Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ubh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ ALA 36.A O no hydrogen 3.262 N/A LYS 5.A NZ GLU 38.A OE2 no hydrogen 3.029 N/A ARG 7.A N ASP 11.A OD2 no hydrogen 3.082 N/A LEU 9.A N GLU 43.A OE1 no hydrogen 2.827 N/A ASP 11.A N THR 8.A OG1 no hydrogen 2.926 N/A LEU 12.A N THR 8.A O no hydrogen 2.773 N/A ILE 13.A N LEU 9.A O no hydrogen 2.902 N/A ARG 14.A N ALA 10.A O no hydrogen 3.033 N/A ARG 14.A NH1 GLU 18.A OE2 no hydrogen 3.061 N/A ARG 14.A NH2 ASP 11.A OD1 no hydrogen 2.637 N/A ILE 15.A N ASP 11.A O no hydrogen 2.942 N/A LEU 16.A N LEU 12.A O no hydrogen 2.833 N/A HIS 17.A N ILE 13.A O no hydrogen 2.947 N/A HIS 17.A NE2 ASP 61.A OD2 no hydrogen 2.612 N/A GLU 18.A N ARG 14.A O no hydrogen 3.252 N/A LEU 19.A N ILE 15.A O no hydrogen 2.959 N/A PHE 20.A N LEU 16.A O no hydrogen 2.997 N/A ALA 21.A N GLU 18.A O no hydrogen 3.166 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.759 N/A GLU 29.A N ASN 26.A OD1 no hydrogen 3.188 N/A VAL 30.A N ASN 26.A O no hydrogen 3.076 N/A GLN 31.A N VAL 27.A O no hydrogen 2.879 N/A GLN 31.A NE2 CYS 127.A O no hydrogen 2.949 N/A ALA 32.A N GLU 28.A O no hydrogen 2.961 N/A VAL 33.A N GLU 29.A O no hydrogen 3.003 N/A LEU 34.A N VAL 30.A O no hydrogen 2.957 N/A GLU 35.A N GLN 31.A O no hydrogen 2.949 N/A ALA 36.A N ALA 32.A O no hydrogen 2.912 N/A TYR 37.A N VAL 33.A O no hydrogen 3.243 N/A TYR 37.A OH GLU 43.A OE1 no hydrogen 2.699 N/A SER 39.A N ASN 125.A OD1 no hydrogen 2.884 N/A SER 39.A OG LEU 95.A O no hydrogen 2.772 N/A ASN 40.A N TYR 37.A OH no hydrogen 3.309 N/A ASN 40.A ND2 GLU 43.A OE2 no hydrogen 3.196 N/A GLU 43.A N ASN 40.A O no hydrogen 2.796 N/A TRP 44.A N PRO 41.A O no hydrogen 3.191 N/A TRP 44.A NE1 SER 39.A OG no hydrogen 2.957 N/A TYR 47.A N TRP 44.A O no hydrogen 2.919 N/A ALA 48.A N ALA 45.A O no hydrogen 3.204 N/A LYS 49.A N TYR 47.A O no hydrogen 2.854 N/A LYS 49.A NZ LEU 46.A O no hydrogen 2.797 N/A LYS 49.A NZ GLY 183.A O no hydrogen 3.063 N/A TYR 53.A N ASP 51.A OD2 no hydrogen 2.948 N/A ARG 54.A N ASP 51.A OD2 no hydrogen 3.337 N/A ARG 54.A NE TYR 55.A O no hydrogen 2.818 N/A ARG 54.A NH2 TYR 55.A O no hydrogen 3.242 N/A THR 56.A N CYS 73.A O no hydrogen 3.117 N/A THR 56.A OG1 LYS 49.A O no hydrogen 2.577 N/A ARG 57.A NH2 TYR 55.A OH no hydrogen 2.715 N/A ASN 58.A N ILE 71.A O no hydrogen 2.859 N/A ASN 58.A ND2 LYS 49.A O no hydrogen 3.682 N/A ASN 58.A ND2 THR 56.A OG1 no hydrogen 3.299 N/A ASN 58.A ND2 ILE 71.A O no hydrogen 2.973 N/A LEU 59.A N SER 180.A O no hydrogen 2.961 N/A VAL 60.A N LEU 69.A O no hydrogen 2.885 N/A ASP 61.A N LEU 69.A O no hydrogen 3.157 N/A GLY 63.A N ASP 61.A OD2 no hydrogen 2.747 N/A GLY 65.A N GLN 62.A O no hydrogen 3.001 N/A LYS 66.A N GLY 63.A O no hydrogen 2.972 N/A LYS 66.A NZ PHE 20.A O no hydrogen 2.997 N/A LYS 66.A NZ GLY 22.A O no hydrogen 2.527 N/A ASN 68.A N PHE 154.A O no hydrogen 2.953 N/A LEU 69.A N ASP 61.A O no hydrogen 2.898 N/A MET 70.A N HIS 152.A O no hydrogen 2.828 N/A ILE 71.A N ASN 58.A O no hydrogen 2.736 N/A LEU 72.A N SER 150.A O no hydrogen 2.701 N/A CYS 73.A N THR 56.A O no hydrogen 2.967 N/A CYS 73.A SG LYS 49.A O no hydrogen 3.914 N/A TRP 74.A N ALA 148.A O no hydrogen 2.750 N/A TRP 74.A NE1 SER 150.A OG no hydrogen 2.800 N/A GLY 75.A N HIS 78.A ND1 no hydrogen 2.852 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.685 N/A GLY 77.A N ASN 141.A O no hydrogen 3.002 N/A HIS 78.A N GLY 75.A O no hydrogen 3.012 N/A HIS 78.A NE2 GLN 52.A O no hydrogen 3.047 N/A SER 80.A N VAL 139.A O no hydrogen 2.858 N/A SER 80.A OG SER 81.A O no hydrogen 2.849 N/A SER 80.A OG VAL 139.A O no hydrogen 3.356 N/A HIS 83.A N HIS 137.A O no hydrogen 2.976 N/A HIS 83.A ND1 SER 81.A O no hydrogen 3.082 N/A HIS 83.A NE2 HIS 85.A NE2 no hydrogen 3.068 N/A ASP 84.A N HIS 162.A O no hydrogen 3.351 N/A HIS 85.A N ASP 132.A OD1 no hydrogen 3.029 N/A THR 86.A OG1 THR 160.A O no hydrogen 2.583 N/A ASP 87.A N ASP 132.A OD2 no hydrogen 2.974 N/A SER 88.A N HIS 85.A O no hydrogen 2.907 N/A SER 88.A OG THR 86.A O no hydrogen 3.276 N/A SER 88.A OG PRO 156.A O no hydrogen 2.978 N/A HIS 89.A N SER 155.A O no hydrogen 2.700 N/A HIS 89.A ND1 TYR 129.A OH no hydrogen 2.758 N/A CYS 90.A N ILE 130.A O no hydrogen 2.925 N/A PHE 91.A N LEU 153.A O no hydrogen 2.829 N/A LEU 92.A N ALA 128.A O no hydrogen 2.840 N/A LYS 93.A N LEU 151.A O no hydrogen 2.814 N/A LYS 93.A NZ LEU 34.A O no hydrogen 2.743 N/A LYS 93.A NZ TYR 37.A O no hydrogen 2.651 N/A LYS 93.A NZ ASN 125.A O no hydrogen 3.013 N/A LYS 93.A NZ ASN 125.A OD1 no hydrogen 3.294 N/A LEU 94.A N GLN 126.A O no hydrogen 2.926 N/A LEU 95.A N VAL 149.A O no hydrogen 2.798 N/A GLN 96.A N VAL 149.A O no hydrogen 3.076 N/A GLY 97.A N GLU 124.A OE2 no hydrogen 3.083 N/A LEU 99.A N LEU 122.A O no hydrogen 3.060 N/A LYS 100.A N GLU 140.A O no hydrogen 2.792 N/A GLU 101.A N ARG 120.A O no hydrogen 2.935 N/A THR 102.A N ARG 138.A O no hydrogen 2.920 N/A LEU 103.A N SER 118.A O no hydrogen 2.800 N/A PHE 104.A N LEU 136.A O no hydrogen 2.887 N/A TRP 106.A NE1 ASP 132.A O no hydrogen 2.694 N/A ASN 112.A N THR 168.A O no hydrogen 3.308 N/A MET 114.A N GLN 166.A O no hydrogen 2.707 N/A LYS 117.A N LEU 103.A O no hydrogen 2.810 N/A ARG 120.A N GLU 101.A O no hydrogen 3.012 N/A ARG 120.A NE GLU 101.A OE1 no hydrogen 2.796 N/A ARG 120.A NH2 GLU 101.A OE1 no hydrogen 2.986 N/A LEU 122.A N LEU 99.A O no hydrogen 2.792 N/A ARG 123.A N GLN 126.A OE1 no hydrogen 3.152 N/A ARG 123.A NH1 ASN 98.A OD1 no hydrogen 3.299 N/A ASN 125.A N LEU 94.A O no hydrogen 2.761 N/A GLN 126.A N ARG 123.A O no hydrogen 2.942 N/A CYS 127.A N GLU 35.A OE1 no hydrogen 3.304 N/A CYS 127.A SG LEU 92.A O no hydrogen 3.772 N/A CYS 127.A SG ALA 128.A O no hydrogen 3.722 N/A ALA 128.A N LEU 92.A O no hydrogen 2.701 N/A TYR 129.A OH HIS 89.A ND1 no hydrogen 2.758 N/A ILE 130.A N CYS 90.A O no hydrogen 2.878 N/A ASN 131.A ND2 TYR 129.A OH no hydrogen 2.761 N/A SER 133.A N ASN 131.A OD1 no hydrogen 2.870 N/A SER 133.A OG ASN 131.A OD1 no hydrogen 2.490 N/A ILE 134.A N ASN 131.A O no hydrogen 2.965 N/A ILE 134.A N ASN 131.A OD1 no hydrogen 3.021 N/A GLY 135.A N ASN 131.A O no hydrogen 3.110 N/A LEU 136.A N PHE 104.A O no hydrogen 2.917 N/A HIS 137.A N HIS 83.A O no hydrogen 3.269 N/A HIS 137.A ND1 GLU 101.A OE2 no hydrogen 2.586 N/A HIS 137.A NE2 HIS 83.A NE2 no hydrogen 3.105 N/A ARG 138.A N THR 102.A O no hydrogen 2.919 N/A ARG 138.A NH1 SER 80.A O no hydrogen 3.068 N/A ARG 138.A NH2 GLN 166.A OE1 no hydrogen 2.744 N/A VAL 139.A N SER 80.A OG no hydrogen 2.948 N/A GLU 140.A N LYS 100.A O no hydrogen 2.891 N/A ASN 141.A N HIS 78.A O no hydrogen 2.783 N/A ASN 141.A ND2 TRP 74.A O no hydrogen 3.107 N/A ASN 141.A ND2 GLY 75.A O no hydrogen 3.199 N/A ASN 141.A ND2 GLU 146.A O no hydrogen 2.877 N/A SER 143.A N ASN 141.A OD1 no hydrogen 3.218 N/A SER 143.A OG GLU 146.A O no hydrogen 3.541 N/A THR 145.A N SER 143.A OG no hydrogen 3.121 N/A GLU 146.A N SER 143.A OG no hydrogen 2.776 N/A ALA 148.A N TRP 74.A O no hydrogen 2.787 N/A VAL 149.A N GLN 96.A O no hydrogen 2.897 N/A SER 150.A N LEU 72.A O no hydrogen 2.881 N/A SER 150.A OG HIS 152.A NE2 no hydrogen 2.794 N/A LEU 151.A N LYS 93.A O no hydrogen 2.734 N/A HIS 152.A N MET 70.A O no hydrogen 2.716 N/A HIS 152.A NE2 SER 150.A OG no hydrogen 2.794 N/A LEU 153.A N PHE 91.A O no hydrogen 2.890 N/A PHE 154.A N ASN 68.A O no hydrogen 2.982 N/A SER 155.A N HIS 89.A O no hydrogen 3.074 N/A SER 155.A OG LYS 66.A O no hydrogen 2.570 N/A CYS 161.A N VAL 174.A O no hydrogen 2.990 N/A HIS 162.A N ASP 84.A OD1 no hydrogen 2.642 N/A HIS 162.A ND1 ASP 84.A OD2 no hydrogen 2.979 N/A ALA 163.A N ASN 172.A O no hydrogen 2.982 N/A PHE 164.A N ILE 82.A O no hydrogen 2.732 N/A ASP 165.A N HIS 170.A O no hydrogen 2.852 N/A ARG 167.A N ASP 165.A OD1 no hydrogen 3.266 N/A THR 168.A N ASP 165.A O no hydrogen 3.046 N/A THR 168.A OG1 ASP 165.A OD2 no hydrogen 2.839 N/A GLY 169.A N ASP 165.A O no hydrogen 2.678 N/A HIS 170.A N THR 168.A OG1 no hydrogen 3.054 N/A ASN 172.A N ALA 163.A O no hydrogen 3.078 N/A VAL 174.A N CYS 161.A O no hydrogen 2.663 N/A MET 176.A N.A ASP 159.A O no hydrogen 2.629 N/A MET 176.A N.B ASP 159.A O no hydrogen 2.617 N/A HIS 179.A N ARG 57.A O no hydrogen 2.726 N/A SER 180.A OG ASN 58.A OD1 no hydrogen 2.547 N/A LYS 181.A N ILE 184.A O no hydrogen 2.842 N/A PHE 182.A N LEU 59.A O no hydrogen 2.889 N/A ILE 184.A N LYS 181.A O no hydrogen 2.864 N/A ARG 185.A NH1 HIS 179.A O no hydrogen 2.789 N/A THR 186.A N HIS 179.A O no hydrogen 3.093 N/A THR 186.A OG1 PHE 178.A O no hydrogen 3.187 N/A