Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5quu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N THR 23.A OG1 no hydrogen 2.815 N/A ARG 5.A NH2.A LEU 17.A O no hydrogen 2.916 N/A ARG 5.A NH2.A GLY 20.A O no hydrogen 2.975 N/A ILE 6.A N ILE 21.A O.A no hydrogen 2.828 N/A ILE 6.A N ILE 21.A O.B no hydrogen 2.860 N/A SER 7.A N GLY 55.A O no hydrogen 2.802 N/A SER 7.A OG ASP 14.A OD2 no hydrogen 2.667 N/A THR 8.A N ASP 14.A OD1 no hydrogen 2.786 N/A THR 8.A OG1 ASP 14.A OD1 no hydrogen 2.814 N/A GLY 9.A N SER 7.A OG no hydrogen 3.070 N/A SER 10.A N THR 8.A OG1 no hydrogen 3.141 N/A SER 10.A OG ASP 219.A OD1 no hydrogen 2.767 N/A SER 12.A N ASP 219.A OD1 no hydrogen 2.945 N/A SER 12.A OG VAL 209.A O no hydrogen 3.507 N/A LEU 13.A N SER 10.A OG no hydrogen 3.067 N/A ASP 14.A N SER 10.A O no hydrogen 2.850 N/A LYS 15.A N LYS 11.A O no hydrogen 2.983 N/A LEU 16.A N SER 12.A O no hydrogen 3.103 N/A LEU 17.A N LEU 13.A O no hydrogen 3.023 N/A GLY 18.A N LYS 15.A O no hydrogen 3.022 N/A GLY 19.A N.A ASP 14.A O no hydrogen 2.780 N/A GLY 19.A N.B ASP 14.A O no hydrogen 2.776 N/A ILE 21.A N.A ILE 6.A O no hydrogen 2.843 N/A ILE 21.A N.B ILE 6.A O no hydrogen 2.928 N/A THR 23.A N GLY 4.A O no hydrogen 2.915 N/A THR 23.A OG1 ASP 169.A OD1 no hydrogen 2.626 N/A GLN 24.A N ILE 170.A O no hydrogen 2.884 N/A GLN 24.A NE2 ALA 1.A O no hydrogen 2.864 N/A GLN 24.A NE2 ASP 169.A OD1 no hydrogen 2.906 N/A ILE 26.A N THR 186.A OG1 no hydrogen 2.906 N/A THR 27.A N VAL 172.A O.A no hydrogen 2.871 N/A THR 27.A N VAL 172.A O.B no hydrogen 2.832 N/A GLU 28.A N LEU 187.A O no hydrogen 2.865 N/A VAL 29.A N.A VAL 174.A O no hydrogen 2.938 N/A VAL 29.A N.B VAL 174.A O no hydrogen 2.928 N/A PHE 30.A N VAL 189.A O no hydrogen 2.914 N/A GLY 31.A N ASN 176.A O no hydrogen 3.262 N/A SER 35.A N GLU 32.A O no hydrogen 3.054 N/A SER 35.A OG GLU 32.A O no hydrogen 2.850 N/A LYS 37.A NZ GLY 31.A O no hydrogen 3.014 N/A THR 38.A OG1 ASP 131.A OD1 no hydrogen 3.330 N/A THR 38.A OG1 ASP 131.A OD2 no hydrogen 2.701 N/A LEU 40.A N GLY 36.A O no hydrogen 2.976 N/A ALA 41.A N LYS 37.A O no hydrogen 3.025 N/A HIS 42.A N THR 38.A O no hydrogen 2.885 N/A HIS 42.A ND1 THR 38.A O no hydrogen 2.812 N/A THR 43.A N GLN 39.A O.A no hydrogen 2.955 N/A THR 43.A N GLN 39.A O.B no hydrogen 2.958 N/A THR 43.A OG1 GLN 39.A O.A no hydrogen 2.866 N/A THR 43.A OG1 GLN 39.A O.B no hydrogen 2.867 N/A LEU 44.A N LEU 40.A O no hydrogen 2.886 N/A ALA 45.A N ALA 41.A O no hydrogen 3.008 N/A VAL 46.A N THR 43.A O no hydrogen 3.028 N/A MET 47.A N THR 43.A O no hydrogen 2.860 N/A VAL 48.A N LEU 44.A O no hydrogen 3.013 N/A GLN 49.A N VAL 46.A O no hydrogen 2.944 N/A GLN 49.A NE2 ALA 45.A O no hydrogen 3.018 N/A GLN 49.A NE2 VAL 89.A O no hydrogen 2.955 N/A LEU 50.A N MET 47.A O no hydrogen 3.012 N/A GLU 53.A N GLU 53.A OE2 no hydrogen 2.732 N/A GLU 54.A N PRO 51.A O no hydrogen 2.971 N/A GLY 55.A N PRO 52.A O no hydrogen 3.031 N/A GLY 56.A N PRO 51.A O no hydrogen 3.152 N/A LEU 57.A N VAL 48.A O no hydrogen 2.916 N/A ASN 58.A N LEU 50.A O no hydrogen 2.911 N/A GLY 59.A N VAL 48.A O no hydrogen 3.062 N/A SER 60.A N.A PRO 124.A O no hydrogen 2.814 N/A SER 60.A N.B PRO 124.A O no hydrogen 2.783 N/A SER 60.A OG.A ARG 123.A O no hydrogen 2.924 N/A SER 60.A OG.B ARG 123.A O no hydrogen 2.671 N/A VAL 61.A N HIS 92.A O.A no hydrogen 2.915 N/A VAL 61.A N HIS 92.A O.B no hydrogen 2.915 N/A MET 62.A N LEU 127.A O no hydrogen 2.943 N/A TRP 63.A N ALA 94.A O no hydrogen 2.774 N/A TRP 63.A NE1 ASP 65.A OD1.A no hydrogen 2.975 N/A ILE 64.A N ILE 129.A O no hydrogen 2.842 N/A ASP 65.A N.A ALA 96.A O no hydrogen 2.861 N/A ASP 65.A N.B ALA 96.A O no hydrogen 2.866 N/A THR 66.A N ASP 131.A O no hydrogen 2.895 N/A THR 66.A OG1 SER 132.A O no hydrogen 3.239 N/A THR 66.A OG1 SER 135.A OG.A no hydrogen 2.829 N/A GLU 67.A N ASP 65.A OD1.B no hydrogen 3.070 N/A THR 69.A N ASP 65.A OD1.B no hydrogen 3.176 N/A THR 69.A OG1 ASP 65.A OD1.A no hydrogen 3.367 N/A THR 69.A OG1 ASP 65.A OD1.B no hydrogen 3.461 N/A PHE 70.A N ASP 65.A OD2.A no hydrogen 2.664 N/A PHE 70.A N ASP 65.A OD2.B no hydrogen 3.078 N/A ARG 71.A N HIS 42.A NE2 no hydrogen 2.948 N/A ARG 71.A NH1 ASN 68.A O no hydrogen 2.786 N/A ARG 71.A NH1 PHE 70.A O no hydrogen 2.927 N/A ARG 71.A NH2 ASN 68.A O no hydrogen 3.546 N/A ARG 74.A N ARG 71.A O no hydrogen 2.915 N/A ARG 74.A NE GLN 39.A OE1.A no hydrogen 2.806 N/A ARG 74.A NE GLN 39.A OE1.B no hydrogen 2.845 N/A ARG 74.A NH1 GLN 39.A OE1.A no hydrogen 2.880 N/A ARG 74.A NH1 GLN 39.A OE1.B no hydrogen 2.971 N/A ARG 74.A NH1 THR 213.A O no hydrogen 2.880 N/A ARG 74.A NH2 GLU 77.A OE1 no hydrogen 2.909 N/A ARG 74.A NH2 THR 213.A O no hydrogen 3.001 N/A ILE 75.A N ARG 71.A O no hydrogen 3.236 N/A ARG 76.A N PRO 72.A O no hydrogen 2.980 N/A ARG 76.A NE ASP 87.A OD1 no hydrogen 2.864 N/A ARG 76.A NH1 ASP 87.A OD1 no hydrogen 3.145 N/A ARG 76.A NH1 ASP 87.A OD2 no hydrogen 3.465 N/A ARG 76.A NH2 GLU 73.A OE2 no hydrogen 2.929 N/A GLU 77.A N GLU 73.A O no hydrogen 2.913 N/A ILE 78.A N ARG 74.A O no hydrogen 2.977 N/A ALA 79.A N ILE 75.A O no hydrogen 2.913 N/A GLN 80.A N ARG 76.A O no hydrogen 2.957 N/A ASN 81.A N GLU 77.A O no hydrogen 2.969 N/A ASN 81.A ND2 GLU 214.A O no hydrogen 2.979 N/A ARG 82.A N ILE 78.A O no hydrogen 3.029 N/A ARG 82.A N ALA 79.A O no hydrogen 3.034 N/A ARG 82.A NE LYS 215.A O no hydrogen 2.806 N/A ARG 82.A NH2 LYS 215.A O no hydrogen 3.143 N/A GLY 83.A N GLN 80.A O no hydrogen 3.041 N/A LEU 84.A N ALA 79.A O no hydrogen 2.835 N/A ASP 87.A N ASP 85.A OD1.B no hydrogen 2.991 N/A GLU 88.A N ASP 85.A OD1.B no hydrogen 3.219 N/A GLU 88.A N ASP 85.A OD2.A no hydrogen 2.735 N/A VAL 89.A N ASP 85.A O.A no hydrogen 3.058 N/A VAL 89.A N ASP 85.A O.B no hydrogen 3.049 N/A LEU 90.A N PRO 86.A O no hydrogen 3.072 N/A LYS 91.A N ASP 87.A O no hydrogen 2.973 N/A LYS 91.A NZ GLU 88.A OE1 no hydrogen 3.309 N/A HIS 92.A N.A GLU 88.A O no hydrogen 3.304 N/A HIS 92.A N.A VAL 89.A O no hydrogen 3.226 N/A HIS 92.A N.B GLU 88.A O no hydrogen 3.304 N/A HIS 92.A N.B VAL 89.A O no hydrogen 3.226 N/A HIS 92.A ND1.A GLU 88.A O no hydrogen 2.682 N/A HIS 92.A ND1.B GLU 88.A O no hydrogen 2.682 N/A ILE 93.A N LEU 90.A O no hydrogen 3.064 N/A ALA 94.A N VAL 61.A O no hydrogen 2.826 N/A TYR 95.A OH ASP 65.A OD2.A no hydrogen 3.346 N/A TYR 95.A OH ASP 65.A OD2.B no hydrogen 2.438 N/A ALA 96.A N TRP 63.A O no hydrogen 2.930 N/A ALA 98.A N ASP 65.A O.A no hydrogen 2.750 N/A ALA 98.A N ASP 65.A O.B no hydrogen 2.999 N/A PHE 99.A N.A HIS 103.A ND1 no hydrogen 2.927 N/A PHE 99.A N.B HIS 103.A ND1 no hydrogen 2.971 N/A SER 101.A N GLU 140.A OE1 no hydrogen 2.822 N/A SER 101.A OG GLU 140.A OE2 no hydrogen 2.556 N/A HIS 103.A N ASN 100.A OD1 no hydrogen 2.762 N/A GLN 104.A N ASN 100.A O no hydrogen 2.910 N/A GLN 104.A NE2 LEU 133.A O no hydrogen 2.983 N/A GLN 104.A NE2 HIS 157.A NE2 no hydrogen 3.028 N/A MET 105.A N SER 101.A O no hydrogen 3.004 N/A LEU 106.A N ASN 102.A O no hydrogen 3.071 N/A LEU 107.A N HIS 103.A O no hydrogen 2.838 N/A VAL 108.A N GLN 104.A O no hydrogen 3.273 N/A GLN 109.A N MET 105.A O no hydrogen 3.374 N/A GLN 110.A N LEU 106.A O no hydrogen 2.753 N/A ALA 111.A N LEU 107.A O no hydrogen 2.840 N/A GLU 112.A N GLN 109.A O no hydrogen 3.214 N/A ASP 113.A N GLN 110.A O no hydrogen 3.043 N/A ILE 115.A N ALA 111.A O no hydrogen 2.971 N/A LYS 116.A N GLU 112.A O no hydrogen 2.900 N/A GLU 117.A N.A ASP 113.A O no hydrogen 3.048 N/A GLU 117.A N.B ASP 113.A O no hydrogen 3.051 N/A LEU 118.A N MET 114.A O.A no hydrogen 2.934 N/A LEU 118.A N MET 114.A O.B no hydrogen 2.986 N/A LEU 119.A N LYS 116.A O no hydrogen 3.305 N/A THR 121.A N LEU 118.A O no hydrogen 3.013 N/A THR 121.A OG1 LEU 118.A O no hydrogen 2.775 N/A ARG 123.A N THR 121.A OG1 no hydrogen 3.258 N/A ARG 123.A NH2 GLN 49.A O no hydrogen 3.067 N/A LYS 126.A N SER 60.A O.A no hydrogen 2.882 N/A LYS 126.A N SER 60.A O.B no hydrogen 2.946 N/A LYS 126.A NZ ASP 169.A O no hydrogen 2.887 N/A LEU 128.A N.A ALA 171.A O no hydrogen 2.889 N/A LEU 128.A N.B ALA 171.A O no hydrogen 2.888 N/A ILE 129.A N MET 62.A O no hydrogen 2.846 N/A VAL 130.A N PHE 173.A O no hydrogen 3.001 N/A ASP 131.A N ILE 64.A O no hydrogen 2.977 N/A SER 132.A N THR 66.A OG1 no hydrogen 2.784 N/A LEU 133.A N THR 175.A O no hydrogen 2.900 N/A THR 134.A N SER 132.A OG no hydrogen 3.160 N/A THR 134.A OG1 ASN 176.A OD1 no hydrogen 2.685 N/A SER 135.A N.A SER 132.A OG no hydrogen 3.132 N/A SER 135.A N.B SER 132.A OG no hydrogen 3.129 N/A SER 135.A OG.A THR 66.A OG1 no hydrogen 2.829 N/A SER 135.A OG.B GLU 67.A OE2 no hydrogen 3.217 N/A HIS 136.A NE2 ALA 98.A O no hydrogen 2.781 N/A ARG 138.A N THR 134.A O no hydrogen 2.848 N/A ARG 138.A NH1 ASN 176.A OD1 no hydrogen 3.334 N/A SER 139.A N.A SER 135.A O.A no hydrogen 3.080 N/A SER 139.A N.A SER 135.A O.B no hydrogen 3.081 N/A SER 139.A N.B SER 135.A O.A no hydrogen 3.057 N/A SER 139.A N.B SER 135.A O.B no hydrogen 3.057 N/A SER 139.A OG.A SER 135.A O.A no hydrogen 3.414 N/A SER 139.A OG.A SER 135.A O.B no hydrogen 3.465 N/A SER 139.A OG.A HIS 136.A O no hydrogen 3.050 N/A GLU 140.A N HIS 136.A O no hydrogen 2.982 N/A TYR 141.A N PHE 137.A O no hydrogen 3.001 N/A ALA 146.A N GLY 143.A O no hydrogen 2.839 N/A GLU 149.A N.A GLY 145.A O no hydrogen 3.486 N/A GLU 149.A N.B GLY 145.A O no hydrogen 3.478 N/A ARG 150.A N.A ALA 146.A O no hydrogen 2.718 N/A ARG 150.A N.B ALA 146.A O no hydrogen 2.752 N/A ARG 150.A NE.B TYR 141.A O no hydrogen 2.963 N/A ARG 150.A NH1.B TYR 141.A O no hydrogen 2.961 N/A ARG 150.A NH2.A TYR 141.A O no hydrogen 2.939 N/A GLN 151.A N LEU 147.A O no hydrogen 2.922 N/A GLN 151.A NE2 ALA 182.A O no hydrogen 2.938 N/A GLN 152.A N ALA 148.A O no hydrogen 2.975 N/A LYS 153.A N.A GLU 149.A O.A no hydrogen 3.126 N/A LYS 153.A N.A GLU 149.A O.B no hydrogen 3.025 N/A LYS 153.A N.B GLU 149.A O.A no hydrogen 3.130 N/A LYS 153.A N.B GLU 149.A O.B no hydrogen 3.028 N/A LYS 153.A NZ.B SER 101.A OG no hydrogen 2.642 N/A LYS 153.A NZ.B ASN 102.A OD1 no hydrogen 2.703 N/A LYS 153.A NZ.B TYR 141.A OH no hydrogen 2.727 N/A LEU 154.A N.A ARG 150.A O.A no hydrogen 2.917 N/A LEU 154.A N.A ARG 150.A O.B no hydrogen 2.813 N/A LEU 154.A N.B ARG 150.A O.A no hydrogen 2.975 N/A LEU 154.A N.B ARG 150.A O.B no hydrogen 2.863 N/A ALA 155.A N GLN 151.A O no hydrogen 2.840 N/A LYS 156.A N GLN 152.A O no hydrogen 3.119 N/A LYS 156.A NZ ASP 160.A OD1 no hydrogen 3.435 N/A LYS 156.A NZ ASP 160.A OD2 no hydrogen 2.781 N/A HIS 157.A N LYS 153.A O.A no hydrogen 2.960 N/A HIS 157.A N LYS 153.A O.B no hydrogen 3.017 N/A LEU 158.A N.A LEU 154.A O.A no hydrogen 2.782 N/A LEU 158.A N.A LEU 154.A O.B no hydrogen 2.812 N/A LEU 158.A N.B LEU 154.A O.A no hydrogen 2.772 N/A LEU 158.A N.B LEU 154.A O.B no hydrogen 2.803 N/A ALA 159.A N ALA 155.A O no hydrogen 2.841 N/A ASP 160.A N LYS 156.A O no hydrogen 2.937 N/A LEU 161.A N HIS 157.A O no hydrogen 2.990 N/A HIS 162.A N LEU 158.A O.A no hydrogen 2.771 N/A HIS 162.A N LEU 158.A O.B no hydrogen 2.740 N/A HIS 162.A NE2 SER 184.A O no hydrogen 2.855 N/A ARG 163.A N ALA 159.A O no hydrogen 2.975 N/A ARG 163.A NH1 GLU 112.A OE2 no hydrogen 2.952 N/A ARG 163.A NH2 GLU 112.A OE1 no hydrogen 2.888 N/A ARG 163.A NH2 GLU 112.A OE2 no hydrogen 3.367 N/A LEU 164.A N ASP 160.A O no hydrogen 3.137 N/A ALA 165.A N LEU 161.A O no hydrogen 2.950 N/A ASN 166.A N HIS 162.A O no hydrogen 2.873 N/A LEU 167.A N ARG 163.A O no hydrogen 2.753 N/A TYR 168.A N LEU 164.A O no hydrogen 3.061 N/A TYR 168.A OH GLU 112.A OE2 no hydrogen 2.595 N/A ILE 170.A N ALA 165.A O no hydrogen 3.057 N/A ALA 171.A N LYS 126.A O no hydrogen 2.931 N/A VAL 172.A N.A ALA 25.A O no hydrogen 3.059 N/A VAL 172.A N.B ALA 25.A O no hydrogen 3.074 N/A PHE 173.A N LEU 128.A O.A no hydrogen 2.892 N/A PHE 173.A N LEU 128.A O.B no hydrogen 2.847 N/A VAL 174.A N THR 27.A O no hydrogen 2.906 N/A THR 175.A N VAL 130.A O no hydrogen 3.112 N/A THR 175.A OG1 ASP 131.A OD1 no hydrogen 2.638 N/A ASN 176.A N VAL 29.A O.A no hydrogen 2.978 N/A ASN 176.A N VAL 29.A O.B no hydrogen 2.955 N/A ASN 176.A ND2 GLU 28.A OE1 no hydrogen 2.865 N/A VAL 178.A N GLY 31.A O no hydrogen 3.014 N/A LEU 187.A N ILE 26.A O no hydrogen 3.164 N/A ARG 188.A NE GLU 28.A OE2 no hydrogen 2.745 N/A ARG 188.A NH1 GLU 28.A OE1 no hydrogen 2.945 N/A VAL 189.A N GLU 28.A O no hydrogen 2.761 N/A TYR 190.A N ARG 202.A O.A no hydrogen 2.769 N/A TYR 190.A N ARG 202.A O.B no hydrogen 2.755 N/A LEU 191.A N.A PHE 30.A O no hydrogen 2.871 N/A LEU 191.A N.B PHE 30.A O no hydrogen 2.878 N/A ARG 192.A N.A ILE 200.A O no hydrogen 2.993 N/A ARG 192.A N.B ILE 200.A O no hydrogen 2.981 N/A ARG 192.A NH1.A GLU 207.A OE1 no hydrogen 3.116 N/A ARG 192.A NH1.A GLU 207.A OE2 no hydrogen 3.409 N/A ARG 192.A NH2.A GLU 207.A OE2 no hydrogen 2.848 N/A ARG 192.A NH2.B LYS 193.A O no hydrogen 3.099 N/A GLY 194.A N LYS 198.A O no hydrogen 2.738 N/A LYS 198.A N LYS 195.A O no hydrogen 3.064 N/A LYS 198.A NZ SER 211.A OG no hydrogen 2.837 N/A LYS 198.A NZ ASP 219.A OXT no hydrogen 2.666 N/A ARG 199.A N PHE 210.A O no hydrogen 2.778 N/A ARG 199.A NE GLY 34.A O no hydrogen 3.372 N/A ARG 199.A NE SER 35.A O no hydrogen 3.178 N/A ARG 199.A NH2 GLY 34.A O no hydrogen 3.095 N/A ILE 200.A N ARG 192.A O.A no hydrogen 2.854 N/A ILE 200.A N ARG 192.A O.B no hydrogen 2.827 N/A ALA 201.A N ALA 208.A O no hydrogen 2.861 N/A ARG 202.A N.A TYR 190.A O no hydrogen 2.921 N/A ARG 202.A N.B TYR 190.A O no hydrogen 2.914 N/A ARG 202.A NE.A GLU 207.A OE2 no hydrogen 2.647 N/A ARG 202.A NH1.A GLU 207.A OE2 no hydrogen 3.054 N/A ILE 204.A N ARG 188.A O no hydrogen 2.912 N/A ALA 208.A N ALA 201.A O no hydrogen 2.962 N/A VAL 209.A N SER 12.A OG no hydrogen 3.030 N/A PHE 210.A N ARG 199.A O no hydrogen 2.954 N/A SER 211.A N GLU 218.A O no hydrogen 2.767 N/A THR 213.A N GLY 216.A O no hydrogen 2.895 N/A THR 213.A OG1 GLU 218.A OE1 no hydrogen 2.587 N/A GLU 214.A N GLU 214.A OE2 no hydrogen 2.733 N/A LYS 215.A N THR 213.A OG1 no hydrogen 2.984 N/A LYS 215.A NZ ASN 81.A O no hydrogen 3.319 N/A GLY 216.A N THR 213.A O no hydrogen 2.926 N/A GLU 218.A N SER 211.A O no hydrogen 3.075 N/A