Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hk3_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 142.A O no hydrogen 3.366 N/A ILE 1.A N ASN 143.A O no hydrogen 2.898 N/A ILE 1.A N ASP 198.A OD2 no hydrogen 2.736 N/A VAL 2.A N ASP 193.A O no hydrogen 2.976 N/A TRP 5.A N VAL 156.A O no hydrogen 2.895 N/A ALA 7.A N LEU 154.A O no hydrogen 2.915 N/A ILE 11.A N GLU 8.A O no hydrogen 3.093 N/A GLN 15.A N ALA 12.A O no hydrogen 3.025 N/A GLN 15.A NE2 THR 139.A O no hydrogen 3.593 N/A VAL 16.A N ALA 30.A O no hydrogen 2.871 N/A MET 17.A N ARG 62.A O no hydrogen 2.940 N/A LEU 18.A N CYS 28.A O no hydrogen 2.844 N/A PHE 19.A N LEU 60.A O no hydrogen 2.991 N/A ARG 20.A N GLU 25.A O no hydrogen 2.788 N/A ARG 20.A NH1 GLU 25.A OE1 no hydrogen 2.969 N/A LYS 21.A N ASP 58.A O no hydrogen 3.051 N/A GLU 25.A N ARG 20.A O no hydrogen 3.450 N/A LEU 27.A N LEU 18.A O no hydrogen 2.894 N/A CYS 28.A N LEU 18.A O no hydrogen 3.424 N/A CYS 28.A SG LEU 27.A O no hydrogen 2.992 N/A GLY 29.A N SER 199.A O no hydrogen 2.846 N/A SER 31.A N LEU 39.A O no hydrogen 2.838 N/A LEU 32.A N TRP 14.A O no hydrogen 2.677 N/A ILE 33.A N TRP 37.A O no hydrogen 3.034 N/A ARG 36.A N SER 34.A OG no hydrogen 3.227 N/A ARG 36.A NE LEU 105.A O no hydrogen 2.567 N/A ARG 36.A NH2 LEU 105.A O no hydrogen 3.426 N/A TRP 37.A N SER 34.A OG no hydrogen 3.239 N/A VAL 38.A N LEU 103.A O no hydrogen 2.895 N/A LEU 39.A N SER 31.A O no hydrogen 2.765 N/A THR 40.A N ALA 101.A O no hydrogen 2.982 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.962 N/A ALA 41.A N THR 40.A OG1 no hydrogen 2.833 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.828 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.681 N/A HIS 43.A NE2 GLU 196.A OE2 no hydrogen 3.070 N/A CYS 44.A N ALA 41.A O no hydrogen 3.070 N/A ILE 45.A N ALA 42.A O no hydrogen 2.932 N/A LEU 46.A N ALA 42.A O no hydrogen 2.898 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.955 N/A ASP 58.A N THR 55I.A O no hydrogen 3.013 N/A LEU 60.A N PHE 19.A O no hydrogen 2.802 N/A VAL 61.A N SER 79.A O no hydrogen 2.933 N/A ARG 62.A N MET 17.A O no hydrogen 2.850 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 2.782 N/A ARG 62.A NH1 GLU 76.A OE1 no hydrogen 3.322 N/A ARG 62.A NH1 GLU 76.A OE2 no hydrogen 2.914 N/A ILE 63.A N LYS 77.A O no hydrogen 2.846 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.739 N/A LYS 65.A NZ GLU 72.A OE2 no hydrogen 2.812 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.789 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 3.384 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 2.823 N/A SER 67.A N GLU 72.A OE1 no hydrogen 2.813 N/A SER 67.A OG SER 152.A O no hydrogen 3.547 N/A ARG 68.A N SER 152.A O no hydrogen 2.844 N/A ARG 68.A NE PRO 151.A O no hydrogen 2.721 N/A THR 69.A N SER 67.A OG no hydrogen 3.229 N/A ARG 70.A N SER 67.A OG no hydrogen 3.035 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.785 N/A VAL 75.A N GLU 72.A O no hydrogen 3.039 N/A GLU 76.A N GLU 72.A O no hydrogen 2.852 N/A LYS 77.A N ILE 63.A O no hydrogen 2.700 N/A SER 79.A N VAL 61.A O no hydrogen 2.913 N/A SER 79.A OG MET 80.A O no hydrogen 2.771 N/A GLU 82.A N LYS 104.A O no hydrogen 2.728 N/A TYR 85.A N LEU 102.A O no hydrogen 2.788 N/A HIS 87.A N ILE 100.A O no hydrogen 3.260 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 3.034 N/A TYR 90.A N HIS 87.A O no hydrogen 3.081 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.680 N/A ARG 93.A N ASN 91.A OD1 no hydrogen 3.095 N/A ASN 95.A N ASN 91.A O no hydrogen 3.409 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 2.859 N/A ARG 98.A NH1 ARG 89.A O no hydrogen 3.369 N/A ILE 100.A N ARG 98.A O no hydrogen 2.809 N/A ALA 101.A N THR 40.A O no hydrogen 2.964 N/A LEU 102.A N TYR 85.A O no hydrogen 2.803 N/A LEU 103.A N VAL 38.A O no hydrogen 2.798 N/A LYS 104.A N LYS 83.A O no hydrogen 2.908 N/A LYS 104.A NZ GLU 82.A OE1 no hydrogen 2.944 N/A LYS 104.A NZ GLU 82.A OE2 no hydrogen 3.554 N/A LYS 104.A NZ PHE 251.A O no hydrogen 2.758 N/A LEU 105.A N ARG 36.A O no hydrogen 2.849 N/A LYS 106.A N MET 80.A O no hydrogen 3.235 N/A VAL 109.A N ASP 35.A O no hydrogen 2.881 N/A SER 112.A N ILE 115.A O no hydrogen 2.949 N/A TYR 114.A N SER 112.A OG no hydrogen 3.024 N/A ILE 115.A N SER 112.A O no hydrogen 3.458 N/A HIS 116.A N PRO 13.A O no hydrogen 3.167 N/A VAL 118.A N LEU 32.A O no hydrogen 2.976 N/A CYS 119.A N TRP 213.A O no hydrogen 3.138 N/A GLN 124.A N ASP 122.A OD2 no hydrogen 2.924 N/A THR 125.A N ASP 122.A OD2 no hydrogen 3.217 N/A VAL 126.A N ASP 122.A O no hydrogen 3.161 N/A LEU 130.A N VAL 126.A O no hydrogen 2.912 N/A ARG 131.A N LEU 129C.A O no hydrogen 2.746 N/A GLY 133.A N ILE 161.A O no hydrogen 2.750 N/A TYR 134.A N ARG 131.A O no hydrogen 3.058 N/A GLY 136.A N LEU 159.A O no hydrogen 3.048 N/A ARG 137.A N VAL 204.A O no hydrogen 2.704 N/A ARG 137.A NE ASN 158.A OD1 no hydrogen 3.187 N/A VAL 138.A N VAL 157.A O no hydrogen 2.864 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.564 N/A GLY 140.A N GLN 155.A O no hydrogen 3.024 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 3.048 N/A GLY 142.A N ASP 198.A OD1 no hydrogen 2.675 N/A LEU 144.A N ILE 149.A O no hydrogen 2.685 N/A ARG 145.A NH2 GLU 146.A OE2 no hydrogen 3.265 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.615 N/A THR 147.A N ASP 226.A OD1 no hydrogen 2.732 N/A THR 147.A OG1 ASP 226.A OD1 no hydrogen 2.973 N/A THR 147.A OG1 ASP 226.A OD2 no hydrogen 2.892 N/A LEU 154.A N HIS 66.A O no hydrogen 2.746 N/A GLN 155.A N GLY 140.A O no hydrogen 2.920 N/A GLN 155.A NE2 ASP 6.A OD1 no hydrogen 2.907 N/A GLN 155.A NE2 VAL 153.A O no hydrogen 2.925 N/A VAL 156.A N TRP 5.A O no hydrogen 2.787 N/A VAL 157.A N VAL 138.A O no hydrogen 2.969 N/A LEU 159.A N GLY 136.A O no hydrogen 2.839 N/A ILE 161.A N TYR 134.A O no hydrogen 2.787 N/A VAL 162.A N CYS 181.A O no hydrogen 2.935 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.697 N/A ARG 164.A NH1 THR 176.A O no hydrogen 3.065 N/A ARG 164.A NH1 MET 179.A O no hydrogen 3.059 N/A ARG 164.A NH2 MET 179.A O no hydrogen 2.753 N/A CYS 167.A N GLU 163.A O no hydrogen 2.930 N/A LYS 168.A N ARG 164.A O no hydrogen 2.909 N/A ALA 169.A N PRO 165.A O no hydrogen 2.989 N/A SER 170.A N CYS 167.A O no hydrogen 3.192 N/A SER 170.A OG CYS 167.A O no hydrogen 2.870 N/A ILE 173.A N THR 171.A OG1 no hydrogen 3.128 N/A THR 176.A OG1 ASP 97.A OD2 no hydrogen 2.528 N/A ASN 178.A N THR 176.A OG1 no hydrogen 3.101 N/A ASN 178.A ND2 ASP 97.A OD2 no hydrogen 3.038 N/A MET 179.A N THR 176.A O no hydrogen 3.086 N/A PHE 180.A N TYR 234.A O no hydrogen 2.966 N/A ALA 182.A N GLY 232.A O no hydrogen 3.100 N/A GLY 183.A N PRO 160.A O no hydrogen 2.935 N/A LYS 185.A N ASP 188B.A OD2 no hydrogen 2.650 N/A LYS 185.A NZ GLU 163.A OE1 no hydrogen 3.108 N/A ARG 191.A N GLU 3.A OE1 no hydrogen 2.955 N/A ARG 191.A NH1 GLU 3.A OE2 no hydrogen 2.838 N/A ASP 193.A N VAL 2.A O no hydrogen 3.188 N/A ALA 194.A N ASP 193.A OD1 no hydrogen 2.795 N/A CYS 195.A N ASP 198.A OD2 no hydrogen 2.824 N/A CYS 195.A SG ASN 143.A O no hydrogen 3.419 N/A ASP 198.A N CYS 195.A O no hydrogen 2.924 N/A SER 199.A N GLU 196.A O no hydrogen 2.887 N/A SER 199.A OG HIS 43.A NE2 no hydrogen 3.329 N/A SER 199.A OG GLU 196.A O no hydrogen 3.234 N/A SER 199.A OG GLU 196.A OE1 no hydrogen 2.881 N/A SER 199.A OG GLU 196.A OE2 no hydrogen 3.230 N/A GLY 200.A N VAL 219.A O no hydrogen 2.833 N/A GLY 201.A N ASP 198.A O no hydrogen 3.059 N/A PHE 203.A N GLY 217.A O no hydrogen 2.827 N/A VAL 204.A N ARG 137.A O no hydrogen 2.850 N/A MET 205.A N TYR 214.A O no hydrogen 2.860 N/A SER 207.A N ARG 212.A O no hydrogen 2.746 N/A ASN 211.A N SER 207.A O no hydrogen 3.168 N/A TYR 214.A N MET 205.A O no hydrogen 2.835 N/A TYR 214.A OH ASN 210B.A OD1 no hydrogen 2.962 N/A GLN 215.A N CYS 119.A O no hydrogen 2.900 N/A GLN 215.A NE2 SER 31.A OG no hydrogen 2.623 N/A MET 216.A N PHE 203.A O no hydrogen 2.940 N/A GLY 217.A N PHE 203.A O no hydrogen 3.051 N/A ILE 218.A N THR 235.A O no hydrogen 3.089 N/A VAL 219.A N GLY 201.A O no hydrogen 2.926 N/A SER 220.A N PHE 233.A O no hydrogen 2.945 N/A SER 220.A OG ASP 99.A OD2 no hydrogen 2.686 N/A ALA 221.A N PHE 233.A O no hydrogen 2.936 N/A ALA 223.A N ASP 193.A OD1 no hydrogen 3.185 N/A GLY 224.A N ALA 194.A O no hydrogen 2.984 N/A CYS 225.A SG ASN 143.A O no hydrogen 3.183 N/A CYS 225.A SG ARG 145.A O no hydrogen 3.425 N/A LYS 228.A NZ TRP 148.A O no hydrogen 2.678 N/A GLY 229.A N ALA 223.A O no hydrogen 2.945 N/A GLY 232.A N ALA 182.A O no hydrogen 3.047 N/A PHE 233.A N ALA 221.A O no hydrogen 2.778 N/A TYR 234.A N PHE 180.A O no hydrogen 2.823 N/A THR 235.A N ILE 218.A O no hydrogen 2.851 N/A THR 235.A OG1 ASP 99.A O no hydrogen 2.784 N/A HIS 236.A N ASN 178.A O no hydrogen 2.838 N/A VAL 237.A N MET 216.A O no hydrogen 3.012 N/A LEU 240.A N VAL 237.A O no hydrogen 2.968 N/A LYS 241.A N PHE 238.A O no hydrogen 2.951 N/A LYS 241.A NZ PRO 121.A O no hydrogen 2.913 N/A ILE 244.A N LEU 240.A O no hydrogen 3.167 N/A GLN 245.A N LYS 241.A O no hydrogen 2.851 N/A LYS 246.A N ARG 242.A O no hydrogen 2.981 N/A VAL 247.A N TRP 243.A O no hydrogen 3.021 N/A ILE 248.A N ILE 244.A O no hydrogen 3.120 N/A ASP 249.A N GLN 245.A O no hydrogen 2.871 N/A GLN 250.A N LYS 246.A O no hydrogen 2.913 N/A PHE 251.A N VAL 247.A O no hydrogen 2.761 N/A GLY 252.A N ILE 248.A O no hydrogen 2.770 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.777 N/A GLU 94A.A N ASN 91.A O no hydrogen 3.133 N/A THR 127A.A N LYS 123.A O no hydrogen 2.994 N/A THR 127A.A OG1 LYS 123.A O no hydrogen 3.091 N/A THR 127A.A OG1 GLN 124.A O no hydrogen 2.953 N/A PHE 209A.A N SER 207.A OG no hydrogen 3.150 N/A ARG 227A.A N GLY 224.A O no hydrogen 3.336 N/A ARG 227A.A NH1 ARG 227A.A O no hydrogen 2.910 N/A SER 128B.A N GLN 124.A O no hydrogen 2.825 N/A SER 128B.A OG GLN 124.A O no hydrogen 2.945 N/A ASP 188B.A N LYS 185.A O no hydrogen 3.056 N/A ASN 210B.A N SER 207.A OG no hydrogen 3.351 N/A LEU 129C.A N THR 125.A O no hydrogen 2.900 N/A TRP 50D.A N TYR 47A.A O no hydrogen 2.923 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.716 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.103 N/A PHE 54H.A N ILE 45.A O no hydrogen 2.784 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.843 N/A