Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3whx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 25.A O no hydrogen 2.982 N/A GLN 5.A N LYS 23.A O no hydrogen 2.860 N/A GLN 5.A NE2 GLN 6.A O no hydrogen 3.510 N/A GLN 6.A NE2 TYR 94.A O no hydrogen 2.888 N/A SER 7.A N SER 21.A O no hydrogen 3.114 N/A SER 7.A OG SER 21.A O no hydrogen 3.518 N/A GLU 10.A N LEU 112.A O no hydrogen 2.835 N/A VAL 12.A N THR 114.A O no hydrogen 2.844 N/A GLY 15.A N LEU 86.A O no hydrogen 2.967 N/A ALA 16.A N LYS 13.A O no hydrogen 3.106 N/A VAL 18.A N LEU 83.A O no hydrogen 3.052 N/A LEU 20.A N LEU 81.A O no hydrogen 2.796 N/A SER 21.A N SER 7.A OG no hydrogen 3.011 N/A CYS 22.A N.A VAL 79.A O no hydrogen 2.905 N/A CYS 22.A N.B VAL 79.A O no hydrogen 2.869 N/A LYS 23.A N GLN 5.A O no hydrogen 2.902 N/A LYS 23.A NZ SER 76.A O no hydrogen 2.682 N/A ALA 24.A N SER 77.A O no hydrogen 2.850 N/A SER 25.A N GLN 3.A O no hydrogen 2.979 N/A GLU 31.A N THR 28.A O no hydrogen 2.915 N/A PHE 33.A N HIS 99.A O no hydrogen 2.784 N/A ILE 34.A N PHE 51.A O no hydrogen 2.800 N/A HIS 35.A N ALA 97.A O no hydrogen 2.754 N/A HIS 35.A NE2 HIS 99.A NE2 no hydrogen 2.885 N/A TRP 36.A N GLY 49.A O no hydrogen 3.189 N/A VAL 37.A N PHE 95.A O no hydrogen 2.860 N/A LYS 38.A N GLU 46.A O.A no hydrogen 2.777 N/A LYS 38.A N GLU 46.A O.B no hydrogen 2.770 N/A LYS 38.A NZ GLU 89.A O no hydrogen 2.790 N/A GLN 39.A N VAL 93.A O no hydrogen 2.903 N/A GLN 39.A NE2 GLN 43.A O no hydrogen 3.052 N/A GLN 43.A N ARG 40.A O no hydrogen 2.906 N/A GLU 46.A N.A LYS 38.A O no hydrogen 2.889 N/A GLU 46.A N.B LYS 38.A O no hydrogen 2.856 N/A TRP 47.A NE1 HIS 35.A ND1 no hydrogen 2.904 N/A ILE 48.A N TRP 36.A O no hydrogen 2.857 N/A TRP 50.A N ASN 59.A O no hydrogen 2.929 N/A PHE 51.A N ILE 34.A O no hydrogen 2.787 N/A TYR 52.A N SER 57.A O no hydrogen 2.839 N/A SER 55.A N TYR 52.A O no hydrogen 3.012 N/A SER 55.A OG SER 57.A OG no hydrogen 2.735 N/A GLY 56.A N TYR 52.A O no hydrogen 2.777 N/A SER 57.A N SER 55.A OG no hydrogen 3.204 N/A SER 57.A OG SER 55.A OG no hydrogen 2.735 N/A ASN 59.A N TRP 50.A O no hydrogen 2.981 N/A ASN 61.A N ILE 48.A O no hydrogen 2.828 N/A ASN 61.A ND2 TRP 47.A O no hydrogen 2.819 N/A LYS 63.A N ASN 61.A OD1 no hydrogen 3.164 N/A PHE 64.A N ASN 61.A O no hydrogen 2.810 N/A LYS 65.A N GLY 62.A O no hydrogen 3.394 N/A LYS 67.A N PHE 64.A O no hydrogen 2.852 N/A LYS 67.A NZ SER 84.A O no hydrogen 2.807 N/A LYS 67.A NZ ASP 90.A OD2 no hydrogen 2.781 N/A ALA 68.A N PHE 64.A O no hydrogen 2.913 N/A THR 69.A N GLU 82.A O no hydrogen 2.957 N/A PHE 70.A N TYR 60.A OH no hydrogen 2.872 N/A THR 71.A N TYR 80.A O no hydrogen 3.151 N/A ASP 73.A N THR 78.A O no hydrogen 2.786 N/A SER 75.A N ASP 73.A OD1 no hydrogen 3.283 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.630 N/A SER 75.A OG ASP 73.A OD2 no hydrogen 3.494 N/A SER 76.A N ASP 73.A O no hydrogen 3.071 N/A SER 76.A OG ASP 73.A O no hydrogen 3.436 N/A SER 76.A OG ASP 73.A OD2 no hydrogen 3.221 N/A SER 76.A OG THR 78.A OG1 no hydrogen 3.063 N/A SER 77.A N LYS 74.A O no hydrogen 3.209 N/A THR 78.A N ASP 73.A O no hydrogen 3.217 N/A THR 78.A OG1 SER 76.A O no hydrogen 2.973 N/A THR 78.A OG1 SER 76.A OG no hydrogen 3.063 N/A VAL 79.A N CYS 22.A O.A no hydrogen 3.006 N/A VAL 79.A N CYS 22.A O.B no hydrogen 2.917 N/A TYR 80.A N THR 71.A O no hydrogen 2.776 N/A LEU 81.A N LEU 20.A O no hydrogen 2.954 N/A GLU 82.A N THR 69.A O no hydrogen 2.869 N/A LEU 83.A N VAL 18.A O no hydrogen 2.868 N/A SER 84.A N LYS 67.A O no hydrogen 2.999 N/A SER 84.A OG LYS 67.A O no hydrogen 3.388 N/A ARG 85.A N SER 17.A OG no hydrogen 3.421 N/A LEU 86.A N ALA 16.A O no hydrogen 2.891 N/A THR 87.A N ASP 90.A OD2 no hydrogen 2.848 N/A THR 87.A OG1 ASP 90.A OD2 no hydrogen 3.404 N/A GLU 89.A N THR 87.A OG1 no hydrogen 3.201 N/A ASP 90.A N THR 87.A O no hydrogen 2.941 N/A SER 91.A N SER 88.A O.A no hydrogen 3.155 N/A SER 91.A N SER 88.A O.B no hydrogen 3.128 N/A ALA 92.A N VAL 113.A O no hydrogen 3.059 N/A VAL 93.A N GLN 39.A O no hydrogen 2.959 N/A TYR 94.A N THR 111.A O no hydrogen 2.838 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.616 N/A PHE 95.A N VAL 37.A O no hydrogen 2.783 N/A CYS 96.A N.A GLN 6.A OE1 no hydrogen 3.062 N/A CYS 96.A N.B GLN 6.A OE1 no hydrogen 3.080 N/A ALA 97.A N HIS 35.A O no hydrogen 2.930 N/A SER 98.A N TYR 106.A O no hydrogen 2.796 N/A SER 98.A OG TYR 27.A OH no hydrogen 2.811 N/A SER 98.A OG PHE 33.A O no hydrogen 3.336 N/A HIS 99.A N PHE 33.A O no hydrogen 3.061 N/A HIS 99.A ND1 ALA 100.A O no hydrogen 2.787 N/A HIS 99.A NE2 HIS 35.A NE2 no hydrogen 2.885 N/A LYS 103.A N ALA 100.A O no hydrogen 2.947 N/A GLU 104.A N GLU 104.A OE1 no hydrogen 2.700 N/A TYR 106.A N SER 98.A O no hydrogen 2.774 N/A TYR 106.A OH GLU 104.A OE2 no hydrogen 2.970 N/A GLY 108.A N CYS 96.A O.A no hydrogen 2.746 N/A GLY 108.A N CYS 96.A O.B no hydrogen 2.742 N/A GLY 110.A N GLN 6.A OE1 no hydrogen 2.916 N/A THR 111.A N TYR 94.A O no hydrogen 2.895 N/A THR 111.A OG1 SER 7.A O no hydrogen 2.714 N/A VAL 113.A N ALA 92.A O no hydrogen 2.823 N/A THR 114.A N GLU 10.A O no hydrogen 2.954 N/A VAL 115.A N SER 91.A OG no hydrogen 2.986 N/A SER 116.A N VAL 12.A O no hydrogen 2.949 N/A SER 116.A OG ASP 171.A O no hydrogen 2.875 N/A ALA 117.A N ASP 171.A OD2 no hydrogen 2.810 N/A ALA 118.A N SER 116.A OG no hydrogen 3.069 N/A THR 121.A N PHE 144.A O no hydrogen 2.811 N/A THR 121.A OG1 LYS 119.A O no hydrogen 2.816 N/A SER 124.A N LYS 141.A O.A no hydrogen 2.867 N/A SER 124.A N LYS 141.A O.B no hydrogen 2.866 N/A TYR 126.A N LEU 139.A O no hydrogen 2.877 N/A LEU 128.A N GLY 137.A O no hydrogen 2.716 N/A VAL 134.A N VAL 181.A O no hydrogen 2.732 N/A THR 135.A OG1 THR 180.A OG1 no hydrogen 2.910 N/A LEU 136.A N VAL 179.A O no hydrogen 2.807 N/A GLY 137.A N LEU 128.A O no hydrogen 3.044 N/A CYS 138.A N.A SER 177.A O no hydrogen 2.947 N/A CYS 138.A N.B SER 177.A O no hydrogen 2.925 N/A CYS 138.A SG.B GLY 137.A O no hydrogen 3.475 N/A LEU 139.A N TYR 126.A O no hydrogen 2.804 N/A VAL 140.A N LEU 175.A O no hydrogen 2.696 N/A LYS 141.A N.A SER 124.A O no hydrogen 2.844 N/A LYS 141.A N.B SER 124.A O no hydrogen 2.837 N/A GLY 142.A N TYR 173.A O no hydrogen 2.883 N/A TYR 143.A N TYR 173.A O no hydrogen 3.164 N/A TYR 143.A OH GLU 146.A OE1 no hydrogen 2.722 N/A PHE 144.A N THR 121.A O no hydrogen 2.957 N/A THR 149.A N ALA 196.A O no hydrogen 2.844 N/A THR 151.A N ASN 194.A O no hydrogen 2.921 N/A THR 151.A OG1 ASN 194.A OD1 no hydrogen 2.791 N/A TRP 152.A NE1 SER 177.A OG no hydrogen 2.979 N/A ASN 153.A N THR 192.A O no hydrogen 2.765 N/A ASN 153.A ND2 THR 190.A O no hydrogen 3.128 N/A SER 154.A N ASN 194.A OD1 no hydrogen 2.804 N/A GLY 155.A N TRP 152.A O no hydrogen 2.992 N/A SER 156.A N ASN 153.A O no hydrogen 3.053 N/A SER 156.A OG ASN 153.A O no hydrogen 2.805 N/A LEU 157.A N TRP 152.A O no hydrogen 3.200 N/A HIS 162.A N SER 178.A O no hydrogen 2.860 N/A THR 163.A OG1 SER 177.A OG no hydrogen 2.806 N/A PHE 164.A N SER 176.A O.A no hydrogen 2.999 N/A PHE 164.A N SER 176.A O.B no hydrogen 2.995 N/A VAL 167.A N THR 174.A O no hydrogen 2.974 N/A GLN 169.A N LEU 172.A O no hydrogen 2.729 N/A LEU 172.A N GLN 169.A O no hydrogen 3.158 N/A TYR 173.A N TYR 143.A O no hydrogen 2.765 N/A THR 174.A N VAL 167.A O no hydrogen 2.989 N/A LEU 175.A N VAL 140.A O no hydrogen 2.815 N/A SER 177.A N CYS 138.A O.A no hydrogen 3.035 N/A SER 177.A N CYS 138.A O.B no hydrogen 3.011 N/A SER 177.A OG HIS 162.A O no hydrogen 3.501 N/A SER 177.A OG THR 163.A OG1 no hydrogen 2.806 N/A SER 178.A N HIS 162.A O no hydrogen 2.779 N/A VAL 179.A N LEU 136.A O no hydrogen 2.862 N/A THR 180.A N GLY 160.A O no hydrogen 3.001 N/A THR 180.A OG1 THR 135.A OG1 no hydrogen 2.910 N/A VAL 181.A N VAL 134.A O no hydrogen 2.945 N/A SER 183.A N SER 132.A O no hydrogen 2.756 N/A THR 185.A N PRO 182.A O no hydrogen 2.904 N/A THR 185.A OG1 PRO 182.A O no hydrogen 2.692 N/A TRP 186.A NE1 ILE 208.A O no hydrogen 2.876 N/A SER 188.A OG SER 184.A O no hydrogen 2.987 N/A GLU 189.A N THR 185.A O no hydrogen 2.801 N/A THR 192.A N ASN 153.A OD1 no hydrogen 2.771 N/A CYS 193.A N.A LYS 206.A O no hydrogen 2.887 N/A CYS 193.A N.B LYS 206.A O no hydrogen 2.936 N/A CYS 193.A SG.B LYS 206.A O no hydrogen 3.852 N/A ASN 194.A N THR 151.A O no hydrogen 2.852 N/A ASN 194.A ND2 ASP 205.A OD1 no hydrogen 2.789 N/A VAL 195.A N VAL 204.A O no hydrogen 2.836 N/A ALA 196.A N THR 149.A O no hydrogen 2.922 N/A HIS 197.A N THR 202.A O no hydrogen 2.845 N/A HIS 197.A ND1 SER 200.A OG no hydrogen 2.609 N/A HIS 197.A NE2 PRO 145.A O no hydrogen 2.855 N/A SER 200.A N HIS 197.A O no hydrogen 3.190 N/A SER 200.A OG HIS 197.A ND1 no hydrogen 2.609 N/A SER 200.A OG HIS 197.A O no hydrogen 3.288 N/A SER 200.A OG THR 202.A OG1 no hydrogen 2.741 N/A SER 201.A N PRO 198.A O no hydrogen 2.943 N/A THR 202.A N HIS 197.A O no hydrogen 3.321 N/A THR 202.A OG1 SER 200.A OG no hydrogen 2.741 N/A VAL 204.A N VAL 195.A O no hydrogen 3.002 N/A LYS 206.A N CYS 193.A O.A no hydrogen 2.807 N/A LYS 206.A N CYS 193.A O.B no hydrogen 2.822 N/A LYS 206.A NZ ASP 205.A O no hydrogen 3.176 N/A ILE 208.A N VAL 191.A O no hydrogen 2.884 N/A