Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7a7u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N GLU 2.A O no hydrogen 3.229 N/A THR 6.A OG1 GLU 3.A O no hydrogen 3.359 N/A VAL 9.A N GLY 32.A O no hydrogen 2.967 N/A ILE 11.A N GLY 30.A O no hydrogen 2.909 N/A LEU 12.A N LEU 113.A O no hydrogen 2.982 N/A VAL 13.A N GLY 28.A O no hydrogen 2.978 N/A GLU 14.A N ASN 115.A O no hydrogen 2.919 N/A LEU 15.A N VAL 26.A O no hydrogen 2.906 N/A ASP 16.A N.A ILE 117.A O no hydrogen 2.986 N/A ASP 16.A N.B ILE 117.A O no hydrogen 2.975 N/A GLY 17.A N PHE 24.A O no hydrogen 2.943 N/A ASP 18.A N LEU 119.A O no hydrogen 3.096 N/A VAL 19.A N HIS 22.A O no hydrogen 2.965 N/A ASN 20.A N GLY 121.A O no hydrogen 3.025 N/A ASN 20.A ND2 PHE 124.A O no hydrogen 2.974 N/A HIS 22.A N VAL 19.A O no hydrogen 2.827 N/A HIS 22.A NE2 GLU 126.A OE2 no hydrogen 3.047 N/A PHE 24.A N GLY 17.A O no hydrogen 3.003 N/A SER 25.A N THR 47.A OG1 no hydrogen 3.097 N/A SER 25.A OG ASP 16.A OD1.A no hydrogen 2.848 N/A VAL 26.A N LEU 15.A O no hydrogen 2.894 N/A ARG 27.A N ILE 44.A O no hydrogen 2.989 N/A ARG 27.A NE GLU 29.A OE2 no hydrogen 3.188 N/A GLY 28.A N VAL 13.A O no hydrogen 2.789 N/A GLU 29.A N LYS 42.A O no hydrogen 3.069 N/A GLY 30.A N ILE 11.A O no hydrogen 3.199 N/A GLU 31.A N THR 40.A O no hydrogen 3.052 N/A GLY 32.A N VAL 9.A O no hydrogen 2.822 N/A ASP 33.A N LYS 38.A O no hydrogen 2.739 N/A THR 35.A OG1 THR 6.A O no hydrogen 3.477 N/A ASN 36.A N ASP 33.A O no hydrogen 3.023 N/A ASN 36.A ND2 ASP 33.A OD2 no hydrogen 3.068 N/A GLY 37.A N ALA 34.A O no hydrogen 2.982 N/A LYS 38.A N ASP 33.A O no hydrogen 3.038 N/A LEU 39.A N GLU 216.A O no hydrogen 2.842 N/A THR 40.A N GLU 31.A O no hydrogen 3.142 N/A MET 41.A N LEU 214.A O no hydrogen 2.874 N/A LYS 42.A N GLU 29.A O no hydrogen 2.996 N/A LYS 42.A NZ ASP 204.A OD2 no hydrogen 3.034 N/A LYS 42.A NZ GLU 207.A OE2 no hydrogen 2.608 N/A PHE 43.A N MET 212.A O no hydrogen 2.851 N/A ILE 44.A N ARG 27.A O no hydrogen 2.871 N/A CYS 45.A N ASP 210.A O no hydrogen 2.994 N/A CYS 45.A SG SER 25.A O no hydrogen 3.642 N/A CYS 45.A SG THR 47.A OG1 no hydrogen 3.475 N/A CYS 45.A SG GLY 48.A O no hydrogen 3.380 N/A THR 46.A N SER 25.A O no hydrogen 2.941 N/A THR 46.A OG1 SER 25.A O no hydrogen 3.452 N/A LEU 50.A N ASP 210.A OD2 no hydrogen 2.986 N/A TRP 54.A NE1 ASP 210.A OD1 no hydrogen 2.964 N/A THR 56.A N PRO 53.A O no hydrogen 2.954 N/A THR 56.A OG1 PRO 53.A O no hydrogen 2.617 N/A THR 56.A OG1 TYR 100.A OH no hydrogen 2.837 N/A LEU 57.A N TRP 54.A O no hydrogen 2.896 N/A THR 59.A OG1 HIS 175.A NE2 no hydrogen 2.941 N/A LEU 61.A N LEU 57.A O no hydrogen 2.962 N/A PHE 65.A N VAL 62.A O no hydrogen 3.083 N/A ALA 66.A N LEU 63.A O no hydrogen 3.120 N/A ARG 67.A N VAL 218.A O no hydrogen 2.916 N/A TYR 68.A OH HIS 193.A NE2 no hydrogen 2.740 N/A MET 72.A N PRO 69.A O no hydrogen 3.319 N/A LYS 73.A N ASP 70.A O no hydrogen 2.930 N/A HIS 75.A N GLN 74.A OE1 no hydrogen 2.735 N/A LYS 79.A N ASP 76.A OD1 no hydrogen 3.204 N/A LYS 79.A NZ CYS 64.A O no hydrogen 2.731 N/A LYS 79.A NZ ALA 66.A O no hydrogen 2.809 N/A LYS 79.A NZ ASP 76.A OD2 no hydrogen 2.812 N/A SER 80.A N ASP 76.A O no hydrogen 3.061 N/A SER 80.A OG ASP 76.A O no hydrogen 3.386 N/A SER 80.A OG PHE 77.A O no hydrogen 3.124 N/A ALA 81.A N PHE 77.A O no hydrogen 3.173 N/A MET 82.A N LYS 79.A O no hydrogen 2.985 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.769 N/A GLY 85.A N ALA 81.A O no hydrogen 2.782 N/A TYR 86.A N VAL 106.A O no hydrogen 3.000 N/A VAL 87.A N THR 180.A O no hydrogen 2.788 N/A GLN 88.A N ALA 104.A O no hydrogen 2.844 N/A GLU 89.A N GLN 178.A O.A no hydrogen 2.923 N/A GLU 89.A N GLN 178.A O.B no hydrogen 2.893 N/A ARG 90.A N THR 102.A O no hydrogen 3.124 N/A ARG 90.A NE GLN 177.A OE1 no hydrogen 2.978 N/A ARG 90.A NH1 THR 59.A O no hydrogen 2.825 N/A ARG 90.A NH2 GLN 177.A OE1 no hydrogen 2.962 N/A THR 91.A N TYR 176.A O no hydrogen 2.999 N/A ILE 92.A N TYR 100.A O no hydrogen 2.917 N/A SER 93.A N.A ASP 174.A O no hydrogen 2.896 N/A SER 93.A N.B ASP 174.A O no hydrogen 2.906 N/A SER 93.A OG.A ASP 174.A O no hydrogen 3.569 N/A PHE 94.A N GLY 98.A O no hydrogen 3.136 N/A GLU 95.A N LEU 172.A O no hydrogen 3.022 N/A ASP 97.A N PHE 94.A O no hydrogen 2.985 N/A GLY 98.A N ASP 97.A OD1 no hydrogen 2.796 N/A TYR 99.A N ILE 122.A O no hydrogen 3.019 N/A TYR 100.A N ILE 92.A O no hydrogen 2.838 N/A TYR 100.A OH THR 56.A OG1 no hydrogen 2.837 N/A LYS 101.A N LYS 120.A O no hydrogen 2.716 N/A THR 102.A N ARG 90.A O no hydrogen 2.943 N/A ARG 103.A N GLU 118.A O no hydrogen 2.945 N/A ARG 103.A NH1 GLU 105.A OE2 no hydrogen 3.464 N/A ARG 103.A NH2 GLU 105.A OE2 no hydrogen 2.928 N/A ALA 104.A N GLN 88.A O no hydrogen 2.802 N/A GLU 105.A N ARG 116.A O no hydrogen 2.955 N/A VAL 106.A N TYR 86.A O no hydrogen 2.927 N/A LYS 107.A N VAL 114.A O no hydrogen 3.069 N/A LYS 107.A NZ GLU 105.A OE1 no hydrogen 3.067 N/A PHE 108.A N PRO 83.A O no hydrogen 3.171 N/A GLU 109.A N THR 112.A O no hydrogen 2.863 N/A THR 112.A N GLU 109.A O no hydrogen 3.238 N/A THR 112.A OG1 ASP 111.A OD1 no hydrogen 3.246 N/A LEU 113.A N PRO 10.A O no hydrogen 2.978 N/A VAL 114.A N LYS 107.A O no hydrogen 2.824 N/A ASN 115.A N LEU 12.A O no hydrogen 2.876 N/A ASN 115.A ND2 THR 60.A O no hydrogen 3.379 N/A ASN 115.A ND2 LEU 61.A O no hydrogen 3.029 N/A ARG 116.A N GLU 105.A O no hydrogen 3.090 N/A ARG 116.A NE GLU 14.A OE2 no hydrogen 2.837 N/A ARG 116.A NH1 GLU 109.A OE1 no hydrogen 2.941 N/A ARG 116.A NH2 GLU 14.A OE2 no hydrogen 3.205 N/A ARG 116.A NH2 GLU 109.A OE2 no hydrogen 3.005 N/A ILE 117.A N GLU 14.A O no hydrogen 2.718 N/A GLU 118.A N ARG 103.A O no hydrogen 2.873 N/A LEU 119.A N ASP 16.A O.A no hydrogen 2.911 N/A LEU 119.A N ASP 16.A O.B no hydrogen 2.967 N/A LYS 120.A N LYS 101.A O no hydrogen 2.836 N/A LYS 120.A NZ ASP 18.A OD2 no hydrogen 3.565 N/A GLY 121.A N ASP 18.A O no hydrogen 2.811 N/A ILE 122.A N TYR 99.A O no hydrogen 2.954 N/A PHE 124.A N ASN 20.A OD1 no hydrogen 3.006 N/A LYS 125.A N ASP 97.A OD1 no hydrogen 2.854 N/A LYS 125.A NZ ASP 96.A O no hydrogen 3.196 N/A LYS 125.A NZ ASP 96.A OD1 no hydrogen 3.375 N/A LYS 125.A NZ ASP 96.A OD2 no hydrogen 3.507 N/A GLY 128.A N LYS 125.A O no hydrogen 2.908 N/A ASN 129.A ND2 GLN 171.A OE1 no hydrogen 2.944 N/A GLY 132.A N GLY 128.A O no hydrogen 2.926 N/A HIS 133.A N ILE 130.A O no hydrogen 3.108 N/A LYS 134.A N ASN 129.A O no hydrogen 2.999 N/A LYS 134.A NZ ASP 127.A O no hydrogen 2.833 N/A LYS 134.A NZ ASP 127.A OD2 no hydrogen 3.473 N/A GLU 136.A N ASN 164.A O no hydrogen 2.881 N/A TYR 137.A OH SER 202.A O no hydrogen 2.633 N/A ASN 138.A ND2 GLU 136.A OE2 no hydrogen 3.090 N/A ASN 140.A ND2 ARG 162.A O.A no hydrogen 3.023 N/A ASN 140.A ND2 ARG 162.A O.B no hydrogen 3.088 N/A ASN 140.A ND2 ASN 164.A OD1 no hydrogen 3.328 N/A HIS 142.A N.A THR 197.A O.A no hydrogen 3.143 N/A HIS 142.A N.A THR 197.A O.B no hydrogen 3.202 N/A HIS 142.A N.B THR 197.A O.A no hydrogen 3.157 N/A HIS 142.A N.B THR 197.A O.B no hydrogen 3.215 N/A HIS 142.A ND1.B ASP 143.A O no hydrogen 2.608 N/A ALA 144.A N LEU 195.A O no hydrogen 2.871 N/A ILE 146.A N HIS 193.A O no hydrogen 2.727 N/A THR 147.A N ARG 156.A O.A no hydrogen 2.965 N/A THR 147.A N ARG 156.A O.B no hydrogen 3.012 N/A THR 147.A OG1 ARG 156.A O.A no hydrogen 3.500 N/A ASP 149.A N GLY 154.A O no hydrogen 2.688 N/A GLN 151.A N GLN 151.A OE1 no hydrogen 2.569 N/A LYS 152.A N ASP 149.A O no hydrogen 3.216 N/A LYS 152.A N ASP 149.A OD2 no hydrogen 3.328 N/A LYS 152.A NZ GLN 178.A OE1.B no hydrogen 2.815 N/A ASN 153.A N LYS 150.A O no hydrogen 3.057 N/A GLY 154.A N ASP 149.A O no hydrogen 3.004 N/A ILE 155.A N ASN 179.A O no hydrogen 3.103 N/A ARG 156.A N.A THR 147.A O no hydrogen 2.861 N/A ARG 156.A N.B THR 147.A O no hydrogen 2.845 N/A ARG 156.A NH1.A ASP 149.A OD1 no hydrogen 2.653 N/A SER 157.A N GLN 177.A O no hydrogen 3.120 N/A SER 157.A OG TYR 145.A O no hydrogen 2.846 N/A PHE 159.A N HIS 175.A O no hydrogen 3.064 N/A ILE 161.A N ALA 173.A O no hydrogen 2.918 N/A ARG 162.A N.A HIS 142.A NE2.A no hydrogen 3.056 N/A ARG 162.A N.B HIS 142.A NE2.A no hydrogen 3.055 N/A LEU 163.A N GLN 171.A O no hydrogen 2.899 N/A ASN 164.A ND2 ASN 138.A OD1 no hydrogen 2.865 N/A ASN 164.A ND2 ASN 140.A OD1 no hydrogen 3.267 N/A VAL 165.A N SER 169.A O no hydrogen 2.851 N/A GLU 166.A N.A LYS 134.A O no hydrogen 2.938 N/A GLU 166.A N.B LYS 134.A O no hydrogen 2.919 N/A GLY 168.A N VAL 165.A O no hydrogen 2.891 N/A SER 169.A N ASP 167.A OD2 no hydrogen 2.891 N/A SER 169.A OG ASP 167.A OD1 no hydrogen 3.491 N/A SER 169.A OG ASP 167.A OD2 no hydrogen 2.550 N/A GLN 171.A N LEU 163.A O no hydrogen 2.774 N/A GLN 171.A NE2 GLU 95.A O no hydrogen 2.858 N/A ALA 173.A N ILE 161.A O no hydrogen 2.831 N/A ASP 174.A N SER 93.A O.A no hydrogen 2.829 N/A ASP 174.A N SER 93.A O.B no hydrogen 2.840 N/A HIS 175.A N PHE 159.A O no hydrogen 2.772 N/A HIS 175.A ND1 ALA 173.A O no hydrogen 2.845 N/A HIS 175.A NE2 THR 59.A OG1 no hydrogen 2.941 N/A TYR 176.A N THR 91.A O no hydrogen 2.930 N/A GLN 177.A N SER 157.A O no hydrogen 2.841 N/A GLN 177.A NE2 ASN 179.A OD1 no hydrogen 2.729 N/A GLN 178.A N.A GLU 89.A O no hydrogen 2.933 N/A GLN 178.A N.B GLU 89.A O no hydrogen 2.925 N/A GLN 178.A NE2.A GLU 89.A OE1 no hydrogen 2.693 N/A ASN 179.A N ILE 155.A O no hydrogen 2.969 N/A ASN 179.A ND2 GLN 88.A OE1 no hydrogen 2.839 N/A THR 180.A N VAL 87.A O no hydrogen 2.990 N/A ILE 182.A N GLY 85.A O no hydrogen 2.882 N/A LEU 188.A N SER 80.A OG no hydrogen 3.215 N/A ASN 192.A ND2 TYR 145.A OH no hydrogen 2.797 N/A HIS 193.A N ILE 146.A O no hydrogen 3.172 N/A HIS 193.A ND1 ASP 191.A O no hydrogen 2.961 N/A HIS 193.A NE2 TYR 68.A OH no hydrogen 2.740 N/A TYR 194.A N SER 221.A O no hydrogen 3.068 N/A LEU 195.A N ALA 144.A O no hydrogen 2.890 N/A SER 196.A N.A THR 219.A O no hydrogen 2.659 N/A SER 196.A N.B THR 219.A O no hydrogen 2.656 N/A SER 196.A OG.A ASP 143.A OD1 no hydrogen 3.218 N/A SER 196.A OG.B ASP 143.A OD1 no hydrogen 2.728 N/A SER 196.A OG.B ASP 143.A OD2 no hydrogen 3.244 N/A THR 197.A N.A HIS 142.A O.A no hydrogen 2.967 N/A THR 197.A N.A HIS 142.A O.B no hydrogen 2.987 N/A THR 197.A N.B HIS 142.A O.A no hydrogen 2.959 N/A THR 197.A N.B HIS 142.A O.B no hydrogen 2.978 N/A THR 197.A OG1.B HIS 142.A O.A no hydrogen 3.192 N/A THR 197.A OG1.B HIS 142.A O.B no hydrogen 3.150 N/A GLN 198.A N PHE 217.A O no hydrogen 3.002 N/A LYS 200.A N LEU 215.A O no hydrogen 2.791 N/A SER 202.A N VAL 213.A O no hydrogen 2.906 N/A LYS 203.A NZ HIS 211.A O no hydrogen 2.907 N/A ASP 204.A N HIS 211.A NE2 no hydrogen 2.782 N/A ASN 206.A N ASP 204.A OD1 no hydrogen 3.117 N/A GLU 207.A N ASP 204.A O no hydrogen 3.096 N/A ARG 209.A N GLU 207.A OE1 no hydrogen 3.116 N/A ARG 209.A NE GLU 207.A OE1 no hydrogen 2.733 N/A ARG 209.A NH1 GLU 207.A OE1 no hydrogen 3.173 N/A ARG 209.A NH1 GLU 207.A OE2 no hydrogen 3.024 N/A HIS 211.A ND1 ARG 209.A O no hydrogen 2.857 N/A MET 212.A N PHE 43.A O no hydrogen 2.982 N/A VAL 213.A N SER 202.A O no hydrogen 3.090 N/A LEU 214.A N MET 41.A O no hydrogen 2.854 N/A LEU 215.A N LYS 200.A O no hydrogen 2.913 N/A GLU 216.A N LEU 39.A O no hydrogen 2.934 N/A PHE 217.A N GLN 198.A O no hydrogen 2.962 N/A VAL 218.A N GLY 37.A O no hydrogen 2.836 N/A THR 219.A N SER 196.A O.A no hydrogen 2.807 N/A THR 219.A N SER 196.A O.B no hydrogen 2.800 N/A ALA 220.A N ARG 67.A O no hydrogen 2.865 N/A SER 221.A N TYR 194.A O no hydrogen 2.818 N/A