Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qq9_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.504 N/A GLY 3.A N ASN 8.A O no hydrogen 2.902 N/A ASP 5.A N ASN 8.A OD1 no hydrogen 2.952 N/A ASN 8.A N ASP 5.A O no hydrogen 3.172 N/A GLN 12.A N GLY 9.A O no hydrogen 2.776 N/A TRP 13.A NE1 GLY 3.A O no hydrogen 3.008 N/A SER 14.A OG ASN 21.A OD1 no hydrogen 3.551 N/A LYS 15.A N GLN 12.A O no hydrogen 3.257 N/A LEU 16.A N TRP 13.A O no hydrogen 3.121 N/A TYR 17.A N TRP 13.A O no hydrogen 2.841 N/A ALA 20.A N TYR 17.A O no hydrogen 2.970 N/A ASN 21.A N PRO 18.A O no hydrogen 3.290 N/A GLY 22.A N ILE 19.A O no hydrogen 2.771 N/A ASN 24.A N GLU 202.A OE1 no hydrogen 3.170 N/A GLN 25.A NE2 LEU 200.A O no hydrogen 3.258 N/A GLN 25.A NE2 GLU 202.A OE1 no hydrogen 3.027 N/A SER 26.A N SER 194.A OG no hydrogen 2.811 N/A SER 26.A OG TYR 191.A OH no hydrogen 2.638 N/A ILE 30.A N THR 105.A O no hydrogen 2.837 N/A THR 32.A N ASP 107.A OD1 no hydrogen 2.937 N/A THR 32.A OG1 ASP 107.A OD1 no hydrogen 2.855 N/A THR 32.A OG1 ASP 107.A OD2 no hydrogen 2.748 N/A GLU 34.A N LYS 31.A O no hydrogen 3.178 N/A THR 35.A OG1 THR 32.A O no hydrogen 2.794 N/A LYS 36.A N VAL 253.A O no hydrogen 3.330 N/A ASP 38.A N ALA 255.A O no hydrogen 3.142 N/A SER 40.A N ASP 38.A OD1 no hydrogen 2.722 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 2.484 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 3.409 N/A LYS 42.A N GLY 79.A O no hydrogen 3.252 N/A SER 45.A N LYS 77.A O no hydrogen 2.951 N/A SER 47.A N VAL 75.A O no hydrogen 3.082 N/A TYR 48.A OH HIS 119.A NE2 no hydrogen 2.609 N/A ASN 49.A N SER 74.A OG no hydrogen 2.753 N/A ALA 51.A N ASN 49.A OD1 no hydrogen 2.785 N/A THR 52.A N ASN 49.A O no hydrogen 2.856 N/A THR 52.A OG1 ASN 49.A O no hydrogen 2.756 N/A THR 52.A OG1 SER 74.A OG no hydrogen 2.725 N/A ALA 53.A N PRO 50.A O no hydrogen 3.255 N/A LYS 54.A N ASN 66.A O no hydrogen 3.015 N/A GLU 55.A N ASN 66.A O no hydrogen 3.263 N/A ILE 56.A N ALA 171.A O no hydrogen 3.102 N/A ILE 57.A N HIS 64.A O no hydrogen 2.851 N/A ASN 58.A N LYS 169.A O no hydrogen 3.017 N/A ASN 58.A ND2 ILE 164.A O no hydrogen 3.085 N/A ASN 58.A ND2 LEU 227.A O no hydrogen 3.086 N/A VAL 59.A N SER 62.A O no hydrogen 3.013 N/A GLY 60.A N ASN 58.A OD1 no hydrogen 2.901 N/A SER 62.A OG PHE 63.A O no hydrogen 3.514 N/A SER 62.A OG PHE 92.A O no hydrogen 3.239 N/A HIS 64.A N ILE 57.A O no hydrogen 2.893 N/A VAL 65.A N PHE 90.A O no hydrogen 2.936 N/A ASN 66.A N GLU 55.A O no hydrogen 2.742 N/A PHE 67.A N PHE 88.A O no hydrogen 2.866 N/A GLU 68.A N THR 52.A O no hydrogen 2.721 N/A ARG 73.A N ASP 71.A OD1 no hydrogen 3.254 N/A ARG 73.A NE ASP 71.A OD1 no hydrogen 2.913 N/A ARG 73.A NH2 GLU 68.A OE1 no hydrogen 2.717 N/A SER 74.A OG THR 52.A OG1 no hydrogen 2.725 N/A VAL 75.A N SER 47.A O no hydrogen 3.080 N/A LEU 76.A N TYR 85.A O no hydrogen 2.770 N/A LYS 77.A N SER 45.A O no hydrogen 2.812 N/A GLY 79.A N PRO 43.A O no hydrogen 3.111 N/A PHE 81.A N GLY 78.A O no hydrogen 3.052 N/A TYR 85.A N LEU 76.A O no hydrogen 2.990 N/A TYR 85.A OH ASP 136.A O no hydrogen 3.148 N/A ARG 86.A N TRP 120.A O no hydrogen 2.592 N/A ARG 86.A NE ASN 72.A OD1 no hydrogen 3.120 N/A ARG 86.A NH1 ASP 69.A O no hydrogen 2.962 N/A ARG 86.A NH2 ASN 72.A OD1 no hydrogen 3.266 N/A LEU 87.A N SER 74.A O no hydrogen 2.920 N/A PHE 88.A N ALA 118.A O no hydrogen 2.913 N/A GLN 89.A N ALA 118.A O no hydrogen 3.448 N/A GLN 89.A NE2 ASN 66.A OD1 no hydrogen 2.800 N/A PHE 90.A N VAL 65.A O no hydrogen 2.953 N/A HIS 91.A N HIS 116.A O no hydrogen 3.072 N/A HIS 91.A ND1 GLN 89.A OE1 no hydrogen 2.914 N/A HIS 93.A N GLU 114.A O no hydrogen 2.969 N/A HIS 93.A ND1 ASN 241.A O no hydrogen 2.814 N/A TRP 94.A N ASN 241.A OD1 no hydrogen 2.891 N/A TRP 94.A NE1 MET 238.A O no hydrogen 2.896 N/A THR 97.A OG1 HIS 100.A ND1 no hydrogen 3.046 N/A ASN 98.A ND2 SER 217.A OG.B no hydrogen 2.798 N/A HIS 100.A N THR 97.A O no hydrogen 3.482 N/A SER 102.A N TYR 111.A O no hydrogen 3.094 N/A SER 102.A OG HIS 104.A O no hydrogen 2.703 N/A GLU 103.A N GLU 114.A OE2 no hydrogen 2.755 N/A HIS 104.A N GLU 114.A OE2 no hydrogen 2.714 N/A HIS 104.A ND1 GLU 114.A OE1 no hydrogen 2.623 N/A HIS 104.A NE2 TYR 191.A OH no hydrogen 2.738 N/A THR 105.A N VAL 28.A O no hydrogen 3.458 N/A THR 105.A OG1 ASP 29.A OD1 no hydrogen 2.799 N/A VAL 106.A N VAL 109.A O no hydrogen 3.229 N/A ASP 107.A N ILE 30.A O no hydrogen 2.819 N/A GLY 108.A N ASP 29.A OD1 no hydrogen 2.807 N/A VAL 109.A N VAL 106.A O no hydrogen 3.086 N/A TYR 111.A N SER 102.A OG no hydrogen 3.085 N/A SER 112.A N MET 145.A O no hydrogen 2.983 N/A SER 112.A OG ASN 98.A O no hydrogen 2.581 N/A ALA 113.A N MET 145.A O no hydrogen 3.259 N/A GLU 114.A N HIS 93.A O no hydrogen 3.015 N/A LEU 115.A N VAL 143.A O no hydrogen 2.831 N/A HIS 116.A N HIS 91.A O no hydrogen 2.916 N/A HIS 116.A ND1 HIS 91.A NE2 no hydrogen 3.176 N/A HIS 116.A NE2 GLU 114.A OE1 no hydrogen 3.006 N/A VAL 117.A N ILE 141.A O no hydrogen 2.859 N/A ALA 118.A N GLN 89.A O no hydrogen 2.841 N/A HIS 119.A N ALA 139.A O no hydrogen 2.744 N/A HIS 119.A ND1 ALA 139.A O no hydrogen 3.026 N/A HIS 119.A NE2 TYR 48.A OH no hydrogen 2.609 N/A TRP 120.A N ARG 86.A O no hydrogen 2.792 N/A TRP 120.A NE1 ASP 69.A OD2 no hydrogen 2.996 N/A ASN 121.A N GLY 137.A O no hydrogen 2.875 N/A ASN 121.A ND2 ASP 83.A OD2 no hydrogen 3.354 N/A ASN 121.A ND2 ASP 136.A O no hydrogen 3.034 N/A SER 122.A OG ASN 72.A OD1 no hydrogen 3.210 N/A LYS 124.A N ASN 121.A OD1 no hydrogen 3.077 N/A LYS 124.A NZ ASP 136.A OD2 no hydrogen 2.904 N/A TYR 125.A N ASN 121.A O no hydrogen 2.930 N/A TYR 125.A OH ASP 136.A OD1 no hydrogen 2.649 N/A SER 126.A N GLU 130.A OE1 no hydrogen 3.027 N/A SER 126.A OG GLU 130.A OE1 no hydrogen 3.475 N/A GLU 130.A N SER 127.A OG no hydrogen 2.941 N/A ALA 131.A N SER 127.A O no hydrogen 2.907 N/A LYS 134.A N ALA 131.A O no hydrogen 2.949 N/A LYS 134.A NZ GLU 130.A O no hydrogen 2.951 N/A GLY 137.A N LYS 134.A O no hydrogen 2.876 N/A LEU 138.A N SER 203.A O no hydrogen 2.941 N/A ALA 139.A N HIS 119.A O no hydrogen 3.021 N/A VAL 140.A N THR 205.A O no hydrogen 3.177 N/A ILE 141.A N VAL 117.A O no hydrogen 2.865 N/A GLY 142.A N ILE 207.A O no hydrogen 2.899 N/A VAL 143.A N LEU 115.A O no hydrogen 2.911 N/A MET 145.A N ALA 113.A O no hydrogen 2.928 N/A LYS 146.A N ILE 213.A O no hydrogen 2.849 N/A GLY 148.A N VAL 215.A O no hydrogen 2.748 N/A ASN 151.A N GLN 219.A OE1 no hydrogen 2.893 N/A ASN 151.A ND2 SER 214.A O no hydrogen 2.902 N/A LYS 153.A N ASN 151.A OD1 no hydrogen 3.007 N/A LEU 154.A N ASN 151.A O no hydrogen 3.216 N/A GLN 155.A N PRO 152.A O no hydrogen 3.091 N/A GLN 155.A NE2 ASP 159.A OD2 no hydrogen 2.995 N/A LYS 156.A NZ THR 174.A O no hydrogen 2.860 N/A LEU 158.A N LEU 154.A O no hydrogen 2.934 N/A ASP 159.A N GLN 155.A O no hydrogen 2.869 N/A ALA 160.A N LYS 156.A O no hydrogen 3.204 N/A ALA 160.A N VAL 157.A O no hydrogen 3.078 N/A LEU 161.A N LEU 158.A O no hydrogen 3.197 N/A GLN 162.A NE2 ASP 159.A O no hydrogen 2.891 N/A ALA 163.A N ALA 160.A O no hydrogen 3.119 N/A ILE 164.A N LEU 161.A O no hydrogen 3.021 N/A LYS 165.A NZ SER 225.A O no hydrogen 2.921 N/A LYS 167.A N ASN 229.A O no hydrogen 2.974 N/A GLY 168.A N ASN 58.A O no hydrogen 2.934 N/A LYS 169.A N THR 166.A O no hydrogen 3.275 N/A LYS 169.A NZ ALA 163.A O no hydrogen 3.302 N/A ALA 171.A N ILE 56.A O no hydrogen 3.081 N/A PHE 173.A N LYS 54.A O no hydrogen 2.889 N/A PHE 176.A N PRO 50.A O no hydrogen 3.138 N/A SER 179.A N ASP 177.A OD1 no hydrogen 2.989 N/A SER 179.A OG ASP 177.A OD1 no hydrogen 2.702 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 3.270 N/A THR 180.A N ASP 177.A O no hydrogen 3.113 N/A THR 180.A OG1 ASP 177.A O no hydrogen 2.910 N/A LEU 181.A N PRO 178.A O no hydrogen 2.926 N/A LEU 182.A N SER 179.A O no hydrogen 3.158 N/A SER 184.A N GLU 211.A OE1 no hydrogen 3.188 N/A SER 185.A N GLU 211.A OE2 no hydrogen 3.216 N/A ASP 187.A N SER 185.A OG no hydrogen 3.297 N/A PHE 188.A N SER 256.A OG no hydrogen 3.199 N/A TRP 189.A N ILE 208.A O no hydrogen 2.729 N/A THR 190.A N ARG 254.A O no hydrogen 2.930 N/A THR 190.A OG1 TRP 206.A O no hydrogen 2.752 N/A TYR 191.A OH SER 26.A OG no hydrogen 2.638 N/A TYR 191.A OH HIS 104.A NE2 no hydrogen 2.738 N/A GLY 193.A N VAL 204.A O no hydrogen 2.787 N/A SER 194.A N SER 26.A OG no hydrogen 2.909 N/A SER 194.A OG LEU 195.A O no hydrogen 2.764 N/A LEU 195.A N TYR 201.A O no hydrogen 2.952 N/A THR 196.A OG1 GLU 103.A OE1 no hydrogen 3.260 N/A THR 196.A OG1 GLU 103.A OE2 no hydrogen 2.589 N/A HIS 197.A ND1 PRO 198.A O no hydrogen 2.983 N/A LEU 200.A N HIS 197.A O no hydrogen 2.940 N/A SER 203.A OG ALA 132.A O no hydrogen 2.540 N/A VAL 204.A N GLY 193.A O no hydrogen 3.253 N/A THR 205.A N LEU 138.A O no hydrogen 2.959 N/A TRP 206.A N TYR 191.A O no hydrogen 3.086 N/A TRP 206.A NE1 SER 194.A O no hydrogen 3.159 N/A ILE 207.A N VAL 140.A O no hydrogen 2.876 N/A ILE 208.A N TRP 189.A O no hydrogen 2.713 N/A CYS 209.A N GLY 142.A O no hydrogen 3.037 N/A CYS 209.A SG GLY 142.A O no hydrogen 4.008 N/A LYS 210.A N ASP 187.A O no hydrogen 3.023 N/A LYS 210.A NZ ASP 187.A OD2 no hydrogen 2.698 N/A ILE 213.A N LEU 144.A O no hydrogen 3.020 N/A SER 214.A OG GLU 149.A O no hydrogen 2.605 N/A VAL 215.A N LYS 146.A O no hydrogen 3.257 N/A SER 216.A N GLN 219.A OE1 no hydrogen 3.080 N/A SER 217.A OG.A GLU 218.A OE2 no hydrogen 2.699 N/A GLN 219.A N SER 216.A OG no hydrogen 3.115 N/A GLN 219.A NE2 ASN 151.A O no hydrogen 2.713 N/A LEU 220.A N SER 216.A O no hydrogen 3.105 N/A ALA 221.A N SER 217.A O no hydrogen 3.022 N/A GLN 222.A N GLU 218.A O no hydrogen 3.203 N/A PHE 223.A N GLN 219.A O no hydrogen 3.325 N/A ARG 224.A N LEU 220.A O no hydrogen 3.193 N/A ARG 224.A NE GLY 95.A O no hydrogen 2.861 N/A ARG 224.A NH1 ASN 98.A OD1 no hydrogen 2.977 N/A SER 225.A N GLN 222.A O no hydrogen 3.104 N/A SER 225.A OG GLN 222.A O no hydrogen 2.675 N/A LEU 226.A N PHE 223.A O no hydrogen 3.157 N/A LEU 227.A N LYS 165.A O no hydrogen 2.841 N/A SER 228.A N VAL 236.A O no hydrogen 2.782 N/A SER 228.A OG VAL 236.A O no hydrogen 2.655 N/A ASP 233.A N VAL 230.A O no hydrogen 3.070 N/A MET 238.A N LEU 226.A O no hydrogen 2.807 N/A ASN 241.A N TRP 94.A O no hydrogen 2.954 N/A ASN 241.A ND2 HIS 61.A O no hydrogen 2.955 N/A ARG 243.A N GLU 103.A OE1 no hydrogen 2.831 N/A ARG 243.A NH1 GLN 25.A OE1 no hydrogen 2.890 N/A ARG 243.A NH1 SER 26.A O no hydrogen 2.895 N/A ARG 243.A NH2 ALA 20.A O no hydrogen 3.320 N/A ARG 243.A NH2 GLN 25.A OE1 no hydrogen 3.156 N/A GLN 246.A N PRO 27.A O no hydrogen 2.842 N/A GLN 246.A NE2 PRO 244.A O no hydrogen 2.822 N/A ARG 251.A N LEU 248.A O no hydrogen 2.936 N/A ARG 251.A NE LEU 248.A O no hydrogen 2.901 N/A ARG 251.A NH1 GLN 25.A O no hydrogen 2.872 N/A ARG 251.A NH1 PRO 192.A O no hydrogen 3.013 N/A ARG 251.A NH2 GLN 25.A O no hydrogen 2.716 N/A ARG 251.A NH2 PRO 247.A O no hydrogen 2.951 N/A ARG 254.A N THR 190.A O no hydrogen 2.981 N/A ARG 254.A NH1 ASP 38.A OD2 no hydrogen 2.921 N/A ALA 255.A N LYS 36.A O no hydrogen 2.836 N/A SER 256.A N PHE 188.A O no hydrogen 2.957 N/A SER 256.A OG PHE 188.A O no hydrogen 3.474 N/A