Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vr0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N GLU 105.A OE2 no hydrogen 2.779 N/A THR 4.A OG1 SER 51.A OG no hydrogen 2.795 N/A THR 4.A OG1 GLU 105.A OE2 no hydrogen 2.518 N/A THR 5.A N TYR 50.A O no hydrogen 2.834 N/A VAL 7.A N GLU 48.A O no hydrogen 2.885 N/A TYR 9.A N PHE 46.A O no hydrogen 2.809 N/A TYR 9.A OH GLU 48.A OE1 no hydrogen 2.753 N/A GLU 10.A N PHE 46.A O no hydrogen 3.174 N/A ARG 11.A NH1 GLU 116.A OE1 no hydrogen 2.875 N/A ARG 11.A NH2 GLU 116.A OE1 no hydrogen 2.775 N/A TYR 15.A N ASP 85.A OD2 no hydrogen 3.151 N/A ASP 16.A N PHE 117.A O no hydrogen 3.059 N/A ILE 18.A N ASP 85.A O no hydrogen 2.946 N/A PHE 19.A N GLU 121.A O no hydrogen 2.812 N/A ILE 20.A N ILE 87.A O no hydrogen 2.659 N/A GLU 21.A N ILE 123.A O no hydrogen 2.947 N/A GLY 22.A N VAL 89.A O no hydrogen 2.918 N/A LEU 23.A N GLU 21.A OE2 no hydrogen 2.807 N/A LEU 28.A N GLY 25.A O no hydrogen 2.896 N/A VAL 29.A N ILE 26.A O no hydrogen 3.124 N/A LYS 31.A NZ GLU 35.A OE2 no hydrogen 2.825 N/A LEU 32.A N LEU 28.A O no hydrogen 2.935 N/A ALA 33.A N VAL 29.A O no hydrogen 2.996 N/A ALA 34.A N GLY 30.A O no hydrogen 2.871 N/A GLU 35.A N LYS 31.A O no hydrogen 2.967 N/A HIS 36.A N LEU 32.A O no hydrogen 2.954 N/A HIS 36.A NE2 ASP 224.A O no hydrogen 2.689 N/A LEU 37.A N ALA 33.A O no hydrogen 2.842 N/A ILE 38.A N ALA 34.A O no hydrogen 2.804 N/A GLN 39.A N GLU 35.A O no hydrogen 2.964 N/A GLN 39.A NE2 GLU 40.A OE2 no hydrogen 3.011 N/A GLU 40.A N HIS 36.A O no hydrogen 2.973 N/A LEU 41.A N LEU 37.A O no hydrogen 3.003 N/A LYS 42.A N GLN 39.A O no hydrogen 3.185 N/A ALA 43.A N ILE 38.A O no hydrogen 2.968 N/A LYS 44.A N TYR 75.A O no hydrogen 2.903 N/A LYS 44.A NZ LYS 45.A O no hydrogen 2.783 N/A LYS 45.A NZ GLU 48.A OE2 no hydrogen 2.782 N/A LYS 45.A NZ GLU 72.A OE1 no hydrogen 2.902 N/A PHE 46.A N PHE 73.A O no hydrogen 2.983 N/A GLU 48.A N VAL 7.A O no hydrogen 3.044 N/A LEU 49.A N ASN 71.A O no hydrogen 2.660 N/A TYR 50.A N THR 5.A O no hydrogen 2.879 N/A TYR 50.A OH GLU 48.A OE1 no hydrogen 2.638 N/A SER 51.A OG THR 4.A OG1 no hydrogen 2.795 N/A HIS 53.A N SER 51.A OG no hydrogen 3.044 N/A HIS 53.A ND1 ASP 99.A OD2 no hydrogen 2.583 N/A PHE 54.A N SER 51.A O no hydrogen 3.115 N/A GLN 57.A N MET 55.A O no hydrogen 2.899 N/A LEU 59.A N GLU 67.A O no hydrogen 2.747 N/A ARG 61.A N VAL 65.A O no hydrogen 2.789 N/A ARG 61.A NE GLU 67.A OE1 no hydrogen 3.125 N/A ARG 61.A NH1 ASP 92.A OD1 no hydrogen 2.764 N/A ARG 61.A NH1 ASP 92.A OD2 no hydrogen 3.520 N/A ARG 61.A NH2 GLU 67.A OE1 no hydrogen 3.493 N/A ARG 61.A NH2 ASP 92.A OD1 no hydrogen 3.495 N/A ARG 61.A NH2 ASP 92.A OD2 no hydrogen 2.678 N/A GLU 67.A N LEU 59.A O no hydrogen 3.146 N/A LYS 70.A N ASP 92.A OD2 no hydrogen 2.862 N/A LYS 70.A NZ GLU 48.A OE2 no hydrogen 2.757 N/A LYS 70.A NZ GLU 67.A OE1 no hydrogen 2.966 N/A LYS 70.A NZ GLU 67.A OE2 no hydrogen 2.687 N/A ASN 71.A N LEU 49.A O no hydrogen 2.866 N/A ASN 71.A ND2 LYS 70.A O no hydrogen 2.967 N/A ASN 71.A ND2 THR 93.A O no hydrogen 3.206 N/A GLU 72.A N THR 90.A O no hydrogen 2.688 N/A PHE 73.A N ALA 47.A O no hydrogen 2.891 N/A TYR 74.A N ILE 88.A O no hydrogen 2.792 N/A TYR 74.A OH GLU 72.A OE2 no hydrogen 3.037 N/A TYR 75.A N LYS 44.A O no hydrogen 2.770 N/A TYR 75.A OH GLU 10.A OE2 no hydrogen 2.576 N/A TRP 76.A N LEU 86.A O no hydrogen 2.955 N/A LYS 77.A NZ ASP 13.A O no hydrogen 2.958 N/A SER 78.A N ASP 85.A OD1 no hydrogen 2.649 N/A SER 78.A OG ASP 80.A O no hydrogen 2.773 N/A SER 78.A OG HIS 83.A O no hydrogen 2.891 N/A ASP 80.A N SER 78.A OG no hydrogen 3.281 N/A GLU 82.A N ASP 80.A OD1 no hydrogen 3.080 N/A HIS 83.A N ASP 80.A OD1 no hydrogen 3.068 N/A HIS 83.A ND1 ASP 80.A OD1 no hydrogen 2.919 N/A HIS 83.A NE2 GLY 220.A O no hydrogen 2.868 N/A ARG 84.A NE ASP 16.A O no hydrogen 3.130 N/A ARG 84.A NH1 GLU 121.A OE2 no hydrogen 2.902 N/A ARG 84.A NH2 ASP 16.A O no hydrogen 3.130 N/A ARG 84.A NH2 GLU 121.A OE2 no hydrogen 3.300 N/A LEU 86.A N TRP 76.A O no hydrogen 2.898 N/A ILE 87.A N ILE 18.A O no hydrogen 3.063 N/A ILE 88.A N TYR 74.A O no hydrogen 2.838 N/A VAL 89.A N ILE 20.A O no hydrogen 2.849 N/A THR 90.A N GLU 72.A O no hydrogen 3.012 N/A THR 90.A OG1 GLY 22.A O no hydrogen 2.848 N/A GLY 91.A N THR 90.A OG1 no hydrogen 2.837 N/A ASP 92.A N LYS 70.A O no hydrogen 2.947 N/A THR 93.A OG1 GLN 94.A O no hydrogen 2.852 N/A GLN 94.A NE2 PRO 24.A O no hydrogen 2.824 N/A ASP 99.A N PRO 96.A O no hydrogen 3.260 N/A GLY 102.A N ASP 99.A OD1 no hydrogen 3.088 N/A HIS 103.A N SER 100.A O no hydrogen 2.871 N/A HIS 103.A NE2 PRO 96.A O no hydrogen 3.110 N/A PHE 104.A N SER 100.A O no hydrogen 3.182 N/A GLU 105.A N TYR 101.A O no hydrogen 2.921 N/A VAL 106.A N GLY 102.A O no hydrogen 2.954 N/A ALA 107.A N HIS 103.A O no hydrogen 2.953 N/A GLY 108.A N PHE 104.A O no hydrogen 2.895 N/A LYS 109.A N GLU 105.A O no hydrogen 3.065 N/A MET 110.A N VAL 106.A O no hydrogen 3.002 N/A LEU 111.A N ALA 107.A O no hydrogen 3.056 N/A ASP 112.A N GLY 108.A O no hydrogen 2.850 N/A PHE 113.A N LYS 109.A O no hydrogen 3.044 N/A VAL 114.A N MET 110.A O no hydrogen 2.976 N/A GLN 115.A N LEU 111.A O no hydrogen 2.938 N/A GLU 116.A N PHE 113.A O no hydrogen 3.037 N/A PHE 117.A N VAL 114.A O no hydrogen 3.034 N/A GLY 118.A N GLN 115.A O no hydrogen 3.053 N/A THR 119.A N VAL 114.A O no hydrogen 3.437 N/A THR 119.A OG1 VAL 114.A O no hydrogen 2.757 N/A ARG 120.A NE ASP 16.A OD1 no hydrogen 3.071 N/A ARG 120.A NH2 ASP 16.A OD1 no hydrogen 2.802 N/A ARG 120.A NH2 ASP 16.A OD2 no hydrogen 3.281 N/A ILE 122.A N PHE 190.A O no hydrogen 2.928 N/A ILE 123.A N PHE 19.A O no hydrogen 2.795 N/A THR 124.A N ILE 192.A O no hydrogen 3.095 N/A THR 124.A OG1 ALA 177.A O no hydrogen 2.694 N/A MET 125.A N GLU 21.A O no hydrogen 2.917 N/A GLY 126.A N LEU 194.A O no hydrogen 3.045 N/A TYR 128.A N GLY 196.A O no hydrogen 2.802 N/A VAL 130.A N SER 198.A O no hydrogen 2.900 N/A ARG 138.A N GLU 197.A OE1 no hydrogen 3.333 N/A ARG 138.A NH2 GLU 197.A OE2 no hydrogen 3.487 N/A VAL 139.A N GLU 162.A O no hydrogen 3.098 N/A LEU 140.A N LEU 195.A O no hydrogen 2.765 N/A ALA 141.A N ILE 164.A O no hydrogen 2.810 N/A ALA 142.A N SER 193.A O no hydrogen 3.137 N/A THR 144.A N GLY 191.A O no hydrogen 3.039 N/A THR 144.A OG1 GLY 191.A O no hydrogen 3.420 N/A LEU 148.A N HIS 145.A O no hydrogen 2.766 N/A ILE 149.A N GLU 146.A O no hydrogen 2.960 N/A TYR 152.A N LEU 148.A O no hydrogen 2.969 N/A TYR 152.A OH GLU 121.A OE1 no hydrogen 2.717 N/A LYS 153.A N ILE 149.A O no hydrogen 2.805 N/A SER 154.A N GLU 150.A O no hydrogen 2.860 N/A SER 154.A OG GLU 150.A O no hydrogen 2.791 N/A LYS 155.A N TYR 151.A O no hydrogen 3.446 N/A LEU 156.A N TYR 152.A O no hydrogen 2.802 N/A LEU 156.A N LYS 153.A O no hydrogen 2.999 N/A GLU 157.A N SER 154.A O no hydrogen 3.230 N/A CYS 159.A N LEU 156.A O no hydrogen 2.978 N/A CYS 159.A SG SER 213.A O no hydrogen 3.970 N/A ILE 164.A N VAL 139.A O no hydrogen 2.837 N/A ARG 166.A N ALA 141.A O no hydrogen 3.123 N/A ARG 166.A NE ASP 168.A OD1 no hydrogen 2.863 N/A ARG 166.A NH2 ASP 168.A OD2 no hydrogen 2.843 N/A GLU 169.A N GLU 167.A O no hydrogen 2.685 N/A GLY 171.A N ASP 168.A O no hydrogen 2.771 N/A ALA 176.A N GLN 94.A OE1 no hydrogen 2.816 N/A GLY 178.A N GLY 175.A O no hydrogen 2.904 N/A LEU 179.A N GLY 175.A O no hydrogen 2.899 N/A LEU 180.A N ALA 176.A O no hydrogen 2.947 N/A GLY 182.A N GLY 178.A O no hydrogen 2.896 N/A ILE 183.A N LEU 179.A O no hydrogen 2.756 N/A GLY 184.A N LEU 180.A O no hydrogen 2.841 N/A LYS 185.A N LEU 181.A O no hydrogen 2.841 N/A LYS 185.A NZ THR 144.A O no hydrogen 2.989 N/A LEU 186.A N ILE 183.A O no hydrogen 3.016 N/A ARG 187.A N GLY 184.A O no hydrogen 2.738 N/A ARG 187.A NH1 ASP 112.A OD1 no hydrogen 2.710 N/A ARG 187.A NH1 GLN 115.A OE1 no hydrogen 2.762 N/A ARG 187.A NH2 GLY 108.A O no hydrogen 3.496 N/A ARG 187.A NH2 ASP 112.A OD1 no hydrogen 3.160 N/A GLY 188.A N LYS 185.A O no hydrogen 3.228 N/A MET 189.A N GLY 184.A O no hydrogen 2.972 N/A PHE 190.A N ARG 120.A O no hydrogen 2.907 N/A GLY 191.A N THR 144.A OG1 no hydrogen 2.915 N/A ILE 192.A N ILE 122.A O no hydrogen 3.082 N/A SER 193.A N ALA 142.A O no hydrogen 2.678 N/A LEU 194.A N THR 124.A O no hydrogen 2.832 N/A LEU 195.A N LEU 140.A O no hydrogen 2.946 N/A GLY 196.A N GLY 126.A O no hydrogen 2.883 N/A GLU 197.A N ARG 138.A O no hydrogen 2.942 N/A SER 198.A N TYR 128.A O no hydrogen 2.884 N/A SER 198.A OG ASP 204.A OD2 no hydrogen 2.501 N/A ASP 204.A N GLY 27.A O no hydrogen 2.868 N/A LYS 206.A NZ GLU 136.A OE1 no hydrogen 3.222 N/A ALA 207.A N ASP 204.A OD1 no hydrogen 3.267 N/A ALA 208.A N ASP 204.A O no hydrogen 2.937 N/A LYS 209.A N ALA 205.A O no hydrogen 2.890 N/A LYS 209.A NZ ASP 229.A OD1 no hydrogen 2.482 N/A LYS 209.A NZ ASP 229.A OD2 no hydrogen 3.506 N/A ALA 210.A N LYS 206.A O no hydrogen 3.139 N/A VAL 211.A N ALA 207.A O no hydrogen 3.009 N/A LEU 212.A N ALA 208.A O no hydrogen 2.929 N/A SER 213.A N LYS 209.A O no hydrogen 2.792 N/A SER 213.A OG LYS 209.A O no hydrogen 2.741 N/A ALA 214.A N ALA 210.A O no hydrogen 3.235 N/A VAL 215.A N VAL 211.A O no hydrogen 2.951 N/A THR 216.A N LEU 212.A O no hydrogen 2.904 N/A THR 216.A OG1 LEU 212.A O no hydrogen 2.974 N/A LYS 217.A N SER 213.A O no hydrogen 3.040 N/A LYS 217.A NZ GLU 157.A O no hydrogen 2.595 N/A ILE 218.A N ALA 214.A O no hydrogen 3.062 N/A LEU 219.A N VAL 215.A O no hydrogen 2.894 N/A GLY 220.A N LYS 217.A O no hydrogen 3.037 N/A LEU 221.A N THR 216.A O no hydrogen 2.901 N/A THR 226.A N ASP 224.A OD1 no hydrogen 2.904 N/A THR 226.A OG1 ASP 224.A OD1 no hydrogen 3.051 N/A LEU 228.A N MET 225.A O no hydrogen 3.069 N/A ASP 229.A N MET 225.A O no hydrogen 3.031 N/A GLU 230.A N THR 226.A O no hydrogen 2.909 N/A ARG 231.A N ALA 227.A O no hydrogen 3.211 N/A ALA 232.A N LEU 228.A O no hydrogen 2.832 N/A LYS 233.A N ASP 229.A O no hydrogen 3.006 N/A GLU 234.A N GLU 230.A O no hydrogen 3.038 N/A THR 235.A N ARG 231.A O no hydrogen 3.028 N/A GLU 236.A N ALA 232.A O no hydrogen 3.059 N/A GLU 237.A N LYS 233.A O no hydrogen 3.198 N/A ILE 238.A N GLU 234.A O no hydrogen 3.115 N/A LEU 239.A N THR 235.A O no hydrogen 2.966 N/A ARG 240.A N GLU 236.A O no hydrogen 2.972 N/A LYS 241.A N GLU 237.A O no hydrogen 3.041 N/A VAL 242.A N ILE 238.A O no hydrogen 2.797 N/A GLU 243.A N LEU 239.A O no hydrogen 3.061 N/A GLU 244.A N ARG 240.A O no hydrogen 3.348 N/A