Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6brw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 79.A O no hydrogen 2.999 N/A ASN 6.A ND2 GLU 85.A OE1 no hydrogen 3.104 N/A ASP 8.A N ARG 5.A O no hydrogen 3.042 N/A LEU 9.A N ASN 6.A O no hydrogen 2.970 N/A ILE 10.A N VAL 27.A O no hydrogen 2.868 N/A ASN 12.A N LYS 25.A O no hydrogen 2.655 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 3.046 N/A LEU 15.A N ILE 23.A O no hydrogen 2.832 N/A GLY 16.A N SER 14.A OG no hydrogen 3.312 N/A GLY 18.A N THR 21.A O no hydrogen 3.043 N/A THR 21.A N GLY 18.A O no hydrogen 3.483 N/A LYS 22.A N VAL 46.A O no hydrogen 2.912 N/A ILE 23.A N GLY 16.A O no hydrogen 2.857 N/A PHE 24.A N LEU 44.A O no hydrogen 2.866 N/A LYS 25.A N GLU 13.A O no hydrogen 2.804 N/A LYS 25.A NZ GLU 41.A OE2 no hydrogen 2.840 N/A GLY 26.A N VAL 42.A O no hydrogen 2.861 N/A VAL 27.A N ILE 10.A O no hydrogen 2.906 N/A ARG 28.A N THR 40.A O no hydrogen 2.850 N/A ARG 29.A N ASP 8.A O no hydrogen 3.013 N/A GLU 30.A N HIS 38.A O no hydrogen 2.907 N/A GLY 32.A N GLN 36.A O no hydrogen 2.809 N/A GLY 35.A N GLY 32.A O no hydrogen 3.154 N/A GLN 36.A N ASP 33.A O no hydrogen 3.358 N/A HIS 38.A N GLU 30.A O no hydrogen 2.887 N/A THR 40.A N ARG 28.A O no hydrogen 2.868 N/A THR 40.A OG1 GLU 30.A OE2 no hydrogen 2.418 N/A VAL 42.A N GLY 26.A O no hydrogen 2.905 N/A LEU 43.A N GLN 90.A O no hydrogen 2.858 N/A LEU 44.A N PHE 24.A O no hydrogen 2.868 N/A LYS 45.A N LEU 88.A O no hydrogen 2.900 N/A LYS 45.A NZ GLN 90.A OE1 no hydrogen 3.056 N/A LYS 45.A NZ ASP 163.A OD1 no hydrogen 2.733 N/A VAL 46.A N LYS 22.A O no hydrogen 2.859 N/A LEU 47.A N ASN 86.A O no hydrogen 3.027 N/A ASP 48.A N PHE 20.A O no hydrogen 2.765 N/A HIS 51.A N ASP 48.A O no hydrogen 2.811 N/A ARG 52.A N LYS 49.A O no hydrogen 2.935 N/A TYR 54.A N HIS 51.A O no hydrogen 2.909 N/A SER 55.A N ARG 52.A O no hydrogen 2.925 N/A PHE 58.A N TYR 54.A O no hydrogen 2.722 N/A PHE 59.A N SER 55.A O no hydrogen 2.823 N/A GLU 60.A N GLU 56.A O no hydrogen 2.709 N/A ALA 61.A N SER 57.A O no hydrogen 2.993 N/A SER 63.A N PHE 59.A O no hydrogen 2.682 N/A MET 64.A N GLU 60.A O no hydrogen 2.713 N/A MET 65.A N ALA 61.A O no hydrogen 3.385 N/A SER 66.A N ALA 62.A O no hydrogen 2.992 N/A SER 66.A N SER 63.A O no hydrogen 2.961 N/A SER 66.A OG ALA 62.A O no hydrogen 3.397 N/A LYS 67.A N SER 63.A O no hydrogen 3.314 N/A HIS 72.A N HIS 70.A ND1 no hydrogen 3.001 N/A HIS 72.A ND1 ILE 159.A O no hydrogen 2.653 N/A LEU 73.A N HIS 70.A O no hydrogen 3.022 N/A VAL 74.A N LEU 161.A O no hydrogen 3.082 N/A LEU 75.A N GLU 91.A OE2 no hydrogen 2.621 N/A ASN 76.A ND2 SER 66.A OG no hydrogen 2.752 N/A TYR 77.A N VAL 89.A O no hydrogen 2.709 N/A GLY 78.A N VAL 89.A O no hydrogen 3.046 N/A VAL 79.A N HIS 2.A O no hydrogen 2.934 N/A CYS 80.A N ILE 87.A O no hydrogen 2.887 N/A CYS 80.A SG ILE 4.A O no hydrogen 3.494 N/A CYS 80.A SG ASN 6.A OD1 no hydrogen 3.586 N/A CYS 82.A SG ILE 4.A O no hydrogen 3.667 N/A ILE 87.A N CYS 80.A O no hydrogen 2.901 N/A LEU 88.A N LYS 45.A O no hydrogen 2.838 N/A VAL 89.A N GLY 78.A O no hydrogen 2.875 N/A GLN 90.A N LEU 43.A O no hydrogen 2.940 N/A GLN 90.A NE2 ASN 76.A OD1 no hydrogen 2.736 N/A GLN 90.A NE2 ASP 163.A OD1 no hydrogen 2.922 N/A GLU 91.A N LEU 75.A O no hydrogen 2.903 N/A PHE 95.A N LEU 145.A O no hydrogen 3.188 N/A GLY 96.A N VAL 93.A O no hydrogen 3.445 N/A SER 97.A OG.A ASP 99.A OD1 no hydrogen 2.755 N/A SER 97.A OG.B LYS 141.A O no hydrogen 2.827 N/A LEU 98.A N ILE 143.A O no hydrogen 2.598 N/A THR 100.A OG1 SER 97.A OG.A no hydrogen 3.356 N/A THR 100.A OG1 ASP 99.A OD1 no hydrogen 3.561 N/A TYR 101.A N SER 97.A O no hydrogen 3.183 N/A TYR 101.A OH GLU 148.A OE1 no hydrogen 2.444 N/A LEU 102.A N LEU 98.A O no hydrogen 2.777 N/A LYS 103.A N ASP 99.A O no hydrogen 3.022 N/A LYS 104.A N THR 100.A O no hydrogen 2.920 N/A ASN 105.A N TYR 101.A O no hydrogen 2.924 N/A ASN 105.A ND2 TYR 101.A O no hydrogen 2.991 N/A LYS 106.A N LYS 103.A O no hydrogen 3.441 N/A CYS 108.A N ASN 105.A O no hydrogen 3.037 N/A CYS 108.A SG ASN 105.A O no hydrogen 3.973 N/A ILE 109.A N LYS 106.A O no hydrogen 3.291 N/A TRP 113.A N ASN 110.A OD1 no hydrogen 3.025 N/A LYS 114.A N ASN 110.A O no hydrogen 3.120 N/A LEU 115.A N ILE 111.A O no hydrogen 2.846 N/A GLU 116.A N LEU 112.A O no hydrogen 2.879 N/A VAL 117.A N TRP 113.A O no hydrogen 3.002 N/A ALA 118.A N LYS 114.A O no hydrogen 2.866 N/A LYS 119.A N LEU 115.A O no hydrogen 2.854 N/A GLN 120.A N GLU 116.A O no hydrogen 2.981 N/A GLN 120.A NE2 GLU 116.A OE2 no hydrogen 3.090 N/A GLN 120.A NE2 PRO 157.A O no hydrogen 2.541 N/A LEU 121.A N VAL 117.A O no hydrogen 2.988 N/A ALA 122.A N ALA 118.A O no hydrogen 2.837 N/A ALA 123.A N LYS 119.A O no hydrogen 2.848 N/A ALA 124.A N GLN 120.A O no hydrogen 2.969 N/A MET 125.A N LEU 121.A O no hydrogen 2.896 N/A HIS 126.A N ALA 122.A O no hydrogen 2.769 N/A PHE 127.A N ALA 123.A O no hydrogen 2.929 N/A LEU 128.A N ALA 124.A O no hydrogen 2.973 N/A GLU 129.A N MET 125.A O no hydrogen 2.801 N/A GLU 130.A N HIS 126.A O no hydrogen 2.856 N/A ASN 131.A N PHE 127.A O no hydrogen 3.080 N/A ASN 131.A ND2 PHE 127.A O no hydrogen 2.956 N/A THR 132.A N GLU 129.A O no hydrogen 2.803 N/A THR 132.A OG1 ASN 131.A O no hydrogen 2.605 N/A LEU 133.A N LEU 128.A O no hydrogen 2.904 N/A HIS 135.A N ASP 199.A OD2 no hydrogen 2.629 N/A HIS 135.A NE2 SER 162.A O no hydrogen 2.629 N/A GLY 136.A N ASP 199.A OD1 no hydrogen 2.912 N/A ASN 137.A N HIS 135.A ND1 no hydrogen 3.083 N/A ASN 137.A ND2 PRO 164.A O no hydrogen 3.035 N/A CYS 139.A SG ASN 137.A O no hydrogen 3.898 N/A CYS 139.A SG ASN 137.A OD1 no hydrogen 3.874 N/A ALA 140.A N GLU 209.A OE1 no hydrogen 2.766 N/A ASN 142.A N CYS 139.A O no hydrogen 2.946 N/A ASN 142.A ND2 ASN 137.A O no hydrogen 2.751 N/A ILE 143.A N ALA 140.A O no hydrogen 3.101 N/A LEU 144.A N LYS 160.A O no hydrogen 2.849 N/A LEU 145.A N GLY 96.A O no hydrogen 2.969 N/A ILE 146.A N PHE 158.A O no hydrogen 2.849 N/A ARG 147.A N PHE 158.A O no hydrogen 3.488 N/A ARG 147.A NE PRO 156.A O no hydrogen 2.968 N/A ARG 147.A NH2 PRO 156.A O no hydrogen 3.540 N/A ASP 150.A N ASN 155.A O no hydrogen 3.028 N/A LYS 152.A N ASP 150.A OD1 no hydrogen 3.105 N/A THR 153.A N ASP 150.A O no hydrogen 3.176 N/A THR 153.A OG1 ASP 150.A OD2 no hydrogen 2.783 N/A GLY 154.A N ARG 151.A O no hydrogen 3.246 N/A PHE 158.A N ARG 147.A O no hydrogen 3.140 N/A ILE 159.A N GLN 120.A OE1 no hydrogen 2.852 N/A LYS 160.A N LEU 144.A O no hydrogen 2.864 N/A LYS 160.A NZ LEU 73.A O no hydrogen 3.387 N/A LYS 160.A NZ GLU 91.A OE1 no hydrogen 3.191 N/A LYS 160.A NZ GLU 91.A OE2 no hydrogen 2.703 N/A LEU 161.A N HIS 72.A O no hydrogen 2.651 N/A SER 162.A N ASN 142.A O no hydrogen 2.762 N/A GLY 165.A N ASP 163.A OD2 no hydrogen 2.966 N/A SER 167.A N SER 57.A OG no hydrogen 3.235 N/A SER 167.A OG THR 169.A OG1 no hydrogen 2.718 N/A THR 169.A N SER 167.A OG no hydrogen 3.023 N/A THR 169.A OG1 SER 167.A OG no hydrogen 2.718 N/A VAL 170.A N SER 167.A O no hydrogen 3.085 N/A LEU 176.A N PRO 172.A O no hydrogen 3.148 N/A GLN 177.A N LYS 173.A O no hydrogen 2.891 N/A GLU 178.A N ASP 174.A O no hydrogen 2.931 N/A ARG 179.A N ILE 175.A O no hydrogen 3.218 N/A ARG 179.A N LEU 176.A O no hydrogen 3.200 N/A ARG 179.A NH2 THR 19.A OG1 no hydrogen 2.572 N/A ILE 180.A N GLN 177.A O no hydrogen 3.134 N/A TRP 182.A N ARG 179.A O no hydrogen 2.718 N/A TRP 182.A NE1 GLU 209.A OE1 no hydrogen 2.807 N/A VAL 183.A N ARG 179.A O no hydrogen 3.121 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.829 N/A CYS 187.A N PRO 184.A O no hydrogen 2.960 N/A CYS 187.A SG ASN 193.A O no hydrogen 3.833 N/A CYS 187.A SG THR 198.A OG1 no hydrogen 3.348 N/A ILE 188.A N PRO 184.A O no hydrogen 3.087 N/A GLU 189.A N PRO 185.A O no hydrogen 2.940 N/A ASN 190.A N GLU 186.A O no hydrogen 2.887 N/A LYS 192.A N ASN 190.A OD1 no hydrogen 3.220 N/A ASN 193.A N ASN 190.A O no hydrogen 2.798 N/A ASN 193.A ND2 GLU 186.A O no hydrogen 3.204 N/A ASN 195.A N THR 198.A OG1 no hydrogen 3.354 N/A ALA 197.A N ASN 195.A OD1 no hydrogen 3.107 N/A ASP 199.A N LEU 196.A O no hydrogen 2.970 N/A LYS 200.A NZ GLU 129.A OE2 no hydrogen 2.500 N/A TRP 201.A N ALA 197.A O no hydrogen 3.113 N/A TRP 201.A NE1 PRO 181.A O no hydrogen 2.772 N/A SER 202.A N THR 198.A O no hydrogen 2.979 N/A SER 202.A OG TRP 182.A O no hydrogen 2.808 N/A SER 202.A OG THR 198.A O no hydrogen 3.061 N/A PHE 203.A N ASP 199.A O no hydrogen 2.850 N/A GLY 204.A N LYS 200.A O no hydrogen 3.004 N/A THR 205.A N TRP 201.A O no hydrogen 3.060 N/A THR 205.A OG1 PRO 181.A O no hydrogen 2.815 N/A THR 205.A OG1 TRP 201.A O no hydrogen 3.336 N/A THR 206.A N SER 202.A O no hydrogen 2.883 N/A THR 206.A OG1 SER 202.A O no hydrogen 2.668 N/A LEU 207.A N PHE 203.A O no hydrogen 2.874 N/A TRP 208.A N GLY 204.A O no hydrogen 3.008 N/A TRP 208.A NE1 PRO 237.A O no hydrogen 2.665 N/A GLU 209.A N THR 205.A O no hydrogen 2.987 N/A ILE 210.A N THR 206.A O no hydrogen 2.854 N/A CYS 211.A N LEU 207.A O no hydrogen 2.885 N/A CYS 211.A SG LEU 207.A O no hydrogen 3.307 N/A SER 212.A N GLU 209.A O no hydrogen 3.112 N/A SER 212.A OG TRP 208.A O no hydrogen 2.744 N/A GLY 214.A N GLU 209.A O no hydrogen 3.400 N/A ASP 215.A N SER 212.A O no hydrogen 3.029 N/A LYS 216.A NZ ASP 99.A OD2 no hydrogen 3.498 N/A LYS 216.A NZ GLY 214.A O no hydrogen 3.310 N/A SER 219.A N LYS 216.A O no hydrogen 3.274 N/A SER 219.A OG LYS 216.A O no hydrogen 3.155 N/A LEU 221.A N LEU 218.A O no hydrogen 2.949 N/A ARG 225.A N ASP 222.A OD1 no hydrogen 3.035 N/A LYS 226.A N ASP 222.A O no hydrogen 2.918 N/A LYS 226.A NZ GLU 178.A O no hydrogen 3.224 N/A LYS 226.A NZ ILE 180.A O no hydrogen 2.650 N/A LEU 227.A N SER 223.A O no hydrogen 2.964 N/A GLN 228.A N GLN 224.A O no hydrogen 2.956 N/A GLN 228.A NE2 ASP 232.A OD2 no hydrogen 3.368 N/A PHE 229.A N ARG 225.A O no hydrogen 2.848 N/A TYR 230.A N LYS 226.A O no hydrogen 3.063 N/A TYR 230.A OH VAL 183.A O no hydrogen 2.601 N/A GLU 231.A N LEU 227.A O no hydrogen 2.877 N/A ASP 232.A N GLN 228.A O no hydrogen 2.724 N/A ARG 233.A N TYR 230.A O no hydrogen 2.993 N/A HIS 234.A N PHE 229.A O no hydrogen 3.140 N/A GLN 235.A NE2 MET 252.A O no hydrogen 3.065 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.748 N/A ALA 245.A N ALA 242.A O no hydrogen 2.931 N/A ILE 248.A N LEU 244.A O no hydrogen 2.902 N/A ASN 249.A N ALA 245.A O no hydrogen 2.935 N/A ASN 250.A N ASN 246.A O no hydrogen 2.818 N/A CYS 251.A N LEU 247.A O no hydrogen 2.921 N/A CYS 251.A SG LEU 247.A O no hydrogen 3.397 N/A MET 252.A N ILE 248.A O no hydrogen 2.928 N/A TYR 254.A OH HIS 234.A O no hydrogen 2.561 N/A GLU 255.A N ASP 253.A OD1 no hydrogen 2.791 N/A ASP 257.A N GLU 255.A OE1 no hydrogen 3.348 N/A HIS 258.A N GLU 255.A O no hydrogen 2.944 N/A ARG 259.A N PRO 256.A O no hydrogen 3.151 N/A ARG 259.A NE ASP 253.A O no hydrogen 2.759 N/A ARG 259.A NH1 GLU 186.A OE2 no hydrogen 2.518 N/A ARG 259.A NH1 ALA 197.A O no hydrogen 2.903 N/A ARG 259.A NH2 GLU 186.A OE1 no hydrogen 2.583 N/A ARG 259.A NH2 GLU 186.A OE2 no hydrogen 3.207 N/A ARG 259.A NH2 ASP 253.A O no hydrogen 3.000 N/A PHE 262.A N GLU 129.A OE1 no hydrogen 3.346 N/A PHE 262.A N GLU 129.A OE2 no hydrogen 3.130 N/A ALA 264.A N SER 261.A OG no hydrogen 3.258 N/A ILE 265.A N SER 261.A O no hydrogen 2.934 N/A ILE 266.A N PHE 262.A O no hydrogen 2.860 N/A ARG 267.A N ARG 263.A O no hydrogen 2.905 N/A ASP 268.A N ALA 264.A O no hydrogen 2.960 N/A LEU 269.A N ILE 265.A O no hydrogen 2.920 N/A ASN 270.A N ILE 266.A O no hydrogen 2.893 N/A SER 271.A N ARG 267.A O no hydrogen 2.910 N/A SER 271.A OG ASP 268.A O no hydrogen 2.703 N/A LEU 272.A N ASP 268.A O no hydrogen 2.999 N/A LEU 272.A N LEU 269.A O no hydrogen 3.224 N/A