Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5qyn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N PRO 126.A O no hydrogen 2.959 N/A ASN 4.A N ASN 7.A OD1 no hydrogen 2.760 N/A ASN 4.A ND2 GLU 128.A OE2.A no hydrogen 3.279 N/A SER 6.A N ASN 4.A OD1 no hydrogen 2.923 N/A ASN 7.A N ASN 4.A O no hydrogen 3.299 N/A ASN 7.A N ASN 4.A OD1 no hydrogen 3.306 N/A ASN 7.A ND2 ALA 2.A O no hydrogen 3.369 N/A LEU 11.A N TYR 8.A O no hydrogen 3.161 N/A PHE 12.A N ALA 9.A O no hydrogen 3.019 N/A ASN 13.A N GLU 10.A O no hydrogen 3.498 N/A ASP 15.A N ASN 13.A OD1 no hydrogen 3.009 N/A LYS 17.A NZ GLU 10.A O no hydrogen 2.853 N/A LYS 17.A NZ ASN 13.A OD1 no hydrogen 2.829 N/A LYS 17.A NZ ASP 15.A O no hydrogen 2.834 N/A LEU 18.A N GLN 100.A O no hydrogen 3.108 N/A PHE 19.A N LEU 50.A O no hydrogen 2.896 N/A VAL 20.A N ILE 102.A O no hydrogen 2.833 N/A ASP 21.A N PHE 48.A O no hydrogen 2.790 N/A THR 23.A N.A ASP 21.A OD1 no hydrogen 3.142 N/A THR 23.A N.B ASP 21.A OD1 no hydrogen 3.125 N/A THR 23.A OG1.A ASP 21.A OD1 no hydrogen 3.011 N/A THR 23.A OG1.A ASP 21.A OD2 no hydrogen 3.162 N/A THR 23.A OG1.B ASP 21.A OD1 no hydrogen 2.509 N/A ASN 24.A ND2 SER 134.A O no hydrogen 2.788 N/A VAL 25.A N ASP 22.A O no hydrogen 3.162 N/A ARG 27.A NE ASN 44.A O no hydrogen 3.095 N/A ARG 27.A NH1 ASN 44.A O no hydrogen 2.759 N/A THR 29.A N LYS 41.A O no hydrogen 2.829 N/A THR 29.A OG1 LYS 41.A O no hydrogen 3.354 N/A HIS 31.A N ALA 39.A O no hydrogen 2.792 N/A HIS 31.A ND1 LYS 32.A O no hydrogen 3.165 N/A THR 33.A N ASN 37.A O no hydrogen 2.756 N/A THR 33.A OG1 ASN 37.A O no hydrogen 3.394 N/A GLY 36.A N THR 33.A O no hydrogen 2.794 N/A ASN 37.A N THR 33.A OG1 no hydrogen 3.028 N/A ALA 39.A N HIS 31.A O no hydrogen 2.852 N/A LYS 41.A N THR 29.A O no hydrogen 2.850 N/A LYS 41.A NZ ALA 42.A O no hydrogen 3.453 N/A ILE 43.A N ARG 27.A O no hydrogen 2.859 N/A ASN 44.A ND2 VAL 146.A O no hydrogen 2.751 N/A ASN 44.A ND2 ALA 149.A O no hydrogen 2.893 N/A GLY 45.A N ILE 62.A O no hydrogen 2.746 N/A CYS 46.A N ASN 24.A O no hydrogen 2.830 N/A ILE 47.A N LYS 60.A O no hydrogen 2.851 N/A PHE 48.A N ASP 21.A O no hydrogen 3.150 N/A LEU 50.A N PHE 19.A O no hydrogen 2.891 N/A ASN 51.A N HIS 56.A O no hydrogen 2.850 N/A LYS 53.A N ASN 51.A OD1 no hydrogen 2.979 N/A LYS 53.A NZ PHE 12.A O no hydrogen 2.591 N/A THR 54.A N ASN 51.A OD1 no hydrogen 3.341 N/A GLY 55.A N ASN 51.A O no hydrogen 2.886 N/A HIS 56.A N THR 54.A OG1 no hydrogen 3.281 N/A LEU 57.A N PHE 157.A O no hydrogen 2.852 N/A PHE 58.A N THR 49.A O no hydrogen 2.836 N/A LEU 59.A N VAL 155.A O no hydrogen 2.954 N/A LYS 60.A N ILE 47.A O no hydrogen 3.267 N/A LYS 60.A NZ GLU 84.A OE1 no hydrogen 3.328 N/A ILE 61.A N GLN 153.A O no hydrogen 2.718 N/A ILE 62.A N GLY 45.A O no hydrogen 2.816 N/A HIS 63.A ND1 SER 65.A OG no hydrogen 2.739 N/A THR 64.A N ASN 44.A OD1 no hydrogen 3.209 N/A SER 65.A N HIS 63.A ND1 no hydrogen 3.230 N/A SER 65.A OG HIS 63.A ND1 no hydrogen 2.739 N/A VAL 66.A N.A HIS 63.A O no hydrogen 3.080 N/A VAL 66.A N.B HIS 63.A O no hydrogen 3.059 N/A TRP 67.A N THR 64.A O no hydrogen 3.129 N/A ALA 68.A N SER 65.A O no hydrogen 3.117 N/A GLN 70.A N TRP 67.A O no hydrogen 3.049 N/A GLN 70.A NE2 ALA 68.A O no hydrogen 3.661 N/A ARG 72.A NH2 GLN 75.A OE1 no hydrogen 3.248 N/A GLN 75.A N ARG 72.A O no hydrogen 3.182 N/A LEU 76.A N ARG 72.A O no hydrogen 2.980 N/A ALA 77.A N LEU 73.A O no hydrogen 2.839 N/A LYS 78.A N GLN 75.A O no hydrogen 3.171 N/A TRP 79.A N GLN 75.A O no hydrogen 3.504 N/A LYS 80.A N LEU 76.A O no hydrogen 2.728 N/A LYS 80.A NZ GLU 84.A OE2 no hydrogen 3.103 N/A THR 81.A N ALA 77.A O no hydrogen 2.878 N/A THR 81.A OG1 ALA 77.A O no hydrogen 2.697 N/A ALA 82.A N LYS 78.A O no hydrogen 2.974 N/A GLU 83.A N TRP 79.A O no hydrogen 2.788 N/A GLU 84.A N LYS 80.A O no hydrogen 2.900 N/A VAL 85.A N THR 81.A O no hydrogen 2.858 N/A SER 86.A N.A ALA 82.A O no hydrogen 3.036 N/A SER 86.A N.B ALA 82.A O no hydrogen 3.007 N/A SER 86.A OG.A ALA 82.A O no hydrogen 3.356 N/A SER 86.A OG.A GLU 83.A O no hydrogen 2.882 N/A SER 86.A OG.B HIS 115.A O no hydrogen 3.234 N/A ALA 87.A N GLU 83.A O no hydrogen 2.875 N/A LEU 88.A N GLU 84.A O no hydrogen 2.917 N/A VAL 89.A N VAL 85.A O no hydrogen 2.900 N/A ARG 90.A N SER 86.A O.A no hydrogen 2.989 N/A ARG 90.A N SER 86.A O.B no hydrogen 3.002 N/A ARG 90.A NE SER 86.A OG.B no hydrogen 2.874 N/A ARG 90.A NH1 ASP 118.A OD2 no hydrogen 2.753 N/A ARG 90.A NH2 SER 86.A OG.B no hydrogen 2.740 N/A ARG 90.A NH2 ASP 118.A OD2 no hydrogen 3.461 N/A SER 91.A N ALA 87.A O no hydrogen 3.026 N/A SER 91.A OG LEU 88.A O no hydrogen 2.631 N/A LEU 92.A N VAL 89.A O no hydrogen 3.029 N/A GLU 95.A N GLU 95.A OE2 no hydrogen 2.766 N/A GLU 96.A N PRO 93.A O no hydrogen 2.796 N/A GLN 97.A N LYS 94.A O no hydrogen 3.091 N/A GLN 97.A NE2 VAL 89.A O no hydrogen 2.965 N/A GLN 97.A NE2 LEU 92.A O no hydrogen 3.310 N/A LYS 99.A N.A ILE 16.A O no hydrogen 2.723 N/A LYS 99.A N.B ILE 16.A O no hydrogen 2.706 N/A GLN 100.A NE2 GLU 10.A OE2 no hydrogen 2.823 N/A ILE 101.A N ALA 123.A O no hydrogen 2.804 N/A ILE 102.A N LEU 18.A O no hydrogen 2.804 N/A VAL 103.A N ARG 125.A O no hydrogen 2.892 N/A THR 104.A N VAL 20.A O no hydrogen 3.037 N/A THR 104.A OG1 VAL 20.A O no hydrogen 3.454 N/A THR 104.A OG1 ASP 21.A OD2 no hydrogen 2.536 N/A ARG 105.A NE ASP 22.A OD1 no hydrogen 2.820 N/A ARG 105.A NH2 ASP 22.A OD2 no hydrogen 2.930 N/A MET 108.A N ARG 105.A O no hydrogen 3.031 N/A LEU 109.A N LYS 106.A O no hydrogen 3.015 N/A LEU 112.A N MET 108.A O no hydrogen 2.955 N/A GLU 113.A N LEU 109.A O no hydrogen 2.790 N/A VAL 114.A N ASP 110.A O no hydrogen 2.991 N/A HIS 115.A N PRO 111.A O no hydrogen 3.147 N/A MET 116.A N LEU 112.A O no hydrogen 2.923 N/A MET 116.A N GLU 113.A O no hydrogen 3.246 N/A LEU 117.A N VAL 114.A O no hydrogen 3.413 N/A PHE 119.A N MET 116.A O no hydrogen 2.773 N/A ILE 122.A N PHE 119.A O no hydrogen 2.967 N/A ALA 123.A N LYS 99.A O.A no hydrogen 3.011 N/A ALA 123.A N LYS 99.A O.B no hydrogen 3.092 N/A ARG 125.A N ILE 101.A O no hydrogen 2.915 N/A ARG 125.A NE GLY 1.A O no hydrogen 2.675 N/A ARG 125.A NH1 GLU 10.A OE1 no hydrogen 3.273 N/A ARG 125.A NH1 GLN 100.A OE1 no hydrogen 2.674 N/A ARG 125.A NH2 GLY 1.A O no hydrogen 3.370 N/A THR 127.A OG1 MET 3.A O no hydrogen 2.755 N/A GLU 128.A N.A MET 3.A O no hydrogen 2.543 N/A GLU 128.A N.B MET 3.A O no hydrogen 2.562 N/A LEU 129.A N THR 127.A OG1 no hydrogen 3.156 N/A ALA 135.A N PRO 132.A O no hydrogen 3.041 N/A ALA 136.A N PHE 133.A O no hydrogen 2.977 N/A SER 138.A N ALA 135.A O no hydrogen 2.773 N/A SER 138.A OG GLU 187.A OE1 no hydrogen 2.874 N/A ILE 139.A N ALA 136.A O no hydrogen 3.059 N/A LYS 141.A NZ LYS 203.A O no hydrogen 2.984 N/A LYS 141.A NZ SER 204.A O no hydrogen 3.017 N/A LYS 141.A NZ HIS 206.A O no hydrogen 2.765 N/A SER 143.A N ILE 139.A O no hydrogen 2.964 N/A ASP 144.A N ASP 140.A O no hydrogen 2.925 N/A VAL 145.A N LYS 141.A O no hydrogen 3.376 N/A VAL 146.A N LEU 142.A O no hydrogen 3.170 N/A MET 147.A N.A SER 143.A O no hydrogen 3.044 N/A MET 147.A N.B SER 143.A O no hydrogen 3.013 N/A MET 147.A N.C SER 143.A O no hydrogen 3.078 N/A LYS 148.A N ASP 144.A O no hydrogen 3.055 N/A ALA 149.A N VAL 145.A O no hydrogen 3.260 N/A ALA 149.A N VAL 146.A O no hydrogen 3.315 N/A VAL 155.A N LEU 59.A O no hydrogen 2.900 N/A PHE 157.A N LEU 57.A O no hydrogen 2.894 N/A ASN 158.A ND2 THR 54.A O no hydrogen 3.232 N/A ILE 159.A N GLY 55.A O no hydrogen 2.859 N/A TYR 160.A N ASN 158.A OD1 no hydrogen 2.867 N/A TYR 160.A OH PRO 52.A O no hydrogen 2.590 N/A ASP 161.A N ASN 158.A O no hydrogen 3.098 N/A TRP 163.A N TYR 160.A O no hydrogen 2.903 N/A ASP 165.A N ASP 162.A O no hydrogen 2.989 N/A ARG 166.A N TRP 163.A O no hydrogen 2.777 N/A ARG 166.A NE ASP 213.A OD1 no hydrogen 2.607 N/A ARG 166.A NE ASP 213.A OD2 no hydrogen 3.246 N/A ARG 166.A NH1 ASP 213.A OD2 no hydrogen 2.785 N/A ILE 167.A N TRP 163.A O no hydrogen 2.925 N/A SER 168.A OG THR 171.A OG1 no hydrogen 3.392 N/A SER 169.A OG.A LYS 53.A O no hydrogen 2.588 N/A THR 171.A N SER 168.A OG no hydrogen 3.411 N/A THR 171.A OG1 SER 168.A OG no hydrogen 3.392 N/A ALA 172.A N SER 168.A O no hydrogen 2.836 N/A PHE 173.A N SER 169.A O.A no hydrogen 2.675 N/A PHE 173.A N SER 169.A O.B no hydrogen 2.994 N/A SER 174.A N TYR 170.A O no hydrogen 3.014 N/A SER 174.A OG TYR 170.A O no hydrogen 2.896 N/A ARG 175.A N THR 171.A O no hydrogen 2.888 N/A ARG 175.A NE GLU 220.A OE1 no hydrogen 2.638 N/A ARG 175.A NH2 GLU 220.A OE1 no hydrogen 3.552 N/A LEU 176.A N ALA 172.A O no hydrogen 2.862 N/A THR 177.A N PHE 173.A O no hydrogen 2.865 N/A THR 177.A OG1 PHE 173.A O no hydrogen 2.998 N/A THR 177.A OG1 SER 174.A O no hydrogen 2.975 N/A LEU 178.A N SER 174.A O no hydrogen 2.894 N/A LEU 179.A N ARG 175.A O no hydrogen 2.888 N/A LEU 180.A N LEU 176.A O no hydrogen 2.948 N/A ARG 181.A N THR 177.A O no hydrogen 2.898 N/A ALA 182.A N LEU 178.A O no hydrogen 3.033 N/A LEU 183.A N LEU 179.A O no hydrogen 2.931 N/A LYS 184.A N LEU 180.A O no hydrogen 2.814 N/A LYS 184.A NZ SER 134.A OG no hydrogen 2.845 N/A THR 185.A N.A ARG 181.A O no hydrogen 2.970 N/A THR 185.A N.A ALA 182.A O no hydrogen 3.045 N/A THR 185.A N.B ARG 181.A O no hydrogen 2.982 N/A THR 185.A N.B ALA 182.A O no hydrogen 3.021 N/A THR 185.A OG1.A ARG 181.A O no hydrogen 3.083 N/A THR 185.A OG1.A ALA 182.A O no hydrogen 2.770 N/A THR 185.A OG1.B ARG 181.A O no hydrogen 2.593 N/A ASN 186.A N ALA 182.A O no hydrogen 2.913 N/A ASN 186.A ND2 GLU 230.A OE1 no hydrogen 2.754 N/A SER 189.A N ASN 186.A OD1 no hydrogen 3.050 N/A ALA 190.A N ASN 186.A O no hydrogen 2.974 N/A LYS 191.A N GLU 187.A O no hydrogen 2.850 N/A LYS 191.A NZ ASP 140.A OD1 no hydrogen 2.681 N/A MET 192.A N GLU 188.A O no hydrogen 2.872 N/A ILE 193.A N SER 189.A O no hydrogen 2.836 N/A LEU 194.A N ALA 190.A O no hydrogen 3.011 N/A LEU 195.A N LYS 191.A O no hydrogen 3.130 N/A LEU 195.A N MET 192.A O no hydrogen 3.308 N/A THR 199.A N ASP 197.A OD1 no hydrogen 2.894 N/A THR 199.A OG1 ASP 197.A OD1 no hydrogen 2.501 N/A THR 199.A OG1 ASP 197.A OD2 no hydrogen 3.091 N/A ILE 200.A N ASP 197.A O no hydrogen 3.269 N/A LYS 203.A NZ THR 201.A OG1 no hydrogen 3.310 N/A LYS 203.A NZ SER 210.A OG no hydrogen 2.928 N/A HIS 206.A N LYS 203.A O no hydrogen 2.998 N/A LEU 207.A N ASP 161.A OD1 no hydrogen 2.824 N/A TRP 208.A N ASP 161.A OD2 no hydrogen 2.938 N/A TRP 208.A NE1 ILE 159.A O no hydrogen 2.860 N/A SER 210.A N THR 201.A O no hydrogen 2.775 N/A SER 210.A OG THR 201.A O no hydrogen 3.502 N/A PHE 211.A N PRO 209.A O no hydrogen 3.027 N/A THR 212.A N GLN 215.A OE1 no hydrogen 3.039 N/A GLN 215.A N THR 212.A OG1 no hydrogen 3.050 N/A TRP 216.A N THR 212.A O no hydrogen 2.961 N/A ILE 217.A N ASP 213.A O no hydrogen 3.307 N/A THR 218.A N GLU 214.A O no hydrogen 3.322 N/A ILE 219.A N GLN 215.A O no hydrogen 2.981 N/A GLU 220.A N TRP 216.A O no hydrogen 2.610 N/A SER 221.A N.A ILE 217.A O no hydrogen 2.967 N/A SER 221.A N.B ILE 217.A O no hydrogen 2.972 N/A SER 221.A OG.A ILE 217.A O no hydrogen 2.263 N/A SER 221.A OG.A THR 218.A O no hydrogen 3.400 N/A GLN 222.A N THR 218.A O no hydrogen 2.883 N/A MET 223.A N ILE 219.A O no hydrogen 3.001 N/A MET 223.A N GLU 220.A O no hydrogen 3.264 N/A ARG 224.A N.A GLU 220.A O no hydrogen 3.131 N/A ARG 224.A N.B GLU 220.A O no hydrogen 3.137 N/A ASP 225.A N SER 221.A O.A no hydrogen 3.095 N/A ASP 225.A N SER 221.A O.B no hydrogen 3.094 N/A LEU 226.A N GLN 222.A O no hydrogen 3.006 N/A ILE 227.A N MET 223.A O no hydrogen 2.901 N/A LEU 228.A N ARG 224.A O.A no hydrogen 2.894 N/A LEU 228.A N ARG 224.A O.B no hydrogen 2.909 N/A THR 229.A N ASP 225.A O no hydrogen 3.093 N/A THR 229.A OG1 ASP 225.A O no hydrogen 2.786 N/A GLU 230.A N LEU 226.A O no hydrogen 3.252 N/A TYR 231.A N ILE 227.A O no hydrogen 3.186 N/A GLY 232.A N LEU 228.A O no hydrogen 2.943 N/A ARG 233.A N THR 229.A O no hydrogen 2.845 N/A LYS 234.A N GLU 230.A O no hydrogen 2.726 N/A TYR 235.A N TYR 231.A O no hydrogen 3.160 N/A ASN 236.A N ARG 233.A O no hydrogen 3.154 N/A VAL 237.A N GLY 232.A O no hydrogen 3.132 N/A