206.A OG PRO 200.A O no hydrogen 3.298 N/A SER 206.A OG ASP 202.A O no hydrogen 3.356 N/A SER 206.A OG THR 205.A OG1 no hydrogen 2.968 N/A HIS 207.A N THR 107.A O no hydrogen 3.000 N/A HIS 207.A NE2 THR 242.A OG1 no hydrogen 2.777 N/A VAL 208.A N HIS 240.A O no hydrogen 2.768 N/A MET 209.A N TRP 109.A O no hydrogen 2.750 N/A LEU 210.A N THR 242.A O no hydrogen 2.787 N/A CYS 211.A N LEU 111.A O no hydrogen 2.839 N/A CYS 211.A SG ALA 116.A O no hydrogen 3.531 N/A CYS 211.A SG GLU 244.A O no hydrogen 3.756 N/A GLY 212.A N GLU 244.A O no hydrogen 3.044 N/A ASN 213.A N THR 113.A OG1 no hydrogen 2.784 N/A GLN 215.A N.A ASN 213.A OD1 no hydrogen 2.855 N/A GLN 215.A N.B ASN 213.A OD1 no hydrogen 2.834 N/A VAL 217.A N ASN 213.A O no hydrogen 2.962 N/A ARG 218.A N PRO 214.A O no hydrogen 2.715 N/A ASP 219.A N GLN 215.A O.A no hydrogen 2.885 N/A ASP 219.A N GLN 215.A O.B no hydrogen 2.869 N/A THR 220.A N MET 216.A O no hydrogen 2.990 N/A THR 220.A OG1 MET 216.A O no hydrogen 2.789 N/A GLN 221.A N VAL 217.A O no hydrogen 2.952 N/A GLN 222.A N ARG 218.A O no hydrogen 2.874 N/A GLN 222.A NE2 GLU 226.A OE2 no hydrogen 2.938 N/A LEU 223.A N ASP 219.A O no hydrogen 3.042 N/A LEU 224.A N THR 220.A O no hydrogen 2.923 N/A LYS 225.A N GLN 221.A O no hydrogen 2.931 N/A GLU 226.A N GLN 222.A O no hydrogen 2.940 N/A THR 227.A N LEU 223.A O no hydrogen 2.888 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.544 N/A ARG 228.A N LEU 224.A O no hydrogen 3.013 N/A ARG 228.A NH1 GLU 194.A OE1 no hydrogen 2.955 N/A ARG 228.A NH1 GLU 194.A OE2 no hydrogen 2.988 N/A ARG 228.A NH1 MET 201.A O no hydrogen 2.902 N/A ARG 228.A NH2 GLU 194.A OE1 no hydrogen 3.315 N/A MET 230.A N LEU 224.A O no hydrogen 3.127 N/A THR 231.A N HIS 240.A ND1 no hydrogen 2.971 N/A HIS 233.A N MET 241.A O no hydrogen 2.824 N/A LEU 234.A N ARG 237.A O no hydrogen 3.064 N/A ARG 237.A N LEU 234.A O no hydrogen 3.045 N/A ARG 237.A NH1 ARG 236.A O no hydrogen 2.976 N/A GLY 239.A N HIS 233.A ND1 no hydrogen 3.018 N/A HIS 240.A N THR 231.A O no hydrogen 2.822 N/A THR 242.A N VAL 208.A O no hydrogen 2.958 N/A THR 242.A OG1 HIS 207.A NE2 no hydrogen 2.777 N/A GLU 244.A N LEU 210.A O no hydrogen 2.871 N/A TYR 246.A N GLY 212.A O no hydrogen 2.965 N/A TYR 246.A OH SER 52.A OG no hydrogen 2.714 N/A