Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5hkm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ THR 73.A O no hydrogen 3.053 N/A LYS 2.A NZ GLU 26.A OE2 no hydrogen 3.008 N/A ARG 3.A N ASP 6.A OD2 no hydrogen 3.410 N/A ASP 6.A N ARG 3.A O no hydrogen 3.202 N/A PHE 7.A N PRO 4.A O no hydrogen 3.273 N/A LYS 8.A N ARG 25.A O no hydrogen 2.771 N/A GLY 10.A N LEU 23.A O no hydrogen 2.653 N/A LEU 13.A N VAL 21.A O no hydrogen 2.627 N/A THR 20.A N ILE 37.A O no hydrogen 3.125 N/A VAL 21.A N GLY 14.A O no hydrogen 2.779 N/A VAL 22.A N ILE 35.A O no hydrogen 2.786 N/A LEU 23.A N LYS 11.A O no hydrogen 2.808 N/A ALA 24.A N TYR 33.A O no hydrogen 2.771 N/A ARG 25.A N LYS 8.A O no hydrogen 2.817 N/A ARG 25.A NH1 SER 30.A O no hydrogen 2.917 N/A GLU 26.A N ARG 31.A O no hydrogen 2.874 N/A LEU 27.A N ASP 6.A O no hydrogen 2.921 N/A THR 29.A OG1 GLU 26.A OE1 no hydrogen 2.729 N/A SER 30.A OG THR 29.A O no hydrogen 3.012 N/A ARG 31.A N THR 29.A OG1 no hydrogen 3.419 N/A TYR 33.A N ALA 24.A O no hydrogen 2.878 N/A TYR 33.A OH GLU 26.A OE1 no hydrogen 3.077 N/A ALA 34.A N LEU 84.A O no hydrogen 2.819 N/A ILE 35.A N VAL 22.A O no hydrogen 2.769 N/A LYS 36.A N PHE 82.A O no hydrogen 2.981 N/A LYS 36.A NZ GLU 55.A OE1 no hydrogen 3.265 N/A LYS 36.A NZ GLU 55.A OE2 no hydrogen 2.807 N/A ILE 37.A N THR 20.A O no hydrogen 2.951 N/A LEU 38.A N LEU 80.A O no hydrogen 2.971 N/A LYS 40.A N GLU 78.A O no hydrogen 2.852 N/A LYS 40.A NZ GLN 75.A OE1 no hydrogen 2.780 N/A LYS 40.A NZ ASP 76.A O no hydrogen 2.804 N/A ILE 43.A N GLU 39.A O no hydrogen 3.273 N/A ILE 44.A N LYS 40.A O no hydrogen 3.149 N/A LYS 45.A N ARG 41.A O no hydrogen 2.947 N/A GLU 46.A N HIS 42.A O no hydrogen 3.031 N/A ASN 47.A N ILE 44.A O no hydrogen 3.022 N/A LYS 48.A N ILE 43.A O no hydrogen 2.852 N/A VAL 52.A N LYS 48.A O no hydrogen 2.914 N/A VAL 52.A N VAL 49.A O no hydrogen 3.245 N/A THR 53.A N VAL 49.A O no hydrogen 2.984 N/A THR 53.A OG1 VAL 49.A O no hydrogen 2.753 N/A ARG 54.A N PRO 50.A O no hydrogen 3.012 N/A GLU 55.A N TYR 51.A O no hydrogen 3.406 N/A ARG 56.A N VAL 52.A O no hydrogen 3.162 N/A ASP 57.A N THR 53.A O no hydrogen 2.910 N/A VAL 58.A N ARG 54.A O no hydrogen 2.728 N/A MET 59.A N GLU 55.A O no hydrogen 2.812 N/A SER 60.A N ARG 56.A O no hydrogen 3.104 N/A SER 60.A OG ARG 56.A O no hydrogen 3.186 N/A ARG 61.A N VAL 58.A O no hydrogen 3.319 N/A LEU 62.A N MET 59.A O no hydrogen 3.057 N/A ASP 63.A N TYR 120.A OH no hydrogen 2.948 N/A PHE 66.A N HIS 64.A ND1 no hydrogen 3.033 N/A PHE 67.A N HIS 64.A O no hydrogen 3.179 N/A VAL 68.A N ILE 146.A O no hydrogen 3.165 N/A LYS 69.A N SER 85.A OG no hydrogen 2.715 N/A TYR 71.A N GLY 83.A O no hydrogen 2.778 N/A PHE 74.A N TYR 81.A O no hydrogen 2.848 N/A ASP 76.A N LYS 79.A O no hydrogen 3.041 N/A GLU 78.A N ASP 76.A OD1 no hydrogen 2.802 N/A LYS 79.A N ASP 76.A OD1 no hydrogen 3.367 N/A LEU 80.A N LEU 38.A O no hydrogen 2.694 N/A TYR 81.A N PHE 74.A O no hydrogen 2.749 N/A TYR 81.A OH ASP 76.A OD2 no hydrogen 2.703 N/A PHE 82.A N LYS 36.A O no hydrogen 2.942 N/A GLY 83.A N PHE 72.A O no hydrogen 2.763 N/A LEU 84.A N ALA 34.A O no hydrogen 2.828 N/A SER 85.A N LYS 69.A O no hydrogen 3.158 N/A SER 85.A OG LYS 69.A O no hydrogen 3.183 N/A ASN 89.A N LEU 138.A O no hydrogen 2.827 N/A ASN 89.A ND2 ASN 139.A O no hydrogen 2.774 N/A GLY 90.A N ALA 87.A O no hydrogen 2.913 N/A LEU 92.A N ILE 136.A O no hydrogen 2.801 N/A LEU 93.A N PRO 133.A O no hydrogen 3.007 N/A ILE 96.A N LEU 92.A O no hydrogen 3.223 N/A ARG 97.A N LEU 93.A O no hydrogen 2.963 N/A LYS 98.A N LYS 94.A O no hydrogen 2.746 N/A ILE 99.A N TYR 95.A O no hydrogen 3.103 N/A ILE 99.A N ILE 96.A O no hydrogen 3.297 N/A PHE 102.A N LEU 189.A O no hydrogen 2.785 N/A CYS 106.A N ASP 103.A OD1 no hydrogen 2.914 N/A CYS 106.A SG ASP 103.A OD1 no hydrogen 3.355 N/A CYS 106.A SG ASP 103.A OD2 no hydrogen 3.119 N/A CYS 106.A SG LYS 271.A O no hydrogen 3.558 N/A THR 107.A N ASP 103.A O no hydrogen 3.000 N/A THR 107.A OG1 PHE 102.A O no hydrogen 3.567 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.883 N/A ARG 108.A N GLU 104.A O no hydrogen 2.749 N/A ARG 108.A NE PHE 255.A O no hydrogen 2.954 N/A PHE 109.A N THR 105.A O no hydrogen 2.760 N/A TYR 110.A N CYS 106.A O no hydrogen 3.107 N/A TYR 110.A OH MET 142.A O no hydrogen 2.614 N/A THR 111.A N THR 107.A O no hydrogen 2.940 N/A THR 111.A OG1 THR 107.A O no hydrogen 2.717 N/A ALA 112.A N ARG 108.A O no hydrogen 3.022 N/A GLU 113.A N PHE 109.A O no hydrogen 3.171 N/A ILE 114.A N TYR 110.A O no hydrogen 2.971 N/A VAL 115.A N THR 111.A O no hydrogen 2.738 N/A SER 116.A N ALA 112.A O no hydrogen 2.678 N/A ALA 117.A N GLU 113.A O no hydrogen 2.757 N/A LEU 118.A N ILE 114.A O no hydrogen 3.063 N/A LEU 121.A N ALA 117.A O no hydrogen 3.076 N/A HIS 122.A N LEU 118.A O no hydrogen 2.970 N/A HIS 122.A ND1 TYR 247.A OH no hydrogen 2.783 N/A HIS 122.A NE2 ASP 178.A OD2 no hydrogen 2.723 N/A LYS 124.A N LEU 121.A O no hydrogen 2.903 N/A LYS 124.A NZ TYR 120.A OH no hydrogen 3.062 N/A GLY 125.A N HIS 122.A O no hydrogen 3.378 N/A ILE 126.A N LEU 121.A O no hydrogen 3.240 N/A ILE 127.A N LYS 153.A O no hydrogen 2.761 N/A HIS 128.A N ASP 178.A OD2 no hydrogen 3.091 N/A HIS 128.A NE2 THR 147.A O no hydrogen 2.810 N/A ARG 129.A N ASP 178.A OD1 no hydrogen 3.103 N/A ARG 129.A NE THR 151.A O no hydrogen 2.869 N/A ARG 129.A NH2 THR 151.A O no hydrogen 2.771 N/A LYS 132.A NZ THR 159.A OG1 no hydrogen 2.949 N/A ASN 135.A N LYS 132.A O no hydrogen 2.952 N/A ASN 135.A ND2 ASP 148.A OD2 no hydrogen 3.381 N/A LEU 137.A N GLN 145.A O no hydrogen 2.776 N/A LEU 138.A N GLY 90.A O no hydrogen 2.791 N/A ASN 139.A N HIS 143.A O no hydrogen 2.973 N/A MET 142.A N ASN 139.A O no hydrogen 2.798 N/A HIS 143.A N ASN 139.A OD1 no hydrogen 2.871 N/A HIS 143.A ND1 GLU 113.A OE2 no hydrogen 2.806 N/A ILE 144.A N GLU 113.A OE1 no hydrogen 3.194 N/A GLN 145.A N LEU 137.A O no hydrogen 2.762 N/A GLN 145.A NE2 PHE 67.A O no hydrogen 3.636 N/A ILE 146.A N PHE 66.A O no hydrogen 2.757 N/A THR 147.A N ASN 135.A O no hydrogen 2.980 N/A ASP 148.A N THR 147.A OG1 no hydrogen 2.783 N/A ALA 152.A N PHE 149.A O no hydrogen 3.308 N/A LYS 153.A N ILE 127.A O no hydrogen 2.764 N/A LEU 155.A N GLY 125.A O no hydrogen 2.872 N/A THR 159.A N ASP 130.A OD1 no hydrogen 3.071 N/A THR 159.A OG1 ASP 130.A OD1 no hydrogen 3.020 N/A GLN 161.A NE2 PHE 196.A O no hydrogen 3.369 N/A TYR 162.A N THR 159.A O no hydrogen 3.031 N/A TYR 162.A OH GLN 188.A OE1 no hydrogen 2.692 N/A VAL 163.A N ALA 160.A O no hydrogen 3.176 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 3.218 N/A LEU 167.A N SER 164.A O no hydrogen 3.010 N/A LEU 168.A N SER 164.A O no hydrogen 3.314 N/A THR 169.A N GLU 166.A O no hydrogen 3.215 N/A THR 169.A OG1 PRO 165.A O no hydrogen 2.979 N/A THR 169.A OG1 GLU 166.A O no hydrogen 2.851 N/A GLU 170.A N GLU 166.A O no hydrogen 2.859 N/A GLU 170.A N THR 169.A OG1 no hydrogen 2.720 N/A LYS 171.A N GLU 166.A O no hydrogen 3.468 N/A SER 172.A OG GLU 170.A OE1 no hydrogen 3.069 N/A CYS 174.A N SER 177.A OG no hydrogen 3.374 N/A LYS 175.A NZ HIS 122.A O no hydrogen 3.009 N/A LYS 175.A NZ GLU 242.A OE2 no hydrogen 2.811 N/A SER 176.A OG ALA 235.A O no hydrogen 2.996 N/A SER 177.A N CYS 174.A O no hydrogen 2.950 N/A SER 177.A OG GLU 166.A OE2 no hydrogen 3.274 N/A ASP 178.A N LYS 175.A O no hydrogen 2.817 N/A LEU 179.A N LYS 175.A O no hydrogen 3.218 N/A TRP 180.A N SER 176.A O no hydrogen 2.970 N/A ALA 181.A N SER 177.A O no hydrogen 3.195 N/A LEU 182.A N ASP 178.A O no hydrogen 2.836 N/A GLY 183.A N LEU 179.A O no hydrogen 2.876 N/A CYS 184.A N TRP 180.A O no hydrogen 2.837 N/A CYS 184.A SG TRP 180.A O no hydrogen 3.366 N/A ILE 185.A N ALA 181.A O no hydrogen 2.793 N/A ILE 186.A N LEU 182.A O no hydrogen 2.976 N/A ILE 186.A N GLY 183.A O no hydrogen 3.251 N/A TYR 187.A N GLY 183.A O no hydrogen 3.440 N/A TYR 187.A OH ASP 214.A O no hydrogen 2.687 N/A GLN 188.A N CYS 184.A O no hydrogen 3.354 N/A LEU 189.A N ILE 185.A O no hydrogen 3.147 N/A LEU 189.A N ILE 186.A O no hydrogen 2.800 N/A VAL 190.A N ILE 186.A O no hydrogen 3.244 N/A ALA 191.A N TYR 187.A O no hydrogen 2.702 N/A GLY 192.A N GLN 188.A O no hydrogen 3.038 N/A ARG 197.A NH1 PRO 194.A O no hydrogen 2.771 N/A LEU 203.A N ASN 200.A OD1 no hydrogen 2.836 N/A ILE 204.A N ASN 200.A O no hydrogen 3.045 N/A PHE 205.A N GLU 201.A O no hydrogen 2.963 N/A GLN 206.A N TYR 202.A O no hydrogen 3.016 N/A LYS 207.A N LEU 203.A O no hydrogen 2.971 N/A LYS 207.A NZ GLU 212.A OE2 no hydrogen 3.120 N/A ILE 208.A N ILE 204.A O no hydrogen 2.753 N/A ILE 209.A N PHE 205.A O no hydrogen 3.099 N/A LEU 211.A N ILE 208.A O no hydrogen 2.802 N/A GLU 212.A N LYS 207.A O no hydrogen 2.761 N/A TYR 213.A N LEU 211.A O no hydrogen 3.158 N/A ARG 224.A N PHE 220.A O no hydrogen 2.786 N/A ARG 224.A NE GLU 228.A OE2 no hydrogen 2.815 N/A ARG 224.A NH2 GLU 228.A OE2 no hydrogen 3.510 N/A ASP 225.A N PRO 221.A O no hydrogen 2.885 N/A LEU 226.A N LYS 222.A O no hydrogen 2.999 N/A VAL 227.A N ALA 223.A O no hydrogen 2.838 N/A GLU 228.A N ARG 224.A O no hydrogen 2.809 N/A LYS 229.A N LEU 226.A O no hydrogen 3.204 N/A LEU 230.A N LEU 226.A O no hydrogen 3.224 N/A LEU 230.A N VAL 227.A O no hydrogen 3.073 N/A LEU 231.A N VAL 227.A O no hydrogen 2.937 N/A THR 236.A N ASP 234.A OD1 no hydrogen 2.956 N/A THR 236.A OG1 ASP 234.A OD1 no hydrogen 2.736 N/A LYS 237.A N ASP 234.A O no hydrogen 3.166 N/A ARG 238.A NE VAL 232.A O no hydrogen 3.066 N/A ARG 238.A NH1 GLU 166.A OE1 no hydrogen 3.023 N/A ARG 238.A NH1 GLU 166.A OE2 no hydrogen 2.763 N/A ARG 238.A NH1 SER 176.A O no hydrogen 2.740 N/A ARG 238.A NH2 GLU 166.A OE1 no hydrogen 2.825 N/A ARG 238.A NH2 VAL 232.A O no hydrogen 2.776 N/A LEU 239.A N LYS 229.A O no hydrogen 3.373 N/A CYS 241.A N ARG 238.A O no hydrogen 2.861 N/A CYS 241.A SG ALA 235.A O no hydrogen 3.855 N/A CYS 241.A SG THR 236.A O no hydrogen 3.371 N/A CYS 241.A SG ARG 238.A O no hydrogen 3.162 N/A CYS 241.A SG GLU 243.A OE1 no hydrogen 3.292 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 3.001 N/A MET 244.A N CYS 241.A O no hydrogen 2.994 N/A GLU 245.A N GLU 242.A O no hydrogen 3.301 N/A GLY 246.A N CYS 241.A O no hydrogen 2.787 N/A TYR 247.A OH HIS 122.A ND1 no hydrogen 2.783 N/A LYS 251.A N TYR 247.A O no hydrogen 2.739 N/A LYS 251.A NZ GLU 119.A OE1 no hydrogen 3.485 N/A LYS 251.A NZ GLU 119.A OE2 no hydrogen 3.206 N/A ALA 252.A N GLY 248.A O no hydrogen 2.830 N/A HIS 253.A N LEU 250.A O no hydrogen 3.354 N/A HIS 253.A NE2 ASP 225.A OD2 no hydrogen 2.834 N/A PHE 255.A N HIS 253.A ND1 no hydrogen 3.037 N/A PHE 256.A N HIS 253.A O no hydrogen 2.965 N/A GLU 257.A N PRO 254.A O no hydrogen 2.751 N/A VAL 259.A N PHE 256.A O no hydrogen 2.958 N/A GLN 266.A N ASN 263.A O no hydrogen 2.735 N/A GLN 267.A N LEU 264.A O no hydrogen 3.077 N/A GLN 267.A NE2 ASN 263.A OD1 no hydrogen 3.219 N/A