Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kh8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASN 2.A OD1 no hydrogen 3.011 N/A ILE 6.A N ASN 2.A O no hydrogen 3.215 N/A LEU 7.A N VAL 3.A O no hydrogen 2.927 N/A ASN 8.A N ASP 4.A O no hydrogen 3.188 N/A ASN 8.A N LYS 5.A O no hydrogen 3.114 N/A SER 9.A N ILE 6.A O no hydrogen 3.288 N/A ALA 12.A N THR 111.A O no hydrogen 2.941 N/A TYR 14.A N GLY 109.A O no hydrogen 2.852 N/A ALA 16.A N LEU 107.A O no hydrogen 2.840 N/A THR 17.A N GLY 59.A O no hydrogen 2.993 N/A THR 17.A OG1 THR 106.A OG1 no hydrogen 3.097 N/A TYR 18.A N GLY 105.A O no hydrogen 3.127 N/A TYR 18.A OH ASP 101.A O no hydrogen 2.662 N/A ASN 19.A N ASP 22.A OD2 no hydrogen 2.797 N/A GLN 20.A NE2 PRO 102.A O no hydrogen 3.131 N/A ASP 22.A N ASN 19.A OD1 no hydrogen 2.964 N/A LEU 23.A N ASN 19.A O no hydrogen 3.344 N/A LEU 24.A N GLN 20.A O no hydrogen 3.096 N/A MET 25.A N ARG 21.A O no hydrogen 2.893 N/A TYR 26.A N ASP 22.A O no hydrogen 2.993 N/A ALA 27.A N LEU 23.A O no hydrogen 2.991 N/A VAL 28.A N LEU 24.A O no hydrogen 3.039 N/A GLY 29.A N MET 25.A O no hydrogen 2.978 N/A ILE 30.A N TYR 26.A O no hydrogen 2.967 N/A GLY 31.A N VAL 28.A O no hydrogen 3.009 N/A GLU 32.A N ALA 27.A O no hydrogen 2.903 N/A SER 33.A N GLU 32.A OE2 no hydrogen 3.061 N/A ASP 34.A N GLU 32.A OE2 no hydrogen 2.910 N/A GLN 36.A N ASP 34.A OD1 no hydrogen 2.958 N/A GLN 36.A NE2 LYS 44.A O no hydrogen 3.262 N/A GLN 36.A NE2 GLY 233.A O no hydrogen 2.861 N/A PHE 37.A N ASP 34.A O no hydrogen 2.847 N/A THR 38.A N ASP 34.A O no hydrogen 3.028 N/A THR 38.A OG1 SER 33.A O no hydrogen 3.138 N/A THR 38.A OG1 ASP 34.A O no hydrogen 3.149 N/A TYR 39.A N LEU 35.A O no hydrogen 3.010 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.664 N/A ASP 42.A N TYR 39.A O no hydrogen 2.947 N/A LYS 44.A N ASP 42.A OD2 no hydrogen 2.889 N/A PHE 45.A N ASP 42.A O no hydrogen 3.018 N/A SER 46.A N GLN 36.A O no hydrogen 2.983 N/A SER 46.A OG LYS 44.A O no hydrogen 2.866 N/A TYR 51.A N PHE 48.A O no hydrogen 2.918 N/A VAL 53.A N LEU 50.A O no hydrogen 3.102 N/A CYS 54.A N TYR 51.A O no hydrogen 2.844 N/A CYS 54.A SG TYR 187.A OH no hydrogen 3.896 N/A LEU 55.A N PRO 52.A O no hydrogen 3.028 N/A PHE 57.A N CYS 54.A O no hydrogen 2.997 N/A LYS 58.A N CYS 54.A O no hydrogen 3.000 N/A LYS 58.A NZ THR 17.A O no hydrogen 2.688 N/A LYS 58.A NZ ASP 22.A OD2 no hydrogen 3.411 N/A LYS 58.A NZ SER 61.A O no hydrogen 2.696 N/A GLY 59.A N LEU 55.A O no hydrogen 2.849 N/A GLN 60.A NE2 THR 17.A OG1 no hydrogen 2.869 N/A SER 61.A N LYS 58.A O no hydrogen 3.015 N/A SER 61.A OG ASP 63.A O no hydrogen 3.281 N/A GLN 62.A NE2 ASP 22.A OD2 no hydrogen 3.271 N/A ASP 63.A N SER 61.A OG no hydrogen 2.967 N/A VAL 64.A N ASP 63.A OD1 no hydrogen 2.734 N/A THR 71.A OG1 PRO 56.A O no hydrogen 3.271 N/A ILE 72.A N PRO 69.A O no hydrogen 2.983 N/A SER 73.A N PRO 69.A O no hydrogen 3.095 N/A SER 73.A OG PRO 69.A O no hydrogen 3.563 N/A ASP 77.A N SER 9.A OG no hydrogen 3.254 N/A ALA 85.A N ASN 83.A O no hydrogen 2.589 N/A LEU 88.A N PHE 146.A O no hydrogen 2.978 N/A HIS 89.A NE2 GLN 92.A OE1 no hydrogen 2.975 N/A GLY 90.A N GLY 144.A O no hydrogen 2.751 N/A GLU 91.A N GLY 144.A O no hydrogen 3.066 N/A GLN 92.A N VAL 243.A O no hydrogen 3.119 N/A GLN 92.A NE2 SER 93.A O no hydrogen 3.194 N/A SER 93.A N ILE 142.A O no hydrogen 2.781 N/A VAL 94.A N ILE 241.A O no hydrogen 2.737 N/A GLU 95.A N LYS 140.A O no hydrogen 2.798 N/A ILE 96.A N LYS 239.A O no hydrogen 2.842 N/A LEU 97.A N VAL 138.A O no hydrogen 2.780 N/A ARG 98.A N VAL 138.A O no hydrogen 3.042 N/A ARG 98.A NH2 ASP 133.A OD1 no hydrogen 2.613 N/A ARG 98.A NH2 GLY 136.A O no hydrogen 3.007 N/A SER 103.A N ASP 101.A OD1 no hydrogen 3.007 N/A SER 103.A OG ASP 101.A OD1 no hydrogen 2.792 N/A SER 103.A OG ASP 101.A OD2 no hydrogen 3.456 N/A GLY 104.A N ASP 101.A O no hydrogen 3.204 N/A GLY 105.A N TYR 18.A O no hydrogen 3.060 N/A THR 106.A OG1 THR 17.A OG1 no hydrogen 3.097 N/A LEU 107.A N ALA 16.A O no hydrogen 2.726 N/A THR 108.A N GLU 132.A O no hydrogen 2.756 N/A GLY 109.A N TYR 14.A O no hydrogen 2.731 N/A LYS 110.A N GLN 130.A O no hydrogen 2.848 N/A THR 111.A N ALA 12.A O no hydrogen 2.876 N/A THR 111.A OG1 GLN 128.A O no hydrogen 3.471 N/A LYS 112.A N GLN 128.A O no hydrogen 2.935 N/A LYS 112.A NZ LEU 7.A O no hydrogen 2.806 N/A LYS 112.A NZ SER 9.A O no hydrogen 3.092 N/A ILE 114.A N GLU 126.A O no hydrogen 2.862 N/A SER 115.A N GLU 126.A O no hydrogen 3.469 N/A SER 115.A OG GLU 126.A OE1 no hydrogen 2.916 N/A PHE 116.A N LYS 156.A O no hydrogen 2.786 N/A TYR 117.A N LEU 124.A O no hydrogen 2.943 N/A TYR 117.A OH ARG 158.A O no hydrogen 2.674 N/A LYS 119.A N GLY 122.A O no hydrogen 2.697 N/A GLY 120.A N ASP 118.A OD1 no hydrogen 2.934 N/A THR 123.A N ILE 147.A O no hydrogen 2.707 N/A THR 123.A OG1 LEU 150.A O no hydrogen 2.537 N/A THR 123.A OG1 TYR 153.A OH no hydrogen 2.670 N/A LEU 124.A N TYR 117.A O no hydrogen 2.918 N/A MET 125.A N SER 145.A O no hydrogen 2.795 N/A GLU 126.A N SER 115.A O no hydrogen 3.050 N/A THR 127.A N SER 143.A O no hydrogen 2.787 N/A GLN 128.A N LYS 112.A O no hydrogen 2.815 N/A THR 129.A N LEU 141.A O no hydrogen 2.727 N/A GLN 130.A N LYS 110.A O no hydrogen 2.847 N/A PHE 131.A N ALA 139.A O no hydrogen 2.770 N/A GLU 132.A N THR 108.A O no hydrogen 3.009 N/A ASP 133.A N GLY 136.A O no hydrogen 3.062 N/A ASN 135.A N ASP 133.A OD1 no hydrogen 2.959 N/A GLY 136.A N ASP 133.A O no hydrogen 3.072 N/A VAL 138.A N PHE 131.A O no hydrogen 2.749 N/A ALA 139.A N PHE 131.A O no hydrogen 3.269 N/A LYS 140.A N GLU 95.A O no hydrogen 2.854 N/A LEU 141.A N THR 129.A O no hydrogen 2.724 N/A ILE 142.A N SER 93.A O no hydrogen 2.953 N/A SER 143.A N THR 127.A O no hydrogen 2.846 N/A SER 143.A OG HIS 89.A NE2 no hydrogen 3.203 N/A GLY 144.A N GLU 91.A O no hydrogen 2.775 N/A SER 145.A N MET 125.A O no hydrogen 2.774 N/A PHE 146.A N LEU 88.A O no hydrogen 2.832 N/A ILE 147.A N THR 123.A O no hydrogen 2.712 N/A ARG 148.A N MET 86.A O no hydrogen 3.128 N/A GLY 149.A N LYS 121.A O no hydrogen 3.087 N/A THR 151.A OG1 GLY 149.A O no hydrogen 3.114 N/A GLY 152.A N ASP 118.A OD2 no hydrogen 3.115 N/A TYR 153.A OH THR 123.A OG1 no hydrogen 2.670 N/A LYS 156.A N PHE 116.A O no hydrogen 3.157 N/A LYS 156.A NZ ASP 4.A OD1 no hydrogen 2.911 N/A ARG 158.A N SER 115.A OG no hydrogen 2.982 N/A ARG 158.A NE GLU 126.A OE1 no hydrogen 2.809 N/A ARG 158.A NH2 GLU 126.A OE2 no hydrogen 2.883 N/A ARG 169.A NH1 ASP 172.A OD1 no hydrogen 2.635 N/A ARG 169.A NH1 ASP 172.A OD2 no hydrogen 3.191 N/A ARG 169.A NH2 ASP 172.A OD2 no hydrogen 2.890 N/A ARG 169.A NH2 GLU 262.A OE2 no hydrogen 2.909 N/A ASP 172.A N MET 259.A O no hydrogen 2.785 N/A PHE 173.A N MET 259.A O no hydrogen 3.003 N/A ASP 175.A N THR 257.A O no hydrogen 3.122 N/A GLU 176.A N ASP 175.A OD1 no hydrogen 2.867 N/A PHE 177.A N ILE 255.A O no hydrogen 2.902 N/A LYS 178.A NZ THR 179.A O no hydrogen 3.020 N/A LYS 178.A NZ GLY 252.A O no hydrogen 3.009 N/A THR 179.A N GLU 253.A O no hydrogen 3.153 N/A THR 179.A OG1 GLU 253.A O no hydrogen 2.661 N/A HIS 182.A N SER 180.A OG no hydrogen 2.934 N/A GLN 183.A N SER 180.A O no hydrogen 3.036 N/A GLN 185.A N HIS 182.A O no hydrogen 3.013 N/A VAL 186.A N GLN 183.A O no hydrogen 3.216 N/A TYR 187.A N GLN 183.A O no hydrogen 2.848 N/A ARG 188.A N ALA 184.A O no hydrogen 3.022 N/A ARG 188.A NH2 TYR 193.A O no hydrogen 3.046 N/A LEU 189.A N VAL 186.A O no hydrogen 3.150 N/A SER 190.A N TYR 187.A O no hydrogen 3.071 N/A GLY 191.A N ARG 188.A O no hydrogen 3.056 N/A ASN 194.A N ASP 192.A OD1 no hydrogen 3.186 N/A LEU 196.A N ASN 194.A OD1 no hydrogen 3.032 N/A HIS 197.A N ASN 194.A O no hydrogen 3.186 N/A HIS 197.A ND1 ILE 212.A O no hydrogen 2.748 N/A ILE 198.A N SER 195.A O no hydrogen 3.128 N/A ASP 199.A N SER 195.A O no hydrogen 2.891 N/A GLU 201.A N ASP 199.A OD1 no hydrogen 3.046 N/A ALA 203.A N ASP 199.A O no hydrogen 2.999 N/A LYS 204.A N PRO 200.A O no hydrogen 2.749 N/A SER 205.A N GLU 201.A O no hydrogen 2.944 N/A VAL 206.A N ALA 203.A O no hydrogen 3.179 N/A GLY 207.A N LYS 204.A O no hydrogen 3.245 N/A PHE 208.A N ALA 203.A O no hydrogen 3.091 N/A LEU 213.A N CYS 249.A O no hydrogen 2.856 N/A HIS 214.A NE2 ASP 192.A O no hydrogen 2.954 N/A CYS 217.A N HIS 214.A O no hydrogen 3.087 N/A CYS 217.A SG GLY 29.A O no hydrogen 3.635 N/A SER 218.A N HIS 214.A O no hydrogen 3.262 N/A MET 219.A N GLY 215.A O no hydrogen 2.985 N/A GLY 220.A N LEU 216.A O no hydrogen 2.931 N/A VAL 221.A N CYS 217.A O no hydrogen 2.869 N/A ALA 222.A N SER 218.A O no hydrogen 3.025 N/A SER 223.A N MET 219.A O no hydrogen 2.882 N/A SER 223.A OG MET 219.A O no hydrogen 2.805 N/A ARG 224.A N GLY 220.A O no hydrogen 2.876 N/A ARG 224.A NE GLU 32.A OE1 no hydrogen 2.833 N/A ARG 224.A NH1 ILE 30.A O no hydrogen 2.874 N/A ALA 225.A N VAL 221.A O no hydrogen 3.285 N/A LEU 226.A N ALA 222.A O no hydrogen 2.996 N/A PHE 227.A N SER 223.A O no hydrogen 2.865 N/A LYS 228.A N ARG 224.A O no hydrogen 2.989 N/A GLN 229.A N ALA 225.A O no hydrogen 2.971 N/A PHE 230.A N LEU 226.A O no hydrogen 3.014 N/A CYS 231.A N PHE 227.A O no hydrogen 3.038 N/A ASP 234.A N CYS 231.A O no hydrogen 3.147 N/A ALA 236.A N ASP 234.A OD1 no hydrogen 2.995 N/A ARG 237.A N ASP 234.A O no hydrogen 3.044 N/A ARG 237.A NE THR 289.A O no hydrogen 2.812 N/A ARG 237.A NH2 THR 289.A O no hydrogen 2.786 N/A ARG 237.A NH2 ASP 291.A OD1 no hydrogen 2.628 N/A PHE 238.A N VAL 235.A O no hydrogen 3.040 N/A LYS 239.A N VAL 287.A O no hydrogen 2.960 N/A LYS 239.A NZ ALA 236.A O no hydrogen 3.034 N/A SER 240.A N VAL 287.A O no hydrogen 3.106 N/A ILE 241.A N VAL 94.A O no hydrogen 2.907 N/A ARG 242.A N GLU 285.A O no hydrogen 3.068 N/A ARG 242.A NE GLU 285.A OE2 no hydrogen 3.331 N/A ARG 242.A NH1 ALA 162.A O no hydrogen 3.180 N/A ARG 242.A NH2 ALA 162.A O no hydrogen 2.765 N/A ARG 242.A NH2 GLU 285.A OE1 no hydrogen 3.125 N/A VAL 243.A N GLN 92.A O no hydrogen 2.890 N/A ARG 244.A N ASP 282.A O no hydrogen 2.897 N/A PHE 245.A N GLY 90.A O no hydrogen 2.789 N/A SER 246.A N ILE 280.A O no hydrogen 3.028 N/A SER 246.A OG VAL 279.A O no hydrogen 2.950 N/A SER 247.A OG VAL 279.A O no hydrogen 2.706 N/A CYS 249.A SG PHE 250.A O no hydrogen 3.873 N/A PHE 250.A N GLU 253.A OE1 no hydrogen 2.971 N/A GLY 252.A N THR 179.A OG1 no hydrogen 2.869 N/A GLU 253.A N PHE 250.A O no hydrogen 2.988 N/A THR 254.A N GLU 275.A OE1 no hydrogen 2.801 N/A THR 254.A N GLU 275.A OE2 no hydrogen 3.200 N/A THR 254.A OG1 GLU 275.A OE2 no hydrogen 2.733 N/A ILE 255.A N PHE 177.A O no hydrogen 2.828 N/A GLN 256.A N VAL 272.A O no hydrogen 2.702 N/A THR 257.A N ASP 175.A O no hydrogen 2.818 N/A ARG 258.A N GLN 270.A O no hydrogen 2.810 N/A ARG 258.A NH1 GLN 270.A OE1 no hydrogen 3.198 N/A MET 259.A N PHE 173.A O no hydrogen 2.827 N/A TRP 260.A N LEU 268.A O no hydrogen 2.723 N/A TRP 260.A NE1 ARG 169.A O no hydrogen 2.839 N/A GLN 261.A N ASP 172.A OD2 no hydrogen 2.728 N/A GLN 261.A NE2 TYR 288.A OH no hydrogen 3.057 N/A GLU 262.A N LYS 266.A O no hydrogen 2.944 N/A GLY 263.A N GLN 261.A OE1 no hydrogen 2.985 N/A LYS 266.A N GLY 263.A O no hydrogen 3.132 N/A VAL 267.A N PHE 286.A O no hydrogen 2.776 N/A LEU 268.A N TRP 260.A O no hydrogen 2.907 N/A PHE 269.A N GLY 284.A O no hydrogen 2.944 N/A GLN 270.A N ARG 258.A O no hydrogen 3.052 N/A GLN 270.A NE2 ASP 282.A OD1 no hydrogen 2.881 N/A ALA 271.A N VAL 281.A O no hydrogen 2.875 N/A VAL 272.A N GLN 256.A O no hydrogen 2.723 N/A VAL 273.A N ALA 278.A O no hydrogen 2.831 N/A LYS 274.A N THR 254.A O no hydrogen 2.838 N/A LYS 274.A NZ GLU 176.A OE1 no hydrogen 3.054 N/A GLU 275.A N GLU 275.A OE1 no hydrogen 2.801 N/A ARG 276.A N VAL 273.A O no hydrogen 3.336 N/A ARG 276.A NE GLU 253.A OE2 no hydrogen 2.660 N/A ARG 276.A NH2 PRO 248.A O no hydrogen 3.115 N/A ARG 276.A NH2 GLU 253.A OE1 no hydrogen 2.741 N/A ARG 276.A NH2 GLU 253.A OE2 no hydrogen 3.438 N/A ILE 280.A N ALA 271.A O no hydrogen 2.832 N/A VAL 281.A N ALA 271.A O no hydrogen 3.187 N/A ASP 282.A N ARG 244.A O no hydrogen 2.860 N/A GLY 283.A N ASP 282.A OD1 no hydrogen 2.835 N/A GLY 284.A N PHE 269.A O no hydrogen 3.011 N/A GLU 285.A N ARG 242.A O no hydrogen 3.007 N/A PHE 286.A N VAL 267.A O no hydrogen 2.697 N/A VAL 287.A N SER 240.A O no hydrogen 2.878 N/A TYR 288.A N GLY 265.A O no hydrogen 2.961 N/A THR 289.A N ARG 237.A O no hydrogen 2.939 N/A SER 293.A N GLN 290.A O no hydrogen 2.855 N/A ALA 294.A N ASP 291.A O no hydrogen 3.119 N/A