Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fkp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N CYS 94.A O no hydrogen 2.773 N/A ARG 6.A N TRP 26.A O no hydrogen 2.915 N/A CYS 7.A N ALA 92.A O no hydrogen 2.643 N/A LEU 8.A N VAL 24.A O no hydrogen 2.843 N/A GLN 9.A N LEU 90.A O no hydrogen 2.891 N/A GLN 9.A NE2 SER 11.A OG no hydrogen 2.858 N/A MET 10.A N ASP 22.A O no hydrogen 2.860 N/A SER 11.A N ILE 88.A O no hydrogen 2.834 N/A SER 11.A OG THR 21.A OG1 no hydrogen 2.906 N/A SER 12.A N ARG 20.A O no hydrogen 2.838 N/A SER 12.A OG GLU 87.A OE1 no hydrogen 2.662 N/A SER 12.A OG GLU 87.A OE2 no hydrogen 3.432 N/A PHE 13.A N ILE 86.A O no hydrogen 2.807 N/A ALA 14.A N TRP 18.A O no hydrogen 3.046 N/A SER 17.A N ASN 15.A OD1 no hydrogen 3.109 N/A ARG 20.A N SER 12.A O no hydrogen 3.003 N/A ARG 20.A NE ASP 22.A OD2 no hydrogen 2.830 N/A ARG 20.A NH2 ASP 22.A OD1 no hydrogen 3.071 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 3.437 N/A THR 21.A N ASN 37.A OD1 no hydrogen 2.862 N/A THR 21.A OG1 SER 11.A OG no hydrogen 2.906 N/A ASP 22.A N MET 10.A O no hydrogen 2.914 N/A SER 23.A N TRP 35.A O no hydrogen 2.909 N/A VAL 24.A N LEU 8.A O no hydrogen 2.983 N/A VAL 25.A N HIS 33.A O no hydrogen 3.002 N/A TRP 26.A N ARG 6.A O no hydrogen 2.873 N/A LEU 27.A N LEU 30.A O no hydrogen 2.843 N/A GLY 28.A N THR 4.A O no hydrogen 2.973 N/A LEU 30.A N LEU 27.A O no hydrogen 3.124 N/A GLN 31.A NE2 HIS 33.A O no hydrogen 3.077 N/A THR 32.A N VAL 25.A O no hydrogen 2.796 N/A THR 32.A OG1 VAL 25.A O no hydrogen 3.320 N/A THR 32.A OG1 HIS 33.A ND1 no hydrogen 2.747 N/A HIS 33.A N VAL 25.A O no hydrogen 3.456 N/A HIS 33.A ND1 THR 32.A OG1 no hydrogen 2.747 N/A HIS 33.A NE2 SER 49.A O no hydrogen 2.719 N/A ARG 34.A N SER 43.A O no hydrogen 3.061 N/A TRP 35.A N SER 23.A O no hydrogen 2.785 N/A ASN 37.A N ASP 22.A OD1 no hydrogen 2.750 N/A ASP 38.A N SER 36.A OG no hydrogen 3.210 N/A SER 39.A N SER 36.A O no hydrogen 3.229 N/A THR 41.A OG1 ILE 42.A O no hydrogen 3.570 N/A THR 41.A OG1 GLN 62.A OE1 no hydrogen 2.382 N/A ILE 42.A N GLN 62.A OE1 no hydrogen 2.744 N/A SER 43.A N ARG 34.A O no hydrogen 2.852 N/A THR 45.A N THR 32.A O no hydrogen 3.093 N/A THR 45.A OG1 GLN 31.A O no hydrogen 2.769 N/A LYS 46.A N SER 49.A OG no hydrogen 3.013 N/A LYS 46.A NZ GLN 31.A O no hydrogen 2.751 N/A LYS 46.A NZ THR 45.A O no hydrogen 3.300 N/A LYS 46.A NZ GLU 229.A OE2 no hydrogen 2.647 N/A TRP 48.A NE1 ASP 170.A OD2 no hydrogen 2.723 N/A SER 49.A N LYS 46.A O no hydrogen 3.421 N/A SER 49.A OG THR 32.A O no hydrogen 2.539 N/A SER 49.A OG LYS 46.A O no hydrogen 3.218 N/A GLN 50.A NE2 LEU 53.A O no hydrogen 3.009 N/A GLN 50.A NE2 ASN 55.A OD1 no hydrogen 2.785 N/A GLY 51.A N TRP 48.A O no hydrogen 3.019 N/A LEU 53.A N GLN 50.A O no hydrogen 3.085 N/A SER 54.A N GLN 57.A OE1 no hydrogen 2.939 N/A SER 54.A OG GLN 57.A OE1 no hydrogen 2.578 N/A GLN 57.A N SER 54.A OG no hydrogen 3.252 N/A TRP 58.A N SER 54.A O no hydrogen 2.922 N/A GLU 59.A N ASN 55.A O no hydrogen 2.840 N/A LYS 60.A N GLN 56.A O no hydrogen 3.105 N/A LEU 61.A N GLN 57.A O no hydrogen 3.014 N/A GLN 62.A N TRP 58.A O no hydrogen 2.862 N/A HIS 63.A N GLU 59.A O no hydrogen 2.987 N/A MET 64.A N LYS 60.A O no hydrogen 2.746 N/A PHE 65.A N LEU 61.A O no hydrogen 2.936 N/A GLN 66.A N GLN 62.A O no hydrogen 2.894 N/A GLN 66.A NE2 ALA 40.A O no hydrogen 2.648 N/A VAL 67.A N HIS 63.A O no hydrogen 3.137 N/A TYR 68.A N MET 64.A O no hydrogen 2.994 N/A TYR 68.A OH GLN 9.A OE1 no hydrogen 2.706 N/A ARG 69.A N PHE 65.A O no hydrogen 2.828 N/A ARG 69.A NH1 SER 36.A O no hydrogen 2.884 N/A ARG 69.A NH1 SER 39.A O no hydrogen 3.366 N/A ARG 69.A NH2 SER 39.A O no hydrogen 2.920 N/A VAL 70.A N GLN 66.A O no hydrogen 3.397 N/A SER 71.A N VAL 67.A O no hydrogen 2.830 N/A SER 71.A OG VAL 67.A O no hydrogen 2.705 N/A PHE 72.A N TYR 68.A O no hydrogen 2.682 N/A THR 73.A N ARG 69.A O no hydrogen 3.170 N/A THR 73.A OG1 ARG 69.A O no hydrogen 2.914 N/A ARG 74.A N VAL 70.A O no hydrogen 3.072 N/A ASP 75.A N SER 71.A O no hydrogen 3.041 N/A ILE 76.A N PHE 72.A O no hydrogen 3.062 N/A GLN 77.A N THR 73.A O no hydrogen 3.132 N/A GLN 77.A NE2 ASN 15.A O no hydrogen 3.163 N/A GLU 78.A N ARG 74.A O no hydrogen 3.014 N/A LEU 79.A N ASP 75.A O no hydrogen 2.872 N/A VAL 80.A N ILE 76.A O no hydrogen 2.904 N/A LYS 81.A N GLN 77.A O no hydrogen 3.218 N/A MET 82.A N GLU 78.A O no hydrogen 3.075 N/A TYR 84.A OH GLN 77.A OE1 no hydrogen 2.509 N/A ILE 86.A N PHE 13.A O no hydrogen 2.830 N/A GLU 87.A N GLN 109.A OE1 no hydrogen 2.835 N/A ILE 88.A N SER 11.A O no hydrogen 2.881 N/A GLN 89.A N ALA 107.A O no hydrogen 2.949 N/A LEU 90.A N GLN 9.A O no hydrogen 2.975 N/A SER 91.A N HIS 105.A O no hydrogen 2.889 N/A ALA 92.A N CYS 7.A O no hydrogen 2.994 N/A GLY 93.A N PHE 103.A O no hydrogen 3.061 N/A CYS 94.A N PHE 5.A O no hydrogen 3.003 N/A GLU 95.A N GLU 101.A O no hydrogen 2.837 N/A MET 96.A N TYR 3.A O no hydrogen 2.777 N/A TYR 97.A N ALA 99.A O no hydrogen 2.948 N/A GLU 101.A N GLU 95.A O no hydrogen 3.074 N/A SER 102.A OG LEU 152.A O no hydrogen 2.644 N/A PHE 103.A N GLY 93.A O no hydrogen 2.985 N/A HIS 105.A N SER 91.A O no hydrogen 2.816 N/A VAL 106.A N VAL 114.A O no hydrogen 2.826 N/A ALA 107.A N GLN 89.A O no hydrogen 2.783 N/A PHE 108.A N LYS 111.A O no hydrogen 2.844 N/A GLN 109.A N GLU 87.A O no hydrogen 2.864 N/A GLN 109.A NE2 PRO 85.A O no hydrogen 3.042 N/A LYS 111.A N PHE 108.A O no hydrogen 3.091 N/A VAL 113.A N VAL 106.A O no hydrogen 2.894 N/A VAL 114.A N VAL 106.A O no hydrogen 3.315 N/A ARG 115.A N GLN 122.A O no hydrogen 2.938 N/A PHE 116.A N LEU 104.A O no hydrogen 3.042 N/A TRP 117.A N SER 120.A O no hydrogen 2.887 N/A SER 120.A N TRP 117.A O no hydrogen 3.352 N/A SER 120.A OG TRP 121.A O no hydrogen 3.555 N/A TRP 121.A N ASN 139.A OD1 no hydrogen 2.765 N/A GLN 122.A N ARG 115.A O no hydrogen 2.817 N/A VAL 124.A N VAL 113.A O no hydrogen 2.919 N/A ALA 127.A N VAL 124.A O no hydrogen 2.974 N/A LEU 131.A N PRO 128.A O no hydrogen 3.155 N/A ASP 132.A N SER 129.A O no hydrogen 3.145 N/A ILE 135.A N LEU 131.A O no hydrogen 3.004 N/A LYS 136.A N ASP 132.A O no hydrogen 2.915 N/A VAL 137.A N LEU 133.A O no hydrogen 2.976 N/A LEU 138.A N PRO 134.A O no hydrogen 2.921 N/A ASN 139.A N ILE 135.A O no hydrogen 2.935 N/A ASN 139.A ND2 TRP 121.A O no hydrogen 2.791 N/A ALA 140.A N LYS 136.A O no hydrogen 3.159 N/A ALA 140.A N VAL 137.A O no hydrogen 3.302 N/A ASP 141.A N LEU 138.A O no hydrogen 3.261 N/A THR 144.A OG1 ASP 141.A OD2 no hydrogen 2.138 N/A SER 145.A N ASP 141.A O no hydrogen 3.230 N/A SER 145.A OG THR 119.A O no hydrogen 2.652 N/A ALA 146.A N GLN 142.A O no hydrogen 2.849 N/A THR 147.A N GLY 143.A O no hydrogen 3.005 N/A THR 147.A OG1 GLY 143.A O no hydrogen 3.118 N/A VAL 148.A N THR 144.A O no hydrogen 2.875 N/A GLN 149.A N SER 145.A O no hydrogen 2.886 N/A GLN 149.A NE2 SER 145.A O no hydrogen 3.442 N/A GLN 149.A NE2 SER 145.A OG no hydrogen 3.140 N/A MET 150.A N ALA 146.A O no hydrogen 2.749 N/A LEU 151.A N THR 147.A O no hydrogen 2.922 N/A LEU 152.A N VAL 148.A O no hydrogen 2.928 N/A ASN 153.A N GLN 149.A O no hydrogen 2.840 N/A ASP 154.A N MET 150.A O no hydrogen 3.048 N/A THR 155.A N MET 150.A O no hydrogen 2.928 N/A THR 155.A OG1 MET 150.A O no hydrogen 3.177 N/A CYS 156.A N LEU 151.A O no hydrogen 2.896 N/A LEU 158.A N ASP 154.A O no hydrogen 3.268 N/A PHE 159.A N THR 155.A O no hydrogen 3.012 N/A VAL 160.A N CYS 156.A O no hydrogen 2.922 N/A ARG 161.A N PRO 157.A O no hydrogen 3.057 N/A GLY 162.A N LEU 158.A O no hydrogen 3.268 N/A LEU 163.A N PHE 159.A O no hydrogen 2.935 N/A LEU 164.A N VAL 160.A O no hydrogen 2.929 N/A GLU 165.A N ARG 161.A O no hydrogen 3.277 N/A ALA 166.A N GLY 162.A O no hydrogen 2.974 N/A GLY 167.A N LEU 163.A O no hydrogen 2.831 N/A LYS 168.A NZ GLU 172.A OE1 no hydrogen 3.281 N/A LYS 168.A NZ GLU 172.A OE2 no hydrogen 2.973 N/A LEU 171.A N GLY 167.A O no hydrogen 2.836 N/A GLU 172.A N LYS 168.A O no hydrogen 2.810 N/A LYS 173.A N ASP 170.A O no hydrogen 3.217 N/A LYS 173.A NZ GLU 229.A O no hydrogen 2.804 N/A GLU 175.A N TYR 200.A O no hydrogen 2.839 N/A VAL 178.A N SER 197.A O no hydrogen 2.845 N/A TRP 180.A N HIS 195.A O no hydrogen 2.985 N/A SER 182.A N VAL 193.A O no hydrogen 2.926 N/A SER 182.A OG HIS 195.A NE2 no hydrogen 2.845 N/A VAL 184.A N GLN 191.A O no hydrogen 2.941 N/A SER 186.A N HIS 189.A O no hydrogen 2.927 N/A SER 186.A OG ASP 238.A OD1.B no hydrogen 2.628 N/A SER 186.A OG ASP 238.A OD2.A no hydrogen 3.382 N/A ARG 190.A N VAL 239.A O.A no hydrogen 2.887 N/A ARG 190.A N VAL 239.A O.B no hydrogen 2.906 N/A GLN 191.A N VAL 184.A O no hydrogen 2.664 N/A GLN 191.A NE2 ASP 238.A OD1.A no hydrogen 3.037 N/A LEU 192.A N LEU 237.A O no hydrogen 2.845 N/A VAL 193.A N SER 182.A O no hydrogen 2.804 N/A CYS 194.A N ALA 235.A O no hydrogen 2.851 N/A HIS 195.A N TRP 180.A O no hydrogen 2.817 N/A HIS 195.A ND1 TYR 232.A OH no hydrogen 2.737 N/A HIS 195.A NE2 SER 182.A OG no hydrogen 2.845 N/A VAL 196.A N LEU 233.A O no hydrogen 2.775 N/A SER 197.A N VAL 178.A O no hydrogen 2.843 N/A GLY 198.A N TRP 231.A O no hydrogen 2.805 N/A PHE 199.A N TRP 231.A O no hydrogen 3.417 N/A TYR 200.A N GLU 175.A O no hydrogen 3.057 N/A TYR 200.A OH ASP 29.A OD1 no hydrogen 2.550 N/A TRP 205.A N LYS 252.A O no hydrogen 3.082 N/A MET 207.A N ARG 250.A O no hydrogen 3.015 N/A TRP 208.A N THR 218.A OG1 no hydrogen 3.065 N/A TRP 208.A NE1 ALA 235.A O no hydrogen 3.153 N/A MET 209.A N ALA 248.A O no hydrogen 2.734 N/A ARG 210.A N GLN 213.A O no hydrogen 2.911 N/A ARG 210.A NH1 GLU 243.A O no hydrogen 2.878 N/A ARG 210.A NH2 GLU 243.A O no hydrogen 2.767 N/A GLN 213.A N ARG 210.A O no hydrogen 3.041 N/A GLN 215.A N TRP 208.A O no hydrogen 2.778 N/A THR 218.A N GLN 215.A O no hydrogen 2.973 N/A THR 218.A OG1 GLN 215.A O no hydrogen 2.751 N/A HIS 219.A N THR 236.A O no hydrogen 2.793 N/A ARG 220.A NE VAL 206.A O no hydrogen 3.378 N/A ARG 220.A NH2 VAL 206.A O no hydrogen 2.457 N/A GLY 221.A N GLN 234.A O no hydrogen 2.777 N/A LEU 224.A N TYR 232.A O no hydrogen 2.850 N/A ASN 226.A N THR 230.A O no hydrogen 2.935 N/A ASN 226.A ND2 SER 197.A OG no hydrogen 3.089 N/A ASN 226.A ND2 THR 230.A OG1 no hydrogen 3.088 N/A THR 230.A OG1 ASP 228.A OD1 no hydrogen 2.676 N/A TRP 231.A N PHE 199.A O no hydrogen 2.880 N/A TRP 231.A NE1 ASP 29.A OD2 no hydrogen 2.966 N/A TYR 232.A N LEU 224.A O no hydrogen 2.824 N/A TYR 232.A OH HIS 195.A ND1 no hydrogen 2.737 N/A TYR 232.A OH GLN 234.A OE1 no hydrogen 2.886 N/A LEU 233.A N VAL 196.A O no hydrogen 2.880 N/A ALA 235.A N CYS 194.A O no hydrogen 2.898 N/A THR 236.A N HIS 219.A O no hydrogen 2.937 N/A LEU 237.A N LEU 192.A O no hydrogen 2.870 N/A VAL 239.A N.A ARG 190.A O no hydrogen 2.737 N/A VAL 239.A N.B ARG 190.A O no hydrogen 2.808 N/A GLY 242.A N GLU 244.A OE1.A no hydrogen 2.789 N/A GLU 243.A N GLU 240.A O no hydrogen 3.059 N/A GLU 244.A N.A GLU 244.A OE1.A no hydrogen 3.066 N/A LEU 247.A N GLU 244.A O.A no hydrogen 3.358 N/A LEU 247.A N GLU 244.A O.B no hydrogen 3.436 N/A ALA 248.A N MET 209.A O no hydrogen 2.985 N/A CYS 249.A N LEU 263.A O no hydrogen 2.811 N/A ARG 250.A N MET 207.A O no hydrogen 2.845 N/A ARG 250.A NE ASP 260.A OD2 no hydrogen 2.723 N/A ARG 250.A NH2 ASP 260.A OD2 no hydrogen 2.913 N/A VAL 251.A N ILE 261.A O no hydrogen 2.858 N/A LYS 252.A N TRP 205.A O no hydrogen 2.877 N/A LYS 252.A NZ ASP 260.A OD2 no hydrogen 2.636 N/A HIS 253.A ND1 SER 255.A OG no hydrogen 2.712 N/A HIS 253.A NE2 PRO 201.A O no hydrogen 2.841 N/A SER 254.A OG GLN 174.A OE1 no hydrogen 2.669 N/A SER 255.A N HIS 253.A ND1 no hydrogen 3.231 N/A SER 255.A OG GLU 175.A O no hydrogen 3.450 N/A SER 255.A OG HIS 253.A ND1 no hydrogen 2.712 N/A LEU 256.A N HIS 253.A O no hydrogen 3.002 N/A GLN 259.A N LEU 256.A O no hydrogen 3.144 N/A ILE 261.A N VAL 251.A O no hydrogen 3.036 N/A LEU 263.A N CYS 249.A O no hydrogen 2.948 N/A TRP 265.A N LEU 247.A O no hydrogen 2.929 N/A TRP 265.A NE1 GLU 244.A OE1.B no hydrogen 2.881 N/A