Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7pu1_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N LEU 40.A O no hydrogen 3.013 N/A PHE 2.A N THR 79.A OG1 no hydrogen 3.066 N/A VAL 3.A N GLN 176.A OE1 no hydrogen 2.915 N/A GLN 4.A N GLN 77.A O no hydrogen 2.845 N/A ASN 5.A ND2 GLN 77.A OE1 no hydrogen 2.917 N/A ILE 6.A N TYR 13.A O no hydrogen 2.902 N/A VAL 7.A N GLU 75.A O no hydrogen 2.828 N/A ILE 8.A N LYS 11.A O no hydrogen 3.049 N/A LYS 11.A N ILE 8.A O no hydrogen 3.142 N/A TYR 13.A N ILE 6.A O no hydrogen 2.760 N/A GLY 15.A N GLN 4.A O no hydrogen 2.927 N/A GLN 20.A N LEU 17.A O no hydrogen 2.907 N/A TYR 21.A N LEU 17.A O no hydrogen 2.830 N/A TYR 23.A N GLN 20.A O no hydrogen 3.075 N/A MET 24.A N TYR 21.A O no hydrogen 3.191 N/A TRP 33.A N CYS 177.A O no hydrogen 2.983 N/A TRP 33.A NE1 ASN 179.A OD1 no hydrogen 2.819 N/A SER 34.A N LYS 60.A O no hydrogen 2.972 N/A SER 34.A OG LYS 60.A O no hydrogen 3.483 N/A THR 36.A N ARG 57.A O no hydrogen 2.849 N/A THR 36.A OG1 ARG 57.A O no hydrogen 3.172 N/A ALA 37.A N THR 35.A OG1 no hydrogen 3.102 N/A THR 38.A N THR 36.A O no hydrogen 2.845 N/A LEU 40.A N ALA 37.A O no hydrogen 2.929 N/A GLY 41.A N ASP 39.A OD1 no hydrogen 2.907 N/A VAL 43.A N ASN 173.A O no hydrogen 2.866 N/A THR 46.A N ASP 44.A OD1 no hydrogen 2.948 N/A THR 46.A OG1 ASP 44.A OD1 no hydrogen 2.677 N/A GLY 47.A N ASP 44.A O no hydrogen 2.788 N/A TYR 48.A N GLY 45.A O no hydrogen 3.310 N/A THR 50.A N GLY 47.A O no hydrogen 3.063 N/A THR 50.A OG1 GLY 47.A O no hydrogen 2.826 N/A ASP 52.A N THR 50.A OG1 no hydrogen 3.242 N/A ILE 53.A N THR 50.A O no hydrogen 3.311 N/A ILE 54.A N PRO 51.A O no hydrogen 3.099 N/A HIS 56.A NE2 GLY 41.A O no hydrogen 2.799 N/A ARG 57.A N HIS 56.A ND1 no hydrogen 2.828 N/A ARG 57.A NH1 PHE 42.A O no hydrogen 2.800 N/A ARG 57.A NH2 ASP 39.A OD1 no hydrogen 2.692 N/A GLY 58.A N ASP 52.A OD1 no hydrogen 3.402 N/A ALA 59.A N HIS 56.A O no hydrogen 3.213 N/A LYS 60.A N SER 34.A O no hydrogen 3.021 N/A LEU 64.A N VAL 30.A O no hydrogen 3.079 N/A ALA 66.A N ASN 179.A O no hydrogen 2.995 N/A VAL 68.A N GLN 181.A O no hydrogen 2.918 N/A SER 69.A N ASP 9.A OD2 no hydrogen 2.882 N/A SER 69.A OG ASP 9.A OD1 no hydrogen 2.873 N/A SER 69.A OG ASP 9.A OD2 no hydrogen 3.143 N/A GLY 72.A N SER 69.A O no hydrogen 2.906 N/A VAL 74.A N VAL 142.A O no hydrogen 2.824 N/A GLU 75.A N VAL 7.A O no hydrogen 2.998 N/A LEU 76.A N TRP 140.A O no hydrogen 2.822 N/A GLN 77.A N ASN 5.A O no hydrogen 2.870 N/A GLN 77.A NE2 GLU 75.A OE2 no hydrogen 2.950 N/A TRP 78.A N ASN 138.A O no hydrogen 2.868 N/A TRP 78.A NE1 HIS 157.A NE2 no hydrogen 2.848 N/A THR 79.A N PHE 2.A O no hydrogen 2.958 N/A THR 79.A OG1 PHE 2.A O no hydrogen 3.465 N/A TRP 81.A NE1 HIS 85.A O no hydrogen 3.075 N/A SER 84.A OG HIS 85.A ND1 no hydrogen 2.826 N/A HIS 85.A N PRO 82.A O no hydrogen 3.027 N/A HIS 85.A ND1 SER 84.A OG no hydrogen 2.826 N/A HIS 86.A N SER 84.A O no hydrogen 2.929 N/A HIS 86.A ND1 ASP 131.A OD2 no hydrogen 2.745 N/A GLY 87.A N SER 130.A OG no hydrogen 2.968 N/A VAL 89.A N SER 116.A O no hydrogen 2.989 N/A ILE 90.A N GLU 158.A O no hydrogen 2.884 N/A ASN 91.A N ALA 114.A O no hydrogen 2.935 N/A TYR 92.A N ARG 156.A O no hydrogen 2.908 N/A TYR 92.A OH TYR 199.A OH no hydrogen 2.719 N/A LEU 93.A N PHE 111.A O no hydrogen 2.922 N/A ALA 94.A N VAL 154.A O no hydrogen 2.932 N/A CYS 96.A N ASN 152.A O no hydrogen 2.798 N/A SER 101.A N ASP 99.A OD1 no hydrogen 2.897 N/A SER 101.A OG ASP 99.A OD1 no hydrogen 3.083 N/A SER 101.A OG ASP 99.A OD2 no hydrogen 2.916 N/A THR 102.A N ASP 99.A O no hydrogen 3.216 N/A THR 102.A OG1 ASP 99.A O no hydrogen 3.282 N/A VAL 103.A N CYS 100.A O no hydrogen 3.252 N/A LYS 105.A NZ ALA 59.A O no hydrogen 3.057 N/A THR 106.A N ASP 104.A OD1 no hydrogen 2.986 N/A THR 106.A OG1 ASP 104.A OD1 no hydrogen 2.744 N/A THR 106.A OG1 ASP 104.A OD2 no hydrogen 3.401 N/A GLN 107.A N ASP 104.A O no hydrogen 3.042 N/A LEU 108.A N LYS 105.A O no hydrogen 3.291 N/A PHE 110.A N THR 193.A O no hydrogen 2.825 N/A PHE 111.A N LEU 93.A O no hydrogen 2.846 N/A LYS 112.A NZ GLU 115.A OE1 no hydrogen 2.795 N/A LYS 112.A NZ PRO 220.A O no hydrogen 2.833 N/A LYS 112.A NZ PRO 222.A O no hydrogen 2.788 N/A ILE 113.A N ASN 91.A O no hydrogen 2.807 N/A ALA 114.A N ASN 91.A O no hydrogen 3.309 N/A SER 116.A N VAL 89.A O no hydrogen 2.986 N/A ILE 119.A N ILE 127.A O no hydrogen 2.762 N/A ASN 120.A N ILE 127.A O no hydrogen 3.101 N/A ASN 120.A ND2 ASP 122.A OD1 no hydrogen 3.146 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 2.941 N/A GLY 126.A N ASN 123.A O no hydrogen 2.894 N/A ILE 127.A N ASN 120.A O no hydrogen 2.854 N/A TRP 128.A N ASP 131.A OD2 no hydrogen 2.834 N/A TRP 128.A NE1 PRO 125.A O no hydrogen 2.832 N/A ALA 129.A N GLY 117.A O no hydrogen 2.846 N/A SER 130.A N GLY 87.A O no hydrogen 3.010 N/A SER 130.A OG HIS 85.A O no hydrogen 3.268 N/A SER 130.A OG GLY 87.A O no hydrogen 3.389 N/A ASN 132.A N TRP 128.A O no hydrogen 3.039 N/A LEU 133.A N ALA 129.A O no hydrogen 2.889 N/A ILE 134.A N SER 130.A O no hydrogen 2.993 N/A ALA 135.A N ASP 131.A O no hydrogen 2.922 N/A ALA 136.A N ASN 132.A O no hydrogen 2.993 N/A ASN 137.A N ILE 134.A O no hydrogen 2.884 N/A ASN 138.A N LEU 133.A O no hydrogen 2.882 N/A SER 139.A N LEU 133.A O no hydrogen 3.264 N/A SER 139.A OG GLU 75.A OE2 no hydrogen 2.782 N/A TRP 140.A N LEU 76.A O no hydrogen 2.925 N/A VAL 142.A N VAL 74.A O no hydrogen 2.834 N/A ILE 144.A N GLY 72.A O no hydrogen 2.970 N/A THR 147.A OG1 TYR 225.A OH no hydrogen 2.652 N/A ALA 149.A N ASP 188.A O no hydrogen 2.844 N/A GLY 151.A N VAL 182.A O no hydrogen 3.097 N/A ASN 152.A ND2 GLY 98.A O no hydrogen 2.951 N/A TYR 153.A N LEU 180.A O no hydrogen 2.825 N/A TYR 153.A OH ALA 149.A O no hydrogen 2.603 N/A VAL 154.A N ALA 94.A O no hydrogen 2.855 N/A LEU 155.A N ILE 178.A O no hydrogen 2.862 N/A ARG 156.A N TYR 92.A O no hydrogen 2.880 N/A ARG 156.A NE ILE 53.A O no hydrogen 3.350 N/A ARG 156.A NE ILE 54.A O no hydrogen 2.783 N/A ARG 156.A NH1 GLU 158.A OE1 no hydrogen 2.806 N/A ARG 156.A NH2 ILE 53.A O no hydrogen 2.831 N/A ARG 156.A NH2 GLU 158.A OE2 no hydrogen 2.879 N/A HIS 157.A N GLN 176.A O no hydrogen 2.884 N/A HIS 157.A ND1 ASN 91.A OD1 no hydrogen 2.731 N/A GLU 158.A N ILE 90.A O no hydrogen 2.956 N/A ILE 159.A N TYR 174.A O no hydrogen 3.414 N/A ILE 160.A N PRO 88.A O no hydrogen 3.040 N/A ALA 161.A N GLN 172.A O no hydrogen 2.835 N/A LEU 162.A N HIS 86.A O no hydrogen 2.777 N/A ALA 165.A N LEU 162.A O no hydrogen 3.106 N/A GLN 166.A N GLN 166.A OE1 no hydrogen 2.860 N/A GLN 168.A NE2 ASP 201.A OD2 no hydrogen 3.144 N/A GLY 170.A N ASN 167.A O no hydrogen 2.980 N/A GLN 172.A N ALA 161.A O no hydrogen 2.998 N/A ASN 173.A N VAL 43.A O no hydrogen 2.913 N/A ASN 173.A ND2 VAL 43.A O no hydrogen 3.512 N/A ASN 173.A ND2 TYR 48.A OH no hydrogen 2.681 N/A TYR 174.A N ILE 159.A O no hydrogen 2.838 N/A TYR 174.A OH GLN 172.A OE1 no hydrogen 2.756 N/A GLN 176.A N HIS 157.A O no hydrogen 2.801 N/A GLN 176.A NE2 PRO 175.A O no hydrogen 2.895 N/A CYS 177.A SG ILE 54.A O no hydrogen 3.761 N/A ILE 178.A N LEU 155.A O no hydrogen 2.960 N/A ASN 179.A N ILE 31.A O no hydrogen 2.908 N/A ASN 179.A ND2 GLY 62.A O no hydrogen 2.896 N/A ASN 179.A ND2 LEU 64.A O no hydrogen 3.018 N/A LEU 180.A N TYR 153.A O no hydrogen 2.837 N/A GLN 181.A N ALA 66.A O no hydrogen 2.835 N/A VAL 182.A N GLY 151.A O no hydrogen 2.816 N/A THR 183.A OG1 VAL 68.A O no hydrogen 2.785 N/A SER 187.A N THR 147.A O no hydrogen 3.267 N/A ASP 188.A N THR 147.A O no hydrogen 2.897 N/A THR 193.A N PHE 110.A O no hydrogen 2.782 N/A ALA 197.A N LEU 194.A O no hydrogen 2.825 N/A LEU 198.A N GLY 195.A O no hydrogen 3.255 N/A TYR 199.A OH TYR 92.A OH no hydrogen 2.719 N/A TYR 199.A OH GLU 158.A OE1 no hydrogen 2.552 N/A HIS 200.A N ASP 203.A OD2 no hydrogen 2.929 N/A ASP 203.A N HIS 200.A O no hydrogen 3.055 N/A ILE 206.A N ASP 203.A O no hydrogen 2.940 N/A LEU 207.A N ASP 203.A O no hydrogen 2.916 N/A ILE 208.A N ALA 165.A O no hydrogen 3.115 N/A TYR 211.A N ASN 209.A OD1 no hydrogen 2.920 N/A TYR 211.A OH HIS 163.A O no hydrogen 2.764 N/A LYS 213.A NZ.A ASP 121.A OD2 no hydrogen 3.112 N/A LYS 213.A NZ.A LEU 214.A O no hydrogen 3.148 N/A LYS 213.A NZ.B ASP 121.A O no hydrogen 2.852 N/A LYS 213.A NZ.B ASP 122.A O no hydrogen 3.374 N/A LEU 214.A N ASP 121.A OD2 no hydrogen 2.860 N/A TYR 217.A OH GLY 205.A O no hydrogen 2.667 N/A TYR 225.A N LYS 112.A O no hydrogen 2.864 N/A TYR 225.A OH THR 147.A OG1 no hydrogen 2.652 N/A TYR 225.A OH ASP 188.A OD2 no hydrogen 2.540 N/A