Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6u1a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N GLU 1.A OE2 no hydrogen 2.922 N/A LYS 4.A NZ GLU 1.A O no hydrogen 3.193 N/A MET 7.A N GLY 30.A O no hydrogen 2.993 N/A MET 9.A N.A GLY 28.A O no hydrogen 2.925 N/A MET 9.A N.B GLY 28.A O no hydrogen 2.943 N/A LYS 10.A N LEU 112.A O no hydrogen 2.884 N/A LEU 11.A N SER 26.A O no hydrogen 2.911 N/A TYR 12.A N TYR 114.A O no hydrogen 2.952 N/A TYR 12.A OH GLU 14.A OE1 no hydrogen 2.650 N/A MET 13.A N CYS 24.A O no hydrogen 2.890 N/A GLU 14.A N VAL 116.A O no hydrogen 3.077 N/A GLY 15.A N PHE 22.A O no hydrogen 3.122 N/A THR 16.A N VAL 118.A O no hydrogen 3.080 N/A VAL 17.A N HIS 20.A O.A no hydrogen 2.909 N/A VAL 17.A N HIS 20.A O.B no hydrogen 2.907 N/A ASN 18.A N GLY 120.A O no hydrogen 2.843 N/A ASN 18.A ND2 PHE 123.A O no hydrogen 2.894 N/A HIS 20.A N.A VAL 17.A O no hydrogen 2.956 N/A HIS 20.A N.B VAL 17.A O no hydrogen 2.962 N/A HIS 20.A NE2.A GLY 46.A O no hydrogen 2.490 N/A HIS 21.A ND1 GLU 45.A OE2.B no hydrogen 2.719 N/A HIS 21.A NE2 GLU 14.A OE2 no hydrogen 3.101 N/A PHE 22.A N GLY 15.A O no hydrogen 2.917 N/A LYS 23.A N GLU 45.A O.A no hydrogen 3.008 N/A LYS 23.A N GLU 45.A O.B no hydrogen 3.004 N/A LYS 23.A NZ GLU 45.A OE1.A no hydrogen 3.185 N/A CYS 24.A N MET 13.A O no hydrogen 2.868 N/A THR 25.A N LYS 42.A O no hydrogen 2.970 N/A SER 26.A N LEU 11.A O no hydrogen 3.008 N/A GLU 27.A N ARG 40.A O no hydrogen 3.103 N/A GLY 28.A N MET 9.A O.A no hydrogen 3.042 N/A GLY 28.A N MET 9.A O.B no hydrogen 3.001 N/A GLU 29.A N THR 38.A O no hydrogen 3.052 N/A GLY 30.A N MET 7.A O no hydrogen 2.939 N/A LYS 31.A N THR 36.A O no hydrogen 2.839 N/A TYR 33.A OH ILE 3.A O no hydrogen 2.711 N/A GLU 34.A N LYS 31.A O no hydrogen 2.937 N/A THR 36.A N LYS 31.A O no hydrogen 3.509 N/A GLN 37.A N.A GLU 212.A O.A no hydrogen 3.054 N/A GLN 37.A N.A GLU 212.A O.B no hydrogen 3.046 N/A GLN 37.A N.B GLU 212.A O.A no hydrogen 3.070 N/A GLN 37.A N.B GLU 212.A O.B no hydrogen 3.061 N/A GLN 37.A NE2.A SER 63.A O no hydrogen 3.311 N/A GLN 37.A NE2.B SER 63.A OG no hydrogen 2.492 N/A THR 38.A N GLU 29.A O no hydrogen 2.955 N/A MET 39.A N.A GLN 210.A O.A no hydrogen 2.912 N/A MET 39.A N.A GLN 210.A O.B no hydrogen 2.885 N/A MET 39.A N.B GLN 210.A O.A no hydrogen 2.894 N/A MET 39.A N.B GLN 210.A O.B no hydrogen 2.867 N/A ARG 40.A N GLU 27.A O no hydrogen 2.861 N/A ARG 40.A NE GLU 27.A OE1 no hydrogen 2.695 N/A ARG 40.A NH1 GLU 29.A OE2 no hydrogen 2.900 N/A ARG 40.A NH2 GLU 27.A OE1 no hydrogen 3.449 N/A ARG 40.A NH2 GLU 27.A OE2 no hydrogen 2.703 N/A ARG 40.A NH2 GLU 29.A OE1 no hydrogen 2.643 N/A ARG 40.A NH2 GLU 29.A OE2 no hydrogen 3.261 N/A ILE 41.A N VAL 208.A O no hydrogen 2.763 N/A LYS 42.A N THR 25.A O no hydrogen 2.853 N/A VAL 43.A N THR 206.A O no hydrogen 2.915 N/A VAL 44.A N LYS 23.A O no hydrogen 2.830 N/A GLU 45.A N.A LYS 23.A O no hydrogen 3.239 N/A GLU 45.A N.B LYS 23.A O no hydrogen 3.265 N/A ALA 52.A N VAL 129.A O no hydrogen 2.906 N/A PHE 53.A N GLU 205.A OE1 no hydrogen 3.015 N/A ILE 55.A N ALA 52.A O no hydrogen 3.160 N/A LEU 56.A N PHE 53.A O no hydrogen 2.811 N/A ALA 57.A N ASP 54.A O no hydrogen 3.121 N/A SER 59.A N LEU 56.A O no hydrogen 2.931 N/A PHE 60.A N.A ALA 57.A O no hydrogen 3.366 N/A PHE 60.A N.B ALA 57.A O no hydrogen 3.350 N/A MET 61.A N.B GLU 212.A OE2.A no hydrogen 2.255 N/A MET 61.A SD.B GLY 35.A O no hydrogen 3.783 N/A MET 61.A SD.B SER 63.A O no hydrogen 3.886 N/A MET 61.A SD.B PHE 66.A O.A no hydrogen 1.723 N/A GLY 62.A N.B THR 58.A O no hydrogen 2.828 N/A GLY 62.A O.B PHE 60.A O.B no hydrogen 3.461 N/A SER 63.A OG GLN 37.A OE1.A no hydrogen 2.595 N/A SER 63.A OG TYR 114.A OH no hydrogen 2.565 N/A ARG 64.A NH1 GLU 142.A OE1 no hydrogen 2.876 N/A ARG 64.A NH2 GLU 142.A OE1 no hydrogen 2.848 N/A PHE 66.A N.A SER 63.A O no hydrogen 3.280 N/A PHE 66.A N.B SER 63.A O no hydrogen 3.271 N/A LYS 68.A N ALA 214.A O no hydrogen 2.958 N/A LYS 68.A NZ GLU 34.A OE1 no hydrogen 3.168 N/A HIS 69.A ND1 ILE 67.A O.A no hydrogen 3.068 N/A HIS 69.A ND1 ILE 67.A O.B no hydrogen 3.053 N/A HIS 69.A NE2 TYR 190.A OH no hydrogen 2.659 N/A ILE 73.A N PRO 70.A O no hydrogen 2.911 N/A LYS 78.A N ASP 75.A OD1 no hydrogen 2.992 N/A LYS 78.A NZ PRO 32.A O no hydrogen 3.071 N/A LYS 78.A NZ THR 65.A O no hydrogen 2.932 N/A LYS 78.A NZ ASP 75.A OD2 no hydrogen 2.893 N/A GLN 79.A N ASP 75.A O no hydrogen 3.004 N/A GLN 79.A NE2 ASP 75.A O no hydrogen 3.247 N/A GLN 79.A NE2 LYS 185.A O.A no hydrogen 2.870 N/A GLN 79.A NE2 LYS 185.A O.B no hydrogen 2.871 N/A SER 80.A N PHE 77.A O no hydrogen 3.009 N/A SER 80.A OG PHE 76.A O no hydrogen 2.805 N/A SER 80.A OG SER 177.A OG no hydrogen 2.745 N/A PHE 81.A N LYS 78.A O no hydrogen 3.472 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.820 N/A GLY 84.A N SER 80.A O no hydrogen 2.923 N/A PHE 85.A N THR 105.A O no hydrogen 3.162 N/A THR 86.A N ARG 176.A O.A no hydrogen 2.853 N/A THR 86.A N ARG 176.A O.B no hydrogen 2.853 N/A THR 86.A OG1 GLU 88.A OE2.A no hydrogen 2.676 N/A TRP 87.A N GLN 103.A O no hydrogen 3.071 N/A TRP 87.A NE1 GLY 62.A O.B no hydrogen 3.071 N/A GLU 88.A N.A THR 174.A O.A no hydrogen 2.962 N/A GLU 88.A N.A THR 174.A O.B no hydrogen 2.961 N/A GLU 88.A N.B THR 174.A O.A no hydrogen 2.955 N/A GLU 88.A N.B THR 174.A O.B no hydrogen 2.954 N/A ARG 89.A N ALA 101.A O no hydrogen 2.858 N/A ARG 89.A NE THR 173.A OG1 no hydrogen 2.768 N/A ARG 89.A NH1 THR 58.A O no hydrogen 2.906 N/A ARG 89.A NH2 TYR 175.A OH no hydrogen 3.043 N/A VAL 90.A N GLU 172.A O no hydrogen 2.971 N/A THR 91.A N LEU 99.A O no hydrogen 2.881 N/A THR 92.A N ASN 170.A O no hydrogen 2.823 N/A TYR 93.A N GLY 97.A O no hydrogen 2.817 N/A GLU 94.A N ILE 168.A O no hydrogen 2.899 N/A GLY 96.A N TYR 93.A O no hydrogen 3.000 N/A GLY 97.A N ASP 95.A OD1 no hydrogen 3.507 N/A VAL 98.A N VAL 121.A O no hydrogen 2.944 N/A LEU 99.A N THR 91.A O no hydrogen 2.876 N/A THR 100.A N.A ARG 119.A O no hydrogen 2.845 N/A THR 100.A N.B ARG 119.A O no hydrogen 2.856 N/A THR 100.A OG1.B ARG 119.A O no hydrogen 3.292 N/A ALA 101.A N ARG 89.A O no hydrogen 3.009 N/A THR 102.A N LYS 117.A O no hydrogen 2.904 N/A GLN 103.A N TRP 87.A O no hydrogen 2.836 N/A GLN 103.A NE2 THR 105.A OG1 no hydrogen 2.907 N/A ASP 104.A N ASN 115.A O.A no hydrogen 2.892 N/A ASP 104.A N ASN 115.A O.B no hydrogen 2.892 N/A THR 105.A N PHE 85.A O no hydrogen 2.878 N/A THR 105.A OG1 GLN 103.A OE1 no hydrogen 2.717 N/A SER 106.A N.A ILE 113.A O no hydrogen 2.967 N/A SER 106.A N.B ILE 113.A O no hydrogen 2.957 N/A SER 106.A OG.A ILE 113.A O no hydrogen 3.540 N/A SER 106.A OG.B ASP 104.A OD1 no hydrogen 2.974 N/A GLN 108.A N CYS 111.A O no hydrogen 2.905 N/A GLN 108.A NE2 SER 106.A OG.A no hydrogen 2.895 N/A CYS 111.A N GLN 108.A O no hydrogen 2.977 N/A LEU 112.A N PRO 8.A O no hydrogen 2.975 N/A ILE 113.A N SER 106.A O.A no hydrogen 2.832 N/A ILE 113.A N SER 106.A O.B no hydrogen 2.841 N/A TYR 114.A N LYS 10.A O no hydrogen 2.843 N/A TYR 114.A OH SER 63.A OG no hydrogen 2.565 N/A ASN 115.A N.A ASP 104.A O no hydrogen 3.011 N/A ASN 115.A N.B ASP 104.A O no hydrogen 3.000 N/A VAL 116.A N TYR 12.A O no hydrogen 2.843 N/A LYS 117.A N THR 102.A O no hydrogen 2.839 N/A VAL 118.A N GLU 14.A O no hydrogen 3.064 N/A ARG 119.A N THR 100.A O.A no hydrogen 2.835 N/A ARG 119.A N THR 100.A O.B no hydrogen 2.834 N/A ARG 119.A NH1 THR 16.A OG1 no hydrogen 2.945 N/A GLY 120.A N THR 16.A O no hydrogen 2.788 N/A VAL 121.A N VAL 98.A O no hydrogen 2.853 N/A PHE 123.A N ASN 18.A OD1 no hydrogen 3.062 N/A GLY 127.A N PRO 124.A O no hydrogen 2.992 N/A GLN 131.A N.A GLY 127.A O no hydrogen 2.980 N/A GLN 131.A N.B GLY 127.A O no hydrogen 2.978 N/A GLN 131.A NE2.A ASN 126.A OD1.A no hydrogen 2.929 N/A GLN 131.A NE2.B ALA 125.A O no hydrogen 2.959 N/A LYS 132.A N VAL 129.A O no hydrogen 3.202 N/A LYS 133.A N PRO 128.A O no hydrogen 2.852 N/A LYS 133.A NZ GLN 131.A O.A no hydrogen 3.281 N/A LYS 133.A NZ GLN 131.A O.B no hydrogen 3.284 N/A THR 134.A OG1 ASP 54.A OD2 no hydrogen 2.635 N/A LEU 135.A N LYS 160.A O.A no hydrogen 2.822 N/A LEU 135.A N LYS 160.A O.B no hydrogen 2.824 N/A GLY 136.A N ASP 54.A OD2 no hydrogen 2.892 N/A TRP 137.A NE1 ASP 54.A O no hydrogen 2.883 N/A GLU 138.A N.A ALA 158.A O no hydrogen 3.048 N/A GLU 138.A N.B ALA 158.A O no hydrogen 3.040 N/A SER 140.A N HIS 194.A O no hydrogen 3.022 N/A THR 141.A OG1 ASP 193.A OD1 no hydrogen 2.822 N/A GLU 142.A N VAL 192.A O no hydrogen 2.834 N/A THR 143.A N ALA 154.A O no hydrogen 2.907 N/A MET 144.A N TYR 190.A O no hydrogen 2.758 N/A TYR 145.A N GLU 152.A O no hydrogen 2.779 N/A ALA 147.A N GLY 150.A O no hydrogen 2.837 N/A GLY 150.A N ALA 147.A O no hydrogen 2.928 N/A LEU 151.A N.A TYR 175.A O no hydrogen 2.984 N/A LEU 151.A N.B TYR 175.A O no hydrogen 2.993 N/A GLU 152.A N TYR 145.A O no hydrogen 2.850 N/A GLY 153.A N THR 173.A O no hydrogen 2.890 N/A ALA 154.A N THR 143.A O no hydrogen 2.904 N/A CYS 155.A N.A LEU 171.A O no hydrogen 3.142 N/A CYS 155.A N.B LEU 171.A O no hydrogen 3.136 N/A CYS 155.A SG.A THR 141.A O no hydrogen 3.654 N/A CYS 155.A SG.A ASP 156.A O no hydrogen 3.673 N/A MET 157.A N CYS 169.A O no hydrogen 2.917 N/A LEU 159.A N LEU 167.A O no hydrogen 2.859 N/A LYS 160.A N.A GLY 136.A O no hydrogen 2.910 N/A LYS 160.A N.B GLY 136.A O no hydrogen 2.903 N/A LYS 160.A NZ.A GLU 138.A OE1.B no hydrogen 3.180 N/A LYS 160.A NZ.A GLU 138.A OE2.A no hydrogen 2.872 N/A LYS 160.A NZ.A GLU 138.A OE2.B no hydrogen 2.654 N/A LEU 161.A N GLY 165.A O no hydrogen 2.987 N/A VAL 162.A N LYS 133.A O no hydrogen 3.028 N/A GLY 164.A N LEU 161.A O no hydrogen 3.001 N/A LEU 167.A N LEU 159.A O no hydrogen 2.865 N/A ILE 168.A N GLU 94.A OE2 no hydrogen 2.870 N/A CYS 169.A N MET 157.A O no hydrogen 2.980 N/A CYS 169.A SG MET 157.A O no hydrogen 3.989 N/A ASN 170.A N THR 92.A O no hydrogen 2.884 N/A ASN 170.A ND2 ASP 156.A OD1 no hydrogen 2.951 N/A LEU 171.A N CYS 155.A O.A no hydrogen 2.741 N/A LEU 171.A N CYS 155.A O.B no hydrogen 2.635 N/A GLU 172.A N VAL 90.A O no hydrogen 3.043 N/A THR 173.A N GLY 153.A O no hydrogen 2.902 N/A THR 174.A N.A GLU 88.A O.A no hydrogen 2.863 N/A THR 174.A N.A GLU 88.A O.B no hydrogen 2.862 N/A THR 174.A N.B GLU 88.A O.A no hydrogen 2.868 N/A THR 174.A N.B GLU 88.A O.B no hydrogen 2.868 N/A THR 174.A OG1.A GLU 88.A O.A no hydrogen 3.422 N/A THR 174.A OG1.A GLU 88.A O.B no hydrogen 3.417 N/A THR 174.A OG1.A GLU 88.A OE1.A no hydrogen 2.765 N/A THR 174.A OG1.B GLU 152.A OE2 no hydrogen 3.327 N/A TYR 175.A N LEU 151.A O.A no hydrogen 2.774 N/A TYR 175.A N LEU 151.A O.B no hydrogen 2.778 N/A TYR 175.A OH GLU 142.A OE2 no hydrogen 2.639 N/A ARG 176.A N.A THR 86.A O no hydrogen 2.955 N/A ARG 176.A N.B THR 86.A O no hydrogen 2.954 N/A ARG 176.A NE.A GLU 88.A OE1.A no hydrogen 2.955 N/A ARG 176.A NE.A GLU 88.A OE2.A no hydrogen 3.261 N/A ARG 176.A NH2.A GLU 88.A OE2.A no hydrogen 3.131 N/A ARG 176.A NH2.A GLU 88.A OE2.B no hydrogen 2.850 N/A SER 177.A OG SER 80.A OG no hydrogen 2.745 N/A LYS 178.A N GLY 84.A O no hydrogen 2.902 N/A LYS 178.A NZ ASP 104.A OD2 no hydrogen 2.718 N/A LYS 179.A N SER 177.A OG no hydrogen 3.021 N/A LYS 179.A NZ GLN 79.A O no hydrogen 2.982 N/A LYS 179.A NZ PHE 81.A O no hydrogen 2.983 N/A LYS 179.A NZ GLU 83.A OE1 no hydrogen 2.978 N/A ASN 183.A N PRO 180.A O no hydrogen 2.903 N/A LEU 184.A N ALA 181.A O no hydrogen 3.097 N/A LYS 185.A N.A GLN 79.A OE1 no hydrogen 2.834 N/A LYS 185.A N.B GLN 79.A OE1 no hydrogen 2.830 N/A GLY 188.A N TYR 218.A OH no hydrogen 3.029 N/A TYR 190.A N MET 144.A O no hydrogen 3.062 N/A TYR 190.A OH HIS 69.A NE2 no hydrogen 2.659 N/A ASN 191.A N ARG 217.A O no hydrogen 2.884 N/A VAL 192.A N GLU 142.A O no hydrogen 2.811 N/A ASP 193.A N VAL 215.A O no hydrogen 2.955 N/A HIS 194.A N SER 140.A O no hydrogen 2.823 N/A HIS 194.A ND1 GLU 212.A OE1.A no hydrogen 2.653 N/A HIS 194.A NE2 GLU 142.A OE1 no hydrogen 2.917 N/A ARG 195.A N.A VAL 213.A O no hydrogen 2.898 N/A ARG 195.A N.B VAL 213.A O no hydrogen 2.874 N/A ARG 195.A NE.A GLU 197.A OE2 no hydrogen 2.737 N/A ARG 195.A NH2.A GLU 197.A OE1 no hydrogen 3.431 N/A GLU 197.A N HIS 211.A O no hydrogen 2.877 N/A ARG 198.A NH1 GLU 201.A OE1 no hydrogen 2.944 N/A ARG 198.A NH1 GLU 205.A OE2 no hydrogen 2.937 N/A ILE 199.A N GLU 209.A O no hydrogen 2.889 N/A ALA 202.A N TYR 207.A O no hydrogen 2.891 N/A GLU 205.A N ALA 202.A O no hydrogen 2.924 N/A THR 206.A N ASP 204.A OD1 no hydrogen 3.035 N/A THR 206.A OG1 ASP 204.A OD1 no hydrogen 2.652 N/A TYR 207.A OH GLU 209.A OE2 no hydrogen 2.600 N/A VAL 208.A N ILE 41.A O no hydrogen 2.913 N/A GLU 209.A N LYS 200.A O.A no hydrogen 2.933 N/A GLU 209.A N LYS 200.A O.B no hydrogen 2.914 N/A GLN 210.A N.A MET 39.A O.A no hydrogen 3.013 N/A GLN 210.A N.A MET 39.A O.B no hydrogen 3.017 N/A GLN 210.A N.B MET 39.A O.A no hydrogen 2.966 N/A GLN 210.A N.B MET 39.A O.B no hydrogen 2.970 N/A GLN 210.A NE2.A ALA 57.A O no hydrogen 3.176 N/A GLN 210.A NE2.A GLU 212.A OE2.B no hydrogen 3.093 N/A GLN 210.A NE2.B ALA 57.A O no hydrogen 2.964 N/A GLN 210.A NE2.B GLU 212.A OE2.B no hydrogen 2.785 N/A HIS 211.A N GLU 197.A O no hydrogen 2.899 N/A GLU 212.A N.A GLN 37.A O.A no hydrogen 2.989 N/A GLU 212.A N.A GLN 37.A O.B no hydrogen 3.005 N/A GLU 212.A N.B GLN 37.A O.A no hydrogen 2.966 N/A GLU 212.A N.B GLN 37.A O.B no hydrogen 2.981 N/A VAL 213.A N ARG 195.A O.A no hydrogen 3.054 N/A VAL 213.A N ARG 195.A O.B no hydrogen 2.973 N/A ALA 214.A N GLY 35.A O no hydrogen 2.852 N/A VAL 215.A N ASP 193.A O no hydrogen 3.049 N/A ALA 216.A N LYS 68.A O no hydrogen 2.861 N/A ARG 217.A N ASN 191.A O no hydrogen 2.800 N/A ARG 217.A NE ASP 193.A OD2 no hydrogen 2.802 N/A ARG 217.A NH2 ASP 193.A OD1 no hydrogen 2.977 N/A SER 219.A OG ASN 191.A OD1 no hydrogen 3.559 N/A