Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jem_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N HIS 38.A O no hydrogen 2.762 N/A SER 3.A N ILE 36.A O no hydrogen 2.958 N/A SER 4.A OG THR 35.A OG1 no hydrogen 2.729 N/A ASN 5.A N ASP 8.A OD2 no hydrogen 2.854 N/A ASP 8.A N ASN 5.A O no hydrogen 3.306 N/A LYS 9.A NZ TYR 18.A OH no hydrogen 3.465 N/A LEU 10.A N ILE 19.A O no hydrogen 2.789 N/A PHE 12.A N TYR 17.A O no hydrogen 2.981 N/A LYS 13.A NZ TRP 227.A O no hydrogen 3.328 N/A LYS 13.A NZ ASP 228.A OD1.A no hydrogen 2.833 N/A LYS 13.A NZ ASP 228.A OD2.A no hydrogen 3.050 N/A LYS 16.A N LYS 13.A O no hydrogen 3.017 N/A LYS 16.A NZ TYR 17.A OH no hydrogen 3.226 N/A LYS 16.A NZ VAL 229.A O no hydrogen 2.850 N/A TYR 17.A N PHE 12.A O no hydrogen 3.320 N/A TYR 17.A OH ASP 228.A OD1.A no hydrogen 2.685 N/A TYR 17.A OH ASP 228.A OD2.B no hydrogen 3.006 N/A TYR 17.A OH VAL 229.A O no hydrogen 3.221 N/A TYR 18.A N VAL 64.A O no hydrogen 3.183 N/A ILE 19.A N LEU 10.A O no hydrogen 2.824 N/A PHE 20.A N SER 62.A O no hydrogen 2.822 N/A ASN 21.A N ASP 8.A O no hydrogen 2.874 N/A ASN 21.A ND2 ASN 5.A O no hydrogen 2.836 N/A ASN 21.A ND2 GLN 34.A O no hydrogen 3.096 N/A ASN 22.A ND2 TYR 60.A O no hydrogen 3.074 N/A TRP 24.A N LYS 58.A O no hydrogen 2.742 N/A TRP 24.A NE1 ASN 22.A OD1 no hydrogen 2.702 N/A GLY 25.A N LYS 58.A O no hydrogen 2.806 N/A GLN 28.A N GLY 25.A O no hydrogen 2.950 N/A VAL 29.A N GLY 25.A O no hydrogen 3.239 N/A TRP 32.A N VAL 29.A O no hydrogen 3.417 N/A TRP 33.A N ASN 49.A O no hydrogen 3.088 N/A GLN 34.A NE2 ASN 21.A OD1 no hydrogen 2.849 N/A THR 35.A N VAL 47.A O no hydrogen 2.800 N/A THR 35.A OG1 SER 4.A OG no hydrogen 2.729 N/A ILE 36.A N SER 3.A O no hydrogen 2.906 N/A TYR 37.A N GLY 45.A O no hydrogen 2.907 N/A TYR 37.A OH ILE 222.A O no hydrogen 3.167 N/A HIS 38.A N ALA 1.A O no hydrogen 2.796 N/A HIS 38.A NE2 ASP 41.A OD1 no hydrogen 2.739 N/A ASN 39.A N ASP 43.A O no hydrogen 2.760 N/A ASN 39.A ND2 ASP 43.A OD1 no hydrogen 3.536 N/A ASN 39.A ND2 ASP 43.A OD2 no hydrogen 3.037 N/A SER 40.A N ASP 43.A O no hydrogen 3.101 N/A SER 42.A N SER 40.A OG no hydrogen 3.136 N/A ASP 43.A N SER 40.A O no hydrogen 3.066 N/A MET 44.A N ILE 224.A O no hydrogen 3.258 N/A GLY 45.A N TYR 37.A O no hydrogen 2.960 N/A TRP 46.A N ILE 222.A O no hydrogen 3.347 N/A TRP 46.A NE1 THR 213.A OG1 no hydrogen 2.851 N/A VAL 47.A N THR 35.A O no hydrogen 2.839 N/A TRP 48.A N GLY 220.A O no hydrogen 2.876 N/A ASN 49.A N TRP 33.A O no hydrogen 2.827 N/A ASN 49.A ND2 GLY 31.A O no hydrogen 2.931 N/A TRP 50.A N GLY 218.A O no hydrogen 2.850 N/A TRP 50.A NE1 GLN 34.A OE1 no hydrogen 2.829 N/A THR 54.A N SER 52.A OG no hydrogen 3.072 N/A THR 54.A OG1 SER 52.A OG no hydrogen 3.043 N/A THR 56.A OG1 GLN 28.A OE1 no hydrogen 3.250 N/A LYS 58.A N VAL 215.A O no hydrogen 2.758 N/A LYS 58.A NZ SER 52.A OG no hydrogen 3.205 N/A LYS 58.A NZ THR 54.A O no hydrogen 3.001 N/A LYS 58.A NZ THR 54.A OG1 no hydrogen 2.796 N/A LYS 58.A NZ THR 56.A O no hydrogen 2.840 N/A LYS 58.A NZ THR 56.A OG1 no hydrogen 3.094 N/A LYS 58.A NZ PHE 216.A O no hydrogen 2.790 N/A TYR 60.A N ASN 22.A O no hydrogen 2.987 N/A TYR 60.A OH.A ALA 106.A O no hydrogen 2.929 N/A TYR 60.A OH.B ALA 106.A O no hydrogen 2.894 N/A SER 62.A N PHE 20.A O no hydrogen 3.220 N/A SER 62.A OG.A TYR 60.A O no hydrogen 2.972 N/A SER 62.A OG.B TYR 60.A O no hydrogen 3.293 N/A ILE 63.A N PHE 211.A O no hydrogen 2.718 N/A VAL 64.A N TYR 18.A O no hydrogen 2.765 N/A SER 65.A N VAL 209.A O no hydrogen 3.016 N/A GLY 66.A N THR 74.A OG1 no hydrogen 2.816 N/A TRP 67.A N SER 207.A O no hydrogen 2.900 N/A TRP 67.A NE1 SER 118.A O no hydrogen 2.968 N/A HIS 68.A N THR 70.A OG1 no hydrogen 3.127 N/A HIS 68.A ND1 GLU 210.A OE2 no hydrogen 2.517 N/A THR 70.A OG1 GLY 72.A O no hydrogen 2.837 N/A GLY 72.A N ALA 117.A O no hydrogen 3.071 N/A THR 74.A N GLY 66.A O no hydrogen 3.000 N/A THR 74.A OG1 LYS 16.A O no hydrogen 2.683 N/A SER 77.A N THR 74.A O no hydrogen 3.199 N/A SER 77.A OG THR 74.A O no hydrogen 2.838 N/A PHE 79.A N SER 77.A OG no hydrogen 3.274 N/A THR 81.A N VAL 206.A O no hydrogen 3.144 N/A ARG 82.A NE THR 203.A O no hydrogen 2.867 N/A LEU 83.A N LYS 204.A O no hydrogen 2.884 N/A SER 84.A N LYS 202.A O no hydrogen 2.844 N/A SER 84.A OG LYS 202.A O no hydrogen 3.426 N/A ASP 85.A N ARG 82.A O no hydrogen 2.897 N/A GLN 86.A N LEU 83.A O no hydrogen 2.945 N/A GLN 86.A NE2 LEU 83.A O no hydrogen 3.164 N/A GLN 86.A NE2 ASN 191.A OD1 no hydrogen 3.018 N/A ASN 88.A N ARG 232.A O no hydrogen 2.876 N/A ILE 89.A N ASN 185.A OD1 no hydrogen 3.044 N/A ASN 90.A N THR 230.A O no hydrogen 2.931 N/A THR 91.A N LEU 184.A O no hydrogen 2.776 N/A THR 91.A OG1.A TYR 107.A OH no hydrogen 3.175 N/A THR 91.A OG1.A LEU 184.A O no hydrogen 3.216 N/A LYS 92.A N ASP 228.A O no hydrogen 2.975 N/A VAL 93.A N ALA 182.A O no hydrogen 3.044 N/A SER 94.A N ASN 226.A O no hydrogen 3.083 N/A SER 94.A OG SER 181.A OG.B no hydrogen 2.953 N/A TYR 95.A N GLN 180.A O no hydrogen 2.793 N/A TYR 95.A OH THR 179.A O no hydrogen 2.698 N/A SER 96.A N ASN 223.A O no hydrogen 2.890 N/A SER 96.A OG GLN 180.A OE1 no hydrogen 3.249 N/A SER 98.A N GLN 221.A O no hydrogen 2.905 N/A ASN 100.A N THR 219.A O no hydrogen 3.049 N/A THR 102.A N GLY 217.A O no hydrogen 2.806 N/A TYR 103.A N THR 134.A O no hydrogen 2.998 N/A ASN 104.A N GLU 214.A O no hydrogen 3.031 N/A ASN 104.A ND2 GLU 214.A OE1 no hydrogen 2.911 N/A ALA 105.A N ASN 132.A O no hydrogen 2.976 N/A ALA 106.A N GLY 212.A O no hydrogen 2.827 N/A TYR 107.A N ILE 129.A O no hydrogen 2.926 N/A ASP 108.A N GLU 210.A O no hydrogen 2.816 N/A ILE 109.A N ILE 127.A O no hydrogen 2.797 N/A TRP 110.A N SER 208.A O no hydrogen 3.234 N/A TRP 110.A NE1 GLU 210.A OE1 no hydrogen 3.277 N/A LEU 111.A N ASP 125.A O no hydrogen 2.938 N/A HIS 112.A N TYR 205.A O no hydrogen 3.061 N/A HIS 112.A ND1 SER 207.A OG no hydrogen 2.696 N/A HIS 112.A NE2 SER 121.A O no hydrogen 2.920 N/A LYS 116.A N THR 114.A OG1 no hydrogen 2.875 N/A ALA 117.A N TYR 73.A OH no hydrogen 2.855 N/A SER 118.A N SER 121.A OG no hydrogen 2.787 N/A SER 118.A OG.A GLU 71.A OE1 no hydrogen 2.450 N/A SER 118.A OG.B GLU 71.A OE1 no hydrogen 3.299 N/A SER 121.A N SER 118.A O no hydrogen 3.111 N/A SER 121.A OG SER 118.A O no hydrogen 3.567 N/A THR 124.A N LEU 111.A O no hydrogen 2.805 N/A THR 124.A OG1 LEU 111.A O no hydrogen 3.167 N/A THR 124.A OG1 ASP 125.A OD1 no hydrogen 2.847 N/A ASP 125.A N LEU 111.A O no hydrogen 3.372 N/A GLN 126.A N ASN 169.A O no hydrogen 2.767 N/A GLN 126.A NE2 ASP 108.A OD1 no hydrogen 2.899 N/A ILE 127.A N ILE 109.A O no hydrogen 2.795 N/A MET 128.A N PHE 171.A O no hydrogen 2.847 N/A ILE 129.A N TYR 107.A O no hydrogen 2.988 N/A TRP 130.A N PHE 173.A O no hydrogen 2.738 N/A LEU 131.A N ALA 105.A O no hydrogen 2.737 N/A ASN 132.A N ALA 105.A O no hydrogen 3.091 N/A ASN 133.A N ASN 178.A OD1 no hydrogen 2.886 N/A ASN 133.A ND2 ALA 136.A O no hydrogen 2.964 N/A THR 134.A N TYR 103.A O no hydrogen 2.822 N/A THR 134.A OG1 ASN 132.A OD1 no hydrogen 2.767 N/A ASN 135.A ND2.A GLY 101.A O no hydrogen 2.887 N/A ASN 135.A ND2.B THR 102.A OG1 no hydrogen 2.809 N/A ALA 136.A N ASN 133.A OD1 no hydrogen 2.927 N/A SER 141.A N LYS 157.A O no hydrogen 2.888 N/A TYR 142.A OH THR 145.A OG1 no hydrogen 2.735 N/A VAL 143.A N VAL 155.A O no hydrogen 2.796 N/A THR 145.A OG1 TYR 142.A OH no hydrogen 2.735 N/A VAL 146.A N TRP 153.A O no hydrogen 2.855 N/A ILE 148.A N HIS 151.A O no hydrogen 2.877 N/A HIS 151.A N ILE 148.A O no hydrogen 3.117 N/A TRP 153.A N VAL 146.A O no hydrogen 2.821 N/A TRP 153.A NE1 ILE 148.A O no hydrogen 2.897 N/A LYS 154.A N ILE 174.A O no hydrogen 2.878 N/A VAL 155.A N GLU 144.A O no hydrogen 2.793 N/A TYR 156.A N SER 172.A O no hydrogen 2.844 N/A LYS 157.A N SER 141.A O no hydrogen 2.895 N/A GLY 158.A N VAL 170.A O no hydrogen 2.864 N/A ILE 160.A N TRP 168.A O no hydrogen 2.740 N/A ALA 162.A N LYS 166.A O no hydrogen 2.777 N/A GLY 163.A N ASP 161.A OD1 no hydrogen 2.739 N/A LYS 166.A N GLY 163.A O no hydrogen 3.051 N/A LYS 166.A NZ ASP 120.A O no hydrogen 3.297 N/A TRP 168.A N ILE 160.A O no hydrogen 2.957 N/A TRP 168.A NE1 GLN 126.A OE1 no hydrogen 2.977 N/A ASN 169.A N THR 124.A O no hydrogen 3.244 N/A ASN 169.A ND2 THR 124.A O no hydrogen 3.562 N/A ASN 169.A ND2 ASP 125.A OD2 no hydrogen 3.005 N/A VAL 170.A N GLY 158.A O no hydrogen 2.832 N/A PHE 171.A N GLN 126.A O no hydrogen 2.873 N/A SER 172.A N TYR 156.A O no hydrogen 2.963 N/A PHE 173.A N MET 128.A O no hydrogen 2.757 N/A ILE 174.A N LYS 154.A O no hydrogen 2.780 N/A ARG 175.A N TRP 130.A O no hydrogen 3.053 N/A ARG 175.A NE HIS 151.A ND1 no hydrogen 2.886 N/A ARG 175.A NH1 ALA 177.A O no hydrogen 2.754 N/A ARG 175.A NH2 HIS 151.A ND1 no hydrogen 3.537 N/A THR 176.A N SER 152.A O no hydrogen 3.091 N/A ASN 178.A ND2 ASN 133.A O no hydrogen 3.493 N/A THR 179.A N LEU 131.A O no hydrogen 2.906 N/A THR 179.A OG1 SER 181.A O no hydrogen 3.265 N/A SER 181.A OG.B VAL 93.A O no hydrogen 3.078 N/A SER 181.A OG.B SER 94.A OG no hydrogen 2.953 N/A ALA 182.A N VAL 93.A O no hydrogen 3.095 N/A ASN 183.A ND2.A THR 91.A O no hydrogen 2.859 N/A LEU 184.A N THR 91.A O no hydrogen 3.044 N/A ASN 185.A ND2 ASN 88.A OD1 no hydrogen 2.921 N/A ILE 186.A N ILE 89.A O no hydrogen 2.848 N/A ARG 187.A N ASN 185.A OD1 no hydrogen 3.025 N/A ARG 187.A NE.B GLN 86.A OE1 no hydrogen 2.740 N/A ARG 187.A NH1.A GLN 86.A O no hydrogen 2.981 N/A ARG 187.A NH1.B ASN 88.A OD1 no hydrogen 2.926 N/A ARG 187.A NH2.B GLN 86.A OE1 no hydrogen 3.030 N/A ASP 188.A N ASN 185.A O no hydrogen 2.992 N/A THR 190.A N ILE 186.A O no hydrogen 2.980 N/A THR 190.A OG1 ILE 186.A O no hydrogen 3.440 N/A THR 190.A OG1 ARG 187.A O no hydrogen 3.337 N/A ASN 191.A N ARG 187.A O no hydrogen 2.853 N/A ASN 191.A ND2 GLN 86.A OE1 no hydrogen 2.979 N/A TYR 192.A N ASP 188.A O no hydrogen 3.028 N/A TYR 192.A OH GLU 144.A OE2 no hydrogen 2.557 N/A LEU 193.A N PHE 189.A O no hydrogen 3.007 N/A ALA 194.A N THR 190.A O no hydrogen 2.824 N/A ASP 195.A N ASN 191.A O no hydrogen 2.746 N/A SER 196.A N ASN 191.A O no hydrogen 3.326 N/A LYS 197.A N TYR 192.A O no hydrogen 2.938 N/A LYS 197.A NZ GLU 144.A OE1 no hydrogen 3.035 N/A LYS 197.A NZ GLU 144.A OE2 no hydrogen 3.451 N/A TRP 199.A N LEU 193.A O no hydrogen 2.862 N/A SER 201.A OG.A THR 203.A OG1 no hydrogen 2.739 N/A LYS 202.A NZ ASN 191.A OD1 no hydrogen 3.223 N/A LYS 202.A NZ ASP 195.A OD1 no hydrogen 2.979 N/A LYS 202.A NZ ASP 195.A OD2 no hydrogen 2.693 N/A THR 203.A N SER 201.A OG.A no hydrogen 3.158 N/A THR 203.A OG1 SER 201.A OG.A no hydrogen 2.739 N/A LYS 204.A N SER 201.A O no hydrogen 3.180 N/A LYS 204.A NZ ASP 125.A OD1 no hydrogen 2.698 N/A TYR 205.A N HIS 112.A O no hydrogen 2.825 N/A VAL 206.A N THR 81.A O no hydrogen 2.872 N/A SER 207.A N TRP 110.A O no hydrogen 2.708 N/A SER 207.A OG HIS 112.A ND1 no hydrogen 2.696 N/A SER 208.A OG SER 65.A O no hydrogen 3.432 N/A SER 208.A OG TRP 67.A O no hydrogen 2.882 N/A SER 208.A OG GLU 210.A OE2 no hydrogen 2.807 N/A VAL 209.A N SER 65.A O no hydrogen 2.999 N/A GLU 210.A N ASP 108.A O no hydrogen 2.775 N/A PHE 211.A N ILE 63.A O no hydrogen 2.937 N/A GLY 212.A N ALA 106.A O no hydrogen 3.050 N/A THR 213.A N PRO 61.A O no hydrogen 3.046 N/A GLU 214.A N ASN 104.A OD1 no hydrogen 2.884 N/A VAL 215.A N ALA 59.A O no hydrogen 2.947 N/A PHE 216.A N THR 102.A O no hydrogen 2.941 N/A GLY 217.A N THR 102.A O no hydrogen 3.307 N/A GLY 218.A N TRP 50.A O no hydrogen 2.762 N/A THR 219.A N ASN 100.A OD1 no hydrogen 2.801 N/A THR 219.A OG1 ASN 49.A OD1 no hydrogen 2.586 N/A GLY 220.A N TRP 48.A O no hydrogen 2.963 N/A GLN 221.A N SER 98.A O no hydrogen 2.950 N/A ILE 222.A N TRP 46.A O no hydrogen 2.971 N/A ASN 223.A N SER 96.A O no hydrogen 2.973 N/A ASN 223.A ND2 TYR 37.A OH no hydrogen 3.002 N/A ASN 223.A ND2 ASP 43.A OD1 no hydrogen 2.771 N/A ILE 224.A N MET 44.A O no hydrogen 2.748 N/A SER 225.A N SER 94.A O no hydrogen 2.885 N/A ASN 226.A N SER 94.A O no hydrogen 3.475 N/A ASP 228.A N LYS 92.A O no hydrogen 3.140 N/A VAL 229.A N TYR 17.A OH no hydrogen 2.927 N/A THR 230.A N ASN 90.A O no hydrogen 2.837 N/A THR 230.A OG1 ASP 228.A OD1.B no hydrogen 2.518 N/A ARG 232.A N ASN 88.A O no hydrogen 2.951 N/A ARG 232.A NH1 ARG 232.A OXT no hydrogen 3.098 N/A