Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6i9t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N SER 2.A OG no hydrogen 3.123 N/A ARG 5.A N SER 2.A O no hydrogen 3.062 N/A ARG 5.A NE TYR 8.A O no hydrogen 2.884 N/A ARG 5.A NH1 TYR 8.A O no hydrogen 2.812 N/A ARG 5.A NH1 GLU 13.A OE1 no hydrogen 2.794 N/A ARG 5.A NH2 GLU 13.A OE1 no hydrogen 2.865 N/A ASN 7.A ND2 VAL 121.A O no hydrogen 2.921 N/A TYR 8.A OH GLN 69.A OE1 no hydrogen 2.690 N/A ASP 11.A N HIS 9.A ND1 no hydrogen 2.860 N/A GLU 13.A N HIS 9.A O no hydrogen 3.020 N/A ALA 14.A N SER 10.A O no hydrogen 2.992 N/A ALA 15.A N ASP 11.A O no hydrogen 2.958 N/A VAL 16.A N CYS 12.A O no hydrogen 2.826 N/A ASN 17.A N GLU 13.A O no hydrogen 3.183 N/A ASN 17.A ND2 ARG 75.A O no hydrogen 3.021 N/A ARG 18.A N ALA 14.A O no hydrogen 2.989 N/A MET 19.A N ALA 15.A O no hydrogen 2.866 N/A LEU 20.A N.A VAL 16.A O no hydrogen 2.897 N/A LEU 20.A N.B VAL 16.A O no hydrogen 2.974 N/A ASN 21.A N ASN 17.A O no hydrogen 3.128 N/A ASN 21.A ND2 ASP 80.A O no hydrogen 2.961 N/A LEU 22.A N ARG 18.A O no hydrogen 3.029 N/A GLU 23.A N MET 19.A O no hydrogen 2.927 N/A LEU 24.A N LEU 20.A O.A no hydrogen 3.051 N/A LEU 24.A N LEU 20.A O.B no hydrogen 3.048 N/A TYR 25.A N ASN 21.A O no hydrogen 2.845 N/A ALA 26.A N LEU 22.A O no hydrogen 2.832 N/A SER 27.A N GLU 23.A O no hydrogen 2.899 N/A SER 27.A OG SER 55.A O no hydrogen 2.761 N/A SER 27.A OG SER 55.A OG.A no hydrogen 3.115 N/A TYR 28.A N LEU 24.A O no hydrogen 2.978 N/A THR 29.A N TYR 25.A O no hydrogen 2.977 N/A THR 29.A OG1 TYR 25.A O no hydrogen 3.446 N/A TYR 30.A N ALA 26.A O no hydrogen 3.015 N/A TYR 30.A OH GLU 103.A OE2 no hydrogen 2.554 N/A SER 31.A N SER 27.A O no hydrogen 2.906 N/A SER 31.A OG.A SER 27.A O no hydrogen 3.289 N/A SER 31.A OG.A SER 55.A OG.A no hydrogen 2.780 N/A SER 31.A OG.B TYR 28.A O no hydrogen 2.763 N/A SER 32.A N TYR 28.A O no hydrogen 2.982 N/A MET 33.A N THR 29.A O no hydrogen 3.030 N/A TYR 34.A N TYR 30.A O no hydrogen 2.942 N/A ALA 35.A N SER 31.A O no hydrogen 2.994 N/A PHE 36.A N SER 32.A O no hydrogen 2.976 N/A PHE 37.A N MET 33.A O no hydrogen 3.033 N/A ASP 38.A N TYR 34.A O no hydrogen 3.089 N/A ARG 39.A N PHE 36.A O no hydrogen 3.085 N/A ARG 39.A NE ASP 41.A OD1.A no hydrogen 2.905 N/A ARG 39.A NE ASP 41.A OD1.B no hydrogen 2.813 N/A ARG 39.A NH1 GLU 88.A OE2.B no hydrogen 2.997 N/A ARG 39.A NH2 ASP 41.A OD1.A no hydrogen 3.353 N/A ARG 39.A NH2 ASP 41.A OD1.B no hydrogen 3.315 N/A ARG 39.A NH2 ASP 41.A OD2.A no hydrogen 3.020 N/A ARG 39.A NH2 ASP 41.A OD2.B no hydrogen 2.715 N/A VAL 42.A N ARG 39.A O no hydrogen 3.004 N/A LEU 44.A N PHE 37.A O no hydrogen 3.062 N/A ASN 46.A ND2 ASP 167.A O no hydrogen 2.851 N/A ASN 46.A ND2 GLU 173.A OE1 no hydrogen 3.134 N/A VAL 47.A N ASP 167.A OD2 no hydrogen 2.992 N/A ALA 48.A N LEU 44.A O no hydrogen 2.922 N/A GLU 49.A N HIS 45.A O no hydrogen 2.967 N/A PHE 50.A N ASN 46.A O no hydrogen 2.970 N/A PHE 51.A N VAL 47.A O no hydrogen 3.101 N/A LYS 52.A N ALA 48.A O no hydrogen 2.910 N/A GLU 53.A N GLU 49.A O no hydrogen 2.915 N/A ASN 54.A N.A PHE 50.A O no hydrogen 3.024 N/A ASN 54.A N.B PHE 50.A O no hydrogen 3.036 N/A ASN 54.A ND2.B PHE 50.A O no hydrogen 2.875 N/A SER 55.A N PHE 51.A O no hydrogen 2.894 N/A SER 55.A OG.A SER 27.A O no hydrogen 2.840 N/A SER 55.A OG.A SER 27.A OG no hydrogen 3.115 N/A SER 55.A OG.A SER 31.A OG.A no hydrogen 2.780 N/A SER 55.A OG.B LYS 52.A O no hydrogen 2.673 N/A SER 55.A OG.B HIS 56.A ND1 no hydrogen 3.273 N/A HIS 56.A N LYS 52.A O no hydrogen 3.111 N/A GLU 57.A N GLU 53.A O no hydrogen 3.003 N/A GLU 58.A N ASN 54.A O.A no hydrogen 2.938 N/A GLU 58.A N ASN 54.A O.B no hydrogen 3.008 N/A ARG 59.A N.A SER 55.A O no hydrogen 3.145 N/A ARG 59.A N.B SER 55.A O no hydrogen 3.146 N/A ARG 59.A NH1.B GLU 63.A OE1 no hydrogen 2.896 N/A GLU 60.A N HIS 56.A O no hydrogen 3.017 N/A HIS 61.A N.A GLU 57.A O no hydrogen 2.906 N/A HIS 61.A N.B GLU 57.A O no hydrogen 2.937 N/A HIS 61.A ND1.A GLU 58.A OE1.A no hydrogen 3.175 N/A HIS 61.A ND1.A GLU 58.A OE1.B no hydrogen 3.040 N/A HIS 61.A NE2.A GLU 136.A OE2.A no hydrogen 2.871 N/A ALA 62.A N GLU 58.A O no hydrogen 3.021 N/A GLU 63.A N ARG 59.A O.A no hydrogen 2.975 N/A GLU 63.A N ARG 59.A O.B no hydrogen 2.974 N/A LYS 64.A N GLU 60.A O no hydrogen 2.917 N/A LYS 64.A NZ GLU 132.A OE1 no hydrogen 2.679 N/A PHE 65.A N HIS 61.A O.A no hydrogen 3.198 N/A PHE 65.A N HIS 61.A O.B no hydrogen 3.275 N/A MET 66.A N ALA 62.A O no hydrogen 3.035 N/A LYS 67.A N GLU 63.A O no hydrogen 2.991 N/A TYR 68.A N LYS 64.A O no hydrogen 2.939 N/A TYR 68.A OH HIS 124.A ND1 no hydrogen 2.745 N/A GLN 69.A N PHE 65.A O no hydrogen 2.908 N/A GLN 69.A NE2 GLU 13.A O no hydrogen 2.959 N/A GLN 69.A NE2 ASN 17.A OD1 no hydrogen 2.989 N/A ASN 70.A N MET 66.A O no hydrogen 3.140 N/A LYS 71.A N LYS 67.A O no hydrogen 2.899 N/A ARG 72.A N TYR 68.A O no hydrogen 3.033 N/A ARG 72.A N GLN 69.A O no hydrogen 3.241 N/A ARG 72.A NH1 TYR 68.A OH no hydrogen 2.837 N/A ARG 72.A NH1 ASP 122.A OD1 no hydrogen 3.029 N/A ARG 72.A NH1 ASP 122.A OD2 no hydrogen 3.032 N/A ARG 72.A NH2 GLN 6.A O no hydrogen 3.009 N/A ARG 72.A NH2 ASN 7.A O no hydrogen 2.938 N/A ARG 72.A NH2 ASP 122.A OD2 no hydrogen 3.332 N/A GLY 73.A N ASN 70.A O no hydrogen 3.097 N/A GLY 74.A N GLN 69.A O no hydrogen 2.905 N/A ARG 75.A N GLU 13.A OE2 no hydrogen 2.881 N/A ARG 75.A NH1 GLY 74.A O no hydrogen 2.845 N/A VAL 77.A N ASN 17.A OD1 no hydrogen 3.210 N/A ARG 86.A NE GLU 88.A O no hydrogen 2.886 N/A ARG 86.A NH1 GLU 94.A OE2 no hydrogen 3.057 N/A ARG 86.A NH2 GLU 88.A O no hydrogen 3.198 N/A ARG 86.A NH2 GLU 88.A OE2.A no hydrogen 3.075 N/A ARG 86.A NH2 GLU 94.A OE2 no hydrogen 2.873 N/A TRP 89.A NE1 SER 32.A OG no hydrogen 2.896 N/A GLY 90.A N GLU 88.A OE1.A no hydrogen 2.878 N/A ASN 91.A N TRP 89.A O no hydrogen 2.878 N/A THR 92.A N GLU 163.A OE2.A no hydrogen 2.848 N/A THR 92.A N GLU 163.A OE2.B no hydrogen 2.766 N/A THR 92.A OG1 GLU 163.A OE2.A no hydrogen 2.680 N/A THR 92.A OG1 GLU 163.A OE2.B no hydrogen 2.743 N/A GLU 94.A N ASN 91.A OD1 no hydrogen 2.946 N/A ALA 95.A N ASN 91.A O no hydrogen 2.962 N/A MET 96.A N THR 92.A O no hydrogen 2.925 N/A GLN 97.A N LEU 93.A O no hydrogen 2.869 N/A ALA 98.A N GLU 94.A O no hydrogen 2.981 N/A ALA 99.A N ALA 95.A O no hydrogen 2.837 N/A LEU 100.A N MET 96.A O no hydrogen 2.827 N/A GLN 101.A N GLN 97.A O no hydrogen 3.086 N/A LEU 102.A N ALA 98.A O no hydrogen 2.885 N/A GLU 103.A N ALA 99.A O no hydrogen 2.852 N/A LYS 104.A N.A LEU 100.A O no hydrogen 2.934 N/A LYS 104.A N.B LEU 100.A O no hydrogen 2.930 N/A THR 105.A N GLN 101.A O no hydrogen 2.850 N/A THR 105.A OG1 GLN 101.A O no hydrogen 2.982 N/A VAL 106.A N LEU 102.A O no hydrogen 2.894 N/A ASN 107.A N GLU 103.A O no hydrogen 2.850 N/A GLN 108.A N LYS 104.A O.A no hydrogen 2.821 N/A GLN 108.A N LYS 104.A O.B no hydrogen 2.837 N/A GLN 108.A NE2 GLN 108.A O no hydrogen 3.348 N/A GLN 108.A NE2 ASP 112.A OD1 no hydrogen 2.933 N/A ALA 109.A N THR 105.A O no hydrogen 3.061 N/A LEU 110.A N VAL 106.A O no hydrogen 2.948 N/A LEU 111.A N ASN 107.A O no hydrogen 2.862 N/A ASP 112.A N GLN 108.A O no hydrogen 2.842 N/A LEU 113.A N ALA 109.A O no hydrogen 2.884 N/A HIS 114.A N LEU 110.A O no hydrogen 2.901 N/A HIS 114.A NE2 GLU 130.A OE2 no hydrogen 2.682 N/A LYS 115.A N LEU 111.A O no hydrogen 2.928 N/A LEU 116.A N ASP 112.A O no hydrogen 3.005 N/A ALA 117.A N LEU 113.A O no hydrogen 2.862 N/A THR 118.A N HIS 114.A O no hydrogen 2.836 N/A THR 118.A OG1 HIS 114.A ND1 no hydrogen 3.376 N/A THR 118.A OG1 HIS 114.A O no hydrogen 2.885 N/A ASP 119.A N LYS 115.A O no hydrogen 2.881 N/A LYS 120.A N LEU 116.A O no hydrogen 2.898 N/A VAL 121.A N THR 118.A O no hydrogen 3.036 N/A ASP 122.A N ALA 117.A O no hydrogen 2.889 N/A HIS 124.A ND1 TYR 68.A OH no hydrogen 2.745 N/A LEU 125.A N ASP 122.A OD1 no hydrogen 3.005 N/A CYS 126.A N ASP 122.A O no hydrogen 3.093 N/A CYS 126.A SG THR 118.A OG1 no hydrogen 3.528 N/A CYS 126.A SG ASP 122.A O no hydrogen 3.468 N/A ASP 127.A N PRO 123.A O no hydrogen 2.888 N/A PHE 128.A N HIS 124.A O no hydrogen 2.939 N/A LEU 129.A N LEU 125.A O no hydrogen 3.028 N/A GLU 130.A N CYS 126.A O no hydrogen 2.927 N/A SER 131.A N ASP 127.A O no hydrogen 2.774 N/A SER 131.A OG.A ASP 127.A O no hydrogen 2.898 N/A SER 131.A OG.A ASP 127.A OD1 no hydrogen 3.013 N/A SER 131.A OG.B ASP 127.A O no hydrogen 2.766 N/A SER 131.A OG.B PHE 128.A O no hydrogen 3.443 N/A GLU 132.A N PHE 128.A O no hydrogen 2.905 N/A TYR 133.A N LEU 129.A O no hydrogen 2.952 N/A TYR 133.A OH HIS 61.A O.A no hydrogen 2.883 N/A TYR 133.A OH HIS 61.A O.B no hydrogen 2.858 N/A LEU 134.A N LEU 129.A O no hydrogen 2.883 N/A GLN 137.A N TYR 133.A O no hydrogen 3.110 N/A GLN 137.A NE2.A GLU 103.A O no hydrogen 2.857 N/A GLN 137.A NE2.A GLU 103.A OE1 no hydrogen 2.953 N/A GLN 137.A NE2.B GLU 103.A O no hydrogen 3.111 N/A VAL 138.A N LEU 134.A O no hydrogen 3.147 N/A LYS 139.A N GLU 135.A O no hydrogen 2.925 N/A ASP 140.A N GLU 136.A O.A no hydrogen 2.868 N/A ASP 140.A N GLU 136.A O.B no hydrogen 2.899 N/A ILE 141.A N GLN 137.A O no hydrogen 2.874 N/A LYS 142.A N VAL 138.A O no hydrogen 2.969 N/A LYS 142.A NZ ASP 146.A OD1 no hydrogen 2.844 N/A LYS 142.A NZ ASP 146.A OD2 no hydrogen 3.056 N/A ARG 143.A N LYS 139.A O no hydrogen 2.978 N/A ILE 144.A N ASP 140.A O no hydrogen 3.029 N/A GLY 145.A N ILE 141.A O no hydrogen 2.877 N/A ASP 146.A N LYS 142.A O no hydrogen 2.906 N/A PHE 147.A N ARG 143.A O no hydrogen 2.966 N/A ILE 148.A N ILE 144.A O no hydrogen 2.877 N/A THR 149.A N GLY 145.A O no hydrogen 2.967 N/A THR 149.A OG1 GLY 145.A O no hydrogen 3.215 N/A ASN 150.A N ASP 146.A O no hydrogen 3.061 N/A ASN 150.A ND2 ASP 146.A O no hydrogen 2.956 N/A LEU 151.A N PHE 147.A O no hydrogen 2.794 N/A LYS 152.A N ILE 148.A O no hydrogen 2.924 N/A ARG 153.A N THR 149.A O no hydrogen 2.972 N/A ARG 153.A NH1 ASN 150.A OD1 no hydrogen 2.867 N/A LEU 154.A N ASN 150.A O no hydrogen 2.912 N/A GLY 155.A N LYS 152.A O no hydrogen 2.969 N/A LEU 156.A N LEU 151.A O no hydrogen 3.077 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.860 N/A ASN 159.A N GLY 155.A O no hydrogen 2.924 N/A GLY 162.A N ASN 159.A OD1 no hydrogen 3.036 N/A GLU 163.A N ASN 159.A O no hydrogen 3.086 N/A TYR 164.A N GLY 160.A O no hydrogen 2.906 N/A LEU 165.A N MET 161.A O no hydrogen 2.919 N/A PHE 166.A N GLY 162.A O no hydrogen 2.962 N/A ASP 167.A N GLU 163.A O no hydrogen 3.239 N/A LYS 168.A N TYR 164.A O no hydrogen 3.214 N/A LYS 168.A NZ.A TYR 164.A O no hydrogen 3.175 N/A LYS 168.A NZ.A ASP 167.A OD1 no hydrogen 2.793 N/A HIS 169.A N LEU 165.A O no hydrogen 2.914 N/A HIS 169.A N PHE 166.A O no hydrogen 3.312 N/A SER 170.A N PHE 166.A O no hydrogen 2.842 N/A SER 174.A N ASN 46.A OD1 no hydrogen 2.971 N/A SER 174.A OG ASN 46.A OD1 no hydrogen 2.857 N/A