Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n5q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ HIS 44.A O no hydrogen 2.782 N/A LYS 4.A NZ THR 47.A O no hydrogen 2.731 N/A ARG 6.A N ARG 2.A O no hydrogen 2.940 N/A ILE 7.A N LEU 3.A O no hydrogen 2.922 N/A PHE 8.A N LYS 4.A O no hydrogen 3.033 N/A ALA 9.A N LYS 5.A O no hydrogen 2.882 N/A ALA 10.A N ARG 6.A O no hydrogen 2.824 N/A VAL 11.A N ILE 7.A O no hydrogen 3.010 N/A SER 12.A N PHE 8.A O no hydrogen 3.128 N/A GLU 13.A N ALA 9.A O no hydrogen 3.019 N/A GLY 14.A N ALA 10.A O no hydrogen 2.874 N/A CYS 15.A N ALA 10.A O no hydrogen 2.936 N/A GLU 18.A N GLU 17.A OE2 no hydrogen 2.676 N/A LEU 19.A N CYS 15.A O no hydrogen 2.914 N/A ARG 20.A N VAL 16.A O no hydrogen 3.085 N/A ARG 20.A NH1 GLU 69.A OE2 no hydrogen 3.320 N/A ARG 20.A NH2 GLU 69.A OE2 no hydrogen 3.548 N/A GLU 21.A N GLU 17.A O no hydrogen 3.333 N/A LEU 22.A N GLU 18.A O no hydrogen 2.789 N/A LEU 23.A N LEU 19.A O no hydrogen 2.866 N/A LEU 23.A N ARG 20.A O no hydrogen 3.189 N/A GLN 24.A N ARG 20.A O no hydrogen 3.037 N/A ASP 25.A N GLU 21.A O no hydrogen 3.007 N/A LEU 26.A N LEU 22.A O no hydrogen 2.922 N/A GLN 27.A N LEU 23.A O no hydrogen 2.880 N/A GLN 27.A NE2 ASN 81.A OD1 no hydrogen 2.863 N/A ASP 28.A N GLN 24.A O no hydrogen 3.003 N/A LEU 29.A N ASP 25.A O no hydrogen 3.081 N/A CYS 30.A N LEU 26.A O no hydrogen 3.290 N/A CYS 30.A N GLN 27.A O no hydrogen 3.178 N/A CYS 30.A SG LEU 26.A O no hydrogen 3.751 N/A ARG 31.A N ASP 28.A O no hydrogen 3.440 N/A ARG 32.A N LEU 29.A O no hydrogen 2.937 N/A ARG 34.A NE CYS 30.A O no hydrogen 2.872 N/A ARG 34.A NH1 LEU 36.A O no hydrogen 2.892 N/A ARG 34.A NH2 CYS 30.A O no hydrogen 2.946 N/A ASP 40.A N ASP 37.A OD1 no hydrogen 2.806 N/A PHE 41.A N ASP 37.A O no hydrogen 2.838 N/A LEU 42.A N VAL 38.A O no hydrogen 2.847 N/A MET 43.A N PRO 39.A O no hydrogen 2.963 N/A HIS 44.A N ASP 40.A O no hydrogen 2.973 N/A LYS 45.A N PHE 41.A O no hydrogen 3.063 N/A LEU 46.A N LEU 42.A O no hydrogen 2.922 N/A LEU 46.A N MET 43.A O no hydrogen 3.177 N/A THR 47.A N HIS 44.A O no hydrogen 3.313 N/A THR 47.A OG1 MET 43.A O no hydrogen 2.635 N/A ALA 48.A N LYS 53.A O no hydrogen 2.787 N/A GLY 52.A N ALA 48.A O no hydrogen 2.854 N/A LYS 53.A N THR 51.A OG1 no hydrogen 3.124 N/A CYS 55.A N LEU 46.A O no hydrogen 3.028 N/A CYS 55.A SG LEU 46.A O no hydrogen 3.836 N/A MET 57.A N THR 54.A OG1 no hydrogen 3.096 N/A LYS 58.A N THR 54.A O no hydrogen 2.848 N/A ALA 59.A N CYS 55.A O no hydrogen 2.851 N/A LEU 60.A N LEU 56.A O no hydrogen 3.117 N/A LEU 61.A N MET 57.A O no hydrogen 2.887 N/A ASN 62.A N ALA 59.A O no hydrogen 3.194 N/A ASN 62.A ND2 LYS 58.A O no hydrogen 2.834 N/A ASN 64.A N THR 67.A OG1 no hydrogen 2.802 N/A ASN 64.A ND2 SER 12.A O no hydrogen 3.457 N/A ASN 64.A ND2 ASN 62.A O no hydrogen 2.968 N/A ASN 66.A N ASN 64.A OD1 no hydrogen 2.779 N/A ASN 66.A ND2 GLY 14.A O no hydrogen 2.849 N/A THR 67.A N ASN 64.A O no hydrogen 3.166 N/A THR 67.A OG1 ASN 64.A O no hydrogen 3.171 N/A ILE 70.A N ASN 66.A O no hydrogen 2.919 N/A VAL 71.A N THR 67.A O no hydrogen 2.804 N/A ARG 72.A N LYS 68.A O no hydrogen 3.010 N/A ILE 73.A N GLU 69.A O no hydrogen 3.014 N/A LEU 74.A N ILE 70.A O no hydrogen 2.987 N/A LEU 75.A N VAL 71.A O no hydrogen 3.046 N/A ALA 76.A N ARG 72.A O no hydrogen 2.934 N/A PHE 77.A N ILE 73.A O no hydrogen 2.914 N/A ALA 78.A N LEU 74.A O no hydrogen 2.964 N/A GLU 79.A N LEU 75.A O no hydrogen 2.860 N/A GLU 80.A N ALA 76.A O no hydrogen 2.767 N/A ASN 81.A N PHE 77.A O no hydrogen 3.134 N/A ASN 81.A N ALA 78.A O no hydrogen 3.128 N/A ASN 81.A ND2 GLN 27.A OE1 no hydrogen 3.074 N/A ASN 81.A ND2 PHE 77.A O no hydrogen 2.973 N/A ASP 82.A N GLU 79.A O no hydrogen 3.033 N/A ILE 83.A N ALA 78.A O no hydrogen 2.851 N/A ARG 86.A NH1 ASP 40.A OD1 no hydrogen 2.758 N/A ARG 86.A NH2 ASP 40.A OD1 no hydrogen 3.078 N/A PHE 87.A N ILE 83.A O no hydrogen 2.811 N/A ILE 88.A N LEU 84.A O no hydrogen 2.907 N/A ASN 89.A N ASP 85.A O no hydrogen 3.054 N/A ASN 89.A ND2 ASP 85.A O no hydrogen 3.233 N/A ASN 89.A ND2 GLY 122.A O no hydrogen 3.112 N/A ALA 90.A N PHE 87.A O no hydrogen 3.427 N/A TYR 92.A N GLN 100.A O no hydrogen 2.998 N/A THR 93.A N THR 51.A O no hydrogen 2.728 N/A GLU 94.A N THR 51.A O no hydrogen 3.183 N/A TYR 97.A N GLU 94.A O no hydrogen 3.012 N/A GLU 98.A N GLU 95.A O no hydrogen 3.100 N/A GLY 99.A N TYR 92.A O no hydrogen 3.415 N/A GLN 100.A N TYR 97.A O no hydrogen 3.283 N/A GLN 100.A NE2 GLY 131.A O no hydrogen 3.150 N/A GLN 100.A NE2 VAL 132.A O no hydrogen 3.298 N/A ASN 104.A N THR 101.A OG1 no hydrogen 3.113 N/A ASN 104.A ND2 GLN 100.A OE1 no hydrogen 3.202 N/A ILE 105.A N THR 101.A O no hydrogen 3.201 N/A ALA 106.A N ALA 102.A O no hydrogen 2.983 N/A ILE 107.A N LEU 103.A O no hydrogen 2.961 N/A GLU 108.A N ASN 104.A O no hydrogen 2.888 N/A ARG 109.A N ILE 105.A O no hydrogen 2.968 N/A ARG 109.A NH1 ASN 135.A O no hydrogen 2.964 N/A ARG 109.A NH2 ASN 135.A O no hydrogen 2.868 N/A ARG 110.A N ILE 107.A O no hydrogen 2.821 N/A ARG 110.A NH1 THR 156.A O no hydrogen 2.784 N/A ARG 110.A NH2 THR 156.A O no hydrogen 3.265 N/A ARG 110.A NH2 ASN 157.A O no hydrogen 3.241 N/A GLN 111.A N ALA 106.A O no hydrogen 2.907 N/A GLN 111.A NE2 ARG 109.A O no hydrogen 3.692 N/A THR 115.A N GLN 111.A O no hydrogen 2.836 N/A THR 115.A OG1 GLN 111.A O no hydrogen 2.729 N/A ALA 116.A N GLY 112.A O no hydrogen 2.933 N/A VAL 117.A N ASP 113.A O no hydrogen 3.240 N/A LEU 118.A N ILE 114.A O no hydrogen 2.817 N/A ILE 119.A N THR 115.A O no hydrogen 2.956 N/A ALA 120.A N ALA 116.A O no hydrogen 3.055 N/A ALA 121.A N VAL 117.A O no hydrogen 2.903 N/A GLY 122.A N ILE 119.A O no hydrogen 2.957 N/A ALA 123.A N LEU 118.A O no hydrogen 2.914 N/A ASP 124.A N ASN 89.A OD1 no hydrogen 2.812 N/A ASN 126.A N ASP 124.A OD1 no hydrogen 2.909 N/A ASN 126.A ND2 GLN 170.A O no hydrogen 2.882 N/A ALA 127.A N ASP 124.A O no hydrogen 3.339 N/A HIS 128.A ND1 ASN 126.A O no hydrogen 2.918 N/A GLY 131.A N GLU 98.A O no hydrogen 2.904 N/A VAL 132.A N ALA 96.A O no hydrogen 2.822 N/A PHE 133.A N GLU 141.A O no hydrogen 3.053 N/A LYS 137.A N GLU 108.A OE2 no hydrogen 2.957 N/A TYR 138.A N GLU 108.A OE1 no hydrogen 2.658 N/A GLN 139.A N GLU 108.A OE1 no hydrogen 2.817 N/A GLY 142.A N HIS 140.A ND1 no hydrogen 2.827 N/A PHE 143.A N HIS 140.A O no hydrogen 3.026 N/A TYR 144.A OH ASP 177.A OD2 no hydrogen 2.472 N/A ALA 151.A N THR 148.A OG1 no hydrogen 2.977 N/A LEU 152.A N THR 148.A O no hydrogen 2.781 N/A ALA 153.A N PRO 149.A O no hydrogen 3.018 N/A ALA 154.A N LEU 150.A O no hydrogen 3.024 N/A CYS 155.A N ALA 151.A O no hydrogen 2.887 N/A CYS 155.A SG PHE 145.A O no hydrogen 3.938 N/A CYS 155.A SG ALA 151.A O no hydrogen 3.320 N/A THR 156.A N LEU 152.A O no hydrogen 3.129 N/A THR 156.A OG1 LEU 152.A O no hydrogen 2.662 N/A THR 156.A OG1 ALA 153.A O no hydrogen 3.359 N/A ASN 157.A N ALA 154.A O no hydrogen 3.249 N/A GLN 158.A N ALA 153.A O no hydrogen 2.863 N/A GLN 158.A NE2 ILE 107.A O no hydrogen 2.902 N/A GLN 158.A NE2 THR 156.A OG1 no hydrogen 2.907 N/A ILE 161.A N GLN 158.A O no hydrogen 3.083 N/A VAL 162.A N GLN 158.A O no hydrogen 3.095 N/A GLN 163.A N PRO 159.A O no hydrogen 2.811 N/A GLN 163.A NE2 PRO 159.A O no hydrogen 3.283 N/A LEU 164.A N GLU 160.A O no hydrogen 3.010 N/A LEU 165.A N ILE 161.A O no hydrogen 2.935 N/A MET 166.A N VAL 162.A O no hydrogen 2.923 N/A GLU 167.A N GLN 163.A O no hydrogen 3.083 N/A ASN 168.A N LEU 165.A O no hydrogen 3.073 N/A GLN 170.A N ASN 168.A OD1 no hydrogen 2.952 N/A THR 171.A N ASN 168.A O no hydrogen 3.081 N/A THR 171.A OG1 LEU 165.A O no hydrogen 2.739 N/A THR 171.A OG1 ASN 168.A O no hydrogen 3.292 N/A ASP 172.A N ASN 126.A OD1 no hydrogen 2.872 N/A THR 174.A OG1 ASP 172.A OD1 no hydrogen 3.490 N/A SER 175.A N ASP 172.A O no hydrogen 3.287 N/A GLN 176.A NE2 GLY 180.A O no hydrogen 2.801 N/A GLN 176.A NE2 ARG 221.A O no hydrogen 2.892 N/A ASP 177.A N ASN 181.A O no hydrogen 2.837 N/A SER 178.A N GLU 147.A OE1 no hydrogen 3.164 N/A SER 178.A OG GLU 147.A OE1 no hydrogen 3.214 N/A SER 178.A OG GLU 147.A OE2 no hydrogen 2.861 N/A ARG 179.A N ASP 177.A OD1 no hydrogen 2.792 N/A GLY 180.A N ASP 177.A O no hydrogen 2.737 N/A ASN 181.A N ASP 177.A OD1 no hydrogen 3.014 N/A ASN 181.A ND2 TYR 144.A OH no hydrogen 2.844 N/A ASN 182.A N HIS 185.A ND1 no hydrogen 2.992 N/A ASN 182.A ND2 LEU 217.A O no hydrogen 3.019 N/A LEU 184.A N ASN 182.A OD1 no hydrogen 2.812 N/A HIS 185.A N ASN 182.A OD1 no hydrogen 3.140 N/A HIS 185.A NE2 LEU 226.A O no hydrogen 2.792 N/A ALA 186.A N ASN 182.A O no hydrogen 3.024 N/A LEU 187.A N ILE 183.A O no hydrogen 2.962 N/A VAL 188.A N LEU 184.A O no hydrogen 2.917 N/A THR 189.A N HIS 185.A O no hydrogen 3.042 N/A THR 189.A OG1 ALA 186.A O no hydrogen 2.638 N/A VAL 190.A N ALA 186.A O no hydrogen 3.141 N/A ALA 191.A N VAL 188.A O no hydrogen 3.220 N/A GLU 192.A N GLN 197.A OE1 no hydrogen 2.560 N/A PHE 194.A N GLU 192.A O no hydrogen 2.864 N/A PHE 194.A N ASN 198.A OD1 no hydrogen 3.152 N/A GLN 197.A NE2 GLN 197.A O no hydrogen 2.396 N/A ASN 198.A ND2 GLU 239.A OE2 no hydrogen 3.155 N/A ASP 199.A N GLN 197.A O no hydrogen 2.199 N/A ARG 203.A N ASP 199.A O no hydrogen 2.964 N/A MET 204.A N PHE 200.A O no hydrogen 2.821 N/A TYR 205.A N VAL 201.A O no hydrogen 2.941 N/A ASP 206.A N LYS 202.A O no hydrogen 2.983 N/A MET 207.A N ARG 203.A O no hydrogen 2.866 N/A ILE 208.A N MET 204.A O no hydrogen 2.885 N/A LEU 209.A N TYR 205.A O no hydrogen 3.192 N/A LEU 210.A N ASP 206.A O no hydrogen 2.889 N/A ARG 211.A N MET 207.A O no hydrogen 2.819 N/A SER 212.A N ILE 208.A O no hydrogen 2.885 N/A SER 212.A OG ILE 208.A O no hydrogen 2.635 N/A GLY 213.A N LEU 209.A O no hydrogen 2.870 N/A ASN 214.A N SER 212.A OG no hydrogen 2.874 N/A ASN 214.A ND2 GLU 216.A OE2 no hydrogen 2.813 N/A TRP 215.A N GLY 213.A O no hydrogen 2.969 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.596 N/A LEU 217.A N ASN 214.A O no hydrogen 2.950 N/A GLU 218.A N TRP 215.A O no hydrogen 2.975 N/A THR 219.A N GLU 216.A O no hydrogen 2.982 N/A THR 219.A OG1 GLU 216.A O no hydrogen 3.205 N/A MET 220.A N GLU 216.A O no hydrogen 3.135 N/A ARG 221.A NH1 GLY 225.A O no hydrogen 2.855 N/A ASN 222.A N LEU 226.A O no hydrogen 2.841 N/A ASN 222.A ND2 ASN 181.A OD1 no hydrogen 3.057 N/A ASN 223.A N ARG 179.A O no hydrogen 2.838 N/A ASP 224.A N ASN 222.A OD1 no hydrogen 2.787 N/A GLY 225.A N ASN 222.A O no hydrogen 2.851 N/A LEU 226.A N ASN 222.A OD1 no hydrogen 3.068 N/A THR 227.A N GLN 230.A OE1 no hydrogen 3.104 N/A THR 227.A OG1 GLN 230.A OE1 no hydrogen 3.439 N/A GLN 230.A N THR 227.A OG1 no hydrogen 3.139 N/A LEU 231.A N THR 227.A O no hydrogen 2.840 N/A ALA 232.A N PRO 228.A O no hydrogen 2.995 N/A ALA 233.A N LEU 229.A O no hydrogen 3.034 N/A LYS 234.A N GLN 230.A O no hydrogen 2.753 N/A MET 235.A N LEU 231.A O no hydrogen 2.826 N/A GLY 236.A N ALA 233.A O no hydrogen 3.051 N/A LYS 237.A N ALA 232.A O no hydrogen 2.978 N/A LYS 237.A NZ VAL 188.A O no hydrogen 2.971 N/A LYS 237.A NZ THR 189.A O no hydrogen 2.640 N/A LYS 237.A NZ ALA 191.A O no hydrogen 2.571 N/A GLU 239.A N ASP 193.A OD1 no hydrogen 2.941 N/A LEU 241.A N LYS 237.A O no hydrogen 3.097 N/A LYS 242.A N ALA 238.A O no hydrogen 2.824 N/A TYR 243.A N GLU 239.A O no hydrogen 3.004 N/A ILE 244.A N ILE 240.A O no hydrogen 2.818 N/A LEU 245.A N LEU 241.A O no hydrogen 2.946 N/A SER 246.A N LYS 242.A O no hydrogen 3.007 N/A SER 246.A OG TYR 243.A O no hydrogen 2.387 N/A ARG 247.A N ILE 244.A O no hydrogen 3.139 N/A ARG 247.A NE GLU 218.A OE1 no hydrogen 3.478 N/A ARG 247.A NH1 ASP 206.A OD2 no hydrogen 2.652 N/A ARG 247.A NH1 TYR 243.A OH no hydrogen 3.224 N/A GLU 248.A N LEU 245.A O no hydrogen 2.838 N/A ILE 249.A N SER 246.A O no hydrogen 3.314 N/A