Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jr0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG.C TYR 5.A O no hydrogen 3.512 N/A SER 4.A OG.C GLU 221.A O no hydrogen 3.253 N/A TYR 5.A N GLU 221.A O no hydrogen 2.903 N/A TYR 5.A OH ASP 141.A OD1 no hydrogen 2.502 N/A TYR 5.A OH THR 219.A OG1 no hydrogen 3.423 N/A LYS 6.A NZ ASP 8.A OD1 no hydrogen 2.570 N/A GLU 11.A N LYS 78.A O no hydrogen 2.992 N/A CYS 15.A N GLU 52.A O no hydrogen 2.895 N/A ILE 16.A N VAL 83.A O no hydrogen 2.852 N/A ILE 17.A N ARG 54.A O no hydrogen 2.897 N/A ILE 18.A N VAL 85.A O no hydrogen 2.813 N/A ASN 19.A N LYS 56.A O no hydrogen 2.815 N/A ASN 19.A ND2 ASP 36.A OD1 no hydrogen 2.993 N/A ASN 19.A ND2 ASN 57.A OD1 no hydrogen 3.074 N/A ASN 20.A N LEU 87.A O no hydrogen 2.974 N/A ASN 20.A ND2 LEU 59.A O no hydrogen 3.210 N/A ASN 20.A ND2 PHE 96.A O no hydrogen 3.018 N/A LYS 21.A N ASP 58.A OD1 no hydrogen 2.840 N/A LYS 21.A NZ ASP 36.A OD2 no hydrogen 3.173 N/A ASN 22.A N ASP 58.A OD1 no hydrogen 3.058 N/A ASN 22.A ND2 ASP 58.A OD2 no hydrogen 2.920 N/A HIS 24.A N THR 98.A O no hydrogen 2.899 N/A SER 26.A N HIS 24.A ND1 no hydrogen 2.959 N/A SER 26.A OG.A HIS 24.A ND1 no hydrogen 2.728 N/A SER 26.A OG.B HIS 24.A ND1 no hydrogen 3.259 N/A THR 27.A N HIS 24.A O no hydrogen 3.014 N/A THR 27.A OG1 HIS 24.A O no hydrogen 2.736 N/A GLY 28.A N LYS 25.A O no hydrogen 3.007 N/A MET 29.A N THR 27.A OG1 no hydrogen 3.013 N/A ARG 32.A N LYS 21.A O no hydrogen 2.919 N/A ARG 32.A NH1 ASN 20.A O no hydrogen 2.931 N/A ARG 32.A NH1 THR 35.A OG1 no hydrogen 2.909 N/A THR 35.A N ARG 32.A O no hydrogen 3.011 N/A THR 35.A OG1 ASN 19.A OD1 no hydrogen 2.637 N/A ASP 38.A N GLY 34.A O no hydrogen 3.367 N/A ALA 39.A N THR 35.A O no hydrogen 2.958 N/A ALA 40.A N ASP 36.A O no hydrogen 2.969 N/A ASN 41.A N VAL 37.A O no hydrogen 3.043 N/A ASN 41.A ND2 GLN 166.A OE1.A no hydrogen 2.719 N/A LEU 42.A N ASP 38.A O no hydrogen 2.885 N/A ARG 43.A N ALA 39.A O no hydrogen 2.971 N/A ARG 43.A NE.B ASN 55.A OD1 no hydrogen 3.314 N/A GLU 44.A N ALA 40.A O no hydrogen 3.109 N/A THR 45.A N ASN 41.A O no hydrogen 2.878 N/A THR 45.A OG1 ASN 41.A O no hydrogen 2.745 N/A THR 45.A OG1 ASN 41.A OD1 no hydrogen 3.472 N/A PHE 46.A N LEU 42.A O no hydrogen 2.848 N/A ARG 47.A N ARG 43.A O no hydrogen 2.961 N/A ARG 47.A NE.B GLU 44.A OE1.A no hydrogen 3.198 N/A ARG 47.A NH1.B GLU 44.A OE1.A no hydrogen 3.243 N/A ARG 47.A NH2.A GLU 44.A OE2.A no hydrogen 3.183 N/A ASN 48.A N GLU 44.A O no hydrogen 3.020 N/A LEU 49.A N THR 45.A O no hydrogen 3.228 N/A LYS 50.A N ARG 47.A O no hydrogen 2.891 N/A TYR 51.A N PHE 46.A O no hydrogen 2.955 N/A TYR 51.A OH SER 81.A OG no hydrogen 2.740 N/A GLU 52.A N GLY 13.A O no hydrogen 2.995 N/A ARG 54.A N CYS 15.A O no hydrogen 2.946 N/A ARG 54.A NH1 GLU 74.A OE2 no hydrogen 2.672 N/A ARG 54.A NH2 GLU 52.A OE2 no hydrogen 3.376 N/A ARG 54.A NH2 GLU 74.A OE1 no hydrogen 3.233 N/A ARG 54.A NH2 GLU 74.A OE2 no hydrogen 3.375 N/A ASN 55.A ND2 ALA 39.A O no hydrogen 3.621 N/A LYS 56.A N ILE 17.A O no hydrogen 2.865 N/A ASP 58.A N ASN 19.A O no hydrogen 2.986 N/A LEU 59.A N ASN 20.A OD1 no hydrogen 2.781 N/A THR 60.A N GLU 63.A OE1 no hydrogen 2.917 N/A THR 60.A OG1 GLU 62.A OE1 no hydrogen 3.421 N/A ARG 61.A N ASN 99.A OD1 no hydrogen 2.789 N/A ARG 61.A NH1 PRO 101.A O no hydrogen 3.192 N/A GLU 63.A N THR 60.A OG1 no hydrogen 3.061 N/A ILE 64.A N THR 60.A O no hydrogen 2.956 N/A VAL 65.A N ARG 61.A O no hydrogen 3.152 N/A GLU 66.A N GLU 62.A O no hydrogen 2.958 N/A LEU 67.A N GLU 63.A O no hydrogen 2.853 N/A MET 68.A N ILE 64.A O no hydrogen 3.034 N/A ARG 69.A N VAL 65.A O no hydrogen 2.865 N/A ARG 69.A NE GLU 66.A OE1.A no hydrogen 3.544 N/A ARG 69.A NE GLU 66.A OE2.A no hydrogen 3.213 N/A ARG 69.A NH2 GLU 66.A OE1.A no hydrogen 3.370 N/A ASP 70.A N GLU 66.A O no hydrogen 2.905 N/A VAL 71.A N LEU 67.A O no hydrogen 2.910 N/A SER 72.A N MET 68.A O no hydrogen 2.937 N/A SER 72.A OG MET 68.A O no hydrogen 3.491 N/A SER 72.A OG ARG 69.A O no hydrogen 2.678 N/A LYS 73.A N ASP 70.A O no hydrogen 2.986 N/A GLU 74.A N VAL 71.A O no hydrogen 3.179 N/A HIS 76.A N SER 118.A OG no hydrogen 2.837 N/A HIS 76.A NE2 VAL 71.A O no hydrogen 2.788 N/A SER 77.A N ASP 75.A OD1 no hydrogen 2.888 N/A SER 77.A OG.A ASP 75.A OD1 no hydrogen 2.512 N/A SER 77.A OG.B ASP 75.A OD1 no hydrogen 2.812 N/A SER 77.A OG.B ASP 75.A OD2 no hydrogen 3.551 N/A ARG 79.A N HIS 76.A O no hydrogen 2.907 N/A ARG 79.A NE GLU 11.A OE1 no hydrogen 3.321 N/A ARG 79.A NH1 GLU 74.A OE1 no hydrogen 2.940 N/A ARG 79.A NH2 GLU 74.A OE1 no hydrogen 3.358 N/A SER 80.A N GLU 11.A O no hydrogen 2.846 N/A SER 80.A OG GLU 11.A O no hydrogen 3.252 N/A SER 81.A OG MET 12.A O no hydrogen 2.822 N/A SER 81.A OG TYR 51.A OH no hydrogen 2.740 N/A PHE 82.A N PRO 123.A O no hydrogen 3.101 N/A VAL 83.A N LEU 14.A O no hydrogen 2.957 N/A CYS 84.A N LEU 125.A O no hydrogen 2.876 N/A VAL 85.A N ILE 16.A O no hydrogen 2.691 N/A LEU 86.A N ILE 127.A O no hydrogen 2.853 N/A LEU 87.A N ILE 18.A O no hydrogen 2.906 N/A SER 88.A N GLN 129.A O no hydrogen 3.202 N/A SER 88.A OG PHE 96.A O no hydrogen 2.663 N/A HIS 89.A NE2 THR 30.A O no hydrogen 2.771 N/A GLU 91.A N ILE 94.A O no hydrogen 3.131 N/A GLU 92.A N GLY 133.A O no hydrogen 2.819 N/A ILE 94.A N GLU 91.A O no hydrogen 2.934 N/A ILE 95.A N VAL 102.A O no hydrogen 2.950 N/A PHE 96.A N HIS 89.A O no hydrogen 2.885 N/A GLY 97.A N GLY 100.A O no hydrogen 2.726 N/A THR 98.A N LEU 59.A O no hydrogen 2.880 N/A ASN 99.A ND2 GLU 62.A OE1 no hydrogen 2.883 N/A GLY 100.A N GLY 97.A O no hydrogen 3.378 N/A VAL 102.A N ILE 95.A O no hydrogen 2.773 N/A LEU 104.A N GLY 93.A O no hydrogen 2.822 N/A LYS 105.A N ASP 103.A OD1.B no hydrogen 2.717 N/A LYS 105.A NZ GLU 139.A OE1 no hydrogen 2.874 N/A LYS 105.A NZ GLU 139.A OE2 no hydrogen 3.144 N/A LYS 106.A N ASP 103.A O no hydrogen 3.092 N/A THR 108.A N LEU 104.A O no hydrogen 2.967 N/A THR 108.A OG1 LEU 104.A O no hydrogen 3.384 N/A THR 108.A OG1 LYS 105.A O no hydrogen 3.431 N/A ASN 109.A N LYS 105.A O no hydrogen 2.927 N/A PHE 111.A N THR 108.A O no hydrogen 2.909 N/A ARG 112.A N ASN 109.A O no hydrogen 3.225 N/A ARG 112.A NE ASP 114.A OD1 no hydrogen 3.362 N/A ARG 112.A NH2 ASP 114.A OD1 no hydrogen 3.380 N/A ARG 112.A NH2 ASP 114.A OD2 no hydrogen 3.439 N/A ARG 115.A N ARG 112.A O no hydrogen 2.820 N/A CYS 116.A N ARG 112.A O no hydrogen 3.199 N/A CYS 116.A SG SER 72.A O no hydrogen 3.405 N/A LEU 119.A N CYS 116.A O no hydrogen 2.911 N/A THR 120.A N ARG 117.A O no hydrogen 3.205 N/A THR 120.A OG1 GLY 113.A O no hydrogen 2.803 N/A THR 120.A OG1 ARG 117.A O no hydrogen 3.150 N/A LYS 122.A N LEU 119.A O no hydrogen 2.940 N/A LYS 122.A NZ HIS 76.A O no hydrogen 2.938 N/A LYS 122.A NZ SER 77.A O no hydrogen 3.302 N/A LYS 122.A NZ ARG 79.A O no hydrogen 2.881 N/A LYS 122.A NZ SER 118.A O no hydrogen 2.874 N/A LYS 124.A N ASP 141.A O no hydrogen 2.830 N/A LYS 124.A NZ LEU 119.A O no hydrogen 2.867 N/A LYS 124.A NZ LYS 122.A O no hydrogen 2.829 N/A LEU 125.A N PHE 82.A O no hydrogen 2.853 N/A PHE 126.A N LEU 143.A O no hydrogen 2.756 N/A ILE 127.A N CYS 84.A O no hydrogen 2.849 N/A ILE 128.A N ALA 145.A O no hydrogen 2.950 N/A GLN 129.A N LEU 86.A O no hydrogen 2.848 N/A GLN 129.A NE2 SER 154.A OG.A no hydrogen 2.902 N/A CYS 131.A SG SER 154.A O no hydrogen 3.790 N/A ARG 132.A N TYR 152.A O no hydrogen 2.846 N/A ARG 132.A NE GLU 92.A OE2 no hydrogen 3.112 N/A ARG 132.A NH1 THR 148.A O no hydrogen 2.887 N/A ARG 132.A NH2 GLU 92.A OE2 no hydrogen 2.961 N/A ALA 140.A N PRO 137.A O no hydrogen 3.184 N/A ASP 141.A N MET 217.A O no hydrogen 2.849 N/A LEU 143.A N LYS 124.A O no hydrogen 2.880 N/A TYR 144.A N VAL 215.A O no hydrogen 2.831 N/A ALA 145.A N PHE 126.A O no hydrogen 2.834 N/A TYR 146.A N CYS 213.A O no hydrogen 3.024 N/A SER 147.A N ILE 128.A O no hydrogen 2.995 N/A SER 147.A OG ILE 128.A O no hydrogen 3.420 N/A SER 147.A OG SER 154.A OG.A no hydrogen 2.836 N/A SER 147.A OG SER 154.A OG.B no hydrogen 2.583 N/A THR 148.A OG1 TYR 153.A O no hydrogen 2.815 N/A GLY 151.A N ARG 132.A O no hydrogen 2.839 N/A TYR 152.A N ALA 149.A O no hydrogen 3.089 N/A SER 154.A OG.A SER 147.A OG no hydrogen 2.836 N/A SER 154.A OG.B ALA 130.A O no hydrogen 2.791 N/A SER 154.A OG.B SER 147.A OG no hydrogen 2.583 N/A TRP 155.A N GLN 210.A OE1 no hydrogen 2.828 N/A ARG 156.A NH2 SER 33.A O no hydrogen 2.861 N/A ASN 157.A N GLY 161.A O no hydrogen 2.950 N/A LYS 159.A N ASN 157.A OD1 no hydrogen 2.979 N/A LYS 159.A NZ.B ASP 160.A OD1 no hydrogen 2.693 N/A ASP 160.A N ASN 157.A OD1 no hydrogen 2.885 N/A GLY 161.A N ASN 157.A O no hydrogen 2.919 N/A SER 162.A N ASP 38.A OD1 no hydrogen 2.852 N/A SER 162.A N ASP 38.A OD2 no hydrogen 3.185 N/A SER 162.A OG ASP 38.A OD2 no hydrogen 2.613 N/A TRP 163.A N TRP 155.A O no hydrogen 3.232 N/A ILE 165.A N SER 162.A OG no hydrogen 3.188 N/A GLN 166.A N SER 162.A O no hydrogen 2.995 N/A GLN 166.A NE2.A ASP 38.A OD1 no hydrogen 2.635 N/A GLN 166.A NE2.B GLY 161.A O no hydrogen 3.188 N/A GLN 166.A NE2.B SER 162.A O no hydrogen 3.366 N/A SER 167.A N TRP 163.A O no hydrogen 3.084 N/A SER 167.A OG TRP 163.A O no hydrogen 2.885 N/A LEU 168.A N PHE 164.A O no hydrogen 2.787 N/A CYS 169.A N ILE 165.A O no hydrogen 2.909 N/A CYS 169.A SG THR 45.A OG1 no hydrogen 3.491 N/A CYS 169.A SG ILE 165.A O no hydrogen 3.445 N/A ALA 170.A N GLN 166.A O no hydrogen 3.059 N/A MET 171.A N SER 167.A O no hydrogen 2.971 N/A LEU 172.A N LEU 168.A O no hydrogen 2.888 N/A LYS 173.A N CYS 169.A O no hydrogen 2.873 N/A LYS 173.A NZ.A ASN 41.A OD1 no hydrogen 2.732 N/A LYS 173.A NZ.A GLU 44.A OE1.B no hydrogen 3.392 N/A LYS 173.A NZ.A THR 45.A OG1 no hydrogen 3.265 N/A GLN 174.A N ALA 170.A O no hydrogen 3.007 N/A TYR 175.A N MET 171.A O no hydrogen 2.780 N/A ALA 176.A N LEU 172.A O no hydrogen 2.957 N/A LYS 178.A N TYR 175.A O no hydrogen 2.862 N/A LEU 179.A N TYR 175.A O no hydrogen 2.818 N/A PHE 181.A N LEU 222.A O no hydrogen 2.827 N/A MET 182.A N GLU 180.A OE1 no hydrogen 2.837 N/A HIS 183.A N GLU 180.A O no hydrogen 2.905 N/A ILE 184.A N GLU 180.A O no hydrogen 3.039 N/A LEU 185.A N PHE 181.A O no hydrogen 2.866 N/A THR 186.A N MET 182.A O no hydrogen 2.938 N/A THR 186.A OG1 MET 182.A O no hydrogen 2.801 N/A ARG 187.A N HIS 183.A O no hydrogen 3.254 N/A VAL 188.A N ILE 184.A O no hydrogen 3.090 N/A ASN 189.A N LEU 185.A O no hydrogen 2.881 N/A ARG 190.A N THR 186.A O no hydrogen 3.110 N/A LYS 191.A N ARG 187.A O no hydrogen 2.876 N/A LYS 191.A NZ GLU 195.A OE2 no hydrogen 3.025 N/A VAL 192.A N VAL 188.A O no hydrogen 2.882 N/A ALA 193.A N ASN 189.A O no hydrogen 2.881 N/A THR 194.A N ARG 190.A O no hydrogen 2.888 N/A THR 194.A N LYS 191.A O no hydrogen 3.324 N/A THR 194.A OG1 ARG 190.A O no hydrogen 2.584 N/A GLU 195.A N LYS 191.A O no hydrogen 2.945 N/A SER 198.A N LYS 208.A O no hydrogen 2.876 N/A SER 198.A OG PHE 205.A O no hydrogen 2.497 N/A SER 200.A N HIS 206.A ND1 no hydrogen 2.990 N/A SER 200.A OG ASP 202.A O no hydrogen 3.342 N/A ASP 202.A N SER 200.A OG no hydrogen 3.094 N/A THR 204.A N ASP 202.A OD1 no hydrogen 3.079 N/A THR 204.A OG1 ASP 202.A OD1 no hydrogen 3.107 N/A PHE 205.A N ASP 202.A O no hydrogen 2.800 N/A HIS 206.A N ALA 203.A O no hydrogen 3.229 N/A ALA 207.A N SER 198.A O no hydrogen 2.925 N/A LYS 208.A N SER 198.A OG no hydrogen 2.875 N/A LYS 208.A NZ ALA 203.A O no hydrogen 3.334 N/A LYS 208.A NZ HIS 206.A O no hydrogen 3.050 N/A GLN 210.A NE2 SER 147.A O no hydrogen 2.796 N/A CYS 213.A N TYR 146.A O no hydrogen 3.036 N/A VAL 215.A N TYR 144.A O no hydrogen 2.837 N/A MET 217.A N PHE 142.A O no hydrogen 2.849 N/A LEU 218.A N SER 216.A OG no hydrogen 3.099 N/A THR 219.A N TYR 5.A OH no hydrogen 2.904 N/A THR 219.A OG1 TYR 5.A OH no hydrogen 3.423 N/A THR 219.A OG1 ASP 141.A OD1 no hydrogen 2.707 N/A GLU 221.A N ASN 3.A O no hydrogen 2.919 N/A LEU 222.A N GLU 180.A OE2 no hydrogen 2.762 N/A TYR 223.A OH GLU 221.A OE1 no hydrogen 2.684 N/A