Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uxe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ASP 95.A OD2 no hydrogen 2.878 N/A VAL 5.A N THR 35.A O no hydrogen 2.774 N/A LEU 6.A N LEU 96.A O no hydrogen 2.922 N/A ILE 7.A N THR 37.A O no hydrogen 2.803 N/A VAL 8.A N ILE 98.A O no hydrogen 2.813 N/A TYR 9.A N SER 39.A O no hydrogen 2.921 N/A ALA 10.A N GLN 100.A O no hydrogen 2.985 N/A GLN 12.A N GLN 12.A OE1 no hydrogen 2.785 N/A GLN 12.A NE2 TYR 104.A OH no hydrogen 3.119 N/A GLU 13.A N HIS 11.A ND1 no hydrogen 3.047 N/A LYS 15.A N GLU 13.A OE2 no hydrogen 3.032 N/A SER 16.A N GLU 13.A O no hydrogen 3.049 N/A SER 16.A OG GLU 13.A O no hydrogen 2.730 N/A ASN 18.A ND2 THR 147.A OG1 no hydrogen 2.829 N/A GLY 19.A N SER 16.A OG no hydrogen 2.887 N/A SER 20.A N SER 16.A O no hydrogen 2.844 N/A SER 20.A OG SER 16.A O no hydrogen 3.285 N/A LEU 21.A N PHE 17.A O no hydrogen 2.942 N/A LYS 22.A N ASN 18.A O no hydrogen 2.896 N/A LYS 22.A NZ ASN 23.A OD1 no hydrogen 2.819 N/A ASN 23.A N GLY 19.A O no hydrogen 2.798 N/A VAL 24.A N SER 20.A O no hydrogen 2.884 N/A ALA 25.A N LEU 21.A O no hydrogen 3.110 N/A VAL 26.A N LYS 22.A O no hydrogen 2.948 N/A ASP 27.A N ASN 23.A O no hydrogen 2.888 N/A GLU 28.A N VAL 24.A O no hydrogen 2.916 N/A LEU 29.A N ALA 25.A O no hydrogen 2.868 N/A SER 30.A N VAL 26.A O no hydrogen 2.721 N/A ARG 31.A N ASP 27.A O no hydrogen 2.927 N/A ARG 31.A NE GLU 28.A OE1 no hydrogen 2.941 N/A ARG 31.A NH2 GLU 28.A OE2 no hydrogen 2.940 N/A GLN 32.A N GLU 28.A O no hydrogen 3.056 N/A GLN 32.A NE2 GLU 28.A OE2 no hydrogen 2.936 N/A GLN 32.A NE2 LEU 211.A O no hydrogen 2.826 N/A GLY 33.A N SER 30.A O no hydrogen 2.981 N/A CYS 34.A N LEU 29.A O no hydrogen 3.130 N/A CYS 34.A SG GLN 32.A OE1 no hydrogen 3.819 N/A THR 35.A N LYS 3.A O no hydrogen 2.918 N/A THR 37.A N VAL 5.A O no hydrogen 2.977 N/A SER 39.A N ILE 7.A O no hydrogen 2.769 N/A SER 39.A OG GLU 87.A OE1 no hydrogen 2.797 N/A LEU 41.A N TYR 9.A O no hydrogen 2.975 N/A ALA 43.A N ASP 40.A OD1 no hydrogen 3.342 N/A MET 44.A N ASP 40.A O no hydrogen 2.939 N/A ASN 45.A N TYR 42.A O no hydrogen 3.009 N/A PHE 46.A N LEU 41.A O no hydrogen 3.002 N/A ARG 49.A N GLU 47.A OE2 no hydrogen 2.887 N/A ARG 49.A NH1 GLU 47.A OE2 no hydrogen 2.969 N/A THR 51.A N ASP 54.A OD2 no hydrogen 3.409 N/A LYS 53.A N THR 51.A OG1 no hydrogen 3.135 N/A ASP 54.A N THR 51.A O no hydrogen 3.051 N/A ILE 55.A N ASP 52.A O no hydrogen 3.427 N/A THR 56.A N SER 79.A O no hydrogen 3.038 N/A THR 56.A OG1 SER 79.A O no hydrogen 3.294 N/A THR 56.A OG1 SER 79.A OG no hydrogen 3.108 N/A SER 60.A N GLU 70.A OE1 no hydrogen 2.833 N/A ASN 61.A N GLU 70.A OE2 no hydrogen 2.919 N/A GLU 63.A N ASN 61.A OD1 no hydrogen 2.987 N/A TYR 67.A OH ASP 54.A OD2 no hydrogen 2.732 N/A VAL 69.A N ASN 66.A OD1 no hydrogen 3.072 N/A GLU 70.A N ASN 66.A O no hydrogen 2.948 N/A THR 71.A N TYR 67.A O no hydrogen 2.863 N/A THR 71.A OG1 TYR 67.A O no hydrogen 2.957 N/A THR 71.A OG1 GLY 68.A O no hydrogen 3.421 N/A HIS 72.A N GLY 68.A O no hydrogen 3.101 N/A GLU 73.A N VAL 69.A O no hydrogen 2.976 N/A ALA 74.A N GLU 70.A O no hydrogen 2.898 N/A TYR 75.A N THR 71.A O no hydrogen 2.873 N/A LYS 76.A N HIS 72.A O no hydrogen 3.119 N/A LYS 76.A NZ GLU 73.A OE1 no hydrogen 3.476 N/A LYS 76.A NZ GLU 73.A OE2 no hydrogen 3.085 N/A GLN 77.A N GLU 73.A O no hydrogen 2.907 N/A ARG 78.A N TYR 75.A O no hydrogen 3.209 N/A SER 79.A N ALA 74.A O no hydrogen 2.692 N/A SER 79.A OG THR 56.A O no hydrogen 2.807 N/A SER 79.A OG THR 56.A OG1 no hydrogen 3.108 N/A ALA 81.A N ASP 54.A O no hydrogen 2.864 N/A THR 85.A N ALA 81.A O no hydrogen 3.079 N/A THR 85.A OG1 SER 82.A O no hydrogen 3.385 N/A ASP 86.A N SER 82.A O no hydrogen 2.877 N/A GLU 87.A N ASP 83.A O no hydrogen 3.306 N/A GLN 88.A N ILE 84.A O no hydrogen 2.917 N/A GLN 88.A NE2 VAL 119.A O no hydrogen 3.010 N/A LYS 89.A N THR 85.A O no hydrogen 2.917 N/A LYS 90.A N ASP 86.A O no hydrogen 3.274 N/A LYS 90.A NZ SER 39.A OG no hydrogen 3.090 N/A LYS 90.A NZ GLU 87.A OE2 no hydrogen 2.730 N/A VAL 91.A N GLU 87.A O no hydrogen 2.950 N/A ARG 92.A N GLN 88.A O no hydrogen 2.804 N/A ARG 92.A NH2 TYR 75.A OH no hydrogen 3.099 N/A GLU 93.A N LYS 89.A O no hydrogen 3.063 N/A ALA 94.A N VAL 91.A O no hydrogen 3.058 N/A ASP 95.A N LYS 4.A O no hydrogen 2.740 N/A LEU 96.A N LYS 4.A O no hydrogen 3.190 N/A VAL 97.A N LEU 141.A O no hydrogen 2.827 N/A ILE 98.A N LEU 6.A O no hydrogen 2.847 N/A PHE 99.A N LEU 143.A O no hydrogen 2.918 N/A GLN 100.A N VAL 8.A O no hydrogen 2.915 N/A GLN 100.A NE2 ASN 18.A OD1 no hydrogen 2.824 N/A PHE 101.A N SER 145.A O no hydrogen 3.124 N/A LEU 103.A N THR 147.A O no hydrogen 2.757 N/A TYR 104.A N SER 107.A O no hydrogen 2.863 N/A SER 107.A N TYR 104.A O no hydrogen 2.955 N/A LYS 113.A N PRO 109.A O no hydrogen 2.848 N/A LYS 113.A NZ ASP 117.A OD1 no hydrogen 2.792 N/A GLY 114.A N ALA 110.A O no hydrogen 2.871 N/A TRP 115.A N ILE 111.A O no hydrogen 3.202 N/A TRP 115.A NE1 GLU 87.A OE1 no hydrogen 2.788 N/A MET 116.A N LEU 112.A O no hydrogen 2.930 N/A ASP 117.A N LYS 113.A O no hydrogen 2.815 N/A ARG 118.A N GLY 114.A O no hydrogen 2.907 N/A ARG 118.A NE ASP 54.A OD1 no hydrogen 3.393 N/A ARG 118.A NE ASP 54.A OD2 no hydrogen 3.017 N/A ARG 118.A NH1 ASP 83.A OD2 no hydrogen 2.967 N/A ARG 118.A NH2 ASP 54.A OD1 no hydrogen 2.795 N/A ARG 118.A NH2 ASP 83.A OD1 no hydrogen 3.191 N/A ARG 118.A NH2 ASP 83.A OD2 no hydrogen 3.015 N/A VAL 119.A N TRP 115.A O no hydrogen 2.862 N/A LEU 120.A N MET 116.A O no hydrogen 3.242 N/A CYS 121.A N VAL 119.A O no hydrogen 2.932 N/A CYS 121.A SG GLN 122.A O no hydrogen 3.447 N/A GLY 123.A N PHE 126.A O no hydrogen 2.804 N/A PHE 124.A N CYS 121.A O no hydrogen 3.009 N/A ALA 125.A N CYS 121.A O no hydrogen 2.964 N/A PHE 131.A N PRO 129.A O no hydrogen 2.616 N/A TYR 132.A N PHE 178.A O no hydrogen 2.762 N/A TYR 132.A OH HIS 173.A NE2 no hydrogen 3.327 N/A SER 134.A N PHE 131.A O no hydrogen 2.925 N/A GLY 135.A N TYR 132.A O no hydrogen 2.853 N/A LEU 136.A N ALA 125.A O no hydrogen 2.989 N/A LEU 137.A N CYS 179.A O no hydrogen 2.880 N/A GLN 138.A N GLY 135.A O no hydrogen 3.202 N/A GLN 138.A NE2 GLY 135.A O no hydrogen 2.910 N/A LYS 140.A N LEU 137.A O no hydrogen 3.088 N/A LYS 140.A NZ ARG 92.A O no hydrogen 2.930 N/A LYS 140.A NZ ALA 94.A O no hydrogen 2.780 N/A LEU 141.A N ASP 95.A O no hydrogen 2.942 N/A ALA 142.A N LYS 182.A O no hydrogen 2.954 N/A LEU 143.A N VAL 97.A O no hydrogen 2.948 N/A SER 145.A N PHE 99.A O no hydrogen 2.764 N/A SER 145.A OG GLN 100.A OE1 no hydrogen 2.790 N/A VAL 146.A N GLN 187.A O no hydrogen 2.857 N/A THR 147.A N PHE 101.A O no hydrogen 3.099 N/A THR 148.A N SER 189.A O no hydrogen 3.268 N/A THR 148.A OG1 GLY 150.A O no hydrogen 2.663 N/A THR 151.A OG1 GLU 153.A OE1 no hydrogen 2.521 N/A MET 154.A N THR 151.A O no hydrogen 3.021 N/A MET 154.A N THR 151.A OG1 no hydrogen 3.131 N/A TYR 155.A N THR 151.A O no hydrogen 3.170 N/A THR 156.A OG1 GLU 153.A O no hydrogen 2.898 N/A GLY 159.A N THR 156.A O no hydrogen 2.807 N/A ASN 161.A N MET 154.A O no hydrogen 2.875 N/A GLY 162.A N GLY 159.A O no hydrogen 3.242 N/A ARG 165.A N ASP 163.A OD1 no hydrogen 3.074 N/A ARG 165.A NH1 TRP 226.A O no hydrogen 2.837 N/A TYR 166.A N ASP 163.A O no hydrogen 2.875 N/A LEU 168.A N SER 164.A O no hydrogen 3.213 N/A LEU 168.A N ARG 165.A O no hydrogen 3.186 N/A GLN 172.A N LEU 168.A O no hydrogen 2.683 N/A HIS 173.A N TRP 169.A O no hydrogen 2.827 N/A HIS 173.A ND1 CYS 222.A O no hydrogen 3.179 N/A GLY 174.A N TRP 169.A O no hydrogen 3.155 N/A THR 175.A OG1 PRO 170.A O no hydrogen 2.977 N/A LEU 176.A N LEU 171.A O no hydrogen 2.964 N/A HIS 177.A N GLN 172.A O no hydrogen 2.778 N/A HIS 177.A ND1 CYS 222.A O no hydrogen 3.155 N/A HIS 177.A NE2 ASP 133.A OD1 no hydrogen 3.009 N/A PHE 178.A N HIS 173.A O no hydrogen 3.238 N/A CYS 179.A N THR 175.A O no hydrogen 3.150 N/A CYS 179.A SG THR 175.A O no hydrogen 3.416 N/A GLY 180.A N HIS 177.A O no hydrogen 2.835 N/A PHE 181.A N LEU 176.A O no hydrogen 3.090 N/A LYS 182.A N LYS 140.A O no hydrogen 3.090 N/A LEU 184.A N ALA 142.A O no hydrogen 2.876 N/A GLN 187.A N LEU 144.A O no hydrogen 2.830 N/A SER 189.A N VAL 146.A O no hydrogen 2.889 N/A ALA 191.A N THR 148.A OG1 no hydrogen 3.034 N/A ILE 194.A N ALA 191.A O no hydrogen 3.115 N/A ALA 195.A N ALA 191.A O no hydrogen 3.199 N/A SER 196.A N GLU 199.A OE1 no hydrogen 2.860 N/A ARG 200.A N SER 196.A O no hydrogen 2.480 N/A ARG 200.A NE ALA 195.A O no hydrogen 3.289 N/A ARG 200.A NH2 ALA 195.A O no hydrogen 3.557 N/A GLY 202.A N GLU 198.A O no hydrogen 2.844 N/A MET 203.A N GLU 199.A O no hydrogen 2.896 N/A VAL 204.A N ARG 200.A O no hydrogen 3.086 N/A ALA 205.A N LYS 201.A O no hydrogen 2.767 N/A ALA 206.A N GLY 202.A O no hydrogen 2.711 N/A TRP 207.A N MET 203.A O no hydrogen 3.180 N/A TRP 207.A NE1 LEU 21.A O no hydrogen 3.170 N/A SER 208.A N VAL 204.A O no hydrogen 2.928 N/A GLN 209.A N ALA 205.A O no hydrogen 2.813 N/A ARG 210.A N ALA 206.A O no hydrogen 2.755 N/A ARG 210.A NE GLU 217.A OE2 no hydrogen 2.808 N/A ARG 210.A NH1 ALA 185.A O no hydrogen 2.914 N/A ARG 210.A NH2 ALA 185.A O no hydrogen 2.760 N/A ARG 210.A NH2 GLU 217.A OE1 no hydrogen 2.757 N/A LEU 211.A N TRP 207.A O no hydrogen 2.997 N/A GLN 212.A N SER 208.A O no hydrogen 3.161 N/A GLN 212.A N GLN 209.A O no hydrogen 3.184 N/A THR 213.A N ARG 210.A O no hydrogen 3.041 N/A THR 213.A OG1 ARG 210.A O no hydrogen 3.515 N/A ILE 214.A N LEU 211.A O no hydrogen 3.345 N/A LYS 216.A N THR 213.A O no hydrogen 2.954 N/A GLU 217.A N ILE 214.A O no hydrogen 3.232 N/A ILE 220.A N VAL 183.A O no hydrogen 2.891 N/A CYS 222.A SG HIS 173.A ND1 no hydrogen 3.775 N/A CYS 222.A SG HIS 177.A ND1 no hydrogen 3.700 N/A THR 223.A N PRO 221.A O no hydrogen 2.854 N/A THR 223.A OG1 PRO 221.A O no hydrogen 3.465 N/A TRP 226.A N THR 223.A OG1 no hydrogen 3.226 N/A HIS 227.A N THR 223.A O no hydrogen 3.357 N/A HIS 227.A ND1 THR 223.A O no hydrogen 2.934 N/A HIS 227.A NE2 GLN 172.A OE1 no hydrogen 3.144 N/A PHE 228.A N ALA 224.A O no hydrogen 2.821 N/A GLY 229.A N HIS 225.A O no hydrogen 2.726 N/A