Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ki0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 GLU 19.A OE2 no hydrogen 2.660 N/A VAL 6.A N THR 13.A O no hydrogen 2.922 N/A THR 8.A N GLY 11.A O no hydrogen 2.936 N/A THR 8.A OG1 GLY 11.A O no hydrogen 2.875 N/A GLN 10.A N THR 8.A OG1 no hydrogen 3.110 N/A GLN 10.A NE2 ASP 94.A O no hydrogen 3.076 N/A GLY 11.A N THR 8.A O no hydrogen 2.837 N/A THR 13.A N VAL 6.A O no hydrogen 2.783 N/A THR 13.A OG1 VAL 6.A O no hydrogen 3.335 N/A THR 13.A OG1 ASN 14.A OD1 no hydrogen 2.976 N/A TRP 15.A NE1 PRO 167.A O no hydrogen 2.841 N/A THR 16.A N GLU 19.A OE1 no hydrogen 2.979 N/A THR 16.A OG1 GLU 19.A OE1 no hydrogen 3.556 N/A GLU 19.A N THR 16.A OG1 no hydrogen 3.128 N/A LEU 20.A N THR 16.A O no hydrogen 2.992 N/A GLU 21.A N TYR 17.A O no hydrogen 2.779 N/A ALA 22.A N GLN 18.A O no hydrogen 3.150 N/A THR 23.A N GLU 19.A O no hydrogen 3.060 N/A THR 23.A OG1 GLU 19.A O no hydrogen 3.174 N/A HIS 24.A N LEU 20.A O no hydrogen 2.763 N/A HIS 24.A ND1 TYR 103.A OH no hydrogen 2.620 N/A GLN 25.A N GLU 21.A O no hydrogen 2.929 N/A GLN 25.A NE2.A GLU 21.A OE2.A no hydrogen 2.867 N/A ALA 26.A N ALA 22.A O no hydrogen 3.055 N/A LEU 27.A N THR 23.A O no hydrogen 2.910 N/A THR 28.A N HIS 24.A O no hydrogen 2.862 N/A THR 28.A OG1 HIS 24.A O no hydrogen 3.015 N/A ARG 29.A N.A GLN 25.A O no hydrogen 2.969 N/A ARG 29.A N.B GLN 25.A O no hydrogen 2.947 N/A GLU 30.A N ALA 26.A O no hydrogen 3.062 N/A GLY 31.A N THR 28.A O no hydrogen 3.012 N/A TYR 32.A N LEU 27.A O no hydrogen 3.004 N/A VAL 33.A N ILE 104.A O no hydrogen 2.803 N/A VAL 35.A N VAL 102.A O no hydrogen 2.861 N/A TYR 37.A N ALA 66.A O no hydrogen 2.824 N/A TYR 37.A OH GLU 188.A OE1 no hydrogen 2.741 N/A HIS 38.A N LEU 100.A O no hydrogen 2.811 N/A HIS 38.A ND1 TYR 64.A O no hydrogen 2.681 N/A THR 40.A N VAL 98.A O no hydrogen 3.081 N/A ALA 44.A N ASN 41.A OD1 no hydrogen 3.010 N/A ALA 45.A N ASN 41.A O no hydrogen 2.976 N/A GLN 46.A N HIS 42.A O no hydrogen 3.330 N/A GLN 46.A NE2 GLN 46.A O no hydrogen 3.261 N/A GLN 46.A NE2 ASN 50.A OD1 no hydrogen 3.134 N/A THR 47.A N VAL 43.A O no hydrogen 3.333 N/A THR 47.A OG1 VAL 43.A O no hydrogen 3.385 N/A ILE 48.A N ALA 44.A O no hydrogen 3.008 N/A VAL 49.A N ALA 45.A O no hydrogen 2.977 N/A ASN 50.A N GLN 46.A O no hydrogen 3.004 N/A ARG 51.A N THR 47.A O no hydrogen 3.047 N/A LYS 59.A NZ GLU 123.A OE1 no hydrogen 2.876 N/A TRP 60.A N ASN 56.A O no hydrogen 3.020 N/A GLY 61.A N GLU 58.A O no hydrogen 3.026 N/A LEU 63.A N ILE 155.A O no hydrogen 2.887 N/A TYR 64.A OH TRP 60.A O no hydrogen 2.650 N/A VAL 65.A N THR 153.A O no hydrogen 2.851 N/A ALA 66.A N TYR 37.A O no hydrogen 2.880 N/A VAL 71.A N HIS 68.A O no hydrogen 2.976 N/A HIS 73.A N ALA 69.A O no hydrogen 2.879 N/A GLY 74.A N GLU 70.A O no hydrogen 3.071 N/A TYR 75.A N ALA 72.A O no hydrogen 2.948 N/A ALA 76.A N HIS 73.A O no hydrogen 3.095 N/A ARG 77.A N TYR 75.A O no hydrogen 2.900 N/A ARG 77.A NE ALA 174.A O no hydrogen 2.851 N/A ARG 77.A NH2 TYR 175.A O no hydrogen 2.795 N/A THR 82.A N GLU 92.A OE1 no hydrogen 2.981 N/A THR 82.A OG1 GLU 92.A OE2 no hydrogen 2.648 N/A GLY 83.A N LEU 87.A O no hydrogen 2.838 N/A GLY 86.A N GLY 83.A O no hydrogen 3.020 N/A LEU 87.A N GLU 84.A O no hydrogen 3.232 N/A THR 89.A N GLU 92.A OE1 no hydrogen 2.846 N/A ARG 90.A NE ASP 94.A OD2 no hydrogen 2.737 N/A GLU 92.A N THR 89.A OG1 no hydrogen 3.097 N/A ARG 93.A N THR 89.A O no hydrogen 2.943 N/A ASP 94.A N ARG 90.A O no hydrogen 2.962 N/A ARG 96.A N PRO 9.A O no hydrogen 2.836 N/A ARG 96.A NH1 ARG 93.A O no hydrogen 3.219 N/A ARG 96.A NH1 ALA 95.A O no hydrogen 2.826 N/A GLY 97.A N ASN 173.A O no hydrogen 2.945 N/A VAL 98.A N THR 40.A O no hydrogen 2.893 N/A LEU 100.A N HIS 38.A O no hydrogen 2.812 N/A ARG 101.A N ILE 166.A O no hydrogen 2.731 N/A ARG 101.A NE TYR 103.A OH no hydrogen 3.044 N/A ARG 101.A NH1 GLU 188.A OE1 no hydrogen 3.069 N/A ARG 101.A NH1 SER 192.A OG no hydrogen 2.744 N/A ARG 101.A NH2 TYR 103.A OH no hydrogen 2.970 N/A ARG 101.A NH2 ILE 191.A O no hydrogen 2.827 N/A VAL 102.A N GLY 36.A O no hydrogen 2.896 N/A TYR 103.A N VAL 164.A O no hydrogen 2.843 N/A TYR 103.A OH HIS 24.A ND1 no hydrogen 2.620 N/A ILE 104.A N VAL 33.A O no hydrogen 2.936 N/A ARG 106.A N GLY 31.A O no hydrogen 2.836 N/A SER 108.A N PRO 105.A O no hydrogen 2.873 N/A LEU 109.A N ARG 106.A O no hydrogen 3.023 N/A GLU 110.A N ALA 107.A O no hydrogen 3.231 N/A ARG 111.A N SER 108.A O no hydrogen 3.101 N/A ARG 111.A NE ASN 138.A O no hydrogen 2.774 N/A ARG 111.A NH2 ASN 138.A OD1 no hydrogen 3.093 N/A PHE 112.A N LEU 109.A O no hydrogen 3.223 N/A TYR 113.A N ALA 140.A O no hydrogen 2.952 N/A ARG 114.A N LYS 198.A O no hydrogen 3.069 N/A ARG 114.A NE ASP 151.A OD2 no hydrogen 2.951 N/A ARG 114.A NH1 ASN 116.A OD1 no hydrogen 2.712 N/A ARG 114.A NH1 GLU 199.A OE1 no hydrogen 3.137 N/A ARG 114.A NH2 ASP 151.A OD1 no hydrogen 2.884 N/A THR 115.A N THR 142.A O no hydrogen 2.909 N/A THR 115.A OG1 THR 117.A OG1 no hydrogen 3.377 N/A THR 117.A N THR 115.A OG1 no hydrogen 3.070 N/A THR 117.A OG1 THR 115.A OG1 no hydrogen 3.377 N/A LEU 119.A N PRO 144.A O no hydrogen 3.011 N/A ASN 121.A N PRO 118.A O no hydrogen 2.807 N/A ALA 122.A N LEU 119.A O no hydrogen 2.965 N/A ILE 126.A N ALA 122.A O no hydrogen 2.812 N/A THR 127.A N GLU 123.A O no hydrogen 2.892 N/A THR 127.A OG1 GLU 123.A O no hydrogen 3.034 N/A THR 127.A OG1 GLU 124.A O no hydrogen 2.809 N/A GLN 128.A N GLU 124.A O no hydrogen 3.033 N/A VAL 129.A N HIS 125.A O no hydrogen 2.917 N/A ILE 130.A N ILE 126.A O no hydrogen 2.890 N/A GLY 131.A N THR 127.A O no hydrogen 2.859 N/A HIS 132.A ND1 SER 133.A O no hydrogen 2.689 N/A HIS 132.A NE2 GLU 139.A OE1 no hydrogen 3.121 N/A HIS 132.A NE2 GLU 139.A OE2 no hydrogen 2.877 N/A ARG 137.A N GLU 139.A OE1 no hydrogen 2.833 N/A ALA 140.A N ARG 111.A O no hydrogen 2.959 N/A PHE 141.A N VAL 154.A O no hydrogen 2.930 N/A THR 142.A N TYR 113.A O no hydrogen 2.845 N/A THR 142.A OG1 THR 153.A OG1 no hydrogen 2.651 N/A GLY 143.A N GLU 152.A O no hydrogen 3.064 N/A GLU 145.A N GLU 150.A O no hydrogen 2.818 N/A SER 146.A OG GLU 145.A OE2 no hydrogen 2.762 N/A GLY 149.A N SER 146.A O no hydrogen 2.836 N/A GLU 152.A N GLY 143.A O no hydrogen 2.922 N/A THR 153.A N VAL 65.A O no hydrogen 2.818 N/A THR 153.A OG1 THR 142.A OG1 no hydrogen 2.651 N/A VAL 154.A N PHE 141.A O no hydrogen 2.879 N/A ILE 155.A N LEU 63.A O no hydrogen 2.860 N/A GLY 156.A N GLU 139.A O no hydrogen 2.847 N/A MET 159.A N GLY 156.A O no hydrogen 2.991 N/A ALA 160.A N GLY 156.A O no hydrogen 2.828 N/A ILE 161.A N TRP 157.A O no hydrogen 2.992 N/A HIS 162.A N MET 159.A O no hydrogen 2.970 N/A ALA 163.A N ALA 160.A O no hydrogen 2.901 N/A VAL 164.A N TYR 103.A O no hydrogen 2.915 N/A ILE 166.A N ARG 101.A O no hydrogen 2.975 N/A SER 168.A N MET 99.A O no hydrogen 2.900 N/A SER 168.A OG GLU 188.A OE1 no hydrogen 2.798 N/A SER 168.A OG GLU 188.A OE2 no hydrogen 3.021 N/A THR 169.A N GLU 188.A OE2 no hydrogen 2.677 N/A THR 169.A OG1 GLU 188.A OE2 no hydrogen 2.623 N/A ILE 170.A N SER 168.A OG no hydrogen 2.959 N/A ASN 173.A N ALA 76.A O no hydrogen 2.819 N/A ASN 173.A ND2 HIS 73.A O no hydrogen 3.006 N/A ALA 174.A N ASN 173.A OD1 no hydrogen 2.821 N/A LEU 178.A N ASN 173.A OD1 no hydrogen 2.878 N/A ALA 184.A N ASP 181.A OD1 no hydrogen 3.274 N/A VAL 185.A N ASP 181.A O no hydrogen 3.131 N/A ALA 186.A N GLU 182.A O no hydrogen 2.853 N/A LYS 187.A N GLU 183.A O no hydrogen 2.971 N/A GLU 188.A N ALA 184.A O no hydrogen 3.215 N/A GLU 188.A N VAL 185.A O no hydrogen 3.179 N/A GLN 189.A N ALA 186.A O no hydrogen 3.178 N/A ILE 191.A N GLU 188.A O no hydrogen 3.185 N/A SER 192.A N GLN 189.A O no hydrogen 2.953 N/A SER 192.A OG TYR 37.A OH no hydrogen 3.234 N/A SER 192.A OG GLU 188.A O no hydrogen 2.691 N/A LYS 198.A N PHE 112.A O no hydrogen 2.897 N/A