Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hta_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ALA 1.A O no hydrogen 2.863 N/A ASN 6.A N SER 2.A O no hydrogen 2.855 N/A LYS 7.A N HIS 3.A O no hydrogen 3.182 N/A ILE 8.A N ILE 5.A O no hydrogen 3.124 N/A PHE 9.A N ILE 5.A O no hydrogen 3.275 N/A ALA 10.A N ASN 6.A O no hydrogen 3.032 N/A ALA 10.A N LYS 7.A O no hydrogen 3.187 N/A LEU 11.A N ILE 8.A O no hydrogen 3.151 N/A ILE 14.A N ARG 23.A O no hydrogen 2.778 N/A GLU 15.A N ARG 23.A O no hydrogen 3.311 N/A GLN 16.A NE2 THR 18.A O no hydrogen 2.739 N/A LEU 17.A N LEU 21.A O no hydrogen 2.757 N/A THR 18.A N LEU 21.A O no hydrogen 3.100 N/A THR 18.A OG1 GLU 113.A OE1 no hydrogen 2.618 N/A THR 18.A OG1 GLU 113.A OE2 no hydrogen 3.198 N/A VAL 20.A N THR 18.A OG1 no hydrogen 3.231 N/A LEU 21.A N THR 18.A O no hydrogen 3.348 N/A LEU 21.A N THR 18.A OG1 no hydrogen 3.132 N/A SER 22.A N VAL 33.A O no hydrogen 3.050 N/A ARG 23.A N GLU 15.A O no hydrogen 2.769 N/A ARG 23.A NE GLU 15.A OE1 no hydrogen 3.091 N/A ARG 23.A NH1 ASP 30.A OD1 no hydrogen 3.186 N/A ARG 23.A NH2 GLU 15.A OE1 no hydrogen 2.651 N/A ARG 24.A N LEU 31.A O no hydrogen 2.900 N/A ARG 24.A NE SER 22.A OG no hydrogen 2.801 N/A ARG 24.A NH1 PHE 9.A O no hydrogen 2.998 N/A ARG 24.A NH1 LEU 11.A O no hydrogen 2.895 N/A GLN 25.A NE2 ASP 27.A O no hydrogen 2.895 N/A LEU 26.A N LEU 29.A O no hydrogen 2.951 N/A ASP 28.A N PHE 70.A O no hydrogen 3.001 N/A LEU 29.A N LEU 26.A O no hydrogen 2.862 N/A LEU 31.A N ARG 24.A O no hydrogen 2.798 N/A ILE 32.A N PHE 43.A O no hydrogen 2.930 N/A VAL 33.A N SER 22.A O no hydrogen 2.856 N/A VAL 34.A N ALA 41.A O no hydrogen 2.765 N/A ASP 35.A N VAL 20.A O no hydrogen 2.827 N/A HIS 36.A N VAL 39.A O no hydrogen 2.976 N/A HIS 36.A NE2 ASP 114.A O no hydrogen 2.866 N/A GLN 38.A N HIS 36.A ND1 no hydrogen 2.920 N/A VAL 39.A N HIS 36.A O no hydrogen 3.200 N/A LYS 40.A N LYS 54.A O no hydrogen 2.952 N/A ALA 41.A N VAL 34.A O no hydrogen 3.020 N/A SER 42.A N SER 52.A O no hydrogen 3.209 N/A SER 42.A OG SER 52.A OG no hydrogen 2.892 N/A PHE 43.A N ILE 32.A O no hydrogen 2.822 N/A ALA 44.A N HIS 49.A O no hydrogen 2.863 N/A LEU 45.A N ASP 30.A O no hydrogen 3.153 N/A GLN 46.A NE2 LYS 71.A O no hydrogen 3.206 N/A GLY 47.A N LEU 104.A O no hydrogen 2.765 N/A ALA 48.A N LEU 45.A O no hydrogen 3.159 N/A HIS 49.A N ALA 44.A O no hydrogen 2.915 N/A HIS 49.A NE2 GLY 78.A O no hydrogen 2.710 N/A LEU 51.A N SER 42.A O no hydrogen 2.828 N/A SER 52.A OG SER 42.A OG no hydrogen 2.892 N/A TRP 53.A NE1 GLY 147.A O no hydrogen 2.977 N/A LYS 54.A N LYS 40.A O no hydrogen 2.816 N/A LYS 54.A NZ GLU 58.A O no hydrogen 2.587 N/A VAL 56.A N GLN 38.A O no hydrogen 3.015 N/A GLU 58.A N PRO 55.A O no hydrogen 3.068 N/A VAL 61.A N TRP 53.A O no hydrogen 2.926 N/A TRP 63.A N TYR 169.A O no hydrogen 2.856 N/A TRP 63.A NE1 THR 265.A OG1 no hydrogen 3.091 N/A SER 65.A N ARG 77.A O no hydrogen 3.060 N/A SER 65.A OG ASP 257.A O no hydrogen 2.428 N/A ASN 67.A N SER 65.A OG no hydrogen 3.047 N/A ASN 67.A ND2 MET 258.A O no hydrogen 3.505 N/A THR 68.A N SER 65.A O no hydrogen 3.276 N/A THR 68.A OG1 PRO 69.A O no hydrogen 3.167 N/A LYS 71.A NZ ASP 27.A OD2 no hydrogen 2.935 N/A THR 72.A N ASP 28.A OD2 no hydrogen 2.848 N/A GLY 73.A N GLN 46.A OE1 no hydrogen 2.821 N/A VAL 74.A N LYS 71.A O no hydrogen 3.051 N/A ARG 77.A N THR 68.A OG1 no hydrogen 2.885 N/A ARG 77.A NE ASP 257.A OD1 no hydrogen 3.296 N/A ARG 77.A NE ASP 257.A OD2 no hydrogen 3.002 N/A ARG 77.A NH1 TYR 169.A OH no hydrogen 2.952 N/A ARG 77.A NH2 ASP 257.A OD1 no hydrogen 3.452 N/A ARG 77.A NH2 ASP 257.A OD2 no hydrogen 3.477 N/A GLY 79.A N TRP 63.A O no hydrogen 2.743 N/A VAL 80.A N LEU 50.A O no hydrogen 2.862 N/A CYS 83.A N ALA 165.A O no hydrogen 2.933 N/A CYS 83.A SG PRO 81.A O no hydrogen 3.871 N/A TRP 86.A NE1 PRO 96.A O no hydrogen 2.975 N/A PHE 87.A N THR 163.A OG1 no hydrogen 3.003 N/A GLY 88.A N HIS 98.A ND1 no hydrogen 2.941 N/A LEU 95.A N GLN 92.A O no hydrogen 3.226 N/A HIS 98.A N GLY 88.A O no hydrogen 2.928 N/A PHE 100.A N TRP 84.A O no hydrogen 3.036 N/A ALA 101.A N TRP 84.A O no hydrogen 3.106 N/A ARG 102.A NH2 SER 97.A O no hydrogen 3.141 N/A ASN 103.A N PHE 100.A O no hydrogen 3.069 N/A ASN 103.A ND2 GLY 73.A O no hydrogen 2.894 N/A LEU 104.A N ALA 101.A O no hydrogen 3.456 N/A TRP 106.A N LEU 45.A O no hydrogen 2.842 N/A TRP 106.A NE1 ALA 101.A O no hydrogen 2.973 N/A ALA 107.A N GLU 123.A O no hydrogen 2.924 N/A LYS 109.A N THR 121.A O no hydrogen 2.810 N/A LYS 109.A NZ GLU 123.A OE2 no hydrogen 3.486 N/A ALA 110.A N THR 121.A O no hydrogen 3.255 N/A ASN 112.A N MET 119.A O no hydrogen 2.990 N/A ASP 114.A N GLY 117.A O no hydrogen 3.067 N/A ASN 116.A N ASP 114.A OD1 no hydrogen 2.802 N/A GLY 117.A N ASP 114.A OD1 no hydrogen 3.170 N/A VAL 118.A N VAL 146.A O no hydrogen 2.971 N/A MET 119.A N ASN 112.A O no hydrogen 2.801 N/A LEU 120.A N PHE 144.A O no hydrogen 2.952 N/A THR 121.A N ALA 110.A O no hydrogen 2.857 N/A PHE 122.A N ALA 142.A O no hydrogen 2.833 N/A GLU 123.A N ALA 107.A O no hydrogen 2.861 N/A LEU 124.A N LEU 140.A O no hydrogen 2.764 N/A GLN 125.A NE2 THR 139.A OG1 no hydrogen 3.126 N/A SER 126.A N PHE 138.A O no hydrogen 3.053 N/A SER 126.A OG ASP 137.A OD1 no hydrogen 2.602 N/A SER 126.A OG PHE 138.A O no hydrogen 3.359 N/A SER 127.A N THR 130.A OG1 no hydrogen 2.999 N/A THR 130.A N SER 127.A OG no hydrogen 3.226 N/A THR 130.A OG1 SER 127.A O no hydrogen 3.184 N/A ARG 131.A N SER 127.A O no hydrogen 2.943 N/A ARG 131.A NH2 ASP 137.A OD1 no hydrogen 3.060 N/A LYS 132.A N ALA 129.A O no hydrogen 3.230 N/A TYR 133.A N THR 130.A O no hydrogen 3.145 N/A TRP 134.A N THR 130.A O no hydrogen 2.829 N/A HIS 136.A N TRP 134.A O no hydrogen 2.722 N/A PHE 138.A N SER 126.A OG no hydrogen 2.991 N/A THR 139.A N HIS 157.A O no hydrogen 3.125 N/A LEU 140.A N LEU 124.A O no hydrogen 2.778 N/A LEU 141.A N GLU 155.A O no hydrogen 2.822 N/A ALA 142.A N PHE 122.A O no hydrogen 2.932 N/A ARG 143.A N GLU 153.A O no hydrogen 2.860 N/A ARG 143.A NH2 GLU 155.A OE1 no hydrogen 3.089 N/A PHE 144.A N LEU 120.A O no hydrogen 2.814 N/A LYS 145.A N GLU 151.A O no hydrogen 2.903 N/A VAL 146.A N VAL 118.A O no hydrogen 2.868 N/A GLY 147.A N THR 149.A O no hydrogen 2.909 N/A CYS 150.A N ILE 292.A O no hydrogen 2.997 N/A GLU 151.A N LYS 145.A O no hydrogen 2.897 N/A ILE 152.A N GLN 290.A O no hydrogen 2.761 N/A GLU 153.A N ARG 143.A O no hydrogen 2.810 N/A LEU 154.A N LEU 288.A O no hydrogen 2.705 N/A GLU 155.A N LEU 141.A O no hydrogen 2.914 N/A ALA 156.A N SER 286.A O no hydrogen 2.980 N/A HIS 157.A N THR 139.A O no hydrogen 2.834 N/A HIS 157.A ND1 GLU 283.A OE1 no hydrogen 2.893 N/A HIS 157.A NE2 GLU 155.A OE1 no hydrogen 2.685 N/A PHE 160.A N ALA 280.A O no hydrogen 3.146 N/A THR 162.A N GLN 278.A O no hydrogen 3.061 N/A THR 163.A N PRO 85.A O no hydrogen 3.209 N/A SER 164.A N TYR 273.A O no hydrogen 3.121 N/A ALA 165.A N CYS 83.A O no hydrogen 3.059 N/A LEU 166.A N THR 271.A O no hydrogen 2.792 N/A HIS 167.A N PRO 81.A O no hydrogen 2.993 N/A HIS 167.A ND1 HIS 167.A O no hydrogen 2.568 N/A SER 168.A OG GLN 290.A OE1 no hydrogen 2.669 N/A TYR 169.A N GLY 79.A O no hydrogen 2.946 N/A PHE 170.A N VAL 267.A O no hydrogen 2.987 N/A ASN 171.A N VAL 61.A O no hydrogen 2.916 N/A ASN 171.A ND2 GLU 60.A O no hydrogen 3.008 N/A VAL 172.A N THR 265.A O no hydrogen 2.859 N/A GLY 173.A N ASP 225.A OD2 no hydrogen 2.860 N/A ILE 175.A N LYS 264.A O no hydrogen 2.836 N/A ALA 176.A N ASP 174.A OD1 no hydrogen 2.952 N/A ASN 177.A N ASP 174.A O no hydrogen 2.965 N/A ASN 177.A ND2 THR 227.A OG1 no hydrogen 2.764 N/A VAL 178.A N ILE 175.A O no hydrogen 3.039 N/A VAL 180.A N GLN 204.A O no hydrogen 2.867 N/A SER 181.A N VAL 222.A O no hydrogen 2.806 N/A SER 181.A OG VAL 222.A O no hydrogen 3.534 N/A SER 181.A OG HIS 224.A NE2 no hydrogen 2.749 N/A LEU 183.A N GLY 202.A O no hydrogen 3.000 N/A ARG 186.A N ASP 185.A OD1 no hydrogen 2.722 N/A ARG 186.A NH1 GLU 196.A OE1 no hydrogen 3.227 N/A PHE 187.A N GLY 197.A O no hydrogen 3.057 N/A ILE 188.A N VAL 213.A O no hydrogen 2.841 N/A ASP 189.A N LYS 195.A O no hydrogen 2.890 N/A LYS 190.A N ASP 211.A O no hydrogen 2.853 N/A VAL 191.A N ASP 189.A OD1 no hydrogen 3.038 N/A ASN 192.A N ASP 189.A O no hydrogen 3.123 N/A ASN 192.A ND2 ASP 189.A OD1 no hydrogen 3.439 N/A ASN 192.A ND2 ASP 189.A OD2 no hydrogen 2.677 N/A LYS 195.A N ASN 192.A O no hydrogen 3.191 N/A GLY 197.A N PHE 187.A O no hydrogen 2.866 N/A LEU 199.A N ASP 185.A O no hydrogen 2.710 N/A ILE 203.A N ASP 201.A OD1 no hydrogen 3.047 N/A GLN 204.A N VAL 180.A O no hydrogen 2.777 N/A GLN 204.A NE2 THR 205.A O no hydrogen 2.854 N/A THR 210.A N ASN 246.A O no hydrogen 3.036 N/A THR 210.A OG1 ASP 208.A O no hydrogen 2.799 N/A ARG 212.A N GLY 244.A O no hydrogen 3.072 N/A ARG 212.A NH1 GLN 204.A OE1 no hydrogen 2.863 N/A ARG 212.A NH2 ASP 189.A OD2 no hydrogen 3.152 N/A VAL 213.A N ILE 188.A O no hydrogen 2.865 N/A TYR 214.A N VAL 242.A O no hydrogen 2.728 N/A TYR 214.A OH GLN 204.A OE1 no hydrogen 2.701 N/A LEU 215.A N ARG 186.A O no hydrogen 3.024 N/A ASN 216.A ND2 ASP 185.A OD1 no hydrogen 3.248 N/A GLU 218.A N GLY 182.A O no hydrogen 2.881 N/A CYS 220.A SG SER 221.A O no hydrogen 3.664 N/A SER 221.A N VAL 234.A O no hydrogen 2.836 N/A SER 221.A OG HIS 236.A NE2 no hydrogen 2.804 N/A VAL 222.A N SER 181.A O no hydrogen 2.905 N/A ILE 223.A N ILE 232.A O no hydrogen 2.803 N/A HIS 224.A N LYS 179.A O no hydrogen 2.808 N/A HIS 224.A NE2 SER 181.A OG no hydrogen 2.749 N/A ASP 225.A N ARG 230.A O no hydrogen 2.965 N/A LEU 228.A N ASP 225.A OD1 no hydrogen 3.008 N/A ARG 230.A N ASP 225.A O no hydrogen 3.015 N/A ARG 230.A NH1 GLU 59.A O no hydrogen 2.986 N/A ARG 230.A NH1 GLU 60.A O no hydrogen 3.481 N/A ARG 230.A NH2 GLU 60.A O no hydrogen 2.735 N/A ARG 230.A NH2 ASN 171.A O no hydrogen 3.091 N/A THR 231.A N ALA 295.A O no hydrogen 2.739 N/A ILE 232.A N ILE 223.A O no hydrogen 2.960 N/A ASP 233.A N CYS 293.A O no hydrogen 2.722 N/A VAL 234.A N SER 221.A O no hydrogen 2.866 N/A VAL 235.A N THR 291.A O no hydrogen 2.750 N/A HIS 236.A N ALA 219.A O no hydrogen 2.814 N/A HIS 236.A ND1 THR 271.A OG1 no hydrogen 2.697 N/A HIS 236.A NE2 SER 221.A OG no hydrogen 2.804 N/A HIS 237.A N ALA 289.A O no hydrogen 2.937 N/A HIS 239.A N HIS 239.A ND1 no hydrogen 2.856 N/A LEU 240.A N VAL 272.A O no hydrogen 2.924 N/A ASN 241.A N VAL 272.A O no hydrogen 2.951 N/A ASN 241.A ND2 THR 275.A OG1 no hydrogen 2.928 N/A VAL 242.A N TYR 214.A O no hydrogen 3.321 N/A VAL 243.A N GLU 270.A O no hydrogen 3.099 N/A GLY 244.A N ARG 212.A O no hydrogen 3.010 N/A TRP 245.A N CYS 268.A O no hydrogen 2.947 N/A ASN 246.A N THR 210.A O no hydrogen 3.032 N/A ASN 246.A ND2 TYR 263.A O no hydrogen 2.758 N/A ASN 246.A ND2 PHE 266.A O no hydrogen 2.672 N/A GLY 248.A N ASN 246.A OD1 no hydrogen 2.783 N/A SER 252.A N GLY 248.A O no hydrogen 3.098 N/A SER 252.A OG PRO 259.A O no hydrogen 3.003 N/A SER 252.A OG ASP 260.A O no hydrogen 3.044 N/A VAL 253.A N PRO 249.A O no hydrogen 2.907 N/A SER 254.A N ALA 250.A O no hydrogen 3.019 N/A SER 254.A OG ALA 250.A O no hydrogen 3.536 N/A SER 254.A OG LEU 251.A O no hydrogen 3.422 N/A MET 255.A N LEU 251.A O no hydrogen 3.008 N/A MET 258.A N MET 255.A O no hydrogen 3.289 N/A GLY 262.A N PRO 259.A O no hydrogen 2.863 N/A TYR 263.A N SER 252.A OG no hydrogen 3.334 N/A LYS 264.A N ASP 261.A O no hydrogen 3.060 N/A THR 265.A N GLY 262.A O no hydrogen 3.073 N/A THR 265.A OG1 GLY 262.A O no hydrogen 3.534 N/A VAL 267.A N PHE 170.A O no hydrogen 3.066 N/A CYS 268.A N TRP 245.A O no hydrogen 2.855 N/A CYS 268.A SG SER 168.A O no hydrogen 3.595 N/A VAL 269.A N SER 168.A O no hydrogen 3.247 N/A GLU 270.A N VAL 243.A O no hydrogen 2.833 N/A THR 271.A N LEU 166.A O no hydrogen 3.096 N/A THR 271.A OG1 HIS 236.A ND1 no hydrogen 2.697 N/A VAL 272.A N ASN 241.A O no hydrogen 3.035 N/A TYR 273.A N SER 164.A O no hydrogen 2.824 N/A ALA 274.A N ASN 241.A OD1 no hydrogen 2.831 N/A THR 275.A N ASN 241.A OD1 no hydrogen 2.995 N/A GLN 278.A N THR 162.A O no hydrogen 2.805 N/A GLN 278.A NE2 ARG 287.A O no hydrogen 2.713 N/A ALA 280.A N PHE 160.A O no hydrogen 2.992 N/A THR 281.A N LYS 284.A O no hydrogen 3.163 N/A LYS 284.A N THR 281.A OG1 no hydrogen 2.858 N/A SER 286.A N ALA 156.A O no hydrogen 3.037 N/A LEU 288.A N LEU 154.A O no hydrogen 2.894 N/A ALA 289.A N HIS 237.A O no hydrogen 3.128 N/A GLN 290.A N ILE 152.A O no hydrogen 2.936 N/A GLN 290.A NE2 VAL 269.A O no hydrogen 3.584 N/A GLN 290.A NE2 THR 271.A OG1 no hydrogen 2.835 N/A THR 291.A N VAL 235.A O no hydrogen 2.978 N/A ILE 292.A N CYS 150.A O no hydrogen 2.811 N/A CYS 293.A N ASP 233.A O no hydrogen 2.992 N/A ALA 295.A N THR 231.A O no hydrogen 2.921 N/A ARG 297.A N ASN 229.A O no hydrogen 3.080 N/A