Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5o4q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N LEU 148.A O no hydrogen 2.795 N/A ALA 4.A N ASP 146.A O no hydrogen 2.770 N/A GLY 8.A N ASP 47.A OD1 no hydrogen 2.916 N/A GLU 9.A N ASP 47.A OD1 no hydrogen 3.103 N/A ARG 11.A N THR 48.A O no hydrogen 2.662 N/A ARG 11.A NE ASP 47.A OD2 no hydrogen 3.304 N/A ARG 11.A NH1 ASP 47.A OD2 no hydrogen 2.896 N/A VAL 13.A N HIS 50.A O no hydrogen 3.165 N/A THR 14.A OG1 TYR 16.A OH no hydrogen 2.964 N/A LEU 15.A N GLU 52.A O no hydrogen 2.845 N/A TYR 16.A N GLY 28.A O no hydrogen 2.903 N/A TYR 16.A OH THR 14.A OG1 no hydrogen 2.964 N/A ALA 17.A N GLU 54.A O no hydrogen 2.998 N/A GLU 18.A N GLY 26.A O no hydrogen 2.832 N/A LEU 20.A N GLN 24.A O no hydrogen 2.863 N/A GLN 24.A N ALA 21.A O no hydrogen 3.493 N/A LEU 25.A N ASN 133.A O no hydrogen 2.885 N/A GLY 26.A N GLU 18.A O no hydrogen 2.960 N/A TYR 27.A OH SER 62.A O no hydrogen 2.715 N/A GLY 28.A N TYR 16.A O no hydrogen 3.006 N/A LYS 31.A NZ GLU 54.A OE1 no hydrogen 3.168 N/A GLY 32.A N GLU 18.A OE2 no hydrogen 2.712 N/A LYS 33.A N GLU 30.A O no hydrogen 3.005 N/A SER 35.A N TYR 27.A O no hydrogen 3.031 N/A SER 35.A OG PRO 37.A O no hydrogen 2.788 N/A GLY 38.A N TYR 136.A O no hydrogen 2.735 N/A ILE 41.A N PRO 138.A O no hydrogen 3.061 N/A LEU 43.A N ILE 140.A O no hydrogen 2.832 N/A ASN 44.A N ASP 47.A OD2 no hydrogen 2.765 N/A GLU 45.A N ARG 142.A O no hydrogen 2.891 N/A GLY 46.A N THR 96.A OG1 no hydrogen 2.660 N/A ASP 47.A N ASN 44.A O no hydrogen 2.876 N/A THR 48.A N GLU 9.A O no hydrogen 2.973 N/A LEU 49.A N TRP 94.A O no hydrogen 2.814 N/A HIS 50.A N ARG 11.A O no hydrogen 2.981 N/A HIS 50.A ND1 THR 93.A OG1 no hydrogen 2.821 N/A VAL 51.A N TYR 92.A O no hydrogen 2.582 N/A GLU 52.A N VAL 13.A O no hydrogen 2.760 N/A PHE 53.A N ARG 90.A O no hydrogen 2.959 N/A GLU 54.A N LEU 15.A O no hydrogen 2.834 N/A ASN 55.A N GLY 88.A O no hydrogen 2.982 N/A ASN 55.A ND2 VAL 59.A O no hydrogen 2.969 N/A ASN 55.A ND2 VAL 84.A O no hydrogen 3.025 N/A ASN 55.A ND2 GLU 85.A O no hydrogen 3.192 N/A THR 56.A N ALA 17.A O no hydrogen 3.214 N/A THR 56.A OG1 ALA 17.A O no hydrogen 2.693 N/A LEU 57.A N ASN 55.A OD1 no hydrogen 2.943 N/A VAL 61.A N VAL 84.A O no hydrogen 3.111 N/A SER 62.A N ASP 119.A OD1 no hydrogen 3.022 N/A SER 62.A OG GLY 76.A O no hydrogen 2.585 N/A HIS 64.A N HIS 118.A O no hydrogen 2.836 N/A HIS 66.A N HIS 116.A O no hydrogen 2.990 N/A LEU 68.A N HIS 66.A O no hydrogen 2.882 N/A ASP 69.A N ARG 95.A O no hydrogen 2.738 N/A SER 74.A N GLU 71.A O no hydrogen 2.732 N/A ASP 75.A N ILE 72.A O no hydrogen 3.078 N/A GLY 76.A N SER 82.A OG no hydrogen 2.715 N/A THR 77.A OG1 ASP 75.A OD2 no hydrogen 2.920 N/A GLN 79.A N GLN 79.A OE1 no hydrogen 2.633 N/A GLN 79.A NE2 GLU 125.A O no hydrogen 3.344 N/A ASN 80.A N THR 77.A O no hydrogen 3.369 N/A ASN 80.A N THR 77.A OG1 no hydrogen 3.240 N/A ASN 80.A ND2 ASP 75.A OD2 no hydrogen 2.831 N/A LYS 81.A N LYS 78.A O no hydrogen 2.821 N/A SER 82.A N THR 77.A O no hydrogen 2.896 N/A SER 82.A OG SER 73.A O no hydrogen 2.972 N/A HIS 83.A N HIS 83.A ND1 no hydrogen 2.885 N/A VAL 84.A N VAL 61.A O no hydrogen 2.814 N/A GLU 85.A N GLU 85.A OE2 no hydrogen 2.552 N/A GLY 87.A N ASN 55.A O no hydrogen 2.844 N/A GLY 88.A N GLU 85.A O no hydrogen 3.004 N/A ARG 90.A N PHE 53.A O no hydrogen 2.933 N/A ARG 90.A NH1 LYS 81.A O no hydrogen 3.087 N/A ARG 90.A NH2 SER 73.A O no hydrogen 2.833 N/A ARG 90.A NH2 LYS 81.A O no hydrogen 3.527 N/A TYR 92.A N VAL 51.A O no hydrogen 2.824 N/A TYR 92.A OH SER 82.A O no hydrogen 2.442 N/A THR 93.A N SER 74.A OG no hydrogen 2.998 N/A THR 93.A OG1 HIS 50.A ND1 no hydrogen 2.821 N/A TRP 94.A N LEU 49.A O no hydrogen 2.907 N/A ARG 95.A N ASP 69.A O no hydrogen 2.687 N/A THR 96.A N ASP 47.A O no hydrogen 3.124 N/A THR 96.A OG1 ASN 44.A O no hydrogen 3.370 N/A THR 96.A OG1 ASP 47.A O no hydrogen 3.066 N/A HIS 97.A N SER 111.A OG no hydrogen 3.050 N/A HIS 97.A ND1 ASP 69.A OD2 no hydrogen 2.600 N/A HIS 97.A NE2 ALA 109.A O no hydrogen 2.583 N/A GLY 100.A N ARG 108.A O no hydrogen 3.335 N/A ARG 101.A NH1 GLY 105.A O no hydrogen 2.658 N/A ARG 102.A N THR 106.A O no hydrogen 2.781 N/A ARG 102.A NH1 THR 106.A OG1 no hydrogen 2.560 N/A GLY 105.A N ARG 102.A O no hydrogen 2.973 N/A THR 106.A N ASP 104.A OD1 no hydrogen 3.131 N/A THR 106.A OG1 ASP 104.A OD1 no hydrogen 2.675 N/A THR 106.A OG1 ASP 104.A OD2 no hydrogen 3.472 N/A ARG 108.A N GLY 100.A O no hydrogen 2.909 N/A SER 111.A N HIS 97.A O no hydrogen 3.105 N/A SER 111.A OG ASP 69.A OD2 no hydrogen 3.520 N/A SER 111.A OG HIS 97.A ND1 no hydrogen 3.066 N/A ALA 112.A N GLU 45.A OE2 no hydrogen 2.874 N/A GLY 113.A N VAL 141.A O no hydrogen 2.985 N/A TYR 114.A OH GLU 182.A OE2 no hydrogen 2.811 N/A TRP 115.A N VAL 139.A O no hydrogen 2.694 N/A TRP 115.A NE1 SER 111.A O no hydrogen 2.858 N/A HIS 116.A NE2 ALA 228.A O no hydrogen 3.112 N/A TYR 117.A N GLY 137.A O no hydrogen 2.841 N/A TYR 117.A OH PRO 39.A O no hydrogen 2.734 N/A HIS 118.A N HIS 64.A O no hydrogen 2.903 N/A HIS 118.A ND1 ASP 119.A O no hydrogen 2.747 N/A ASP 119.A N LEU 135.A O no hydrogen 3.107 N/A HIS 120.A N SER 62.A OG no hydrogen 2.870 N/A HIS 120.A ND1 HIS 120.A O no hydrogen 2.702 N/A HIS 120.A ND1 GLU 125.A O no hydrogen 2.985 N/A VAL 121.A N ASP 119.A OD1 no hydrogen 3.150 N/A VAL 121.A N ASP 119.A OD2 no hydrogen 3.107 N/A VAL 122.A N ASP 119.A OD2 no hydrogen 2.765 N/A THR 124.A N VAL 122.A O no hydrogen 2.927 N/A THR 124.A OG1 THR 128.A OG1 no hydrogen 3.133 N/A HIS 126.A N THR 124.A OG1 no hydrogen 3.206 N/A GLY 127.A N THR 124.A O no hydrogen 3.122 N/A THR 128.A N THR 124.A OG1 no hydrogen 3.342 N/A THR 128.A OG1 THR 124.A OG1 no hydrogen 3.133 N/A GLY 129.A N VAL 122.A O no hydrogen 3.041 N/A GLY 130.A N VAL 122.A O no hydrogen 3.284 N/A ILE 131.A N GLY 127.A O no hydrogen 2.750 N/A ARG 132.A N THR 128.A O no hydrogen 3.013 N/A ASN 133.A N GLY 129.A O no hydrogen 3.266 N/A ASN 133.A ND2 GLY 129.A O no hydrogen 2.566 N/A GLY 134.A N GLY 130.A O no hydrogen 3.191 N/A GLY 134.A N ILE 131.A O no hydrogen 3.232 N/A LEU 135.A N GLY 130.A O no hydrogen 2.928 N/A TYR 136.A N GLY 134.A O no hydrogen 2.866 N/A TYR 136.A OH ASN 164.A OD1 no hydrogen 2.661 N/A GLY 137.A N TYR 117.A O no hydrogen 2.901 N/A VAL 139.A N TRP 115.A O no hydrogen 3.048 N/A ILE 140.A N ILE 41.A O no hydrogen 2.847 N/A VAL 141.A N GLY 113.A O no hydrogen 3.132 N/A ARG 142.A N LEU 43.A O no hydrogen 2.620 N/A ARG 142.A NE GLU 42.A OE1 no hydrogen 2.988 N/A ARG 142.A NH1 GLU 182.A OE2 no hydrogen 2.727 N/A ARG 142.A NH2 GLU 42.A OE1 no hydrogen 3.549 N/A ARG 142.A NH2 GLU 182.A OE1 no hydrogen 2.972 N/A ARG 142.A NH2 GLU 182.A OE2 no hydrogen 3.468 N/A ARG 143.A N ASP 146.A OD2 no hydrogen 2.734 N/A ARG 143.A NE GLU 45.A OE1 no hydrogen 2.871 N/A ARG 143.A NE GLU 45.A OE2 no hydrogen 3.374 N/A ARG 143.A NH2 GLU 45.A OE2 no hydrogen 2.757 N/A GLY 145.A N ALA 4.A O no hydrogen 2.873 N/A ASP 146.A N ARG 143.A O no hydrogen 2.777 N/A LEU 148.A N GLY 2.A O no hydrogen 2.982 N/A ASP 150.A N ARG 180.A O no hydrogen 2.862 N/A THR 152.A OG1 GLU 182.A OE1 no hydrogen 2.520 N/A HIS 153.A N GLU 182.A O no hydrogen 2.848 N/A ILE 155.A N VAL 184.A O no hydrogen 2.848 N/A VAL 156.A N ASN 163.A OD1 no hydrogen 2.638 N/A PHE 157.A N ILE 186.A O no hydrogen 2.835 N/A ASN 158.A N THR 161.A O no hydrogen 2.969 N/A ASN 158.A ND2 ILE 131.A O no hydrogen 3.059 N/A ASN 158.A ND2 ARG 132.A O no hydrogen 3.451 N/A ASN 158.A ND2 ASN 164.A OD1 no hydrogen 2.713 N/A ASP 159.A N HIS 188.A O no hydrogen 2.946 N/A THR 161.A N ASN 158.A O no hydrogen 2.957 N/A THR 161.A OG1 ASN 158.A O no hydrogen 2.841 N/A ASN 163.A N VAL 156.A O no hydrogen 2.816 N/A ASN 163.A ND2 THR 154.A O no hydrogen 3.004 N/A ASN 164.A N THR 161.A OG1 no hydrogen 3.068 N/A ASN 164.A ND2 GLN 24.A OE1 no hydrogen 3.602 N/A ASN 164.A ND2 ARG 132.A O no hydrogen 2.918 N/A ARG 165.A N ILE 162.A O no hydrogen 3.015 N/A ARG 165.A NE THR 169.A O no hydrogen 2.622 N/A ARG 165.A NH2 THR 169.A O no hydrogen 2.910 N/A HIS 168.A N GLY 259.A O no hydrogen 3.229 N/A HIS 168.A NE2 ASP 257.A O no hydrogen 2.971 N/A THR 169.A N PRO 166.A O no hydrogen 3.222 N/A THR 169.A OG1 PRO 166.A O no hydrogen 2.532 N/A PHE 173.A N LEU 263.A O no hydrogen 2.856 N/A ALA 175.A N LEU 265.A O no hydrogen 2.773 N/A THR 176.A N ASP 179.A OD2 no hydrogen 2.895 N/A VAL 177.A N LYS 267.A O no hydrogen 2.891 N/A GLY 178.A N ALA 237.A O no hydrogen 2.887 N/A ASP 179.A N THR 176.A O no hydrogen 2.830 N/A ARG 180.A N ASP 150.A OD2 no hydrogen 3.060 N/A ARG 180.A NH1 GLN 234.A OE1 no hydrogen 3.027 N/A VAL 181.A N ILE 235.A O no hydrogen 2.887 N/A GLU 182.A N ALA 151.A O no hydrogen 2.816 N/A ILE 183.A N PHE 233.A O no hydrogen 2.902 N/A VAL 184.A N HIS 153.A O no hydrogen 2.980 N/A MET 185.A N PHE 231.A O no hydrogen 2.860 N/A ILE 186.A N ILE 155.A O no hydrogen 3.052 N/A THR 187.A N ASP 229.A O no hydrogen 3.058 N/A HIS 188.A N PHE 157.A O no hydrogen 2.862 N/A GLU 190.A N ASP 159.A OD1 no hydrogen 3.067 N/A HIS 193.A N CYS 225.A O.A no hydrogen 2.923 N/A HIS 193.A N CYS 225.A O.B no hydrogen 2.876 N/A PHE 195.A N LYS 223.A O no hydrogen 2.915 N/A HIS 196.A N HIS 249.A O no hydrogen 2.996 N/A HIS 196.A ND1 ASP 221.A O no hydrogen 2.735 N/A MET 197.A N ASP 221.A O no hydrogen 3.377 N/A HIS 198.A N MET 247.A O no hydrogen 2.709 N/A HIS 198.A NE2 HIS 249.A NE2 no hydrogen 3.152 N/A HIS 200.A ND1 HIS 198.A O no hydrogen 2.903 N/A TRP 202.A N ILE 220.A O no hydrogen 2.908 N/A ALA 203.A N GLY 208.A O no hydrogen 2.974 N/A ASP 204.A N GLN 218.A O no hydrogen 2.830 N/A ASN 205.A N ALA 203.A O no hydrogen 2.928 N/A ASN 205.A ND2 MET 209.A O no hydrogen 3.088 N/A ASN 205.A ND2 ASP 215.A OD2 no hydrogen 3.012 N/A ARG 206.A NH1 ASP 146.A OD2 no hydrogen 3.049 N/A ARG 206.A NH2 ASP 146.A OD1 no hydrogen 2.957 N/A GLY 208.A N ASN 205.A OD1 no hydrogen 2.786 N/A MET 209.A N THR 207.A OG1 no hydrogen 3.087 N/A THR 211.A N ASP 215.A OD2 no hydrogen 3.029 N/A ASP 215.A N GLY 212.A O no hydrogen 3.213 N/A SER 217.A N ASP 215.A OD1 no hydrogen 2.845 N/A SER 217.A OG ASP 215.A OD1 no hydrogen 2.527 N/A ILE 220.A N TRP 202.A O no hydrogen 2.771 N/A LYS 223.A N PHE 195.A O no hydrogen 2.978 N/A LYS 223.A NZ ASP 204.A OD1 no hydrogen 3.176 N/A LYS 223.A NZ ASP 204.A OD2 no hydrogen 3.411 N/A CYS 225.A N.A HIS 193.A O no hydrogen 2.815 N/A CYS 225.A N.B HIS 193.A O no hydrogen 2.821 N/A CYS 225.A SG.A LYS 223.A O no hydrogen 4.019 N/A CYS 225.A SG.A ILE 224.A O no hydrogen 3.134 N/A CYS 225.A SG.B THR 187.A OG1 no hydrogen 3.176 N/A CYS 225.A SG.B HIS 193.A O no hydrogen 3.663 N/A CYS 225.A SG.B LYS 223.A O no hydrogen 3.845 N/A GLY 226.A N ASP 229.A OD2 no hydrogen 3.023 N/A ALA 228.A N THR 187.A O no hydrogen 2.715 N/A ASP 229.A N GLY 226.A O no hydrogen 2.886 N/A SER 230.A OG TYR 114.A O no hydrogen 2.585 N/A PHE 231.A N MET 185.A O no hydrogen 2.921 N/A PHE 233.A N ILE 183.A O no hydrogen 3.150 N/A GLN 234.A NE2 VAL 147.A O no hydrogen 2.980 N/A GLN 234.A NE2 GLU 182.A OE2 no hydrogen 3.236 N/A ILE 235.A N VAL 181.A O no hydrogen 2.965 N/A ALA 237.A N ASP 179.A O no hydrogen 2.799 N/A GLY 238.A N HIS 200.A NE2 no hydrogen 3.029 N/A GLU 239.A N ILE 236.A O no hydrogen 2.907 N/A VAL 241.A N GLY 238.A O no hydrogen 2.922 N/A GLY 242.A N GLY 238.A O no hydrogen 2.887 N/A GLY 244.A N VAL 266.A O no hydrogen 2.940 N/A TRP 246.A N PHE 264.A O no hydrogen 2.938 N/A TRP 246.A NE1 GLY 242.A O no hydrogen 3.209 N/A TYR 248.A N GLY 262.A O no hydrogen 3.136 N/A TYR 248.A OH PRO 171.A O no hydrogen 2.650 N/A HIS 249.A N HIS 196.A O no hydrogen 3.007 N/A HIS 249.A ND1 CYS 250.A O no hydrogen 2.793 N/A HIS 249.A NE2 HIS 198.A NE2 no hydrogen 3.152 N/A CYS 250.A N MET 260.A O no hydrogen 3.073 N/A CYS 250.A SG HIS 193.A ND1 no hydrogen 3.899 N/A CYS 250.A SG THR 194.A O no hydrogen 3.669 N/A CYS 250.A SG HIS 255.A ND1 no hydrogen 3.742 N/A HIS 251.A N THR 194.A O no hydrogen 2.764 N/A HIS 251.A ND1 HIS 251.A O no hydrogen 2.802 N/A SER 256.A N VAL 252.A O no hydrogen 3.221 N/A SER 256.A OG GLN 253.A O no hydrogen 2.890 N/A ASP 257.A N GLN 253.A O no hydrogen 3.168 N/A MET 258.A N SER 254.A O no hydrogen 2.865 N/A GLY 259.A N SER 256.A O no hydrogen 3.160 N/A MET 260.A N HIS 255.A O no hydrogen 3.036 N/A VAL 261.A N.A GLY 259.A O no hydrogen 2.798 N/A VAL 261.A N.B GLY 259.A O no hydrogen 2.795 N/A GLY 262.A N TYR 248.A O no hydrogen 2.774 N/A LEU 263.A N ASN 172.A OD1 no hydrogen 3.010 N/A PHE 264.A N TRP 246.A O no hydrogen 2.710 N/A LEU 265.A N PHE 173.A O no hydrogen 2.694 N/A VAL 266.A N GLY 244.A O no hydrogen 3.031 N/A LYS 267.A N ALA 175.A O no hydrogen 2.798 N/A LYS 267.A NZ GLU 174.A OE2 no hydrogen 2.710 N/A LYS 268.A N THR 272.A O no hydrogen 2.862 N/A GLY 271.A N LYS 268.A O no hydrogen 2.836 N/A THR 272.A N ASP 270.A OD1 no hydrogen 3.140 N/A THR 272.A OG1 ASP 270.A OD1 no hydrogen 2.647 N/A TYR 276.A N ILE 273.A O no hydrogen 3.155 N/A GLN 279.A N ASP 277.A OD1 no hydrogen 3.149 N/A GLU 280.A N ASP 277.A O no hydrogen 2.953 N/A