Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q6v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 GLU 18.A OE2 no hydrogen 2.952 N/A THR 3.A N.A GLU 15.A O no hydrogen 2.925 N/A THR 3.A N.B GLU 15.A O no hydrogen 2.935 N/A THR 5.A N ILE 13.A O no hydrogen 2.929 N/A HIS 6.A NE2 GLY 9.A O no hydrogen 2.558 N/A PHE 7.A N LEU 11.A O no hydrogen 2.854 N/A LYS 8.A N LEU 11.A O no hydrogen 3.052 N/A LYS 8.A NZ GLU 158.A O no hydrogen 2.745 N/A LEU 11.A N LYS 8.A O no hydrogen 2.875 N/A TYR 12.A N VAL 26.A O no hydrogen 2.875 N/A ILE 13.A N THR 5.A O no hydrogen 2.794 N/A VAL 14.A N SER 24.A O no hydrogen 2.798 N/A GLU 15.A N THR 3.A O.A no hydrogen 2.883 N/A GLU 15.A N THR 3.A O.B no hydrogen 2.976 N/A ASP 16.A N GLU 22.A O no hydrogen 2.926 N/A LYS 17.A N ASN 1.A O no hydrogen 2.676 N/A VAL 20.A N ASN 111.A OD1 no hydrogen 3.108 N/A GLN 21.A NE2 ASN 23.A OD1 no hydrogen 2.909 N/A GLU 22.A N ASP 16.A O no hydrogen 3.007 N/A ASN 23.A N GLY 206.A O no hydrogen 2.822 N/A ASN 23.A ND2 ALA 205.A O no hydrogen 3.032 N/A ASN 23.A ND2 ASP 208.A O no hydrogen 2.895 N/A SER 24.A N VAL 14.A O no hydrogen 2.949 N/A SER 24.A OG GLU 22.A OE1 no hydrogen 3.441 N/A SER 24.A OG GLU 22.A OE2 no hydrogen 2.579 N/A MET 25.A N ILE 36.A O no hydrogen 2.996 N/A VAL 26.A N TYR 12.A O no hydrogen 2.937 N/A TYR 27.A N THR 34.A O no hydrogen 2.790 N/A ILE 28.A N PRO 10.A O no hydrogen 2.831 N/A GLY 29.A N GLY 32.A O no hydrogen 2.935 N/A ILE 33.A N PRO 59.A O no hydrogen 2.771 N/A THR 34.A N TYR 27.A O no hydrogen 2.935 N/A THR 34.A OG1 GLU 62.A OE1 no hydrogen 2.686 N/A ILE 35.A N.A GLU 62.A O no hydrogen 2.923 N/A ILE 35.A N.B GLU 62.A O no hydrogen 2.928 N/A ILE 36.A N MET 25.A O no hydrogen 2.748 N/A GLY 37.A N ILE 64.A O no hydrogen 2.866 N/A ALA 38.A N ARG 72.A O no hydrogen 2.930 N/A THR 39.A OG1 ALA 38.A O no hydrogen 2.631 N/A THR 39.A OG1 THR 44.A OG1 no hydrogen 2.704 N/A TRP 40.A N ASP 16.A OD2 no hydrogen 3.093 N/A TRP 40.A NE1 VAL 20.A O no hydrogen 2.797 N/A THR 41.A N THR 44.A OG1 no hydrogen 2.938 N/A THR 44.A N THR 41.A OG1 no hydrogen 3.046 N/A THR 44.A OG1 THR 39.A OG1 no hydrogen 2.704 N/A THR 44.A OG1 THR 41.A O no hydrogen 3.068 N/A ALA 45.A N THR 41.A O no hydrogen 2.949 N/A GLU 46.A N PRO 42.A O no hydrogen 2.994 N/A THR 47.A N GLU 43.A O.A no hydrogen 3.223 N/A THR 47.A N GLU 43.A O.B no hydrogen 3.035 N/A THR 47.A OG1 GLU 43.A O.A no hydrogen 3.076 N/A THR 47.A OG1 GLU 43.A O.B no hydrogen 3.220 N/A LEU 48.A N THR 44.A O no hydrogen 2.909 N/A TYR 49.A N ALA 45.A O no hydrogen 2.853 N/A LYS 50.A N GLU 46.A O no hydrogen 2.986 N/A GLU 51.A N.A THR 47.A O no hydrogen 3.007 N/A GLU 51.A N.B THR 47.A O no hydrogen 2.995 N/A ILE 52.A N LEU 48.A O no hydrogen 2.806 N/A ARG 53.A N TYR 49.A O no hydrogen 2.910 N/A ARG 53.A NE TYR 49.A OH no hydrogen 2.877 N/A ARG 53.A NH1 SER 56.A O no hydrogen 2.869 N/A ARG 53.A NH1 LEU 58.A O no hydrogen 2.795 N/A ARG 53.A NH2 LEU 58.A O no hydrogen 2.756 N/A LYS 54.A N GLU 51.A O.A no hydrogen 3.209 N/A LYS 54.A N GLU 51.A O.B no hydrogen 3.262 N/A LYS 54.A NZ GLU 51.A OE1.B no hydrogen 2.947 N/A LYS 54.A NZ GLU 51.A OE2.A no hydrogen 2.821 N/A VAL 55.A N ILE 52.A O no hydrogen 2.870 N/A SER 56.A N ILE 52.A O no hydrogen 2.832 N/A LEU 58.A N SER 56.A OG no hydrogen 3.239 N/A ASN 61.A N ILE 33.A O no hydrogen 2.751 N/A VAL 63.A N LYS 85.A O.A no hydrogen 2.772 N/A VAL 63.A N LYS 85.A O.B no hydrogen 2.752 N/A ILE 64.A N ILE 35.A O.A no hydrogen 2.889 N/A ILE 64.A N ILE 35.A O.B no hydrogen 2.758 N/A ASN 65.A N VAL 87.A O no hydrogen 2.875 N/A ASN 65.A ND2 ASN 76.A OD1 no hydrogen 2.861 N/A THR 66.A OG1 ASN 164.A OD1 no hydrogen 2.751 N/A HIS 69.A N ASN 67.A OD1 no hydrogen 2.863 N/A THR 70.A OG1 THR 107.A OG1 no hydrogen 2.640 N/A ARG 72.A N HIS 69.A O no hydrogen 3.034 N/A ARG 72.A NE ASN 164.A OD1 no hydrogen 3.189 N/A ARG 72.A NH1 ASN 23.A O no hydrogen 3.049 N/A ARG 72.A NH2 GLY 206.A O no hydrogen 2.882 N/A ALA 73.A N HIS 69.A O no hydrogen 2.920 N/A GLY 74.A N THR 70.A O no hydrogen 2.901 N/A ASN 76.A N ALA 73.A O no hydrogen 3.116 N/A ASN 76.A ND2 ASN 65.A OD1 no hydrogen 2.902 N/A ASN 76.A ND2 SER 120.A O no hydrogen 2.888 N/A TRP 79.A N GLY 75.A O no hydrogen 3.300 N/A TRP 79.A NE1 ALA 38.A O no hydrogen 2.902 N/A LYS 80.A N ASN 76.A O no hydrogen 2.990 N/A LYS 80.A NZ LEU 121.A O no hydrogen 2.789 N/A THR 81.A N TYR 78.A O no hydrogen 2.891 N/A THR 81.A OG1 TYR 78.A O no hydrogen 2.721 N/A LEU 82.A N TRP 79.A O no hydrogen 3.073 N/A GLY 83.A N LYS 80.A O no hydrogen 2.977 N/A ALA 84.A N TRP 79.A O no hydrogen 3.327 N/A LYS 85.A N.A ASN 61.A O no hydrogen 2.954 N/A LYS 85.A N.B ASN 61.A O no hydrogen 2.953 N/A ILE 86.A N ASP 123.A OD1 no hydrogen 2.920 N/A VAL 87.A N VAL 63.A O no hydrogen 2.809 N/A ALA 88.A N THR 124.A O no hydrogen 3.079 N/A THR 89.A OG1 THR 92.A OG1 no hydrogen 3.156 N/A GLN 90.A N PHE 126.A O no hydrogen 2.781 N/A GLN 90.A NE2 GLN 90.A O no hydrogen 3.646 N/A GLN 90.A NE2 ASP 94.A OD1 no hydrogen 2.858 N/A THR 92.A N THR 89.A OG1 no hydrogen 3.083 N/A THR 92.A OG1 THR 89.A OG1 no hydrogen 3.156 N/A THR 92.A OG1 ASP 149.A OD2 no hydrogen 2.663 N/A TYR 93.A N THR 89.A O no hydrogen 2.899 N/A ASP 94.A N GLN 90.A O no hydrogen 2.843 N/A LEU 95.A N MET 91.A O no hydrogen 3.055 N/A GLN 96.A N THR 92.A O no hydrogen 2.935 N/A GLN 96.A NE2 SER 120.A O no hydrogen 3.477 N/A LYS 97.A N TYR 93.A O no hydrogen 2.900 N/A SER 98.A N.A ASP 94.A O no hydrogen 3.070 N/A SER 98.A N.B ASP 94.A O no hydrogen 3.031 N/A SER 98.A OG.A ASP 94.A O no hydrogen 2.874 N/A GLN 99.A N LEU 95.A O no hydrogen 2.748 N/A GLN 99.A NE2 SER 98.A OG.B no hydrogen 3.066 N/A TRP 100.A N GLN 96.A O no hydrogen 3.109 N/A TRP 100.A NE1 LEU 117.A O no hydrogen 2.954 N/A SER 102.A OG.B GLN 99.A OE1 no hydrogen 3.267 N/A ILE 103.A N GLN 99.A O no hydrogen 2.956 N/A VAL 104.A N TRP 100.A O no hydrogen 2.885 N/A ASN 105.A N GLY 101.A O no hydrogen 2.998 N/A PHE 106.A N SER 102.A O.A no hydrogen 2.815 N/A PHE 106.A N SER 102.A O.B no hydrogen 2.879 N/A THR 107.A N ILE 103.A O no hydrogen 2.860 N/A THR 107.A OG1 THR 70.A OG1 no hydrogen 2.640 N/A THR 107.A OG1 ILE 103.A O no hydrogen 2.694 N/A ARG 108.A N VAL 104.A O no hydrogen 2.978 N/A ARG 108.A NH1 TYR 114.A O no hydrogen 2.762 N/A GLN 109.A N ASN 105.A O no hydrogen 3.248 N/A GLN 109.A N PHE 106.A O no hydrogen 3.142 N/A ASN 111.A ND2 THR 107.A O no hydrogen 3.257 N/A TYR 114.A N ASN 111.A O no hydrogen 2.953 N/A TYR 114.A OH TRP 40.A O no hydrogen 2.578 N/A LEU 117.A N PRO 115.A O no hydrogen 3.046 N/A LYS 119.A NZ LYS 97.A O no hydrogen 2.694 N/A ASP 123.A N ILE 86.A O no hydrogen 2.928 N/A THR 124.A N ILE 86.A O no hydrogen 3.003 N/A THR 124.A OG1 ASP 123.A OD1 no hydrogen 2.933 N/A PHE 126.A N ALA 88.A O no hydrogen 2.941 N/A PHE 130.A N ALA 139.A O no hydrogen 3.244 N/A LEU 132.A N ILE 137.A O no hydrogen 2.892 N/A GLN 133.A NE2 GLY 32.A O no hydrogen 3.051 N/A GLN 133.A NE2 THR 34.A OG1 no hydrogen 2.941 N/A GLY 135.A N LEU 132.A O no hydrogen 3.205 N/A SER 136.A N GLN 133.A O no hydrogen 3.069 N/A SER 136.A OG TYR 27.A OH no hydrogen 3.277 N/A SER 136.A OG GLN 133.A O no hydrogen 3.233 N/A ILE 137.A N LEU 132.A O no hydrogen 3.087 N/A ARG 138.A N TYR 154.A O no hydrogen 2.839 N/A ALA 139.A N PHE 130.A O no hydrogen 2.796 N/A MET 140.A N PHE 152.A O no hydrogen 2.923 N/A TYR 141.A N ASP 129.A OD1 no hydrogen 2.865 N/A TYR 141.A OH LYS 148.A O no hydrogen 2.651 N/A ALA 145.A N THR 147.A O no hydrogen 2.967 N/A THR 147.A OG1 ASP 149.A OD1 no hydrogen 2.722 N/A ILE 151.A N THR 66.A O no hydrogen 3.042 N/A PHE 152.A N MET 140.A O no hydrogen 2.908 N/A VAL 153.A N TYR 162.A O no hydrogen 3.297 N/A TYR 154.A N ARG 138.A O no hydrogen 2.818 N/A TYR 154.A OH LYS 199.A O no hydrogen 3.353 N/A PHE 155.A N VAL 160.A O no hydrogen 2.824 N/A GLU 158.A N PHE 155.A O no hydrogen 3.231 N/A ARG 159.A N PRO 156.A O no hydrogen 3.270 N/A ARG 159.A NE.A ASP 201.A OD1 no hydrogen 3.213 N/A ARG 159.A NE.B ASP 201.A OD2 no hydrogen 2.979 N/A ARG 159.A NH2.A ASP 201.A OD1 no hydrogen 3.119 N/A VAL 160.A N PHE 155.A O no hydrogen 3.343 N/A LEU 161.A N SER 202.A O no hydrogen 2.931 N/A TYR 162.A N VAL 153.A O no hydrogen 2.709 N/A TYR 162.A OH ASN 23.A O no hydrogen 2.699 N/A GLY 163.A N ILE 204.A O no hydrogen 2.696 N/A ASN 164.A ND2 THR 66.A O no hydrogen 2.981 N/A ASN 164.A ND2 ILE 151.A O no hydrogen 2.856 N/A CYS 165.A SG ASP 71.A OD1 no hydrogen 3.836 N/A CYS 165.A SG ASP 71.A OD2 no hydrogen 3.484 N/A CYS 165.A SG ASN 164.A OD1 no hydrogen 3.974 N/A CYS 165.A SG HIS 207.A NE2 no hydrogen 3.681 N/A ILE 166.A N GLY 163.A O no hydrogen 3.015 N/A LEU 167.A N GLY 163.A O no hydrogen 3.188 N/A LYS 168.A NZ CYS 165.A O no hydrogen 2.689 N/A GLU 169.A N ASP 208.A OD2 no hydrogen 3.061 N/A ASN 170.A ND2 ASP 208.A OD1 no hydrogen 3.262 N/A SER 175.A N ASN 173.A OD1 no hydrogen 3.004 N/A SER 175.A OG.A ASN 173.A OD1 no hydrogen 3.189 N/A ALA 177.A N MET 174.A O no hydrogen 3.218 N/A ASN 178.A N ALA 145.A O no hydrogen 2.910 N/A ASN 178.A ND2 GLU 144.A OE1 no hydrogen 2.964 N/A ARG 179.A NH1 LEU 224.A O no hydrogen 3.190 N/A THR 180.A OG1 ASN 178.A OD1 no hydrogen 3.187 N/A GLU 181.A N ASN 178.A OD1 no hydrogen 2.978 N/A TYR 182.A N ASN 178.A O no hydrogen 2.886 N/A TYR 182.A OH ILE 166.A O no hydrogen 2.613 N/A LYS 184.A NZ GLU 181.A OE2 no hydrogen 2.902 N/A THR 185.A N GLU 181.A O no hydrogen 2.851 N/A THR 185.A OG1 LEU 142.A O no hydrogen 3.539 N/A THR 185.A OG1 GLU 144.A O no hydrogen 2.713 N/A THR 185.A OG1 GLU 181.A O no hydrogen 3.215 N/A LEU 186.A N TYR 182.A O no hydrogen 3.096 N/A GLU 187.A N PRO 183.A O no hydrogen 2.850 N/A LYS 188.A N LYS 184.A O no hydrogen 3.033 N/A LYS 188.A NZ LEU 142.A O no hydrogen 2.894 N/A LEU 189.A N THR 185.A O no hydrogen 3.063 N/A LYS 190.A N LEU 186.A O no hydrogen 2.847 N/A LYS 190.A NZ GLU 194.A OE2.A no hydrogen 3.552 N/A LYS 190.A NZ ASP 218.A OD1 no hydrogen 3.330 N/A GLY 191.A N GLU 187.A O no hydrogen 2.823 N/A LEU 192.A N LYS 188.A O no hydrogen 3.009 N/A ILE 193.A N LEU 189.A O no hydrogen 3.046 N/A GLU 194.A N.A LYS 190.A O no hydrogen 2.811 N/A GLU 194.A N.B LYS 190.A O no hydrogen 2.810 N/A LYS 199.A N TYR 154.A OH no hydrogen 2.912 N/A ASP 201.A N ARG 159.A O no hydrogen 2.759 N/A SER 202.A N ARG 159.A O no hydrogen 3.416 N/A ILE 203.A N HIS 212.A O no hydrogen 2.864 N/A ILE 204.A N LEU 161.A O no hydrogen 2.816 N/A ALA 205.A N PRO 210.A O no hydrogen 2.825 N/A GLY 206.A N LEU 167.A O no hydrogen 3.425 N/A HIS 207.A ND1 GLN 21.A O no hydrogen 2.791 N/A THR 209.A N.A GLU 169.A OE2 no hydrogen 2.958 N/A THR 209.A N.B GLU 169.A OE2 no hydrogen 3.003 N/A THR 209.A OG1.A GLU 169.A OE2 no hydrogen 3.012 N/A THR 209.A OG1.B GLU 169.A OE2 no hydrogen 2.240 N/A THR 209.A OG1.B HIS 212.A NE2 no hydrogen 3.254 N/A HIS 212.A N ILE 203.A O no hydrogen 2.956 N/A HIS 212.A NE2 THR 209.A O.A no hydrogen 2.678 N/A HIS 212.A NE2 THR 209.A O.B no hydrogen 2.733 N/A GLY 215.A N ASP 213.A OD1 no hydrogen 2.970 N/A LEU 216.A N ASP 213.A O no hydrogen 3.223 N/A ILE 217.A N VAL 214.A O.A no hydrogen 3.114 N/A ILE 217.A N VAL 214.A O.B no hydrogen 3.209 N/A HIS 219.A N GLY 215.A O no hydrogen 3.031 N/A HIS 219.A NE2 GLU 169.A O no hydrogen 2.866 N/A TYR 220.A N LEU 216.A O no hydrogen 2.952 N/A TYR 220.A OH LEU 171.A O no hydrogen 2.758 N/A LEU 221.A N ILE 217.A O no hydrogen 2.906 N/A THR 222.A N ASP 218.A O no hydrogen 2.946 N/A THR 222.A OG1 ASP 218.A O no hydrogen 2.855 N/A LEU 223.A N HIS 219.A O no hydrogen 3.136 N/A LEU 224.A N TYR 220.A O no hydrogen 3.016 N/A GLU 225.A N.A LEU 221.A O no hydrogen 3.086 N/A GLU 225.A N.B LEU 221.A O no hydrogen 3.090 N/A LYS 226.A N THR 222.A O no hydrogen 3.182 N/A ALA 227.A N LEU 223.A O no hydrogen 3.012 N/A GLN 195A.A N GLY 191.A O no hydrogen 2.902 N/A GLY 196B.A N ILE 193.A O no hydrogen 2.986 N/A LEU 198D.A N LEU 192.A O no hydrogen 3.042 N/A