Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rua_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N THR 24.A O no hydrogen 2.871 N/A GLN 5.A N THR 22.A O no hydrogen 2.974 N/A VAL 11.A N THR 115.A O no hydrogen 2.895 N/A LYS 12.A NZ ALA 118.A O no hydrogen 3.277 N/A SER 14.A N VAL 85C.A O no hydrogen 2.836 N/A SER 14.A OG PRO 13.A O no hydrogen 2.584 N/A GLN 15.A N LYS 12.A O no hydrogen 2.981 N/A LEU 17.A N LEU 82.A O no hydrogen 3.055 N/A LEU 19.A N LEU 80.A O no hydrogen 2.853 N/A THR 20.A N SER 6.A O no hydrogen 2.841 N/A CYS 21.A N PHE 78.A O no hydrogen 2.850 N/A THR 22.A N GLN 5.A O no hydrogen 2.789 N/A VAL 23.A N ASN 76.A O no hydrogen 3.119 N/A THR 24.A N GLN 3.A O no hydrogen 2.864 N/A TYR 26.A OH ASP 31.A OD2 no hydrogen 2.519 N/A ILE 28.A N ASN 76.A OD1 no hydrogen 2.880 N/A THR 29.A N SER 27.A OG no hydrogen 3.075 N/A THR 29.A OG1 SER 27.A OG no hydrogen 2.657 N/A SER 30.A N SER 27.A O no hydrogen 3.157 N/A PHE 32.A N SER 30.A O no hydrogen 2.729 N/A ALA 33.A N LEU 98.A O no hydrogen 2.887 N/A TRP 34.A N ILE 51.A O no hydrogen 2.914 N/A TRP 34.A NE1 ILE 28.A O no hydrogen 2.955 N/A TRP 36.A N GLY 49.A O no hydrogen 2.803 N/A ILE 37.A N TYR 94.A O no hydrogen 2.852 N/A ARG 38.A N GLU 46.A O no hydrogen 2.902 N/A ARG 38.A NE GLU 46.A OE1 no hydrogen 2.678 N/A ARG 38.A NH1 ASP 89.A OD1 no hydrogen 2.847 N/A ARG 38.A NH1 TYR 93.A OH no hydrogen 3.018 N/A ARG 38.A NH2 GLU 46.A OE1 no hydrogen 2.915 N/A GLN 39.A N THR 92.A O no hydrogen 2.771 N/A GLN 39.A NE2 ASN 43.A O no hydrogen 3.114 N/A PHE 40.A N LYS 44.A O no hydrogen 2.862 N/A ASN 43.A N PHE 40.A O no hydrogen 2.492 N/A ASN 43.A ND2 PHE 40.A O no hydrogen 3.622 N/A GLU 46.A N ARG 38.A O no hydrogen 2.850 N/A TRP 47.A NE1 ASN 35A.A OD1 no hydrogen 2.958 N/A MET 48.A N TRP 36.A O no hydrogen 2.788 N/A GLY 49.A N TRP 36.A O no hydrogen 3.371 N/A TYR 50.A N SER 58.A O no hydrogen 2.898 N/A ILE 51.A N TRP 34.A O no hydrogen 2.933 N/A ASN 52.A N PHE 56.A O no hydrogen 2.812 N/A SER 54.A N ASN 52.A OD1 no hydrogen 2.872 N/A SER 54.A OG ASN 52.A OD1 no hydrogen 3.233 N/A GLY 55.A N ASN 52.A O no hydrogen 2.907 N/A PHE 56.A N ASN 52.A OD1 no hydrogen 3.159 N/A SER 58.A N TYR 50.A O no hydrogen 3.072 N/A ASN 60.A N MET 48.A O no hydrogen 2.877 N/A ASN 60.A ND2 TRP 47.A O no hydrogen 2.983 N/A SER 62.A N ASN 60.A OD1 no hydrogen 2.944 N/A SER 62.A OG GLU 46.A OE2 no hydrogen 2.788 N/A LEU 63.A N ASN 60.A O no hydrogen 3.018 N/A LYS 64.A N PRO 61.A O no hydrogen 3.080 N/A SER 65.A OG LYS 64.A O no hydrogen 2.297 N/A ARG 66.A N LEU 63.A O no hydrogen 2.705 N/A ARG 66.A NH1 ASP 89.A OD2 no hydrogen 2.997 N/A ARG 66.A NH1 ASN 83A.A O no hydrogen 3.077 N/A ARG 66.A NH2 ASP 89.A OD1 no hydrogen 3.045 N/A SER 68.A N GLN 81.A O no hydrogen 2.742 N/A THR 70.A N PHE 79.A O no hydrogen 3.196 N/A ARG 71.A NH1 TYR 53.A O no hydrogen 3.067 N/A ASP 72.A N GLN 77.A O no hydrogen 2.924 N/A SER 74.A OG ASP 72.A OD1 no hydrogen 2.568 N/A LYS 75.A N ASP 72.A O no hydrogen 3.064 N/A LYS 75.A N ASP 72.A OD1 no hydrogen 3.162 N/A ASN 76.A N THR 73.A O no hydrogen 3.060 N/A ASN 76.A ND2 VAL 23.A O no hydrogen 2.860 N/A ASN 76.A ND2 TYR 26.A O no hydrogen 2.834 N/A GLN 77.A N ASP 72.A O no hydrogen 3.226 N/A GLN 77.A NE2 THR 22.A OG1 no hydrogen 3.002 N/A PHE 78.A N CYS 21.A O no hydrogen 3.023 N/A PHE 79.A N THR 70.A O no hydrogen 2.735 N/A LEU 80.A N LEU 19.A O no hydrogen 3.028 N/A GLN 81.A N SER 68.A O no hydrogen 2.837 N/A LEU 82.A N LEU 17.A O no hydrogen 2.926 N/A THR 86.A N ASP 89.A OD2 no hydrogen 2.961 N/A GLU 88.A N THR 86.A OG1 no hydrogen 3.160 N/A ASP 89.A N THR 86.A O no hydrogen 2.893 N/A THR 90.A N THR 87.A O no hydrogen 3.169 N/A THR 90.A OG1 THR 87.A O no hydrogen 3.445 N/A ALA 91.A N VAL 114.A O no hydrogen 3.136 N/A THR 92.A N GLN 39.A O no hydrogen 3.030 N/A TYR 93.A N THR 112.A O no hydrogen 2.900 N/A TYR 93.A OH ASP 89.A O no hydrogen 2.562 N/A TYR 94.A N ILE 37.A O no hydrogen 2.767 N/A ALA 96.A N ASN 35A.A O no hydrogen 2.960 N/A GLY 97.A N SER 107.A O no hydrogen 2.815 N/A LEU 98.A N ALA 33.A O no hydrogen 2.970 N/A LEU 99.A N GLY 104A.A O no hydrogen 2.924 N/A TRP 100.A N ASP 31.A O no hydrogen 2.930 N/A GLY 103.A N LEU 99.A O no hydrogen 2.691 N/A SER 107.A N GLY 97.A O no hydrogen 2.976 N/A SER 107.A OG ALA 105B.A O no hydrogen 2.593 N/A GLY 109.A N CYS 95.A O no hydrogen 2.829 N/A GLN 110.A N GLN 110.A OE1 no hydrogen 2.753 N/A THR 112.A N TYR 93.A O no hydrogen 2.896 N/A VAL 114.A N ALA 91.A O no hydrogen 2.891 N/A THR 115.A N GLY 9.A O no hydrogen 2.909 N/A VAL 116.A N THR 90.A OG1 no hydrogen 2.902 N/A SER 117.A N VAL 11.A O no hydrogen 2.939 N/A ALA 119.A N SER 117.A OG no hydrogen 2.922 N/A THR 122.A N PHE 151.A O no hydrogen 2.749 N/A THR 122.A OG1 LYS 120.A O no hydrogen 3.228 N/A SER 125.A N LYS 148.A O no hydrogen 3.045 N/A TYR 127.A N LEU 146.A O no hydrogen 2.809 N/A LEU 129.A N GLY 144.A O no hydrogen 2.753 N/A ASP 135.A N VAL 132.A O no hydrogen 2.867 N/A THR 136.A N CYS 133.A O no hydrogen 3.058 N/A THR 136.A OG1 CYS 133.A O no hydrogen 2.423 N/A VAL 141.A N VAL 188.A O no hydrogen 2.740 N/A THR 142.A OG1 THR 187.A OG1 no hydrogen 2.783 N/A LEU 143.A N VAL 186.A O no hydrogen 2.924 N/A GLY 144.A N LEU 129.A O no hydrogen 2.901 N/A CYS 145.A N SER 184.A O no hydrogen 2.944 N/A LEU 146.A N TYR 127.A O no hydrogen 2.832 N/A VAL 147.A N LEU 182.A O no hydrogen 2.618 N/A LYS 148.A N SER 125.A O no hydrogen 2.878 N/A GLY 149.A N TYR 180.A O no hydrogen 2.839 N/A TYR 150.A N TYR 180.A O no hydrogen 3.148 N/A TYR 150.A OH GLU 153.A OE1 no hydrogen 2.717 N/A PHE 151.A N THR 122.A O no hydrogen 3.080 N/A THR 156.A N ALA 203.A O no hydrogen 3.010 N/A THR 158.A N ASN 201.A O no hydrogen 3.003 N/A THR 158.A OG1 ASN 201.A OD1 no hydrogen 2.951 N/A TRP 159.A NE1 SER 184.A OG no hydrogen 2.876 N/A ASN 160.A N THR 199.A O no hydrogen 2.817 N/A ASN 160.A ND2 SER 197.A O no hydrogen 3.000 N/A SER 161.A N ASN 201.A OD1 no hydrogen 2.548 N/A GLY 162.A N TRP 159.A O no hydrogen 2.932 N/A SER 163.A N ASN 160.A O no hydrogen 3.054 N/A SER 163.A OG ASN 160.A O no hydrogen 3.308 N/A LEU 164.A N TRP 159.A O no hydrogen 3.198 N/A HIS 169.A N SER 185.A O no hydrogen 2.904 N/A THR 170.A OG1 SER 184.A OG no hydrogen 3.011 N/A PHE 171.A N SER 183.A O no hydrogen 2.962 N/A VAL 174.A N THR 181.A O no hydrogen 2.783 N/A GLN 176.A N LEU 179.A O no hydrogen 2.865 N/A LEU 179.A N GLN 176.A O no hydrogen 3.161 N/A TYR 180.A N TYR 150.A O no hydrogen 2.678 N/A THR 181.A N VAL 174.A O no hydrogen 2.981 N/A LEU 182.A N VAL 147.A O no hydrogen 2.912 N/A SER 184.A N CYS 145.A O no hydrogen 3.071 N/A SER 184.A OG HIS 169.A O no hydrogen 3.409 N/A SER 184.A OG THR 170.A OG1 no hydrogen 3.011 N/A SER 185.A N HIS 169.A O no hydrogen 2.793 N/A VAL 186.A N LEU 143.A O no hydrogen 3.016 N/A THR 187.A N GLY 167.A O no hydrogen 3.057 N/A THR 187.A OG1 THR 142.A OG1 no hydrogen 2.783 N/A VAL 188.A N VAL 141.A O no hydrogen 2.849 N/A SER 190.A N SER 139.A O no hydrogen 2.750 N/A SER 190.A OG THR 136.A O no hydrogen 2.982 N/A THR 192.A N THR 189.A O no hydrogen 2.831 N/A THR 192.A OG1 THR 189.A O no hydrogen 2.850 N/A TRP 193.A N SER 190.A O no hydrogen 3.007 N/A GLN 196.A N THR 192.A O no hydrogen 2.768 N/A THR 199.A N ASN 160.A OD1 no hydrogen 2.842 N/A CYS 200.A N LYS 213.A O no hydrogen 2.948 N/A ASN 201.A N THR 158.A O no hydrogen 2.848 N/A ASN 201.A ND2 ASP 212.A OD1 no hydrogen 2.970 N/A VAL 202.A N VAL 211.A O no hydrogen 2.837 N/A ALA 203.A N THR 156.A O no hydrogen 2.942 N/A HIS 204.A N THR 209.A O no hydrogen 2.827 N/A HIS 204.A ND1 SER 207.A OG no hydrogen 2.830 N/A HIS 204.A NE2 PRO 152.A O no hydrogen 2.897 N/A SER 207.A N HIS 204.A O no hydrogen 3.110 N/A SER 207.A OG HIS 204.A ND1 no hydrogen 2.830 N/A SER 207.A OG HIS 204.A O no hydrogen 3.491 N/A SER 207.A OG THR 209.A OG1 no hydrogen 3.170 N/A SER 208.A N PRO 205.A O no hydrogen 2.995 N/A THR 209.A N HIS 204.A O no hydrogen 3.284 N/A THR 209.A OG1 SER 207.A O no hydrogen 3.103 N/A THR 209.A OG1 SER 207.A OG no hydrogen 3.170 N/A VAL 211.A N VAL 202.A O no hydrogen 2.967 N/A LYS 213.A N CYS 200.A O no hydrogen 2.785 N/A ILE 215.A N ILE 198.A O no hydrogen 2.941 N/A ASN 35A.A N ALA 96.A O no hydrogen 2.865 N/A ASN 35A.A ND2 ALA 96.A O no hydrogen 3.314 N/A ASN 83A.A N ARG 66.A O no hydrogen 2.872 N/A GLY 104A.A N ASP 102.A OD1 no hydrogen 2.785 N/A VAL 85C.A N GLN 15.A O no hydrogen 3.135 N/A