Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5i3j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLN 224.A O no hydrogen 2.753 N/A LYS 2.A NZ VAL 227.A O no hydrogen 2.850 N/A GLN 4.A NE2 ASP 35.A OD1 no hydrogen 2.950 N/A ILE 6.A N ASN 228.A O no hydrogen 3.034 N/A ALA 7.A N GLN 37.A O no hydrogen 2.931 N/A ALA 8.A N PHE 230.A O no hydrogen 2.776 N/A ALA 9.A N VAL 39.A O no hydrogen 2.675 N/A ASN 10.A N VAL 232.A O no hydrogen 2.899 N/A TRP 11.A N ALA 41.A O no hydrogen 3.104 N/A TRP 11.A NE1 SER 236.A O no hydrogen 2.985 N/A LYS 12.A N ASN 10.A OD1 no hydrogen 3.044 N/A LYS 12.A NZ GLU 96.A OE2 no hydrogen 2.705 N/A ASN 14.A ND2 TRP 11.A O no hydrogen 2.820 N/A SER 16.A N SER 19.A OG no hydrogen 3.206 N/A SER 16.A OG SER 19.A OG no hydrogen 2.881 N/A GLN 18.A NE2 GLU 22.A OE2 no hydrogen 2.980 N/A SER 19.A N SER 16.A OG no hydrogen 3.204 N/A SER 19.A OG SER 16.A O no hydrogen 3.352 N/A SER 19.A OG SER 16.A OG no hydrogen 2.881 N/A LEU 20.A N SER 16.A O no hydrogen 2.873 N/A SER 21.A N GLN 17.A O no hydrogen 2.987 N/A SER 21.A OG.A GLN 17.A O no hydrogen 3.357 N/A SER 21.A OG.A GLN 18.A O no hydrogen 2.698 N/A GLU 22.A N GLN 18.A O no hydrogen 3.145 N/A LEU 23.A N SER 19.A O no hydrogen 3.025 N/A ILE 24.A N LEU 20.A O no hydrogen 2.709 N/A ASP 25.A N SER 21.A O no hydrogen 2.985 N/A LEU 26.A N GLU 22.A O no hydrogen 2.907 N/A PHE 27.A N LEU 23.A O no hydrogen 2.947 N/A ASN 28.A N ILE 24.A O no hydrogen 2.849 N/A ASN 28.A ND2 ASP 25.A OD1 no hydrogen 3.146 N/A ASN 28.A ND2 ARG 53.A O no hydrogen 2.728 N/A SER 29.A N ASP 25.A O no hydrogen 2.859 N/A SER 29.A N LEU 26.A O no hydrogen 2.982 N/A SER 29.A OG LEU 26.A O no hydrogen 2.533 N/A THR 30.A N PHE 27.A O no hydrogen 3.002 N/A THR 30.A OG1 LEU 26.A O no hydrogen 3.243 N/A THR 30.A OG1 PHE 27.A O no hydrogen 3.450 N/A HIS 34.A NE2 THR 248.A OG1 no hydrogen 2.846 N/A GLN 37.A N PRO 5.A O no hydrogen 2.966 N/A GLN 37.A NE2 CYS 38.A O no hydrogen 3.146 N/A CYS 38.A N LYS 58.A O no hydrogen 2.864 N/A VAL 39.A N ALA 7.A O no hydrogen 2.895 N/A VAL 40.A N VAL 60.A O no hydrogen 2.961 N/A ALA 41.A N ALA 9.A O no hydrogen 2.792 N/A SER 42.A OG THR 43.A O no hydrogen 3.067 N/A THR 43.A OG1 HIS 46.A ND1 no hydrogen 3.038 N/A HIS 46.A N THR 43.A O no hydrogen 3.051 N/A LEU 47.A N PHE 44.A O no hydrogen 3.304 N/A THR 50.A N HIS 46.A O no hydrogen 2.964 N/A THR 50.A OG1 HIS 46.A O no hydrogen 2.802 N/A LYS 51.A N LEU 47.A O no hydrogen 2.853 N/A LYS 51.A NZ PHE 85.A O no hydrogen 2.881 N/A GLU 52.A N ALA 48.A O no hydrogen 3.032 N/A ARG 53.A N MET 49.A O no hydrogen 2.724 N/A LEU 54.A N THR 50.A O no hydrogen 3.041 N/A SER 55.A N ASN 28.A OD1 no hydrogen 2.902 N/A HIS 56.A N ASN 28.A OD1 no hydrogen 3.191 N/A HIS 56.A NE2 THR 30.A O no hydrogen 2.761 N/A LYS 58.A N HIS 56.A ND1 no hydrogen 3.112 N/A LYS 58.A NZ ILE 32.A O no hydrogen 2.384 N/A PHE 59.A N HIS 56.A O no hydrogen 3.110 N/A VAL 60.A N CYS 38.A O no hydrogen 2.907 N/A ALA 62.A N VAL 40.A O no hydrogen 2.802 N/A ALA 63.A N TRP 89.A O no hydrogen 3.090 N/A GLN 64.A NE2 LYS 12.A O no hydrogen 2.847 N/A GLN 64.A NE2 ALA 41.A O no hydrogen 2.960 N/A ILE 67.A N VAL 77.A O no hydrogen 2.860 N/A SER 70.A OG SER 78.A OG no hydrogen 2.645 N/A PHE 73.A N GLY 71.A O no hydrogen 2.906 N/A GLU 76.A N PHE 73.A O no hydrogen 3.037 N/A SER 78.A OG SER 70.A OG no hydrogen 2.645 N/A LEU 79.A N ILE 67.A O no hydrogen 2.930 N/A ILE 81.A N SER 78.A OG no hydrogen 3.422 N/A LEU 82.A N SER 78.A O no hydrogen 3.159 N/A LYS 83.A N LEU 79.A O no hydrogen 2.855 N/A LYS 83.A NZ SER 118.A O no hydrogen 3.207 N/A ASP 84.A N PRO 80.A O no hydrogen 2.866 N/A PHE 85.A N ILE 81.A O no hydrogen 3.009 N/A GLY 86.A N LYS 83.A O no hydrogen 2.981 N/A VAL 87.A N LEU 82.A O no hydrogen 2.982 N/A ILE 90.A N MET 121.A O no hydrogen 3.001 N/A VAL 91.A N ALA 63.A O no hydrogen 2.881 N/A LEU 92.A N ILE 123.A O no hydrogen 2.918 N/A SER 95.A N GLU 166.A OE1 no hydrogen 2.692 N/A SER 95.A OG GLU 166.A OE1 no hydrogen 3.500 N/A SER 95.A OG GLU 166.A OE2 no hydrogen 2.742 N/A GLU 96.A N HIS 94.A ND1 no hydrogen 3.050 N/A ARG 97.A N HIS 94.A O no hydrogen 2.812 N/A ARG 97.A NE GLU 103.A OE2 no hydrogen 2.881 N/A ARG 98.A N HIS 94.A O no hydrogen 3.026 N/A ARG 98.A NE GLY 93.A O no hydrogen 2.924 N/A ARG 98.A NH1 ASN 105.A OD1 no hydrogen 2.808 N/A ARG 98.A NH2 CYS 125.A O no hydrogen 2.940 N/A ALA 99.A N SER 95.A O no hydrogen 2.968 N/A TYR 100.A N GLU 96.A O no hydrogen 2.897 N/A TYR 101.A N ARG 97.A O no hydrogen 2.994 N/A GLU 103.A N ARG 97.A O no hydrogen 3.361 N/A ILE 107.A N THR 104.A OG1 no hydrogen 3.336 N/A VAL 108.A N THR 104.A O no hydrogen 2.927 N/A ALA 109.A N ASN 105.A O no hydrogen 2.933 N/A ASP 110.A N GLU 106.A O no hydrogen 2.910 N/A LYS 111.A N ILE 107.A O no hydrogen 3.167 N/A LYS 111.A NZ ASN 65.A OD1 no hydrogen 2.962 N/A LYS 111.A NZ ALA 66.A O no hydrogen 3.085 N/A LYS 111.A NZ GLU 103.A OE2 no hydrogen 2.707 N/A VAL 112.A N VAL 108.A O no hydrogen 2.885 N/A ALA 113.A N ALA 109.A O no hydrogen 2.931 N/A ALA 114.A N ASP 110.A O no hydrogen 2.973 N/A ALA 115.A N LYS 111.A O no hydrogen 2.894 N/A VAL 116.A N VAL 112.A O no hydrogen 2.953 N/A ALA 117.A N ALA 113.A O no hydrogen 2.922 N/A SER 118.A N ALA 114.A O no hydrogen 3.009 N/A SER 118.A N ALA 115.A O no hydrogen 3.116 N/A SER 118.A OG ALA 114.A O no hydrogen 3.125 N/A GLY 119.A N VAL 116.A O no hydrogen 2.964 N/A PHE 120.A N ALA 115.A O no hydrogen 2.925 N/A MET 121.A N ASN 88.A O.A no hydrogen 2.860 N/A MET 121.A N ASN 88.A O.B no hydrogen 2.820 N/A VAL 122.A N LYS 160.A O no hydrogen 2.942 N/A ILE 123.A N ILE 90.A O no hydrogen 2.850 N/A ALA 124.A N VAL 162.A O no hydrogen 2.779 N/A CYS 125.A N LEU 92.A O no hydrogen 2.934 N/A CYS 125.A SG LEU 92.A O no hydrogen 3.812 N/A CYS 125.A SG ILE 123.A O no hydrogen 4.016 N/A ILE 126.A N ALA 164.A O no hydrogen 2.949 N/A GLY 127.A N GLN 145.A OE1 no hydrogen 2.787 N/A GLU 128.A N GLU 128.A OE1 no hydrogen 2.696 N/A THR 129.A N GLU 132.A OE1 no hydrogen 2.758 N/A GLU 132.A N THR 129.A OG1 no hydrogen 3.268 N/A ARG 133.A N THR 129.A O no hydrogen 2.898 N/A ARG 133.A NE GLU 128.A OE2 no hydrogen 2.791 N/A ARG 133.A NH2 GLU 128.A OE2 no hydrogen 3.002 N/A ARG 133.A NH2 TYR 165.A OH no hydrogen 3.406 N/A GLU 134.A N LEU 130.A O no hydrogen 2.847 N/A SER 135.A N GLN 131.A O no hydrogen 3.182 N/A SER 135.A OG GLN 131.A O no hydrogen 2.755 N/A SER 135.A OG GLU 132.A O no hydrogen 2.944 N/A GLY 136.A N ARG 133.A O no hydrogen 3.073 N/A ARG 137.A N GLU 132.A O no hydrogen 2.943 N/A ARG 137.A NE SER 135.A OG no hydrogen 3.074 N/A THR 138.A OG1 GLU 128.A OE2 no hydrogen 2.672 N/A VAL 141.A N ARG 137.A O no hydrogen 2.864 N/A VAL 142.A N THR 138.A O no hydrogen 2.945 N/A LEU 143.A N ALA 139.A O no hydrogen 3.008 N/A THR 144.A N VAL 140.A O no hydrogen 2.936 N/A THR 144.A OG1 VAL 140.A O no hydrogen 2.629 N/A GLN 145.A N VAL 141.A O no hydrogen 2.889 N/A GLN 145.A NE2 GLY 127.A O no hydrogen 3.137 N/A ILE 146.A N VAL 142.A O no hydrogen 3.068 N/A ALA 147.A N LEU 143.A O no hydrogen 2.942 N/A ALA 148.A N THR 144.A O no hydrogen 2.980 N/A ILE 149.A N GLN 145.A O no hydrogen 3.358 N/A ALA 150.A N ILE 146.A O no hydrogen 2.758 N/A LYS 151.A N ALA 147.A O no hydrogen 2.878 N/A LYS 152.A N ILE 149.A O no hydrogen 3.016 N/A LYS 152.A NZ ASP 110.A OD1 no hydrogen 2.574 N/A LEU 153.A N ALA 150.A O no hydrogen 3.015 N/A LYS 154.A N ASP 157.A OD2 no hydrogen 2.758 N/A LYS 155.A NZ ILE 197.A O no hydrogen 3.503 N/A LYS 155.A NZ ASP 200.A OD1 no hydrogen 2.513 N/A LYS 155.A NZ ASP 200.A OD2 no hydrogen 2.959 N/A ASP 157.A N LYS 154.A O no hydrogen 2.846 N/A TRP 158.A N LYS 155.A O no hydrogen 3.288 N/A ALA 159.A N ALA 156.A O no hydrogen 3.395 N/A LYS 160.A N ASP 157.A O no hydrogen 2.893 N/A LYS 160.A NZ GLY 119.A O no hydrogen 3.328 N/A VAL 161.A N TRP 158.A O no hydrogen 3.100 N/A VAL 162.A N VAL 122.A O no hydrogen 2.693 N/A ILE 163.A N ARG 206.A O no hydrogen 3.017 N/A ALA 164.A N ALA 124.A O no hydrogen 2.951 N/A TYR 165.A N LEU 208.A O no hydrogen 2.880 N/A TYR 165.A OH GLU 128.A OE1 no hydrogen 2.763 N/A TYR 165.A OH GLU 128.A OE2 no hydrogen 3.339 N/A GLU 166.A N ILE 126.A O no hydrogen 2.734 N/A VAL 168.A N GLU 166.A O no hydrogen 2.830 N/A TRP 169.A N GLU 128.A O no hydrogen 3.257 N/A TRP 169.A NE1 TYR 165.A OH no hydrogen 2.968 N/A ALA 170.A N PRO 167.A O no hydrogen 2.965 N/A ILE 171.A N VAL 168.A O no hydrogen 3.151 N/A THR 173.A OG1 ALA 170.A O no hydrogen 2.997 N/A LYS 175.A N THR 173.A OG1 no hydrogen 3.165 N/A THR 178.A N GLN 181.A OE1 no hydrogen 2.915 N/A GLN 181.A N THR 178.A OG1 no hydrogen 2.885 N/A ALA 182.A N THR 178.A O no hydrogen 2.863 N/A GLN 183.A N PRO 179.A O no hydrogen 2.749 N/A GLN 183.A NE2 ASP 226.A OD2 no hydrogen 2.684 N/A GLU 184.A N GLN 180.A O no hydrogen 2.887 N/A ALA 185.A N GLN 181.A O no hydrogen 3.192 N/A HIS 186.A N ALA 182.A O no hydrogen 2.974 N/A HIS 186.A ND1 ASP 226.A O no hydrogen 2.876 N/A ALA 187.A N GLN 183.A O no hydrogen 2.803 N/A LEU 188.A N GLU 184.A O no hydrogen 3.061 N/A ILE 189.A N ALA 185.A O no hydrogen 3.026 N/A ARG 190.A N HIS 186.A O no hydrogen 2.938 N/A ARG 190.A NE ASP 226.A OD1 no hydrogen 2.681 N/A ARG 190.A NH1 ALA 202.A O no hydrogen 2.836 N/A ARG 190.A NH1 LEU 205.A O no hydrogen 2.874 N/A ARG 190.A NH2 ASP 226.A O no hydrogen 3.161 N/A ARG 190.A NH2 ASN 228.A OD1 no hydrogen 2.624 N/A SER 191.A N ALA 187.A O no hydrogen 2.904 N/A TRP 192.A N LEU 188.A O no hydrogen 3.025 N/A VAL 193.A N ILE 189.A O no hydrogen 2.946 N/A SER 194.A N ARG 190.A O no hydrogen 2.929 N/A SER 195.A N.A SER 191.A O no hydrogen 3.065 N/A SER 195.A N.B SER 191.A O no hydrogen 3.051 N/A SER 195.A OG.B SER 191.A O no hydrogen 3.086 N/A LYS 196.A N TRP 192.A O no hydrogen 2.841 N/A ILE 197.A N VAL 193.A O no hydrogen 2.824 N/A GLY 198.A N VAL 193.A O no hydrogen 2.882 N/A VAL 201.A N ASP 200.A OD1 no hydrogen 2.777 N/A ALA 202.A N GLY 198.A O no hydrogen 2.853 N/A GLY 203.A N ALA 199.A O no hydrogen 2.968 N/A GLU 204.A N ASP 200.A O no hydrogen 3.348 N/A GLU 204.A N VAL 201.A O no hydrogen 3.126 N/A ARG 206.A NH1 GLN 4.A O no hydrogen 2.833 N/A ARG 206.A NH1 GLN 4.A OE1 no hydrogen 3.007 N/A ILE 207.A N ASN 228.A OD1 no hydrogen 2.882 N/A LEU 208.A N ILE 163.A O no hydrogen 2.661 N/A TYR 209.A N GLY 229.A O no hydrogen 2.880 N/A GLY 210.A N TYR 165.A O no hydrogen 2.815 N/A ASN 214.A N ASN 217.A OD1 no hydrogen 2.882 N/A GLY 215.A N GLU 240.A OE1 no hydrogen 3.473 N/A LYS 216.A N ASN 214.A OD1 no hydrogen 2.694 N/A ASN 217.A N ASN 214.A OD1 no hydrogen 3.144 N/A ALA 218.A N ASN 214.A O no hydrogen 3.085 N/A THR 220.A OG1.A ASN 217.A O no hydrogen 2.745 N/A LEU 221.A N ASN 217.A O no hydrogen 3.049 N/A TYR 222.A N ALA 218.A O no hydrogen 2.883 N/A GLN 223.A N ARG 219.A O no hydrogen 2.955 N/A GLN 224.A N LEU 221.A O no hydrogen 3.220 N/A GLN 224.A NE2 THR 220.A O no hydrogen 3.564 N/A ASP 226.A N GLN 183.A OE1 no hydrogen 2.824 N/A VAL 227.A N GLN 224.A O no hydrogen 3.453 N/A ASN 228.A N ILE 207.A O no hydrogen 3.030 N/A PHE 230.A N ILE 6.A O no hydrogen 2.952 N/A ALA 231.A N TYR 209.A O no hydrogen 2.939 N/A VAL 232.A N ALA 8.A O no hydrogen 2.800 N/A SER 236.A N GLY 233.A O no hydrogen 2.942 N/A SER 236.A OG ASN 10.A O no hydrogen 3.265 N/A SER 236.A OG VAL 232.A O no hydrogen 3.378 N/A SER 236.A OG GLY 233.A O no hydrogen 2.690 N/A LEU 237.A N GLY 234.A O no hydrogen 3.114 N/A LYS 238.A N ALA 235.A O no hydrogen 3.270 N/A LYS 238.A NZ GLU 240.A OE2 no hydrogen 2.902 N/A PHE 241.A N LYS 238.A O no hydrogen 3.144 N/A VAL 242.A N PRO 239.A O no hydrogen 3.024 N/A ILE 244.A N GLU 240.A O no hydrogen 3.109 N/A ILE 245.A N PHE 241.A O no hydrogen 2.932 N/A LYS 246.A N VAL 242.A O no hydrogen 2.977 N/A ALA 247.A N ASP 243.A O no hydrogen 3.086 N/A ALA 247.A N ILE 244.A O no hydrogen 3.172 N/A THR 248.A N ILE 245.A O no hydrogen 3.215 N/A THR 248.A OG1 HIS 34.A NE2 no hydrogen 2.846 N/A THR 248.A OG1 ILE 245.A O no hydrogen 2.720 N/A GLN 249.A N LYS 246.A O no hydrogen 3.215 N/A GLN 249.A NE2 ALA 247.A O no hydrogen 2.747 N/A