Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qds_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N GLU 16.A O no hydrogen 2.975 N/A THR 6.A N VAL 14.A O no hydrogen 2.916 N/A GLN 7.A NE2 GLY 10.A O no hydrogen 2.799 N/A VAL 8.A N VAL 12.A O no hydrogen 2.812 N/A SER 9.A N VAL 12.A O no hydrogen 3.153 N/A VAL 12.A N SER 9.A O no hydrogen 2.919 N/A TYR 13.A N VAL 27.A O no hydrogen 2.871 N/A VAL 14.A N THR 6.A O no hydrogen 2.759 N/A VAL 15.A N SER 25.A O no hydrogen 2.762 N/A GLU 16.A N SER 4.A O no hydrogen 2.996 N/A ASP 17.A N GLU 23.A O no hydrogen 2.841 N/A ASN 18.A N GLY 2.A O no hydrogen 2.876 N/A ASN 18.A ND2 ALA 1.A O no hydrogen 3.096 N/A ASN 18.A ND2 GLY 2.A O no hydrogen 3.686 N/A TYR 19.A N ASP 17.A OD1 no hydrogen 3.115 N/A GLN 22.A NE2 ASN 24.A OD1 no hydrogen 3.022 N/A GLU 23.A N ASP 17.A O no hydrogen 2.970 N/A ASN 24.A N GLY 203.A O no hydrogen 2.909 N/A ASN 24.A ND2 GLY 202.A O no hydrogen 2.929 N/A ASN 24.A ND2 ASP 205.A O no hydrogen 2.853 N/A SER 25.A N VAL 15.A O no hydrogen 2.852 N/A SER 25.A OG GLU 23.A OE1 no hydrogen 2.642 N/A SER 25.A OG GLU 23.A OE2 no hydrogen 3.420 N/A MET 26.A N VAL 37.A O no hydrogen 2.951 N/A VAL 27.A N TYR 13.A O no hydrogen 2.970 N/A TYR 28.A N THR 35.A O no hydrogen 2.865 N/A PHE 29.A N PRO 11.A O no hydrogen 2.907 N/A GLY 30.A N GLY 33.A O no hydrogen 2.929 N/A VAL 34.A N PRO 60.A O no hydrogen 2.808 N/A THR 35.A N TYR 28.A O no hydrogen 2.958 N/A THR 35.A OG1 GLU 63.A OE2 no hydrogen 2.577 N/A VAL 36.A N GLU 63.A O no hydrogen 2.898 N/A VAL 37.A N MET 26.A O no hydrogen 2.791 N/A GLY 38.A N ILE 65.A O no hydrogen 2.882 N/A ALA 39.A N ARG 73.A O no hydrogen 2.903 N/A THR 40.A OG1 ALA 39.A O no hydrogen 2.601 N/A THR 40.A OG1 THR 45.A OG1 no hydrogen 2.740 N/A TRP 41.A NE1 VAL 21.A O no hydrogen 2.878 N/A THR 42.A N THR 45.A OG1 no hydrogen 2.837 N/A THR 45.A N THR 42.A OG1 no hydrogen 2.996 N/A THR 45.A OG1 THR 40.A OG1 no hydrogen 2.740 N/A THR 45.A OG1 THR 42.A O no hydrogen 3.006 N/A ALA 46.A N THR 42.A O no hydrogen 2.886 N/A ARG 47.A N PRO 43.A O no hydrogen 2.946 N/A GLU 48.A N ASP 44.A O no hydrogen 3.034 N/A LEU 49.A N THR 45.A O no hydrogen 2.948 N/A HIS 50.A N ALA 46.A O no hydrogen 2.851 N/A HIS 50.A ND1 TYR 79.A OH no hydrogen 2.637 N/A LYS 51.A N ARG 47.A O no hydrogen 2.948 N/A LYS 51.A NZ GLU 48.A OE2 no hydrogen 3.127 N/A LEU 52.A N GLU 48.A O no hydrogen 3.300 N/A ILE 53.A N LEU 49.A O no hydrogen 2.866 N/A LYS 54.A N HIS 50.A O no hydrogen 2.917 N/A ARG 55.A N LEU 52.A O no hydrogen 3.089 N/A VAL 56.A N ILE 53.A O no hydrogen 2.965 N/A SER 57.A N ILE 53.A O no hydrogen 2.972 N/A LYS 59.A N SER 57.A OG no hydrogen 3.062 N/A LYS 59.A NZ ALA 31.A O no hydrogen 3.038 N/A LEU 62.A N VAL 34.A O no hydrogen 2.853 N/A VAL 64.A N LYS 86.A O no hydrogen 2.837 N/A ILE 65.A N VAL 36.A O no hydrogen 2.785 N/A ASN 66.A N VAL 88.A O no hydrogen 2.852 N/A ASN 66.A ND2 ARG 73.A O no hydrogen 3.089 N/A ASN 66.A ND2 ASN 77.A OD1 no hydrogen 2.881 N/A THR 67.A OG1 ASN 165.A OD1 no hydrogen 2.849 N/A HIS 70.A N ASN 68.A OD1 no hydrogen 2.881 N/A THR 71.A OG1 THR 108.A OG1 no hydrogen 2.742 N/A ARG 73.A N HIS 70.A O no hydrogen 3.118 N/A ARG 73.A NE ASN 165.A OD1 no hydrogen 3.175 N/A ARG 73.A NH1 GLU 23.A OE1 no hydrogen 2.841 N/A ARG 73.A NH1 ASN 24.A O no hydrogen 3.075 N/A ARG 73.A NH2 GLY 203.A O no hydrogen 2.974 N/A ALA 74.A N HIS 70.A O no hydrogen 2.935 N/A GLY 75.A N THR 71.A O no hydrogen 2.899 N/A GLY 76.A N THR 40.A O no hydrogen 2.922 N/A ASN 77.A N ALA 74.A O no hydrogen 3.033 N/A ASN 77.A ND2 ASN 66.A OD1 no hydrogen 2.848 N/A ASN 77.A ND2 VAL 121.A O no hydrogen 3.046 N/A TYR 79.A N GLY 76.A O no hydrogen 2.937 N/A TYR 79.A OH HIS 50.A ND1 no hydrogen 2.637 N/A TRP 80.A N GLY 76.A O no hydrogen 3.258 N/A TRP 80.A NE1 ALA 39.A O no hydrogen 2.976 N/A LYS 81.A N ASN 77.A O no hydrogen 2.904 N/A LYS 81.A NZ LEU 122.A O no hydrogen 2.722 N/A SER 82.A N ALA 78.A O no hydrogen 3.056 N/A SER 82.A OG TYR 79.A O no hydrogen 2.609 N/A ILE 83.A N TYR 79.A O no hydrogen 3.183 N/A ILE 83.A N TRP 80.A O no hydrogen 3.338 N/A GLY 84.A N LYS 81.A O no hydrogen 2.912 N/A ALA 85.A N TRP 80.A O no hydrogen 3.036 N/A LYS 86.A N LEU 62.A O no hydrogen 3.023 N/A VAL 87.A N ASN 124.A OD1 no hydrogen 2.933 N/A VAL 88.A N VAL 64.A O no hydrogen 2.795 N/A SER 89.A N VAL 125.A O no hydrogen 3.071 N/A SER 89.A OG THR 90.A O no hydrogen 2.805 N/A THR 90.A OG1 THR 93.A OG1 no hydrogen 3.097 N/A ARG 91.A N HIS 127.A O no hydrogen 2.797 N/A ARG 91.A NE ASP 128.A OD1 no hydrogen 2.942 N/A ARG 91.A NH2 ASP 128.A OD1 no hydrogen 2.874 N/A GLN 92.A NE2 PRO 149.A O no hydrogen 3.121 N/A THR 93.A N THR 90.A OG1 no hydrogen 3.057 N/A THR 93.A OG1 THR 90.A OG1 no hydrogen 3.097 N/A THR 93.A OG1 ASP 150.A OD2 no hydrogen 2.699 N/A ARG 94.A N THR 90.A O no hydrogen 3.102 N/A ARG 94.A NE ASP 95.A OD1 no hydrogen 2.857 N/A ARG 94.A NH2 ASP 95.A OD1 no hydrogen 3.038 N/A ASP 95.A N ARG 91.A O no hydrogen 2.874 N/A LEU 96.A N GLN 92.A O no hydrogen 2.894 N/A MET 97.A N THR 93.A O no hydrogen 2.884 N/A LYS 98.A N ARG 94.A O no hydrogen 2.951 N/A SER 99.A N ASP 95.A O no hydrogen 3.174 N/A SER 99.A OG ASP 95.A O no hydrogen 3.395 N/A SER 99.A OG LEU 96.A O no hydrogen 3.199 N/A SER 99.A OG ASP 100.A OD1 no hydrogen 2.648 N/A ASP 100.A N LEU 96.A O no hydrogen 2.737 N/A TRP 101.A N MET 97.A O no hydrogen 2.994 N/A TRP 101.A NE1 LEU 118.A O no hydrogen 2.950 N/A ILE 104.A N ASP 100.A O no hydrogen 3.003 N/A VAL 105.A N TRP 101.A O no hydrogen 2.878 N/A ALA 106.A N ALA 102.A O no hydrogen 2.957 N/A PHE 107.A N GLU 103.A O no hydrogen 2.885 N/A THR 108.A N ILE 104.A O no hydrogen 2.872 N/A THR 108.A OG1 THR 71.A OG1 no hydrogen 2.742 N/A THR 108.A OG1 ILE 104.A O no hydrogen 2.724 N/A ARG 109.A N VAL 105.A O no hydrogen 2.957 N/A ARG 109.A NE TYR 115.A O no hydrogen 2.788 N/A LYS 110.A N ALA 106.A O no hydrogen 3.078 N/A LYS 110.A N PHE 107.A O no hydrogen 3.190 N/A LEU 112.A N THR 108.A O no hydrogen 2.864 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.734 N/A TYR 115.A N LEU 112.A O no hydrogen 2.787 N/A TYR 115.A OH TRP 41.A O no hydrogen 2.594 N/A ASN 124.A N VAL 87.A O no hydrogen 2.839 N/A VAL 125.A N VAL 87.A O no hydrogen 3.019 N/A HIS 127.A N SER 89.A O no hydrogen 2.886 N/A PHE 131.A N ALA 140.A O no hydrogen 3.074 N/A LEU 133.A N VAL 138.A O no hydrogen 2.829 N/A GLN 134.A NE2 GLY 33.A O no hydrogen 2.997 N/A GLN 134.A NE2 THR 35.A OG1 no hydrogen 2.892 N/A GLY 136.A N LEU 133.A O no hydrogen 3.093 N/A LYS 137.A N GLN 134.A O no hydrogen 3.087 N/A LYS 137.A NZ ASP 158.A OD2 no hydrogen 2.861 N/A VAL 138.A N LEU 133.A O no hydrogen 3.164 N/A ARG 139.A N TYR 155.A O no hydrogen 2.840 N/A ARG 139.A NH1 GLY 136.A O no hydrogen 3.030 N/A ALA 140.A N PHE 131.A O no hydrogen 2.808 N/A PHE 141.A N PHE 153.A O no hydrogen 2.932 N/A TYR 142.A N ASP 130.A OD1 no hydrogen 2.972 N/A TYR 142.A OH.A PRO 149.A O no hydrogen 2.596 N/A ALA 146.A N THR 148.A O no hydrogen 2.918 N/A THR 148.A OG1 ASP 150.A OD1 no hydrogen 2.668 N/A ILE 152.A N THR 67.A O no hydrogen 2.981 N/A PHE 153.A N PHE 141.A O no hydrogen 2.909 N/A TYR 155.A N ARG 139.A O no hydrogen 2.754 N/A TYR 155.A OH PRO 196.A O no hydrogen 2.486 N/A PHE 156.A N VAL 161.A O no hydrogen 2.865 N/A GLN 160.A N PRO 157.A O no hydrogen 3.306 N/A VAL 161.A N PHE 156.A O no hydrogen 3.243 N/A LEU 162.A N THR 199.A O no hydrogen 2.855 N/A TYR 163.A N VAL 154.A O no hydrogen 2.705 N/A TYR 163.A OH ASN 24.A O no hydrogen 2.628 N/A GLY 164.A N ILE 201.A O no hydrogen 2.780 N/A ASN 165.A ND2 THR 67.A O no hydrogen 2.932 N/A ASN 165.A ND2 ILE 152.A O no hydrogen 2.878 N/A CYS 166.A SG ASP 72.A OD1 no hydrogen 3.838 N/A CYS 166.A SG ASP 72.A OD2 no hydrogen 3.607 N/A CYS 166.A SG ASN 165.A OD1 no hydrogen 3.893 N/A CYS 166.A SG HIS 204.A NE2 no hydrogen 3.846 N/A ILE 167.A N GLY 164.A O no hydrogen 2.993 N/A LEU 168.A N GLY 164.A O no hydrogen 3.077 N/A LYS 169.A NZ CYS 166.A O no hydrogen 2.693 N/A GLU 170.A N ASP 205.A OD2 no hydrogen 3.113 N/A LYS 171.A N ASP 205.A OD2 no hydrogen 2.875 N/A SER 176.A N ASN 174.A OD1.A no hydrogen 3.236 N/A SER 176.A N ASN 174.A OD1.B no hydrogen 2.761 N/A SER 176.A OG ASN 174.A OD1.A no hydrogen 3.146 N/A SER 176.A OG ASN 174.A OD1.B no hydrogen 3.168 N/A ALA 178.A N LEU 175.A O no hydrogen 3.146 N/A ASP 179.A N ALA 146.A O no hydrogen 2.872 N/A ALA 182.A N ASP 179.A OD1 no hydrogen 3.118 N/A TYR 183.A N ASP 179.A O no hydrogen 2.946 N/A TYR 183.A OH ILE 167.A O no hydrogen 2.628 N/A THR 186.A N ALA 182.A O no hydrogen 2.849 N/A THR 186.A OG1 ALA 143.A O no hydrogen 3.543 N/A THR 186.A OG1 PRO 145.A O no hydrogen 2.601 N/A THR 186.A OG1 ALA 182.A O no hydrogen 3.478 N/A LEU 187.A N TYR 183.A O no hydrogen 2.996 N/A GLU 188.A N PRO 184.A O no hydrogen 2.896 N/A ARG 189.A N GLN 185.A O no hydrogen 2.895 N/A ARG 189.A NE ALA 143.A O no hydrogen 2.772 N/A ARG 189.A NH2 ALA 143.A O no hydrogen 3.569 N/A ARG 189.A NH2 THR 186.A OG1 no hydrogen 3.019 N/A LEU 190.A N THR 186.A O no hydrogen 2.913 N/A LYS 191.A N LEU 187.A O no hydrogen 2.951 N/A LYS 191.A NZ GLU 188.A OE2 no hydrogen 2.979 N/A LYS 191.A NZ ASP 215.A OD1 no hydrogen 2.656 N/A LYS 191.A NZ GLU 218.A OE1 no hydrogen 2.941 N/A ALA 192.A N GLU 188.A O no hydrogen 2.881 N/A MET 193.A N LEU 190.A O no hydrogen 3.091 N/A LYS 194.A N LYS 191.A O no hydrogen 3.084 N/A LYS 198.A N GLN 160.A O no hydrogen 2.829 N/A THR 199.A N GLN 160.A O no hydrogen 3.148 N/A VAL 200.A N HIS 209.A O no hydrogen 2.807 N/A ILE 201.A N LEU 162.A O no hydrogen 2.895 N/A GLY 202.A N PRO 207.A O no hydrogen 2.987 N/A GLY 203.A N LEU 168.A O no hydrogen 3.065 N/A HIS 204.A ND1 GLN 22.A O no hydrogen 2.784 N/A HIS 209.A N VAL 200.A O no hydrogen 2.939 N/A HIS 209.A NE2 GLU 170.A OE2 no hydrogen 2.785 N/A GLY 210.A N GLU 212.A OE2 no hydrogen 2.916 N/A LEU 213.A N GLY 210.A O no hydrogen 3.101 N/A ILE 214.A N PRO 211.A O no hydrogen 3.135 N/A HIS 216.A N GLU 212.A O no hydrogen 2.859 N/A HIS 216.A NE2 GLU 170.A O no hydrogen 2.649 N/A TYR 217.A N LEU 213.A O no hydrogen 3.030 N/A TYR 217.A OH LEU 172.A O no hydrogen 2.609 N/A GLU 218.A N ILE 214.A O no hydrogen 2.967 N/A ALA 219.A N ASP 215.A O no hydrogen 3.001 N/A LEU 220.A N HIS 216.A O no hydrogen 3.211 N/A ILE 221.A N TYR 217.A O no hydrogen 2.907 N/A LYS 222.A N GLU 218.A O no hydrogen 3.116 N/A LYS 222.A NZ GLU 218.A OE2 no hydrogen 3.306 N/A ALA 223.A N LEU 220.A O no hydrogen 3.207 N/A ALA 224.A N ILE 221.A O no hydrogen 3.303 N/A PRO 225.A N ALA 223.A O no hydrogen 3.644 N/A