Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lun_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE1 no hydrogen 2.711 N/A VAL 3.A N GLY 58.A O no hydrogen 2.843 N/A ILE 5.A N GLU 60.A O no hydrogen 2.635 N/A VAL 7.A N PHE 62.A O no hydrogen 2.621 N/A VAL 8.A N LEU 109.A O no hydrogen 2.837 N/A VAL 9.A N GLY 75.A O no hydrogen 2.761 N/A HIS 10.A N ILE 111.A O no hydrogen 2.726 N/A HIS 10.A ND1 THR 77.A OG1 no hydrogen 2.756 N/A HIS 10.A NE2 ASN 110.A OD1 no hydrogen 2.602 N/A VAL 11.A N THR 77.A O no hydrogen 2.702 N/A VAL 12.A N VAL 113.A O no hydrogen 2.759 N/A TRP 13.A N THR 79.A O no hydrogen 2.835 N/A ASN 14.A N GLU 18.A OE1 no hydrogen 2.729 N/A GLU 15.A N GLU 18.A OE1 no hydrogen 3.094 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.539 N/A GLU 18.A N GLU 15.A O no hydrogen 2.880 N/A ASN 19.A N GLU 16.A O no hydrogen 2.932 N/A GLN 24.A N SER 21.A OG no hydrogen 2.908 N/A GLN 24.A NE2 PHE 148.A O no hydrogen 2.759 N/A GLN 24.A NE2 THR 153.A OG1 no hydrogen 2.777 N/A ILE 25.A N SER 21.A O no hydrogen 3.008 N/A GLN 26.A N ASP 22.A O no hydrogen 2.583 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 3.044 N/A SER 27.A N ALA 23.A O no hydrogen 2.898 N/A SER 27.A OG GLN 24.A O no hydrogen 2.628 N/A SER 27.A OG THR 150.A OG1 no hydrogen 3.289 N/A GLN 28.A N GLN 24.A O no hydrogen 3.180 N/A GLN 28.A NE2 GLN 28.A O no hydrogen 3.073 N/A GLN 28.A NE2 GLY 161.A O no hydrogen 2.708 N/A ILE 29.A N ILE 25.A O no hydrogen 3.124 N/A ASP 30.A N GLN 26.A O no hydrogen 2.900 N/A ILE 31.A N SER 27.A O no hydrogen 2.996 N/A LEU 32.A N GLN 28.A O no hydrogen 2.952 N/A ASN 33.A N ILE 29.A O no hydrogen 2.922 N/A ASN 33.A ND2 PHE 61.A O no hydrogen 2.728 N/A LYS 34.A N ASP 30.A O no hydrogen 3.214 N/A LYS 34.A N ILE 31.A O no hydrogen 2.967 N/A ASP 35.A N ILE 31.A O no hydrogen 2.821 N/A PHE 36.A N LEU 32.A O no hydrogen 2.855 N/A ARG 37.A N LYS 34.A O no hydrogen 2.897 N/A ARG 37.A NE ASP 56.A OD1 no hydrogen 2.781 N/A ARG 37.A NE ASP 56.A OD2 no hydrogen 3.374 N/A ARG 37.A NH1 GLU 60.A OE2 no hydrogen 2.739 N/A ARG 37.A NH2 ASP 56.A OD2 no hydrogen 2.760 N/A LYS 38.A N ASP 35.A O no hydrogen 3.390 N/A LEU 39.A N LYS 34.A O no hydrogen 2.761 N/A ASN 40.A ND2 ASP 42.A OD1 no hydrogen 2.767 N/A ASN 40.A ND2 VAL 237.A O no hydrogen 2.712 N/A VAL 43.A N ASN 40.A O no hydrogen 3.101 N/A SER 44.A N SER 41.A O no hydrogen 3.157 N/A SER 44.A OG SER 41.A O no hydrogen 3.099 N/A GLN 45.A N ASP 42.A O no hydrogen 2.813 N/A VAL 46.A N VAL 43.A O no hydrogen 2.955 N/A TRP 50.A N PRO 47.A O no hydrogen 2.729 N/A SER 51.A N SER 48.A O no hydrogen 3.115 N/A SER 51.A OG SER 48.A O no hydrogen 2.982 N/A LEU 53.A N TRP 50.A O no hydrogen 2.801 N/A ALA 55.A N PHE 239.A O no hydrogen 2.746 N/A GLY 58.A N ASP 56.A OD1 no hydrogen 2.664 N/A ILE 59.A N PHE 36.A O no hydrogen 3.369 N/A GLU 60.A N VAL 3.A O no hydrogen 2.783 N/A PHE 61.A N ASN 33.A OD1 no hydrogen 2.599 N/A PHE 62.A N ILE 5.A O no hydrogen 3.023 N/A ALA 64.A N VAL 7.A O no hydrogen 2.747 N/A LYS 66.A NZ THR 65.A OG1 no hydrogen 3.404 N/A ASP 67.A N ASN 71.A O no hydrogen 2.629 N/A ASN 69.A N ASP 67.A OD1 no hydrogen 2.748 N/A GLY 70.A N ASP 67.A O no hydrogen 2.771 N/A ASN 71.A N ASP 67.A OD1 no hydrogen 2.868 N/A THR 73.A N THR 65.A O no hydrogen 2.838 N/A GLY 75.A N THR 73.A OG1 no hydrogen 2.855 N/A ILE 76.A N THR 74.A OG1 no hydrogen 3.262 N/A THR 77.A N VAL 9.A O no hydrogen 2.664 N/A THR 77.A OG1 HIS 10.A ND1 no hydrogen 2.756 N/A ARG 78.A NH1 ILE 20.A O no hydrogen 2.932 N/A ARG 78.A NH1 ASP 22.A OD1 no hydrogen 2.763 N/A ARG 78.A NH2 ASN 19.A OD1 no hydrogen 2.665 N/A ARG 78.A NH2 ILE 20.A O no hydrogen 2.553 N/A THR 79.A N VAL 11.A O no hydrogen 2.738 N/A THR 79.A OG1 GLU 100.A OE1 no hydrogen 2.488 N/A THR 81.A N TRP 13.A O no hydrogen 2.610 N/A THR 81.A OG1 GLY 98.A O no hydrogen 2.510 N/A VAL 83.A N THR 81.A OG1 no hydrogen 3.015 N/A PHE 86.A N VAL 116.A O no hydrogen 2.852 N/A THR 87.A N GLU 91.A OE1 no hydrogen 2.686 N/A THR 87.A OG1 GLU 91.A OE1 no hydrogen 3.086 N/A THR 87.A OG1 GLU 91.A OE2 no hydrogen 2.509 N/A THR 88.A N LYS 118.A O no hydrogen 3.149 N/A THR 88.A OG1 GLU 120.A OE2 no hydrogen 2.761 N/A SER 89.A N THR 87.A OG1 no hydrogen 2.969 N/A SER 89.A OG GLU 120.A OE1 no hydrogen 3.307 N/A SER 89.A OG GLU 120.A OE2 no hydrogen 2.600 N/A ASP 90.A N THR 87.A O no hydrogen 3.128 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.766 N/A LYS 93.A N ASP 90.A O no hydrogen 2.950 N/A LYS 93.A NZ ASP 90.A OD1 no hydrogen 2.783 N/A LYS 93.A NZ THR 138.A O no hydrogen 2.849 N/A PHE 94.A N GLU 91.A O no hydrogen 3.469 N/A ALA 95.A N ASP 101.A OD1 no hydrogen 2.861 N/A SER 97.A N PHE 94.A O no hydrogen 3.061 N/A SER 97.A OG GLU 91.A O no hydrogen 2.725 N/A SER 97.A OG PHE 94.A O no hydrogen 3.122 N/A GLY 98.A N ALA 95.A O no hydrogen 2.996 N/A GLY 99.A N PHE 94.A O no hydrogen 2.848 N/A GLU 100.A N VAL 92.A O no hydrogen 2.842 N/A TRP 103.A N ASN 110.A OD1 no hydrogen 2.748 N/A ARG 107.A N PRO 104.A O no hydrogen 2.895 N/A ARG 107.A NH2 PRO 68.A O no hydrogen 2.903 N/A TYR 108.A N PRO 104.A O no hydrogen 2.897 N/A TYR 108.A OH LYS 66.A O no hydrogen 2.674 N/A LEU 109.A N PRO 6.A O no hydrogen 2.740 N/A ASN 110.A ND2 TRP 103.A O no hydrogen 2.865 N/A ASN 110.A ND2 ASP 139.A O no hydrogen 3.549 N/A ILE 111.A N VAL 8.A O no hydrogen 2.777 N/A TRP 112.A N VAL 141.A O no hydrogen 2.738 N/A TRP 112.A NE1 GLU 100.A O no hydrogen 2.725 N/A VAL 113.A N HIS 10.A O no hydrogen 2.777 N/A CYS 114.A N ILE 143.A O no hydrogen 3.258 N/A CYS 114.A SG VAL 116.A O no hydrogen 3.697 N/A HIS 115.A ND1 ASP 145.A OD1 no hydrogen 2.624 N/A LYS 118.A N PHE 86.A O no hydrogen 2.861 N/A LYS 118.A NZ ASP 124.A OD1 no hydrogen 3.069 N/A SER 119.A N GLN 123.A O no hydrogen 2.730 N/A GLY 122.A N SER 119.A O no hydrogen 2.803 N/A GLN 123.A N SER 119.A OG no hydrogen 3.113 N/A ILE 125.A N LEU 117.A O no hydrogen 2.762 N/A TYR 128.A N VAL 142.A O no hydrogen 2.870 N/A TYR 128.A OH THR 87.A O no hydrogen 3.344 N/A TYR 128.A OH ASP 90.A OD1 no hydrogen 2.425 N/A GLN 130.A N GLY 140.A O no hydrogen 3.011 N/A GLN 130.A NE2 PRO 135.A O no hydrogen 2.902 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.657 N/A THR 138.A N PRO 135.A O no hydrogen 3.263 N/A THR 138.A OG1 GLN 130.A OE1 no hydrogen 2.521 N/A ASP 139.A N ALA 136.A O no hydrogen 3.053 N/A VAL 141.A N ASN 110.A O no hydrogen 2.893 N/A VAL 142.A N TYR 128.A O no hydrogen 2.759 N/A ILE 143.A N TRP 112.A O no hydrogen 2.802 N/A VAL 144.A N LEU 126.A O no hydrogen 2.790 N/A ASP 145.A N CYS 114.A O no hydrogen 2.868 N/A ALA 147.A N VAL 144.A O no hydrogen 2.891 N/A PHE 148.A N ASP 145.A O no hydrogen 3.002 N/A GLY 149.A N GLN 28.A OE1 no hydrogen 2.811 N/A THR 150.A N SER 27.A OG no hydrogen 2.762 N/A THR 153.A N GLN 24.A OE1 no hydrogen 2.778 N/A THR 153.A OG1 ASP 145.A O no hydrogen 3.246 N/A THR 153.A OG1 ASP 145.A OD2 no hydrogen 2.588 N/A ALA 154.A N THR 151.A O no hydrogen 3.260 N/A LEU 155.A N ALA 146.A O no hydrogen 2.882 N/A PHE 158.A N LEU 155.A O no hydrogen 2.898 N/A LYS 160.A N ASP 233.A OD2 no hydrogen 2.838 N/A ARG 162.A N ASP 233.A OD2 no hydrogen 3.078 N/A ARG 162.A NE ASP 35.A OD1 no hydrogen 3.373 N/A ARG 162.A NE ASP 35.A OD2 no hydrogen 2.751 N/A ARG 162.A NH1 ASP 35.A OD1 no hydrogen 2.949 N/A ARG 162.A NH1 ASP 42.A OD1 no hydrogen 2.818 N/A ARG 162.A NH1 ASP 42.A OD2 no hydrogen 3.234 N/A ARG 162.A NH2 ASP 42.A OD2 no hydrogen 2.833 N/A ARG 162.A NH2 ASP 233.A O no hydrogen 2.765 N/A THR 165.A N GLY 161.A O no hydrogen 3.413 N/A THR 165.A OG1 ASP 35.A OD2 no hydrogen 2.674 N/A THR 165.A OG1 GLY 161.A O no hydrogen 3.458 N/A HIS 166.A N ARG 162.A O no hydrogen 2.735 N/A HIS 166.A ND1 TYR 227.A O no hydrogen 2.577 N/A HIS 166.A NE2 HIS 176.A NE2 no hydrogen 3.213 N/A GLU 167.A N THR 163.A O no hydrogen 2.803 N/A ILE 168.A N ALA 164.A O no hydrogen 2.639 N/A GLY 169.A N THR 165.A O no hydrogen 2.833 N/A HIS 170.A N HIS 166.A O no hydrogen 3.213 N/A HIS 170.A ND1 LEU 174.A O no hydrogen 2.570 N/A HIS 170.A NE2 HIS 176.A NE2 no hydrogen 2.930 N/A TRP 171.A N GLU 167.A O no hydrogen 2.877 N/A TRP 171.A NE1 ASP 139.A OD2 no hydrogen 2.738 N/A LEU 172.A N ILE 168.A O no hydrogen 2.761 N/A LEU 172.A N GLY 169.A O no hydrogen 3.037 N/A ASN 173.A N HIS 170.A O no hydrogen 2.791 N/A LEU 174.A N GLY 169.A O no hydrogen 2.864 N/A HIS 176.A ND1 ASP 180.A OD1 no hydrogen 2.611 N/A ILE 177.A N CYS 228.A O no hydrogen 2.920 N/A GLY 179.A N HIS 176.A O no hydrogen 3.016 N/A GLU 181.A N GLU 181.A OE2 no hydrogen 3.007 N/A LEU 182.A N GLU 185.A OE1 no hydrogen 2.646 N/A GLU 185.A N LEU 182.A O no hydrogen 2.757 N/A CYS 188.A N ASP 186.A OD1 no hydrogen 2.680 N/A SER 189.A N ASP 186.A O no hydrogen 3.132 N/A SER 189.A OG ASP 186.A O no hydrogen 2.440 N/A ARG 190.A N GLU 181.A OE1 no hydrogen 2.687 N/A ARG 190.A NE GLU 185.A OE1 no hydrogen 2.800 N/A ARG 190.A NE GLU 185.A OE2 no hydrogen 3.185 N/A ARG 190.A NH2 GLU 185.A OE2 no hydrogen 2.576 N/A GLU 193.A N SER 191.A OG no hydrogen 2.767 N/A VAL 194.A N ASP 192.A OD1 no hydrogen 2.928 N/A THR 197.A N VAL 194.A O no hydrogen 3.396 N/A THR 197.A OG1 ASP 192.A OD1 no hydrogen 2.863 N/A THR 197.A OG1 ASP 192.A OD2 no hydrogen 2.548 N/A THR 197.A OG1 VAL 194.A O no hydrogen 2.804 N/A ASN 199.A ND2 CYS 188.A O no hydrogen 2.994 N/A GLN 200.A NE2 ASP 202.A O no hydrogen 2.805 N/A GLN 200.A NE2 ASP 229.A OD1 no hydrogen 3.338 N/A GLN 200.A NE2 ASP 229.A OD2 no hydrogen 2.704 N/A ALA 201.A N SER 214.A OG no hydrogen 2.773 N/A ASN 204.A N ASP 229.A OD1 no hydrogen 2.755 N/A ASN 204.A ND2 ASP 222.A OD2 no hydrogen 2.961 N/A ASN 204.A ND2 ASP 229.A OD2 no hydrogen 2.859 N/A CYS 207.A SG PRO 208.A O no hydrogen 3.903 N/A HIS 212.A ND1 ASP 222.A OD2 no hydrogen 2.901 N/A SER 214.A N ASN 217.A OD1 no hydrogen 2.878 N/A SER 214.A OG ASP 222.A OD1 no hydrogen 2.620 N/A SER 214.A OG ASP 222.A OD2 no hydrogen 3.456 N/A CYS 215.A SG PRO 187.A O no hydrogen 3.839 N/A ASN 217.A N SER 214.A O no hydrogen 2.814 N/A ASN 217.A ND2 ASN 199.A O no hydrogen 2.769 N/A ASN 217.A ND2 ASP 222.A OD1 no hydrogen 2.758 N/A GLY 221.A N ASN 217.A O no hydrogen 2.926 N/A ASP 222.A N HIS 212.A O no hydrogen 2.603 N/A ASN 226.A N MET 223.A O no hydrogen 3.005 N/A TYR 227.A N MET 238.A O no hydrogen 2.927 N/A ASP 229.A N ASN 226.A O no hydrogen 2.974 N/A TYR 230.A N ASP 229.A OD1 no hydrogen 2.731 N/A ASP 232.A N GLY 206.A O no hydrogen 2.760 N/A ASP 233.A N PRO 157.A O no hydrogen 3.113 N/A CYS 235.A N ASP 232.A O no hydrogen 2.819 N/A MET 236.A N ASP 233.A O no hydrogen 3.309 N/A VAL 237.A N MET 225.A O no hydrogen 2.646 N/A MET 238.A N MET 225.A O no hydrogen 3.243 N/A THR 240.A N GLN 243.A OE1 no hydrogen 2.733 N/A THR 240.A OG1 ASP 196.A OD1 no hydrogen 2.582 N/A THR 240.A OG1 ASP 196.A OD2 no hydrogen 3.460 N/A GLN 241.A N LEU 53.A O no hydrogen 2.647 N/A GLN 241.A NE2 ILE 54.A O no hydrogen 2.815 N/A GLY 242.A N ASP 196.A OD2 no hydrogen 2.676 N/A GLN 243.A N THR 240.A OG1 no hydrogen 2.956 N/A ALA 244.A N THR 240.A O no hydrogen 2.888 N/A THR 245.A N GLN 241.A O no hydrogen 3.048 N/A THR 245.A OG1 GLN 241.A O no hydrogen 3.211 N/A ARG 246.A N GLY 242.A O no hydrogen 3.461 N/A ARG 246.A NE ASN 173.A O no hydrogen 2.688 N/A ARG 246.A NH2 ASN 173.A O no hydrogen 2.768 N/A VAL 247.A N GLN 243.A O no hydrogen 2.823 N/A ASN 248.A N ALA 244.A O no hydrogen 2.615 N/A ALA 249.A N THR 245.A O no hydrogen 2.824 N/A CYS 250.A N ARG 246.A O no hydrogen 2.804 N/A CYS 250.A SG TRP 171.A O no hydrogen 3.970 N/A LEU 251.A N VAL 247.A O no hydrogen 2.820 N/A ASP 252.A N ASN 248.A O no hydrogen 2.686 N/A GLY 253.A N CYS 250.A O no hydrogen 3.063 N/A ARG 255.A N CYS 250.A O no hydrogen 2.875 N/A ARG 255.A NE TRP 171.A O no hydrogen 2.780 N/A ARG 255.A NH1 ASP 139.A OD1 no hydrogen 2.801 N/A ARG 255.A NH2 ASP 139.A OD1 no hydrogen 3.036 N/A ARG 255.A NH2 TRP 171.A O no hydrogen 2.865 N/A SER 256.A N GLY 253.A O no hydrogen 3.044 N/A SER 256.A OG GLY 253.A O no hydrogen 3.062 N/A SER 257.A OG ASP 106.A O no hydrogen 2.668 N/A PHE 258.A N ARG 255.A O no hydrogen 2.933 N/A LEU 259.A N SER 256.A O no hydrogen 2.853 N/A