Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3riu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD2 no hydrogen 2.618 N/A TYR 6.A N ASN 5.A OD1 no hydrogen 2.791 N/A GLN 7.A N PHE 3.A O no hydrogen 2.981 N/A LYS 8.A N SER 4.A O no hydrogen 2.911 N/A TYR 9.A N ASN 5.A O no hydrogen 2.940 N/A ASP 11.A N GLN 7.A O no hydrogen 2.903 N/A ASN 12.A N LYS 8.A O no hydrogen 2.903 N/A ASN 12.A N TYR 9.A O no hydrogen 2.956 N/A GLU 13.A N TYR 9.A O no hydrogen 2.956 N/A GLN 14.A N ILE 10.A O no hydrogen 2.882 N/A ARG 17.A N GLU 13.A O no hydrogen 2.928 N/A GLU 18.A N GLU 15.A O no hydrogen 2.954 N/A ASN 19.A N GLU 15.A O no hydrogen 2.910 N/A ILE 20.A N VAL 16.A O no hydrogen 2.944 N/A ARG 21.A NH2 GLU 18.A OE1 no hydrogen 3.406 N/A ILE 22.A N GLU 18.A O no hydrogen 2.999 N/A VAL 24.A N ILE 20.A O no hydrogen 2.887 N/A ARG 25.A N ARG 21.A O no hydrogen 2.920 N/A GLU 26.A N ILE 22.A O no hydrogen 2.960 N/A ILE 27.A N VAL 23.A O no hydrogen 2.915 N/A GLU 28.A N VAL 24.A O no hydrogen 2.909 N/A HIS 29.A N ARG 25.A O no hydrogen 2.989 N/A LEU 30.A N GLU 26.A O no hydrogen 2.944 N/A SER 31.A N ILE 27.A O no hydrogen 2.911 N/A SER 31.A OG GLU 28.A O no hydrogen 3.099 N/A LYS 32.A N GLU 28.A O no hydrogen 2.926 N/A GLU 33.A N HIS 29.A O no hydrogen 3.020 N/A GLN 35.A N SER 31.A O no hydrogen 2.877 N/A ILE 36.A N LYS 32.A O no hydrogen 2.983 N/A LYS 37.A N GLU 33.A O no hydrogen 2.995 N/A LEU 38.A N ALA 34.A O no hydrogen 2.895 N/A GLN 39.A N GLN 35.A O no hydrogen 2.914 N/A ILE 40.A N ILE 36.A O no hydrogen 2.963 N/A ILE 40.A N LYS 37.A O no hydrogen 2.995 N/A ILE 41.A N LEU 38.A O no hydrogen 3.282 N/A SER 43.A N ILE 40.A O no hydrogen 3.123 N/A SER 46.A N ASP 44.A OD1 no hydrogen 2.923 N/A SER 46.A OG ASP 44.A OD1 no hydrogen 2.743 N/A ILE 48.A N LEU 45.A O no hydrogen 2.933 N/A ALA 51.A N GLN 47.A O no hydrogen 2.891 N/A CYS 52.A N ILE 48.A O no hydrogen 3.047 N/A CYS 52.A N SER 49.A O no hydrogen 2.930 N/A CYS 52.A SG VAL 99.A O no hydrogen 4.015 N/A GLY 53.A N SER 49.A O no hydrogen 3.157 N/A LEU 54.A N ALA 50.A O no hydrogen 2.904 N/A ALA 55.A N ALA 51.A O no hydrogen 2.961 N/A ARG 56.A N CYS 52.A O no hydrogen 2.784 N/A LYS 57.A N GLY 53.A O no hydrogen 2.977 N/A LYS 57.A NZ GLU 60.A OE2 no hydrogen 3.038 N/A GLN 58.A N LEU 54.A O no hydrogen 2.765 N/A VAL 59.A N ALA 55.A O no hydrogen 2.827 N/A GLU 60.A N ARG 56.A O no hydrogen 2.939 N/A LEU 61.A N GLN 58.A O no hydrogen 2.895 N/A CYS 62.A N GLN 58.A O no hydrogen 3.039 N/A CYS 62.A SG GLN 58.A O no hydrogen 3.934 N/A ALA 63.A N VAL 59.A O no hydrogen 3.056 N/A LYS 65.A N LEU 61.A O no hydrogen 3.176 N/A TYR 66.A N CYS 62.A O no hydrogen 2.801 N/A TYR 66.A OH THR 89.A OG1 no hydrogen 3.405 N/A GLN 67.A N ALA 63.A O no hydrogen 2.984 N/A LEU 69.A N LYS 65.A O no hydrogen 3.150 N/A ALA 70.A N GLN 67.A O no hydrogen 2.896 N/A GLU 71.A N GLN 67.A O no hydrogen 3.333 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 3.217 N/A VAL 73.A N ALA 70.A O no hydrogen 2.920 N/A TYR 78.A OH HIS 127.A O no hydrogen 3.000 N/A ARG 80.A N GLN 77.A O no hydrogen 3.136 N/A ARG 80.A NE TYR 81.A OH no hydrogen 3.295 N/A ARG 80.A NH2 TYR 81.A OH no hydrogen 3.254 N/A HIS 84.A N TYR 81.A O no hydrogen 3.178 N/A HIS 84.A ND1 TYR 81.A O no hydrogen 3.227 N/A TRP 85.A N SER 82.A O no hydrogen 2.743 N/A TRP 85.A NE1 TYR 78.A OH no hydrogen 3.273 N/A THR 86.A N SER 82.A O no hydrogen 3.264 N/A ILE 88.A N TRP 85.A O no hydrogen 3.300 N/A THR 89.A N TRP 85.A O no hydrogen 2.742 N/A THR 89.A OG1 TYR 66.A OH no hydrogen 3.405 N/A THR 89.A OG1 TRP 85.A O no hydrogen 2.744 N/A GLN 90.A N THR 86.A O no hydrogen 2.889 N/A ARG 91.A NE SER 31.A OG no hydrogen 3.061 N/A ARG 91.A NH2 SER 31.A OG no hydrogen 2.659 N/A LEU 92.A N ILE 88.A O no hydrogen 2.970 N/A ILE 93.A N THR 89.A O no hydrogen 2.901 N/A PHE 94.A N GLN 90.A O no hydrogen 2.904 N/A ILE 95.A N ARG 91.A O no hydrogen 2.911 N/A ILE 96.A N LEU 92.A O no hydrogen 2.877 N/A ALA 97.A N ILE 93.A O no hydrogen 2.905 N/A LEU 98.A N PHE 94.A O no hydrogen 2.892 N/A LEU 98.A N ILE 95.A O no hydrogen 2.847 N/A VAL 99.A N ILE 95.A O no hydrogen 2.909 N/A ILE 100.A N ILE 96.A O no hydrogen 2.918 N/A TYR 101.A N LEU 98.A O no hydrogen 2.824 N/A LEU 102.A N LEU 98.A O no hydrogen 2.923 N/A GLU 103.A N VAL 99.A O no hydrogen 2.895 N/A THR 109.A OG1 THR 112.A OG1 no hydrogen 3.321 N/A THR 112.A OG1 THR 109.A OG1 no hydrogen 3.321 N/A VAL 113.A N THR 109.A O no hydrogen 2.796 N/A ALA 114.A N ARG 110.A O no hydrogen 2.922 N/A GLU 115.A N GLU 111.A O no hydrogen 2.931 N/A LEU 118.A N ALA 114.A O no hydrogen 2.862 N/A LYS 119.A N PHE 126.A O no hydrogen 3.077 N/A SER 121.A OG SER 123.A OG no hydrogen 2.898 N/A SER 123.A OG SER 121.A OG no hydrogen 2.898 N/A GLU 124.A N SER 121.A O no hydrogen 2.906 N/A GLY 125.A N GLN 122.A O no hydrogen 3.287 N/A LEU 128.A N LYS 119.A O no hydrogen 3.224 N/A TYR 133.A N ASP 129.A O no hydrogen 3.255 N/A TYR 133.A OH VAL 108.A O no hydrogen 2.573 N/A LEU 134.A N VAL 130.A O no hydrogen 2.912 N/A LEU 135.A N GLU 131.A O no hydrogen 2.886 N/A GLY 136.A N ASP 132.A O no hydrogen 2.884 N/A ILE 137.A N TYR 133.A O no hydrogen 2.927 N/A LEU 138.A N LEU 134.A O no hydrogen 2.961 N/A ALA 141.A N LEU 138.A O no hydrogen 2.682 N/A SER 142.A OG ASP 191.A OD2 no hydrogen 2.646 N/A GLU 143.A N GLN 139.A O no hydrogen 2.972 N/A LEU 144.A N LEU 140.A O no hydrogen 2.881 N/A SER 145.A N ALA 141.A O no hydrogen 2.922 N/A PHE 147.A N GLU 143.A O no hydrogen 2.919 N/A ALA 148.A N LEU 144.A O no hydrogen 2.920 N/A THR 149.A N SER 145.A O no hydrogen 2.983 N/A THR 149.A OG1 SER 145.A O no hydrogen 3.128 N/A ASN 150.A N ARG 146.A O no hydrogen 2.927 N/A SER 151.A N PHE 147.A O no hydrogen 2.904 N/A SER 151.A OG PHE 147.A O no hydrogen 2.565 N/A SER 151.A OG ALA 148.A O no hydrogen 3.006 N/A VAL 152.A N ALA 148.A O no hydrogen 2.975 N/A VAL 152.A N THR 149.A O no hydrogen 3.175 N/A THR 153.A N THR 149.A O no hydrogen 2.975 N/A THR 153.A OG1 THR 149.A O no hydrogen 3.239 N/A ARG 158.A NH1 TYR 101.A OH no hydrogen 2.846 N/A ASN 161.A N GLU 157.A O no hydrogen 2.937 N/A ILE 162.A N ARG 158.A O no hydrogen 2.901 N/A SER 163.A N PRO 159.A O no hydrogen 2.907 N/A HIS 164.A N LEU 160.A O no hydrogen 2.917 N/A PHE 165.A N ASN 161.A O no hydrogen 2.923 N/A ILE 166.A N ILE 162.A O no hydrogen 2.906 N/A GLY 167.A N SER 163.A O no hydrogen 2.909 N/A ASP 168.A N HIS 164.A O no hydrogen 2.954 N/A LEU 169.A N PHE 165.A O no hydrogen 2.960 N/A ASN 170.A N ILE 166.A O no hydrogen 2.872 N/A THR 171.A N GLY 167.A O no hydrogen 2.991 N/A THR 171.A OG1 GLY 167.A O no hydrogen 3.016 N/A GLY 172.A N ASP 168.A O no hydrogen 2.920 N/A PHE 173.A N LEU 169.A O no hydrogen 2.931 N/A PHE 173.A N ASN 170.A O no hydrogen 2.900 N/A ARG 174.A N ASN 170.A O no hydrogen 2.892 N/A ARG 174.A N THR 171.A O no hydrogen 2.877 N/A LEU 175.A N THR 171.A O no hydrogen 2.955 N/A PHE 185.A N LEU 181.A O no hydrogen 3.113 N/A ASP 186.A N ARG 182.A O no hydrogen 2.971 N/A ALA 187.A N LYS 183.A O no hydrogen 2.955 N/A LEU 188.A N ARG 184.A O no hydrogen 2.913 N/A LYS 189.A N PHE 185.A O no hydrogen 2.940 N/A TYR 190.A N ASP 186.A O no hydrogen 3.015 N/A ASP 191.A N ALA 187.A O no hydrogen 2.976 N/A VAL 192.A N LEU 188.A O no hydrogen 2.869 N/A LYS 193.A N LYS 189.A O no hydrogen 2.989 N/A LYS 194.A N TYR 190.A O no hydrogen 2.996 N/A ILE 195.A N ASP 191.A O no hydrogen 2.963 N/A GLU 196.A N VAL 192.A O no hydrogen 2.903 N/A GLU 197.A N LYS 193.A O no hydrogen 2.946 N/A VAL 198.A N LYS 194.A O no hydrogen 2.953 N/A VAL 199.A N ILE 195.A O no hydrogen 2.904 N/A TYR 200.A N GLU 196.A O no hydrogen 2.933 N/A ASP 201.A N GLU 197.A O no hydrogen 2.928 N/A VAL 202.A N VAL 199.A O no hydrogen 3.254 N/A SER 203.A OG TYR 200.A O no hydrogen 3.274 N/A