Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j6j_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 GLN 7.A OE1 no hydrogen 2.704 N/A ARG 3.A NH2 GLN 7.A OE1 no hydrogen 3.088 N/A HIS 4.A N MET 1.A O no hydrogen 3.347 N/A LEU 6.A N ARG 3.A O no hydrogen 3.177 N/A ASP 8.A N HIS 5.A O no hydrogen 2.960 N/A HIS 9.A N HIS 5.A O no hydrogen 3.302 N/A PHE 10.A N LEU 6.A O no hydrogen 3.196 N/A LEU 11.A N CYS 18.A O no hydrogen 2.888 N/A CYS 18.A SG LYS 15.A O no hydrogen 2.987 N/A CYS 19.A N SER 181.A O no hydrogen 3.295 N/A ARG 22.A NH2 ARG 90.A O no hydrogen 3.549 N/A LYS 28.A N PHE 25.A O no hydrogen 3.019 N/A VAL 29.A N ILE 26.A O no hydrogen 3.247 N/A LEU 30.A N ILE 26.A O no hydrogen 2.921 N/A LEU 34.A N LEU 30.A O no hydrogen 2.896 N/A GLY 35.A N PRO 31.A O no hydrogen 2.883 N/A LEU 36.A N PRO 32.A O no hydrogen 2.956 N/A GLU 37.A N VAL 33.A O no hydrogen 2.916 N/A PHE 38.A N LEU 34.A O no hydrogen 2.840 N/A ILE 39.A N GLY 35.A O no hydrogen 2.943 N/A PHE 40.A N LEU 36.A O no hydrogen 2.979 N/A GLY 41.A N GLU 37.A O no hydrogen 2.885 N/A LEU 42.A N PHE 38.A O no hydrogen 2.845 N/A LEU 43.A N ILE 39.A O no hydrogen 3.001 N/A GLY 44.A N PHE 40.A O no hydrogen 2.959 N/A ASN 45.A N GLY 41.A O no hydrogen 2.876 N/A ASN 45.A ND2 GLY 41.A O no hydrogen 2.578 N/A GLY 46.A N LEU 42.A O no hydrogen 2.901 N/A LEU 47.A N LEU 43.A O no hydrogen 2.970 N/A ALA 48.A N GLY 44.A O no hydrogen 2.918 N/A LEU 49.A N ASN 45.A O no hydrogen 2.897 N/A TRP 50.A N GLY 46.A O no hydrogen 2.921 N/A ILE 51.A N LEU 47.A O no hydrogen 2.959 N/A PHE 52.A N ALA 48.A O no hydrogen 2.906 N/A CYS 53.A N TRP 50.A O no hydrogen 3.449 N/A CYS 53.A SG LEU 49.A O no hydrogen 3.653 N/A PHE 54.A N ILE 51.A O no hydrogen 3.113 N/A SER 58.A OG HIS 55.A O no hydrogen 3.383 N/A TRP 59.A N LEU 56.A O no hydrogen 3.041 N/A ILE 64.A N LYS 60.A O no hydrogen 2.533 N/A PHE 65.A N SER 61.A O no hydrogen 2.923 N/A LEU 66.A N SER 62.A O no hydrogen 2.932 N/A PHE 67.A N ARG 63.A O no hydrogen 2.854 N/A ASN 68.A N ILE 64.A O no hydrogen 2.943 N/A ASN 68.A ND2 ILE 64.A O no hydrogen 2.396 N/A LEU 69.A N PHE 65.A O no hydrogen 2.934 N/A ALA 70.A N LEU 66.A O no hydrogen 2.902 N/A VAL 71.A N PHE 67.A O no hydrogen 2.886 N/A ALA 72.A N ASN 68.A O no hydrogen 2.953 N/A ASP 73.A N LEU 69.A O no hydrogen 2.934 N/A PHE 74.A N ALA 70.A O no hydrogen 2.868 N/A LEU 75.A N VAL 71.A O no hydrogen 2.922 N/A LEU 76.A N ALA 72.A O no hydrogen 2.956 N/A ILE 77.A N ASP 73.A O no hydrogen 2.917 N/A ILE 78.A N PHE 74.A O no hydrogen 2.897 N/A CYS 79.A N LEU 75.A O no hydrogen 2.929 N/A CYS 79.A SG LEU 75.A O no hydrogen 3.456 N/A LEU 80.A N ILE 77.A O no hydrogen 3.199 N/A PHE 82.A N CYS 79.A O no hydrogen 3.276 N/A MET 84.A N LEU 80.A O no hydrogen 2.950 N/A ASP 85.A N PRO 81.A O no hydrogen 2.872 N/A ASN 86.A N PHE 82.A O no hydrogen 2.927 N/A TYR 87.A N LEU 83.A O no hydrogen 2.882 N/A VAL 88.A N MET 84.A O no hydrogen 2.932 N/A ARG 89.A N ASP 85.A O no hydrogen 3.305 N/A ARG 90.A N TYR 87.A O no hydrogen 2.867 N/A TRP 91.A N ASN 86.A O no hydrogen 3.137 N/A TRP 93.A N ASN 175.A O no hydrogen 3.398 N/A CYS 100.A N GLY 96.A O no hydrogen 3.426 N/A ARG 101.A N ASP 97.A O no hydrogen 2.896 N/A ARG 101.A NE ASP 97.A OD2 no hydrogen 2.842 N/A ARG 101.A NH1 LEU 163.A O no hydrogen 2.238 N/A ARG 101.A NH2 ASP 97.A OD2 no hydrogen 2.433 N/A LEU 102.A N ILE 98.A O no hydrogen 2.918 N/A MET 103.A N PRO 99.A O no hydrogen 2.873 N/A LEU 104.A N CYS 100.A O no hydrogen 2.933 N/A PHE 105.A N ARG 101.A O no hydrogen 2.946 N/A MET 106.A N LEU 102.A O no hydrogen 2.850 N/A LEU 107.A N MET 103.A O no hydrogen 2.900 N/A ALA 108.A N LEU 104.A O no hydrogen 2.994 N/A MET 109.A N PHE 105.A O no hydrogen 2.890 N/A ASN 110.A N MET 106.A O no hydrogen 2.828 N/A ASN 110.A ND2 MET 106.A O no hydrogen 2.479 N/A ARG 111.A N LEU 107.A O no hydrogen 2.982 N/A GLN 112.A N ALA 108.A O no hydrogen 2.973 N/A GLY 113.A N MET 109.A O no hydrogen 2.846 N/A SER 114.A N ASN 110.A O no hydrogen 2.870 N/A SER 114.A OG ASP 73.A OD1 no hydrogen 2.994 N/A ILE 115.A N ARG 111.A O no hydrogen 2.996 N/A ILE 116.A N GLN 112.A O no hydrogen 2.890 N/A PHE 117.A N GLY 113.A O no hydrogen 2.836 N/A LEU 118.A N SER 114.A O no hydrogen 2.941 N/A THR 119.A N ILE 115.A O no hydrogen 2.933 N/A THR 119.A OG1 ILE 115.A O no hydrogen 2.785 N/A VAL 120.A N ILE 116.A O no hydrogen 2.880 N/A VAL 121.A N PHE 117.A O no hydrogen 2.871 N/A ALA 122.A N LEU 118.A O no hydrogen 2.925 N/A VAL 123.A N THR 119.A O no hydrogen 2.904 N/A ASP 124.A N VAL 120.A O no hydrogen 2.857 N/A ARG 125.A N VAL 121.A O no hydrogen 2.916 N/A TYR 126.A N ALA 122.A O no hydrogen 2.905 N/A PHE 127.A N VAL 123.A O no hydrogen 2.889 N/A ARG 128.A N ASP 124.A O no hydrogen 2.896 N/A ARG 128.A NH1 ASP 124.A OD1 no hydrogen 3.111 N/A VAL 129.A N ARG 125.A O no hydrogen 2.929 N/A VAL 130.A N TYR 126.A O no hydrogen 2.883 N/A HIS 131.A N PHE 127.A O no hydrogen 3.025 N/A HIS 134.A ND1 HIS 134.A O no hydrogen 2.527 N/A ALA 135.A N HIS 131.A O no hydrogen 3.119 N/A LEU 136.A N HIS 133.A O no hydrogen 3.356 N/A ASN 137.A N HIS 134.A O no hydrogen 3.131 N/A ASN 137.A ND2 HIS 134.A ND1 no hydrogen 3.279 N/A LYS 138.A N ALA 135.A O no hydrogen 3.143 N/A SER 140.A OG THR 143.A OG1 no hydrogen 2.955 N/A ASN 141.A ND2 TRP 59.A O no hydrogen 2.623 N/A THR 143.A N SER 140.A OG no hydrogen 3.392 N/A THR 143.A OG1 SER 140.A OG no hydrogen 2.955 N/A ALA 144.A N SER 140.A O no hydrogen 2.968 N/A ALA 145.A N ASN 141.A O no hydrogen 2.899 N/A ILE 146.A N ARG 142.A O no hydrogen 2.911 N/A ILE 147.A N THR 143.A O no hydrogen 2.883 N/A SER 148.A N ALA 144.A O no hydrogen 2.893 N/A SER 148.A OG ALA 144.A O no hydrogen 2.967 N/A CYS 149.A N ALA 145.A O no hydrogen 2.907 N/A CYS 149.A SG ALA 145.A O no hydrogen 3.534 N/A LEU 150.A N ILE 146.A O no hydrogen 2.890 N/A LEU 151.A N ILE 147.A O no hydrogen 2.884 N/A TRP 152.A N SER 148.A O no hydrogen 2.910 N/A TRP 152.A NE1 ASN 68.A OD1 no hydrogen 3.042 N/A GLY 153.A N CYS 149.A O no hydrogen 2.879 N/A ILE 154.A N LEU 150.A O no hydrogen 2.921 N/A THR 155.A N LEU 151.A O no hydrogen 2.910 N/A THR 155.A OG1 LEU 151.A O no hydrogen 2.845 N/A ILE 156.A N TRP 152.A O no hydrogen 2.909 N/A GLY 157.A N GLY 153.A O no hydrogen 2.881 N/A LEU 158.A N ILE 154.A O no hydrogen 2.949 N/A THR 159.A N THR 155.A O no hydrogen 3.261 N/A THR 159.A N ILE 156.A O no hydrogen 3.079 N/A THR 159.A OG1 THR 155.A O no hydrogen 2.583 N/A THR 159.A OG1 ILE 156.A O no hydrogen 3.152 N/A LEU 162.A N THR 159.A O no hydrogen 3.309 N/A LEU 163.A N VAL 160.A O no hydrogen 2.902 N/A LYS 165.A N LEU 163.A O no hydrogen 2.913 N/A LYS 165.A NZ ASP 14.A OD1 no hydrogen 3.120 N/A LYS 165.A NZ LYS 166.A O no hydrogen 2.833 N/A ASN 171.A N ALA 174.A O no hydrogen 2.577 N/A ALA 174.A N ASN 171.A O no hydrogen 2.922 N/A ASN 175.A N ASP 92.A OD1 no hydrogen 3.448 N/A ASN 175.A ND2 TRP 93.A O no hydrogen 3.664 N/A LEU 176.A N ILE 169.A O no hydrogen 2.560 N/A SER 178.A OG PHE 180.A O no hydrogen 2.943 N/A CYS 183.A SG THR 185.A O no hydrogen 3.511 N/A CYS 183.A SG THR 185.A OG1 no hydrogen 2.884 N/A HIS 184.A N LYS 16.A O no hydrogen 3.270 N/A GLN 187.A N THR 185.A O no hydrogen 2.741 N/A TRP 188.A N GLN 187.A OE1 no hydrogen 2.998 N/A GLU 190.A N GLN 187.A O no hydrogen 3.203 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.557 N/A MET 192.A N TRP 188.A O no hydrogen 2.897 N/A PHE 193.A N HIS 189.A O no hydrogen 2.894 N/A LEU 194.A N GLU 190.A O no hydrogen 2.892 N/A LEU 195.A N ALA 191.A O no hydrogen 2.935 N/A GLU 196.A N MET 192.A O no hydrogen 2.886 N/A PHE 197.A N LEU 194.A O no hydrogen 3.150 N/A PHE 198.A N LEU 194.A O no hydrogen 2.929 N/A LEU 199.A N LEU 195.A O no hydrogen 2.934 N/A LEU 201.A N PHE 197.A O no hydrogen 3.164 N/A GLY 202.A N PHE 198.A O no hydrogen 3.348 N/A ILE 203.A N LEU 199.A O no hydrogen 2.952 N/A ILE 204.A N PRO 200.A O no hydrogen 2.875 N/A LEU 205.A N LEU 201.A O no hydrogen 2.908 N/A PHE 206.A N GLY 202.A O no hydrogen 2.915 N/A CYS 207.A N ILE 203.A O no hydrogen 2.936 N/A CYS 207.A SG ALA 122.A O no hydrogen 3.935 N/A CYS 207.A SG ILE 203.A O no hydrogen 3.371 N/A SER 208.A N ILE 204.A O no hydrogen 2.876 N/A SER 208.A OG ILE 204.A O no hydrogen 3.106 N/A ALA 209.A N LEU 205.A O no hydrogen 2.895 N/A ARG 210.A N PHE 206.A O no hydrogen 2.942 N/A ILE 211.A N CYS 207.A O no hydrogen 2.921 N/A ILE 212.A N SER 208.A O no hydrogen 2.853 N/A TRP 213.A N ALA 209.A O no hydrogen 2.927 N/A SER 214.A N ARG 210.A O no hydrogen 2.930 N/A SER 214.A OG ARG 210.A O no hydrogen 3.036 N/A LEU 215.A N ILE 211.A O no hydrogen 2.906 N/A ARG 216.A N ILE 212.A O no hydrogen 2.890 N/A GLN 217.A N TRP 213.A O no hydrogen 2.946 N/A GLN 219.A N LEU 215.A O no hydrogen 3.026 N/A ARG 222.A N GLN 219.A O no hydrogen 2.884 N/A ILE 226.A N HIS 223.A O no hydrogen 3.160 N/A ARG 228.A N ALA 224.A O no hydrogen 2.920 N/A ARG 228.A NE SER 297.A O no hydrogen 3.349 N/A ARG 228.A NH2 SER 297.A O no hydrogen 3.221 N/A ALA 229.A N LYS 225.A O no hydrogen 2.889 N/A ILE 230.A N ILE 226.A O no hydrogen 2.896 N/A THR 231.A N LYS 227.A O no hydrogen 2.886 N/A THR 231.A OG1 LYS 227.A O no hydrogen 2.880 N/A THR 231.A OG1 ARG 228.A O no hydrogen 2.557 N/A PHE 232.A N ARG 228.A O no hydrogen 2.940 N/A ILE 233.A N ALA 229.A O no hydrogen 2.871 N/A MET 234.A N ILE 230.A O no hydrogen 2.957 N/A VAL 235.A N THR 231.A O no hydrogen 2.866 N/A VAL 236.A N PHE 232.A O no hydrogen 2.916 N/A ALA 237.A N ILE 233.A O no hydrogen 3.482 N/A ILE 238.A N MET 234.A O no hydrogen 2.919 N/A VAL 239.A N VAL 235.A O no hydrogen 2.860 N/A PHE 240.A N VAL 236.A O no hydrogen 2.952 N/A VAL 241.A N ALA 237.A O no hydrogen 2.897 N/A ILE 242.A N ILE 238.A O no hydrogen 2.907 N/A CYS 243.A N VAL 239.A O no hydrogen 2.947 N/A CYS 243.A SG VAL 239.A O no hydrogen 3.161 N/A PHE 244.A N PHE 240.A O no hydrogen 2.915 N/A LEU 245.A N VAL 241.A O no hydrogen 2.885 N/A SER 247.A OG THR 283.A OG1 no hydrogen 3.278 N/A VAL 248.A N PHE 244.A O no hydrogen 3.449 N/A VAL 249.A N LEU 245.A O no hydrogen 2.868 N/A VAL 250.A N PRO 246.A O no hydrogen 2.938 N/A ARG 251.A N SER 247.A O no hydrogen 2.938 N/A ILE 252.A N VAL 248.A O no hydrogen 2.843 N/A ARG 253.A N VAL 249.A O no hydrogen 2.906 N/A ILE 254.A N VAL 250.A O no hydrogen 2.923 N/A PHE 255.A N ARG 251.A O no hydrogen 2.919 N/A TRP 256.A N ILE 252.A O no hydrogen 2.855 N/A LEU 257.A N ARG 253.A O no hydrogen 2.931 N/A HIS 259.A ND1 THR 260.A OG1 no hydrogen 3.188 N/A THR 260.A N HIS 259.A ND1 no hydrogen 2.878 N/A THR 260.A OG1 HIS 259.A ND1 no hydrogen 3.188 N/A THR 263.A OG1 LEU 258.A O no hydrogen 3.147 N/A THR 263.A OG1 HIS 259.A O no hydrogen 3.155 N/A TYR 269.A OH ASP 273.A OD1 no hydrogen 2.347 N/A ARG 270.A NH1 GLU 267.A O no hydrogen 3.097 N/A VAL 272.A N TYR 269.A O no hydrogen 3.030 N/A LEU 274.A N ARG 270.A O no hydrogen 2.957 N/A ALA 275.A N SER 271.A O no hydrogen 2.876 N/A PHE 276.A N VAL 272.A O no hydrogen 2.884 N/A PHE 277.A N ASP 273.A O no hydrogen 3.012 N/A ILE 278.A N LEU 274.A O no hydrogen 3.419 N/A THR 279.A N ALA 275.A O no hydrogen 2.885 N/A THR 279.A OG1 ALA 275.A O no hydrogen 3.374 N/A THR 279.A OG1 PHE 276.A O no hydrogen 2.165 N/A LEU 280.A N PHE 276.A O no hydrogen 2.944 N/A SER 281.A N PHE 277.A O no hydrogen 2.957 N/A SER 281.A OG ILE 278.A O no hydrogen 2.441 N/A PHE 282.A N ILE 278.A O no hydrogen 2.881 N/A THR 283.A N THR 279.A O no hydrogen 2.887 N/A THR 283.A OG1 SER 247.A OG no hydrogen 3.278 N/A THR 283.A OG1 THR 279.A O no hydrogen 3.141 N/A TYR 284.A N LEU 280.A O no hydrogen 2.990 N/A MET 285.A N SER 281.A O no hydrogen 2.855 N/A ASN 286.A N PHE 282.A O no hydrogen 2.911 N/A SER 287.A N THR 283.A O no hydrogen 2.913 N/A MET 288.A N TYR 284.A O no hydrogen 2.949 N/A LEU 289.A N MET 285.A O no hydrogen 2.957 N/A ASP 290.A N ASN 286.A O no hydrogen 2.919 N/A VAL 293.A N LEU 289.A O no hydrogen 3.166 N/A TYR 294.A N ASP 290.A O no hydrogen 2.937 N/A TYR 295.A N PRO 291.A O no hydrogen 2.842 N/A TYR 295.A OH LEU 66.A O no hydrogen 2.326 N/A SER 297.A N TYR 294.A O no hydrogen 3.322 N/A SER 297.A OG TYR 294.A O no hydrogen 2.303 N/A SER 298.A OG TYR 295.A O no hydrogen 3.127 N/A PHE 301.A N SER 298.A O no hydrogen 3.148 N/A PHE 304.A N SER 300.A O no hydrogen 2.927 N/A PHE 305.A N PHE 301.A O no hydrogen 2.875 N/A SER 306.A N PRO 302.A O no hydrogen 2.888 N/A SER 306.A OG PRO 302.A O no hydrogen 2.900 N/A THR 307.A N ASN 303.A O no hydrogen 2.921 N/A THR 307.A OG1 ASN 303.A O no hydrogen 2.917 N/A THR 307.A OG1 PHE 304.A O no hydrogen 2.497 N/A LEU 308.A N PHE 304.A O no hydrogen 2.961 N/A