Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6w6d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A SG TYR 3.A O no hydrogen 3.244 N/A VAL 9.A N CYS 5.A O no hydrogen 3.070 N/A VAL 11.A N ASP 8.A O no hydrogen 3.100 N/A GLU 13.A N VAL 9.A O no hydrogen 2.709 N/A GLU 14.A N SER 10.A O no hydrogen 3.026 N/A MET 15.A N VAL 11.A O no hydrogen 3.205 N/A ILE 16.A N HIS 12.A O no hydrogen 3.100 N/A ALA 17.A N GLU 13.A O no hydrogen 2.849 N/A ASP 18.A N MET 15.A O no hydrogen 3.138 N/A ARG 21.A N ASP 18.A OD1 no hydrogen 3.023 N/A ARG 21.A NE GLU 110.A OE1 no hydrogen 2.573 N/A ARG 21.A NE GLU 110.A OE2 no hydrogen 3.263 N/A ARG 21.A NH1 GLU 110.A OE2 no hydrogen 2.685 N/A ARG 21.A NH2 THR 22.A OG1 no hydrogen 3.052 N/A THR 22.A N ASP 18.A O no hydrogen 2.971 N/A THR 22.A OG1 ASP 18.A O no hydrogen 2.829 N/A ASP 23.A N ARG 19.A O no hydrogen 2.814 N/A ALA 24.A N VAL 20.A O no hydrogen 3.027 N/A TYR 25.A N ARG 21.A O no hydrogen 3.180 N/A TYR 25.A OH SER 109.A O no hydrogen 2.681 N/A ARG 26.A N THR 22.A O no hydrogen 2.922 N/A ARG 26.A NH1 GLN 57.A OE1 no hydrogen 2.368 N/A LEU 27.A N ASP 23.A O no hydrogen 2.798 N/A GLY 28.A N ALA 24.A O no hydrogen 2.786 N/A ILE 29.A N TYR 25.A O no hydrogen 2.973 N/A LEU 30.A N ARG 26.A O no hydrogen 3.060 N/A ARG 31.A N LEU 27.A O no hydrogen 2.941 N/A ARG 31.A NH1 LYS 256.A O no hydrogen 3.027 N/A ARG 31.A NH2 LYS 256.A O no hydrogen 2.860 N/A ASN 32.A N ILE 29.A O no hydrogen 2.971 N/A ASN 32.A ND2 GLY 28.A O no hydrogen 2.899 N/A ASN 32.A ND2 PRO 252.A O no hydrogen 2.678 N/A TRP 33.A N LEU 30.A O no hydrogen 3.060 N/A ALA 35.A N ASN 32.A O no hydrogen 2.923 N/A LEU 36.A N TRP 33.A O no hydrogen 3.012 N/A ARG 37.A N TRP 33.A O no hydrogen 2.818 N/A GLY 38.A N GLY 59.A O no hydrogen 2.953 N/A LYS 39.A N LEU 36.A O no hydrogen 2.824 N/A THR 40.A N ASP 105.A OD2 no hydrogen 2.867 N/A THR 40.A OG1 ASP 105.A OD2 no hydrogen 3.103 N/A VAL 41.A N ARG 62.A O no hydrogen 2.940 N/A LEU 42.A N ALA 106.A O no hydrogen 2.912 N/A ASP 43.A N TYR 64.A O no hydrogen 2.761 N/A VAL 44.A N VAL 108.A O no hydrogen 3.000 N/A GLY 45.A N VAL 66.A O no hydrogen 2.829 N/A ALA 46.A N VAL 66.A O no hydrogen 3.090 N/A GLY 47.A N GLU 67.A OE1 no hydrogen 2.888 N/A GLY 49.A N ALA 46.A O no hydrogen 2.836 N/A SER 52.A OG ASP 43.A OD2 no hydrogen 2.627 N/A ILE 53.A N GLY 49.A O no hydrogen 3.141 N/A PHE 54.A N ILE 50.A O no hydrogen 2.922 N/A CYS 55.A N LEU 51.A O no hydrogen 3.053 N/A CYS 55.A SG LEU 51.A O no hydrogen 3.323 N/A ALA 56.A N SER 52.A O no hydrogen 3.151 N/A GLN 57.A N ILE 53.A O no hydrogen 2.847 N/A ALA 58.A N PHE 54.A O no hydrogen 2.923 N/A GLY 59.A N ALA 56.A O no hydrogen 2.926 N/A ALA 60.A N CYS 55.A O no hydrogen 3.132 N/A ARG 61.A N.A LYS 39.A O no hydrogen 2.818 N/A ARG 61.A N.B LYS 39.A O no hydrogen 2.803 N/A ARG 61.A NE.B GLY 38.A O no hydrogen 2.860 N/A ARG 61.A NH1.B GLY 38.A O no hydrogen 2.874 N/A ARG 62.A N LYS 39.A O no hydrogen 3.401 N/A VAL 63.A N ARG 87.A O no hydrogen 2.860 N/A TYR 64.A N VAL 41.A O no hydrogen 2.823 N/A TYR 64.A OH GLU 102.A OE2 no hydrogen 2.764 N/A ALA 65.A N HIS 89.A O no hydrogen 2.983 N/A VAL 66.A N ASP 43.A O no hydrogen 2.959 N/A GLU 67.A N LEU 91.A O no hydrogen 3.063 N/A SER 69.A N GLU 67.A OE2 no hydrogen 2.976 N/A SER 69.A OG GLU 67.A OE2 no hydrogen 3.045 N/A TRP 72.A N.A SER 69.A O no hydrogen 3.186 N/A TRP 72.A N.B SER 69.A O no hydrogen 3.170 N/A GLN 73.A N ALA 70.A O no hydrogen 3.042 N/A ALA 75.A N ILE 71.A O no hydrogen 3.090 N/A ARG 76.A N TRP 72.A O.A no hydrogen 2.890 N/A ARG 76.A N TRP 72.A O.B no hydrogen 2.928 N/A GLU 77.A N GLN 73.A O no hydrogen 3.117 N/A VAL 78.A N GLN 74.A O no hydrogen 2.841 N/A VAL 79.A N ALA 75.A O no hydrogen 2.937 N/A ARG 80.A N ARG 76.A O no hydrogen 3.062 N/A PHE 81.A N GLU 77.A O no hydrogen 2.910 N/A ASN 82.A N VAL 78.A O no hydrogen 3.127 N/A ASN 82.A N VAL 79.A O no hydrogen 2.996 N/A ASN 82.A ND2 VAL 78.A O no hydrogen 2.561 N/A GLY 83.A N ARG 80.A O no hydrogen 2.838 N/A LEU 84.A N VAL 79.A O no hydrogen 3.223 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.880 N/A ARG 87.A N LEU 84.A O no hydrogen 2.926 N/A ARG 87.A NE ALA 60.A O no hydrogen 3.438 N/A ARG 87.A NH2 ALA 56.A O no hydrogen 2.735 N/A ARG 87.A NH2 ALA 60.A O no hydrogen 2.753 N/A VAL 88.A N LEU 84.A O no hydrogen 2.735 N/A HIS 89.A N VAL 63.A O no hydrogen 2.789 N/A LEU 91.A N ALA 65.A O no hydrogen 2.722 N/A GLY 93.A N GLU 67.A O no hydrogen 2.909 N/A GLU 96.A N GLU 96.A OE1 no hydrogen 2.766 N/A THR 97.A N PRO 94.A O no hydrogen 3.262 N/A THR 97.A OG1 PRO 94.A O no hydrogen 3.490 N/A VAL 98.A N PRO 94.A O no hydrogen 3.232 N/A VAL 104.A N TRP 132.A O no hydrogen 2.857 N/A ASP 105.A N THR 40.A O no hydrogen 2.906 N/A ASP 105.A N THR 40.A OG1 no hydrogen 3.275 N/A ILE 107.A N LEU 138.A O no hydrogen 2.966 N/A VAL 108.A N LEU 42.A O no hydrogen 2.892 N/A SER 109.A N LEU 140.A O no hydrogen 3.145 N/A LEU 116.A N ASP 328.A OXT no hydrogen 3.121 N/A HIS 118.A N GLY 115.A O no hydrogen 3.180 N/A HIS 118.A ND1 TRP 111.A O no hydrogen 2.853 N/A GLU 119.A N GLY 115.A O no hydrogen 3.072 N/A SER 120.A N LEU 116.A O no hydrogen 2.990 N/A SER 120.A OG LEU 116.A O no hydrogen 3.112 N/A MET 121.A N LEU 117.A O no hydrogen 2.966 N/A LEU 122.A N HIS 118.A O no hydrogen 2.883 N/A SER 123.A N GLU 119.A O no hydrogen 3.052 N/A SER 123.A OG GLU 119.A O no hydrogen 3.469 N/A SER 124.A N SER 120.A O no hydrogen 2.864 N/A SER 124.A OG GLU 96.A OE2 no hydrogen 2.546 N/A SER 124.A OG SER 120.A O no hydrogen 3.210 N/A VAL 125.A N MET 121.A O no hydrogen 2.975 N/A LEU 126.A N LEU 122.A O no hydrogen 3.018 N/A HIS 127.A N SER 123.A O no hydrogen 2.948 N/A ALA 128.A N SER 124.A O no hydrogen 3.020 N/A ARG 129.A N VAL 125.A O no hydrogen 2.898 N/A ARG 129.A NE SER 214.A O no hydrogen 3.123 N/A ARG 129.A NH1 ARG 129.A O no hydrogen 3.513 N/A ARG 129.A NH2 SER 214.A O no hydrogen 2.698 N/A THR 130.A N LEU 126.A O no hydrogen 3.061 N/A THR 130.A OG1 LEU 126.A O no hydrogen 3.019 N/A THR 130.A OG1 GLU 219.A OE1 no hydrogen 2.739 N/A LYS 131.A N HIS 127.A O no hydrogen 3.028 N/A LYS 131.A NZ GLU 96.A O no hydrogen 3.327 N/A TRP 132.A N ALA 128.A O no hydrogen 2.714 N/A LEU 133.A N ARG 129.A O no hydrogen 3.115 N/A LYS 134.A N VAL 104.A O no hydrogen 2.937 N/A LYS 134.A NZ ASP 105.A OD1 no hydrogen 2.898 N/A GLY 137.A N LYS 134.A O no hydrogen 2.764 N/A LEU 138.A N ASP 105.A O no hydrogen 2.977 N/A LEU 140.A N ILE 107.A O no hydrogen 2.919 N/A ALA 142.A N THR 250.A O no hydrogen 2.755 N/A ALA 144.A N LEU 211.A O no hydrogen 2.924 N/A GLU 145.A N GLN 248.A O no hydrogen 2.837 N/A LEU 146.A N ALA 209.A O no hydrogen 2.975 N/A PHE 147.A N TRP 246.A O no hydrogen 2.902 N/A ILE 148.A N GLN 206.A O no hydrogen 2.921 N/A VAL 149.A N ALA 244.A O no hydrogen 2.987 N/A ILE 151.A N GLY 242.A O no hydrogen 2.890 N/A SER 152.A N ASP 200.A O no hydrogen 2.795 N/A SER 152.A OG PRO 239.A O no hydrogen 2.560 N/A ASP 153.A N HIS 241.A ND1 no hydrogen 2.859 N/A GLN 154.A N ASP 200.A OD1 no hydrogen 3.376 N/A LEU 156.A N ASP 153.A OD1 no hydrogen 3.203 N/A GLU 157.A N ASP 153.A O no hydrogen 2.958 N/A TRP 158.A N GLN 154.A O no hydrogen 3.150 N/A ARG 159.A N MET 155.A O no hydrogen 3.139 N/A LEU 160.A N LEU 156.A O no hydrogen 2.928 N/A GLY 161.A N GLU 157.A O no hydrogen 3.007 N/A GLN 165.A N PHE 162.A O no hydrogen 3.035 N/A VAL 166.A N TRP 163.A O no hydrogen 3.446 N/A HIS 169.A N GLN 165.A O no hydrogen 3.394 N/A TYR 170.A N VAL 166.A O no hydrogen 2.872 N/A SER 175.A N ASP 173.A OD1 no hydrogen 3.087 N/A SER 175.A OG ASP 173.A OD1 no hydrogen 2.804 N/A LEU 177.A N MET 174.A O no hydrogen 3.146 N/A GLU 178.A N SER 175.A O no hydrogen 3.117 N/A ALA 181.A N LEU 177.A O no hydrogen 2.959 N/A THR 182.A N GLU 178.A O no hydrogen 2.819 N/A THR 182.A OG1 GLU 178.A O no hydrogen 2.901 N/A ARG 183.A N GLY 179.A O no hydrogen 2.940 N/A CYS 184.A N PHE 180.A O no hydrogen 2.905 N/A CYS 184.A SG PHE 180.A O no hydrogen 3.093 N/A LEU 185.A N ALA 181.A O no hydrogen 2.836 N/A MET 186.A N THR 182.A O no hydrogen 2.854 N/A GLY 187.A N ARG 183.A O no hydrogen 2.888 N/A HIS 188.A NE2 LEU 185.A O no hydrogen 2.964 N/A GLU 190.A N HIS 188.A ND1 no hydrogen 3.076 N/A VAL 192.A N LEU 275.A O no hydrogen 3.058 N/A GLN 194.A N GLN 273.A O no hydrogen 3.026 N/A GLN 194.A NE2 ASP 153.A OD1 no hydrogen 3.039 N/A GLN 194.A NE2 ASP 153.A OD2 no hydrogen 2.623 N/A LEU 196.A N GLN 273.A OE1 no hydrogen 2.778 N/A SER 197.A N ASP 200.A OD2 no hydrogen 3.097 N/A SER 197.A OG GLU 199.A OE1 no hydrogen 2.696 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 3.070 N/A ASP 200.A N SER 197.A O no hydrogen 3.074 N/A VAL 201.A N GLY 198.A O no hydrogen 3.063 N/A LEU 202.A N PRO 150.A O no hydrogen 3.089 N/A GLN 206.A N ILE 148.A O no hydrogen 2.953 N/A GLN 206.A NE2 ARG 204.A O no hydrogen 2.788 N/A ARG 207.A NH1 GLU 145.A OE2 no hydrogen 2.862 N/A PHE 208.A N LEU 146.A O no hydrogen 2.927 N/A LEU 211.A N ALA 144.A O no hydrogen 2.849 N/A LEU 213.A N ALA 142.A O no hydrogen 2.959 N/A ARG 215.A N GLU 212.A O no hydrogen 3.225 N/A ARG 215.A NE GLU 221.A OE1 no hydrogen 3.357 N/A ARG 215.A NE GLU 221.A OE2 no hydrogen 3.359 N/A ARG 215.A NH1 GLU 221.A OE1 no hydrogen 3.300 N/A ARG 215.A NH1 GLU 221.A OE2 no hydrogen 2.735 N/A LEU 218.A N ARG 215.A O no hydrogen 3.212 N/A GLU 221.A N GLY 217.A O no hydrogen 2.990 N/A LEU 222.A N LEU 218.A O no hydrogen 2.751 N/A GLU 223.A N GLN 220.A O no hydrogen 3.276 N/A ALA 224.A N GLU 221.A O no hydrogen 3.178 N/A GLY 225.A N LEU 222.A O no hydrogen 2.816 N/A VAL 226.A N LEU 296.A O no hydrogen 2.945 N/A GLY 228.A N ILE 294.A O no hydrogen 2.949 N/A PHE 230.A N GLY 292.A O no hydrogen 2.898 N/A ARG 231.A NH1 ASP 289.A OD2 no hydrogen 2.653 N/A CYS 232.A N VAL 290.A O no hydrogen 2.795 N/A CYS 232.A SG VAL 290.A O no hydrogen 3.634 N/A CYS 234.A N THR 288.A O no hydrogen 2.899 N/A CYS 234.A SG THR 288.A O no hydrogen 3.579 N/A TYR 235.A N LEU 202.A O no hydrogen 2.752 N/A SER 237.A OG GLU 285.A OE1 no hydrogen 2.131 N/A ALA 238.A N VAL 284.A O no hydrogen 3.194 N/A MET 240.A N VAL 282.A O no hydrogen 2.777 N/A HIS 241.A N ILE 151.A O no hydrogen 2.925 N/A PHE 243.A N LEU 276.A O.A no hydrogen 2.903 N/A PHE 243.A N LEU 276.A O.B no hydrogen 2.856 N/A ALA 244.A N VAL 149.A O no hydrogen 2.866 N/A ILE 245.A N ALA 274.A O no hydrogen 2.798 N/A TRP 246.A N PHE 147.A O no hydrogen 3.073 N/A PHE 247.A N THR 262.A OG1 no hydrogen 3.168 N/A GLN 248.A N GLU 145.A O no hydrogen 3.058 N/A GLN 248.A NE2 GLU 145.A OE1 no hydrogen 2.538 N/A VAL 249.A N LEU 260.A O no hydrogen 2.978 N/A THR 250.A N SER 143.A O no hydrogen 3.006 N/A PHE 251.A N LEU 258.A O no hydrogen 2.818 N/A LEU 258.A N PHE 251.A O no hydrogen 2.840 N/A LEU 260.A N VAL 249.A O no hydrogen 2.876 N/A SER 261.A OG HIS 266.A ND1.B no hydrogen 2.934 N/A THR 262.A N PHE 247.A O no hydrogen 3.085 N/A THR 262.A OG1 PHE 247.A O no hydrogen 2.704 N/A SER 263.A N SER 261.A OG no hydrogen 3.315 N/A PHE 265.A N SER 263.A OG no hydrogen 2.905 N/A HIS 266.A N.A SER 263.A O no hydrogen 3.058 N/A HIS 266.A N.B SER 263.A O no hydrogen 3.067 N/A HIS 266.A ND1.B SER 261.A OG no hydrogen 2.934 N/A HIS 270.A N ASP 18.A OD2 no hydrogen 2.960 N/A HIS 270.A ND1 ASP 18.A OD2 no hydrogen 2.727 N/A TRP 271.A N THR 269.A OG1 no hydrogen 3.130 N/A TRP 271.A NE1 MET 112.A O no hydrogen 2.836 N/A LYS 272.A N THR 269.A O no hydrogen 3.214 N/A GLN 273.A N GLN 194.A O no hydrogen 3.245 N/A GLN 273.A NE2 THR 262.A O no hydrogen 2.954 N/A ALA 274.A N ILE 245.A O no hydrogen 2.939 N/A LEU 275.A N VAL 192.A O no hydrogen 2.707 N/A LEU 276.A N.A PHE 243.A O no hydrogen 2.818 N/A LEU 276.A N.B PHE 243.A O no hydrogen 2.821 N/A TYR 277.A OH ASP 153.A OD2 no hydrogen 2.541 N/A LEU 278.A N HIS 241.A O no hydrogen 2.912 N/A VAL 282.A N MET 240.A O no hydrogen 2.986 N/A VAL 284.A N ALA 238.A O no hydrogen 2.861 N/A GLU 285.A N THR 288.A OG1 no hydrogen 2.859 N/A ASP 287.A N CYS 234.A O no hydrogen 2.913 N/A THR 288.A N GLU 285.A O no hydrogen 3.024 N/A THR 288.A OG1 GLU 285.A O no hydrogen 2.909 N/A VAL 290.A N CYS 232.A O no hydrogen 2.863 N/A SER 291.A N LYS 313.A O no hydrogen 3.057 N/A GLY 292.A N PHE 230.A O no hydrogen 3.025 N/A GLU 293.A N ARG 311.A O no hydrogen 2.818 N/A ILE 294.A N GLY 228.A O no hydrogen 2.958 N/A THR 295.A N LEU 309.A O no hydrogen 2.892 N/A LEU 296.A N VAL 226.A O no hydrogen 2.774 N/A LEU 297.A N ARG 307.A O no hydrogen 2.898 N/A SER 299.A N GLU 119.A OE2 no hydrogen 2.864 N/A SER 299.A OG GLU 119.A OE1 no hydrogen 2.682 N/A SER 299.A OG GLU 119.A OE2 no hydrogen 3.292 N/A ARG 304.A NE SER 299.A OG no hydrogen 2.890 N/A ARG 304.A NH2 LEU 116.A O no hydrogen 3.284 N/A ARG 304.A NH2 GLU 119.A OE1 no hydrogen 3.026 N/A ARG 304.A NH2 SER 120.A OG no hydrogen 2.803 N/A LEU 306.A N MET 326.A O no hydrogen 2.972 N/A ARG 307.A N LEU 297.A O no hydrogen 3.147 N/A VAL 308.A N PHE 324.A O no hydrogen 2.897 N/A LEU 309.A N THR 295.A O no hydrogen 2.846 N/A LEU 310.A N ASP 323.A OD1 no hydrogen 3.160 N/A ARG 311.A N GLU 293.A O no hydrogen 3.051 N/A ARG 311.A NH2 THR 321.A OG1 no hydrogen 2.991 N/A TYR 312.A N LYS 320.A O no hydrogen 2.916 N/A LYS 313.A N SER 291.A O no hydrogen 2.844 N/A LYS 313.A NZ GLY 315.A O no hydrogen 3.452 N/A LYS 313.A NZ GLN 317.A O no hydrogen 2.526 N/A GLY 315.A N ASP 289.A O no hydrogen 2.803 N/A GLN 317.A N VAL 314.A O no hydrogen 3.047 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.690 N/A LYS 320.A N TYR 312.A O no hydrogen 2.786 N/A LYS 322.A N LEU 310.A O no hydrogen 2.882 N/A LYS 322.A NZ HIS 188.A O no hydrogen 2.903 N/A LYS 322.A NZ TYR 277.A O no hydrogen 2.690 N/A LYS 322.A NZ ASN 279.A OD1 no hydrogen 2.891 N/A PHE 324.A N VAL 308.A O no hydrogen 2.713 N/A ALA 325.A N SER 189.A O no hydrogen 3.173 N/A MET 326.A N LEU 306.A O no hydrogen 3.004 N/A