Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ILE 4.A O no hydrogen 2.901 N/A SER 1.A OG ILE 4.A O no hydrogen 3.510 N/A SER 1.A OG GLU 74.A OE1 no hydrogen 2.647 N/A HIS 3.A N GLU 74.A OE1 no hydrogen 2.949 N/A HIS 3.A ND1 GLU 74.A OE2 no hydrogen 2.635 N/A GLU 5.A N ASN 39.A OD1 no hydrogen 2.948 N/A LYS 7.A N GLU 10.A OE1 no hydrogen 2.951 N/A GLN 8.A NE2 SER 78.A O no hydrogen 2.969 N/A GLU 10.A N LYS 7.A O no hydrogen 3.060 N/A ALA 12.A N SER 57.A OG.A no hydrogen 2.913 N/A ALA 12.A N SER 57.A OG.B no hydrogen 2.652 N/A SER 14.A OG ALA 231.A O.A no hydrogen 3.566 N/A SER 14.A OG ALA 231.A O.B no hydrogen 2.647 N/A ILE 15.A N ASN 83.A O no hydrogen 2.901 N/A LEU 16.A N SER 57.A O.A no hydrogen 2.923 N/A LEU 16.A N SER 57.A O.B no hydrogen 2.886 N/A LEU 17.A N ILE 85.A O no hydrogen 2.837 N/A LEU 22.A N ASP 20.A OD1 no hydrogen 2.815 N/A ARG 23.A N ASP 20.A O no hydrogen 2.930 N/A ALA 24.A N ASP 20.A O no hydrogen 3.197 N/A LYS 25.A N PRO 21.A O no hydrogen 3.125 N/A LYS 25.A NZ GLU 29.A OE2 no hydrogen 2.872 N/A TYR 26.A N LEU 22.A O no hydrogen 3.003 N/A TYR 26.A OH ASN 221.A OD1 no hydrogen 2.652 N/A ILE 27.A N ARG 23.A O no hydrogen 2.819 N/A ALA 28.A N ALA 24.A O no hydrogen 2.977 N/A GLU 29.A N LYS 25.A O no hydrogen 2.935 N/A THR 30.A N TYR 26.A O no hydrogen 2.859 N/A THR 30.A OG1 TYR 26.A O no hydrogen 2.747 N/A PHE 31.A N ILE 27.A O no hydrogen 2.920 N/A LEU 32.A N ALA 28.A O no hydrogen 3.113 N/A GLU 33.A N THR 50.A O.A no hydrogen 2.799 N/A GLU 33.A N THR 50.A O.B no hydrogen 3.145 N/A THR 36.A N.A THR 48.A O no hydrogen 2.860 N/A THR 36.A N.B THR 48.A O no hydrogen 2.834 N/A CYS 37.A SG ASN 39.A O no hydrogen 3.420 N/A CYS 37.A SG GLY 46.A O no hydrogen 3.545 N/A TYR 38.A N GLY 46.A O no hydrogen 2.892 N/A TYR 38.A OH GLN 59.A OE1.A no hydrogen 2.751 N/A TYR 38.A OH GLN 59.A OE1.B no hydrogen 2.718 N/A ASN 39.A ND2 HIS 3.A O no hydrogen 3.671 N/A ASN 39.A ND2 MET 44.A O no hydrogen 2.808 N/A ASN 40.A N GLU 5.A OE2 no hydrogen 2.879 N/A VAL 41.A N ASN 39.A OD1 no hydrogen 3.267 N/A GLY 43.A N ASN 40.A O no hydrogen 2.931 N/A MET 44.A N VAL 41.A O no hydrogen 2.940 N/A LEU 45.A N GLY 43.A O no hydrogen 2.962 N/A GLY 46.A N ASN 39.A O no hydrogen 3.296 N/A PHE 47.A N VAL 58.A O.A no hydrogen 2.849 N/A PHE 47.A N VAL 58.A O.B no hydrogen 2.881 N/A THR 48.A N THR 36.A O.A no hydrogen 2.971 N/A THR 48.A N THR 36.A O.B no hydrogen 2.904 N/A THR 48.A OG1 GLU 10.A O no hydrogen 2.724 N/A THR 48.A OG1 SER 57.A OG.A no hydrogen 2.686 N/A THR 48.A OG1 SER 57.A OG.B no hydrogen 2.938 N/A GLY 49.A N VAL 56.A O.A no hydrogen 2.983 N/A GLY 49.A N VAL 56.A O.B no hydrogen 2.942 N/A THR 50.A N.A GLU 33.A O no hydrogen 2.798 N/A THR 50.A N.B GLU 33.A O no hydrogen 2.791 N/A THR 50.A OG1.B LYS 54.A O.B no hydrogen 3.386 N/A TYR 51.A N.A LYS 54.A O.A no hydrogen 2.880 N/A TYR 51.A N.A LYS 54.A O.B no hydrogen 3.239 N/A TYR 51.A N.B LYS 54.A O.A no hydrogen 2.368 N/A TYR 51.A N.B LYS 54.A O.B no hydrogen 2.702 N/A TYR 51.A OH.B ASP 229.A OD1.A no hydrogen 2.842 N/A LYS 52.A NZ.B ASP 229.A OD1.A no hydrogen 2.987 N/A LYS 52.A NZ.B ASP 229.A OD1.B no hydrogen 3.091 N/A LYS 54.A N.A TYR 51.A O.A no hydrogen 3.026 N/A LYS 54.A N.A TYR 51.A O.B no hydrogen 2.417 N/A LYS 54.A N.B TYR 51.A O.B no hydrogen 2.927 N/A ARG 55.A NH1.A ASP 34.A O no hydrogen 3.133 N/A ARG 55.A NH1.A THR 50.A OG1.A no hydrogen 3.294 N/A VAL 56.A N.A GLY 49.A O no hydrogen 2.904 N/A VAL 56.A N.B GLY 49.A O no hydrogen 2.904 N/A SER 57.A N.A SER 14.A O no hydrogen 3.003 N/A SER 57.A N.B SER 14.A O no hydrogen 2.974 N/A SER 57.A OG.A THR 48.A OG1 no hydrogen 2.686 N/A SER 57.A OG.B THR 48.A OG1 no hydrogen 2.938 N/A VAL 58.A N.A PHE 47.A O no hydrogen 2.882 N/A VAL 58.A N.B PHE 47.A O no hydrogen 2.877 N/A GLN 59.A N.A LEU 16.A O no hydrogen 2.914 N/A GLN 59.A N.B LEU 16.A O no hydrogen 3.032 N/A GLN 59.A NE2.A MET 44.A O no hydrogen 2.986 N/A GLN 59.A NE2.A GLY 60.A O.A no hydrogen 2.951 N/A GLN 59.A NE2.A GLY 60.A O.B no hydrogen 2.917 N/A GLN 59.A NE2.B GLY 60.A O.A no hydrogen 2.978 N/A GLN 59.A NE2.B GLY 60.A O.B no hydrogen 3.100 N/A GLY 60.A N.A LEU 45.A O no hydrogen 3.043 N/A GLY 60.A N.B LEU 45.A O no hydrogen 2.997 N/A THR 61.A N PRO 18.A O no hydrogen 2.951 N/A THR 61.A OG1 PRO 18.A O no hydrogen 3.527 N/A THR 61.A OG1 GLY 62.A O no hydrogen 2.809 N/A GLY 62.A N GLY 19.A O no hydrogen 2.943 N/A GLY 64.A N GLU 180.A OE2 no hydrogen 3.032 N/A SER 67.A OG THR 61.A O no hydrogen 2.679 N/A ILE 68.A N GLY 64.A O no hydrogen 3.083 N/A SER 69.A N VAL 65.A O no hydrogen 2.932 N/A SER 69.A OG VAL 65.A O no hydrogen 2.759 N/A ILE 70.A N PRO 66.A O no hydrogen 3.281 N/A TYR 71.A N SER 67.A O no hydrogen 3.380 N/A VAL 72.A N ILE 68.A O no hydrogen 2.842 N/A ASN 73.A N SER 69.A O no hydrogen 2.968 N/A ASN 73.A ND2 GLN 77.A OE1 no hydrogen 3.026 N/A GLU 74.A N ILE 70.A O no hydrogen 3.161 N/A LEU 75.A N TYR 71.A O no hydrogen 2.850 N/A ILE 76.A N VAL 72.A O no hydrogen 2.996 N/A GLN 77.A N ASN 73.A O no hydrogen 2.875 N/A SER 78.A N GLU 74.A O no hydrogen 2.844 N/A TYR 79.A N LEU 75.A O no hydrogen 3.232 N/A TYR 79.A OH ILE 4.A O no hydrogen 3.135 N/A TYR 79.A OH ALA 6.A O no hydrogen 2.709 N/A VAL 81.A N.A LEU 75.A O no hydrogen 3.142 N/A VAL 81.A N.B LEU 75.A O no hydrogen 3.160 N/A LYS 82.A N GLU 13.A O no hydrogen 2.800 N/A ASN 83.A N GLU 13.A O no hydrogen 3.012 N/A LEU 84.A N ASN 194.A O no hydrogen 2.855 N/A ILE 85.A N ILE 15.A O no hydrogen 2.916 N/A ARG 86.A N LEU 196.A O no hydrogen 2.839 N/A ARG 86.A NE GLU 178.A OE2 no hydrogen 2.856 N/A ARG 86.A NH2 GLU 178.A OE2 no hydrogen 3.286 N/A VAL 87.A N LEU 17.A O no hydrogen 3.310 N/A GLY 88.A N VAL 198.A O no hydrogen 3.192 N/A CYS 90.A N THR 200.A O.A no hydrogen 2.987 N/A CYS 90.A N THR 200.A O.B no hydrogen 3.159 N/A CYS 90.A SG THR 200.A O.A no hydrogen 3.876 N/A GLY 91.A N VAL 177.A O.A no hydrogen 2.926 N/A GLY 91.A N VAL 177.A O.B no hydrogen 2.976 N/A ALA 92.A N ASN 203.A O no hydrogen 2.869 N/A ILE 93.A N LEU 175.A O no hydrogen 3.015 N/A GLN 94.A NE2 ASP 96.A OD1 no hydrogen 2.753 N/A VAL 97.A N GLN 94.A O no hydrogen 3.172 N/A LYS 98.A N ASP 101.A OD1 no hydrogen 2.897 N/A LYS 98.A NZ LYS 95.A O no hydrogen 2.939 N/A ARG 100.A N VAL 201.A O no hydrogen 2.846 N/A ASP 101.A N LYS 98.A O no hydrogen 2.955 N/A VAL 102.A N HIS 146.A O no hydrogen 2.878 N/A ILE 103.A N.A LEU 199.A O.A no hydrogen 2.823 N/A ILE 103.A N.A LEU 199.A O.B no hydrogen 2.790 N/A ILE 103.A N.B LEU 199.A O.A no hydrogen 2.774 N/A ILE 103.A N.B LEU 199.A O.B no hydrogen 2.751 N/A ILE 104.A N ARG 148.A O no hydrogen 2.875 N/A ALA 105.A N SER 197.A O no hydrogen 3.130 N/A MET 106.A N.A GLY 150.A O no hydrogen 2.812 N/A MET 106.A N.B GLY 150.A O no hydrogen 2.815 N/A THR 107.A OG1 PRO 126.A O no hydrogen 2.557 N/A CYS 109.A N VAL 152.A O no hydrogen 2.803 N/A CYS 109.A SG ASN 151.A OD1 no hydrogen 3.634 N/A THR 110.A OG1 THR 154.A O no hydrogen 2.752 N/A SER 112.A N THR 110.A OG1 no hydrogen 2.915 N/A MET 114.A N SER 112.A OG no hydrogen 3.001 N/A ASN 115.A ND2 THR 186.A OG1 no hydrogen 3.125 N/A LEU 117.A N.A ASN 113.A O no hydrogen 3.140 N/A LEU 117.A N.B ASN 113.A O no hydrogen 3.124 N/A THR 118.A OG1 MET 114.A O no hydrogen 3.215 N/A PHE 119.A N ASN 115.A O no hydrogen 2.835 N/A PHE 122.A N PHE 119.A O no hydrogen 2.992 N/A ALA 128.A N MET 106.A O.A no hydrogen 2.951 N/A ALA 128.A N MET 106.A O.B no hydrogen 3.107 N/A ASN 129.A N ALA 195.A O no hydrogen 2.999 N/A LEU 132.A N ASN 129.A OD1 no hydrogen 2.937 N/A LEU 133.A N ASN 129.A O no hydrogen 2.957 N/A LYS 134.A N PHE 130.A O no hydrogen 2.828 N/A LYS 134.A NZ ASP 138.A OD2 no hydrogen 2.892 N/A LYS 135.A N.A ASP 131.A O.A no hydrogen 3.128 N/A LYS 135.A N.A ASP 131.A O.B no hydrogen 3.066 N/A LYS 135.A N.B ASP 131.A O.A no hydrogen 3.133 N/A LYS 135.A N.B ASP 131.A O.B no hydrogen 3.068 N/A LYS 135.A NZ.A ASP 131.A OD2.B no hydrogen 2.886 N/A LYS 135.A NZ.A GLN 233.A O.A no hydrogen 3.207 N/A LYS 135.A NZ.B ASP 229.A O.B no hydrogen 3.024 N/A LYS 135.A NZ.B ALA 230.A O.A no hydrogen 2.090 N/A LYS 135.A NZ.B ALA 230.A O.B no hydrogen 3.076 N/A ALA 136.A N LEU 132.A O no hydrogen 2.943 N/A TYR 137.A N LEU 133.A O no hydrogen 2.841 N/A ASP 138.A N LYS 134.A O no hydrogen 2.845 N/A ALA 139.A N LYS 135.A O.A no hydrogen 2.924 N/A ALA 139.A N LYS 135.A O.B no hydrogen 3.107 N/A GLY 140.A N ALA 136.A O no hydrogen 2.803 N/A THR 141.A N TYR 137.A O no hydrogen 2.912 N/A THR 141.A OG1 TYR 137.A O no hydrogen 2.917 N/A GLU 142.A N ASP 138.A O no hydrogen 3.016 N/A LYS 143.A N ALA 139.A O no hydrogen 2.948 N/A LYS 143.A NZ GLU 225.A OE1 no hydrogen 2.808 N/A GLY 144.A N THR 141.A O no hydrogen 3.216 N/A LEU 145.A N GLY 140.A O no hydrogen 3.227 N/A ARG 148.A N VAL 102.A O no hydrogen 2.815 N/A ARG 148.A NH1 ASP 96.A O no hydrogen 3.258 N/A ARG 148.A NH2 ASP 96.A OD1 no hydrogen 3.544 N/A ARG 148.A NH2 ASP 96.A OD2 no hydrogen 3.374 N/A GLY 150.A N ILE 104.A O no hydrogen 3.176 N/A VAL 152.A N THR 107.A O no hydrogen 3.424 N/A LEU 153.A N ALA 176.A O no hydrogen 2.867 N/A THR 154.A N CYS 109.A O no hydrogen 2.776 N/A THR 154.A OG1 GLU 178.A OE1 no hydrogen 2.803 N/A THR 154.A OG1 THR 182.A OG1 no hydrogen 3.198 N/A ALA 155.A N GLU 178.A O no hydrogen 2.788 N/A ASP 156.A N ASP 111.A OD1 no hydrogen 2.700 N/A ARG 160.A NH1 ASP 111.A OD2 no hydrogen 2.869 N/A ARG 160.A NH2 ASP 111.A OD2 no hydrogen 2.880 N/A ASP 164.A N SER 162.A OG no hydrogen 3.133 N/A LYS 167.A N MET 163.A O no hydrogen 2.906 N/A LYS 168.A N ASP 164.A O no hydrogen 2.972 N/A LEU 169.A N MET 165.A O no hydrogen 2.920 N/A GLY 170.A N VAL 166.A O no hydrogen 3.009 N/A ASP 171.A N LYS 167.A O no hydrogen 3.007 N/A TYR 172.A N LEU 169.A O no hydrogen 2.952 N/A GLY 173.A N GLY 170.A O no hydrogen 3.025 N/A VAL 174.A N LEU 169.A O no hydrogen 3.059 N/A LEU 175.A N ASN 151.A O no hydrogen 2.819 N/A VAL 177.A N.A GLY 91.A O no hydrogen 2.787 N/A VAL 177.A N.B GLY 91.A O no hydrogen 2.810 N/A GLU 178.A N LEU 153.A O no hydrogen 2.850 N/A MET 179.A N GLU 180.A OE1 no hydrogen 3.364 N/A GLU 180.A N GLU 178.A OE1 no hydrogen 3.086 N/A THR 181.A N GLU 178.A OE1 no hydrogen 2.842 N/A THR 181.A OG1 GLU 178.A OE2 no hydrogen 2.662 N/A THR 181.A OG1 SER 197.A OG no hydrogen 2.817 N/A THR 182.A N THR 154.A OG1 no hydrogen 3.034 N/A ALA 183.A N GLU 180.A O no hydrogen 3.145 N/A LEU 184.A N GLU 180.A O no hydrogen 3.325 N/A TYR 185.A N THR 181.A O no hydrogen 2.924 N/A TYR 185.A OH ALA 105.A O no hydrogen 2.591 N/A THR 186.A N THR 182.A O no hydrogen 2.973 N/A THR 186.A OG1 THR 182.A O no hydrogen 2.749 N/A LEU 187.A N ALA 183.A O no hydrogen 2.993 N/A ALA 188.A N LEU 184.A O no hydrogen 2.986 N/A ALA 189.A N TYR 185.A O no hydrogen 3.130 N/A LYS 190.A N THR 186.A O no hydrogen 2.928 N/A LYS 190.A NZ TYR 191.A OH no hydrogen 3.336 N/A TYR 191.A N LEU 187.A O no hydrogen 3.090 N/A GLY 192.A N ALA 189.A O no hydrogen 3.204 N/A VAL 193.A N ALA 188.A O no hydrogen 2.932 N/A ASN 194.A N LYS 82.A O no hydrogen 2.969 N/A ASN 194.A ND2 ASN 83.A OD1 no hydrogen 2.926 N/A LEU 196.A N LEU 84.A O no hydrogen 3.058 N/A SER 197.A N TYR 185.A OH no hydrogen 2.835 N/A SER 197.A OG THR 181.A OG1 no hydrogen 2.817 N/A VAL 198.A N ARG 86.A O no hydrogen 2.882 N/A LEU 199.A N.A ILE 103.A O.A no hydrogen 2.832 N/A LEU 199.A N.A ILE 103.A O.B no hydrogen 2.761 N/A LEU 199.A N.B ILE 103.A O.A no hydrogen 2.877 N/A LEU 199.A N.B ILE 103.A O.B no hydrogen 2.803 N/A THR 200.A N.A GLY 88.A O no hydrogen 2.866 N/A THR 200.A N.B GLY 88.A O no hydrogen 2.972 N/A VAL 201.A N ASP 101.A O no hydrogen 2.896 N/A SER 202.A N CYS 90.A O no hydrogen 2.949 N/A SER 202.A OG CYS 90.A O no hydrogen 3.548 N/A ASN 203.A ND2 SER 202.A OG no hydrogen 2.895 N/A HIS 204.A N GLU 209.A O no hydrogen 2.936 N/A ILE 205.A N ALA 92.A O no hydrogen 3.001 N/A GLY 208.A N HIS 204.A O no hydrogen 3.025 N/A GLU 209.A N THR 207.A OG1 no hydrogen 3.210 N/A THR 211.A OG1 SER 202.A O no hydrogen 2.824 N/A THR 212.A N GLU 215.A OE1 no hydrogen 2.875 N/A GLU 215.A N THR 212.A OG1 no hydrogen 3.159 N/A ARG 216.A N SER 213.A O no hydrogen 3.108 N/A ARG 216.A NH1 THR 211.A O no hydrogen 2.862 N/A ARG 216.A NH1 THR 211.A OG1 no hydrogen 2.856 N/A GLN 217.A N GLU 214.A O no hydrogen 3.395 N/A GLN 217.A NE2 TYR 26.A OH no hydrogen 3.065 N/A PHE 220.A N ARG 216.A O no hydrogen 2.820 N/A ASN 221.A N GLN 217.A O no hydrogen 2.840 N/A GLU 222.A N THR 218.A O no hydrogen 3.073 N/A MET 223.A N.A THR 219.A O no hydrogen 2.874 N/A MET 223.A N.B THR 219.A O no hydrogen 2.863 N/A ILE 224.A N PHE 220.A O no hydrogen 2.890 N/A GLU 225.A N ASN 221.A O no hydrogen 2.968 N/A ILE 226.A N.A GLU 222.A O no hydrogen 3.087 N/A ILE 226.A N.B GLU 222.A O no hydrogen 3.109 N/A ILE 226.A N.B MET 223.A O.A no hydrogen 3.194 N/A ALA 227.A N MET 223.A O.A no hydrogen 2.993 N/A ALA 227.A N MET 223.A O.B no hydrogen 3.103 N/A LEU 228.A N ILE 224.A O no hydrogen 2.867 N/A ASP 229.A N.A GLU 225.A O no hydrogen 2.886 N/A ASP 229.A N.B GLU 225.A O no hydrogen 3.005 N/A ALA 230.A N.A ILE 226.A O.A no hydrogen 2.907 N/A ALA 230.A N.A ILE 226.A O.B no hydrogen 3.191 N/A ALA 230.A N.B ILE 226.A O.A no hydrogen 2.845 N/A ALA 230.A N.B ILE 226.A O.B no hydrogen 3.088 N/A ALA 231.A N.A ALA 227.A O no hydrogen 3.074 N/A ALA 231.A N.B ALA 227.A O no hydrogen 2.798 N/A ILE 232.A N.A LEU 228.A O no hydrogen 2.826 N/A ILE 232.A N.B LEU 228.A O no hydrogen 3.317 N/A GLN 233.A N.A ASP 229.A O.B no hydrogen 3.241 N/A GLN 233.A N.A ALA 230.A O.A no hydrogen 3.128 N/A