Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l1i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N GLU 6.A OE1 no hydrogen 3.058 N/A SER 3.A N GLU 6.A OE1 no hydrogen 3.274 N/A GLU 6.A N SER 3.A OG no hydrogen 3.010 N/A GLU 7.A N LYS 4.A O no hydrogen 3.031 N/A LEU 8.A N GLY 5.A O no hydrogen 2.979 N/A PHE 9.A N GLU 6.A O no hydrogen 3.062 N/A THR 10.A OG1 GLU 7.A O no hydrogen 3.481 N/A VAL 13.A N GLY 36.A O no hydrogen 2.879 N/A ILE 15.A N GLY 34.A O no hydrogen 2.875 N/A LEU 16.A N LEU 117.A O no hydrogen 2.906 N/A VAL 17.A N GLY 32.A O no hydrogen 2.903 N/A GLU 18.A N ASN 119.A O no hydrogen 2.920 N/A LEU 19.A N VAL 30.A O no hydrogen 2.883 N/A ASP 20.A N ILE 121.A O no hydrogen 2.991 N/A GLY 21.A N PHE 28.A O no hydrogen 2.828 N/A ASP 22.A N LEU 123.A O no hydrogen 3.042 N/A VAL 23.A N HIS 26.A O no hydrogen 2.954 N/A ASN 24.A N GLY 125.A O no hydrogen 2.869 N/A ASN 24.A ND2 PHE 128.A O no hydrogen 2.888 N/A ASN 24.A ND2 GLU 130.A OE2.A no hydrogen 3.019 N/A GLY 25.A N ASP 22.A OD1 no hydrogen 2.878 N/A HIS 26.A N VAL 23.A O no hydrogen 2.826 N/A HIS 26.A NE2 GLU 130.A OE1.A no hydrogen 3.272 N/A HIS 26.A NE2 GLU 130.A OE2.B no hydrogen 2.852 N/A LYS 27.A NZ ASP 22.A OD2 no hydrogen 2.491 N/A PHE 28.A N GLY 21.A O no hydrogen 2.933 N/A SER 29.A N THR 51.A OG1 no hydrogen 3.051 N/A SER 29.A OG ASP 20.A OD1.B no hydrogen 2.839 N/A VAL 30.A N LEU 19.A O no hydrogen 2.922 N/A SER 31.A N ILE 48.A O no hydrogen 2.958 N/A SER 31.A OG.A GLU 18.A OE1 no hydrogen 2.829 N/A SER 31.A OG.A GLU 18.A OE2 no hydrogen 3.565 N/A SER 31.A OG.C GLU 18.A OE2 no hydrogen 3.367 N/A GLY 32.A N VAL 17.A O no hydrogen 2.792 N/A GLU 33.A N LYS 46.A O no hydrogen 3.031 N/A GLY 34.A N ILE 15.A O no hydrogen 3.229 N/A GLU 35.A N THR 44.A O no hydrogen 3.044 N/A GLY 36.A N VAL 13.A O no hydrogen 2.917 N/A ASP 37.A N LYS 42.A O no hydrogen 2.718 N/A THR 39.A OG1 THR 10.A O no hydrogen 3.273 N/A TYR 40.A N ASP 37.A O no hydrogen 3.049 N/A GLY 41.A N ALA 38.A O no hydrogen 3.028 N/A LYS 42.A N ASP 37.A O no hydrogen 3.131 N/A LEU 43.A N GLU 220.A O no hydrogen 3.064 N/A THR 44.A N GLU 35.A O no hydrogen 2.934 N/A LEU 45.A N LEU 218.A O no hydrogen 2.933 N/A LYS 46.A N GLU 33.A O no hydrogen 2.966 N/A LYS 46.A NZ ASP 208.A OD2 no hydrogen 2.818 N/A LYS 46.A NZ GLU 211.A OE1 no hydrogen 2.771 N/A PHE 47.A N MET 216.A O no hydrogen 2.816 N/A ILE 48.A N SER 31.A O no hydrogen 2.811 N/A CYS 49.A N ASP 214.A O no hydrogen 2.863 N/A CYS 49.A SG SER 29.A O no hydrogen 3.675 N/A CYS 49.A SG THR 51.A OG1 no hydrogen 3.383 N/A CYS 49.A SG GLY 52.A O no hydrogen 3.132 N/A THR 50.A N SER 29.A O no hydrogen 2.951 N/A THR 50.A OG1 SER 29.A O no hydrogen 3.548 N/A GLY 52.A N CYS 49.A O no hydrogen 3.483 N/A LEU 54.A N ASP 214.A OD2 no hydrogen 2.807 N/A TRP 58.A NE1 ASP 214.A OD1 no hydrogen 2.928 N/A THR 60.A N PRO 57.A O no hydrogen 2.926 N/A THR 60.A OG1 PRO 57.A O no hydrogen 2.788 N/A THR 60.A OG1 TYR 104.A OH no hydrogen 2.832 N/A LEU 61.A N TRP 58.A O no hydrogen 2.980 N/A VAL 62.A N PRO 59.A O no hydrogen 3.328 N/A THR 63.A OG1 HIS 179.A NE2 no hydrogen 2.695 N/A LEU 65.A N LEU 61.A O no hydrogen 2.912 N/A PHE 69.A N VAL 66.A O no hydrogen 2.946 N/A SER 70.A N GLN 67.A O no hydrogen 3.131 N/A SER 70.A OG GLN 67.A O no hydrogen 2.767 N/A ARG 71.A N VAL 222.A O no hydrogen 2.952 N/A ARG 71.A NH1.A GLU 223.A OE1.A no hydrogen 3.063 N/A ARG 71.A NH2.B GLU 223.A OE1.B no hydrogen 2.580 N/A TYR 72.A OH HIS 197.A NE2 no hydrogen 2.699 N/A MET 76.A N PRO 73.A O no hydrogen 2.781 N/A LYS 77.A NZ TYR 72.A O no hydrogen 2.960 N/A HIS 79.A N MET 76.A O no hydrogen 2.923 N/A PHE 81.A N HIS 79.A O no hydrogen 3.246 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 3.100 N/A LYS 83.A NZ CYS 68.A O no hydrogen 2.877 N/A LYS 83.A NZ SER 70.A O no hydrogen 2.812 N/A LYS 83.A NZ ASP 80.A OD2 no hydrogen 2.754 N/A SER 84.A N ASP 80.A O no hydrogen 3.407 N/A SER 84.A OG PHE 81.A O no hydrogen 2.781 N/A ALA 85.A N PHE 81.A O no hydrogen 3.164 N/A MET 86.A N LYS 83.A O no hydrogen 2.968 N/A GLY 89.A N ALA 85.A O no hydrogen 2.845 N/A TYR 90.A N VAL 110.A O no hydrogen 2.885 N/A VAL 91.A N THR 184.A O no hydrogen 2.827 N/A GLN 92.A N ALA 108.A O no hydrogen 2.844 N/A GLU 93.A N GLN 182.A O no hydrogen 2.900 N/A ARG 94.A N THR 106.A O no hydrogen 2.974 N/A ARG 94.A NE GLN 181.A OE1 no hydrogen 2.874 N/A ARG 94.A NH1 THR 63.A O no hydrogen 2.791 N/A ARG 94.A NH2 GLN 181.A OE1 no hydrogen 2.869 N/A THR 95.A N TYR 180.A O no hydrogen 3.047 N/A ILE 96.A N TYR 104.A O no hydrogen 2.766 N/A PHE 97.A N ASP 178.A O no hydrogen 2.854 N/A PHE 98.A N GLY 102.A O no hydrogen 2.951 N/A LYS 99.A N LEU 176.A O no hydrogen 3.035 N/A LYS 99.A NZ ASP 100.A OD2 no hydrogen 2.678 N/A ASP 101.A N PHE 98.A O no hydrogen 2.858 N/A GLY 102.A N ASP 101.A OD1 no hydrogen 2.879 N/A ASN 103.A N ILE 126.A O no hydrogen 3.054 N/A TYR 104.A N ILE 96.A O no hydrogen 2.853 N/A TYR 104.A OH THR 60.A OG1 no hydrogen 2.832 N/A LYS 105.A N LYS 124.A O no hydrogen 2.835 N/A LYS 105.A NZ.A ASN 103.A OD1 no hydrogen 2.960 N/A THR 106.A N ARG 94.A O no hydrogen 2.862 N/A ARG 107.A N GLU 122.A O no hydrogen 3.033 N/A ARG 107.A NH1 GLU 109.A OE2 no hydrogen 3.096 N/A ARG 107.A NH2 GLU 109.A OE2 no hydrogen 3.385 N/A ALA 108.A N GLN 92.A O no hydrogen 2.834 N/A GLU 109.A N ARG 120.A O no hydrogen 2.891 N/A VAL 110.A N TYR 90.A O no hydrogen 2.911 N/A LYS 111.A N VAL 118.A O no hydrogen 3.006 N/A PHE 112.A N PRO 87.A O no hydrogen 3.000 N/A GLU 113.A N THR 116.A O no hydrogen 2.870 N/A THR 116.A N GLU 113.A O no hydrogen 3.104 N/A THR 116.A OG1 ASP 115.A OD1 no hydrogen 2.773 N/A LEU 117.A N PRO 14.A O no hydrogen 2.935 N/A VAL 118.A N LYS 111.A O no hydrogen 2.843 N/A ASN 119.A N LEU 16.A O no hydrogen 2.919 N/A ASN 119.A ND2 THR 64.A O no hydrogen 3.456 N/A ASN 119.A ND2 LEU 65.A O no hydrogen 2.954 N/A ARG 120.A N GLU 109.A O no hydrogen 2.983 N/A ARG 120.A NH1 GLU 113.A OE1 no hydrogen 3.055 N/A ARG 120.A NH1 GLU 113.A OE2 no hydrogen 2.609 N/A ARG 120.A NH2 GLU 113.A OE1 no hydrogen 2.490 N/A ILE 121.A N GLU 18.A O no hydrogen 2.777 N/A GLU 122.A N ARG 107.A O no hydrogen 2.833 N/A LEU 123.A N ASP 20.A O no hydrogen 2.880 N/A LYS 124.A N LYS 105.A O no hydrogen 2.911 N/A GLY 125.A N ASP 22.A O no hydrogen 2.670 N/A ILE 126.A N ASN 103.A O no hydrogen 3.029 N/A PHE 128.A N ASN 24.A OD1 no hydrogen 3.026 N/A LYS 129.A N ASP 101.A OD1 no hydrogen 2.735 N/A LYS 129.A NZ.A ASP 100.A O no hydrogen 2.807 N/A LYS 129.A NZ.B ASP 100.A O no hydrogen 2.722 N/A GLY 132.A N LYS 129.A O no hydrogen 3.050 N/A ASN 133.A ND2 GLN 175.A OE1 no hydrogen 2.912 N/A GLY 136.A N GLY 132.A O no hydrogen 2.846 N/A HIS 137.A N ILE 134.A O no hydrogen 3.045 N/A LYS 138.A N ASN 133.A O no hydrogen 2.956 N/A LYS 138.A NZ ASP 131.A O no hydrogen 2.779 N/A GLU 140.A N ASN 168.A O no hydrogen 2.937 N/A TYR 141.A OH SER 206.A O no hydrogen 2.692 N/A ASN 142.A ND2 GLU 140.A OE1 no hydrogen 2.906 N/A ASN 144.A ND2 ARG 166.A O no hydrogen 2.889 N/A HIS 146.A N THR 201.A O no hydrogen 3.046 N/A VAL 148.A N LEU 199.A O no hydrogen 2.885 N/A TYR 149.A N ASN 162.A O no hydrogen 3.197 N/A ILE 150.A N HIS 197.A O no hydrogen 2.810 N/A THR 151.A N LYS 160.A O no hydrogen 2.930 N/A THR 151.A OG1.B ASN 196.A OD1 no hydrogen 2.826 N/A ASP 153.A N.A GLY 158.A O no hydrogen 2.842 N/A ASP 153.A N.B GLY 158.A O no hydrogen 2.855 N/A GLN 155.A N.B ASP 153.A OD1 no hydrogen 3.270 N/A LYS 156.A N.A ASP 153.A O.A no hydrogen 3.094 N/A LYS 156.A N.B ASP 153.A O.A no hydrogen 3.158 N/A LYS 156.A N.B ASP 153.A O.B no hydrogen 3.458 N/A LYS 156.A NZ.B ASP 153.A OD2 no hydrogen 2.491 N/A GLY 158.A N ASP 153.A O.A no hydrogen 3.271 N/A GLY 158.A N LYS 156.A O.B no hydrogen 3.144 N/A ILE 159.A N ASN 183.A O no hydrogen 3.001 N/A LYS 160.A N THR 151.A O no hydrogen 2.897 N/A LYS 160.A NZ ASP 153.A OD2 no hydrogen 2.602 N/A LYS 160.A NZ GLN 182.A OE1.A no hydrogen 2.973 N/A ALA 161.A N GLN 181.A O no hydrogen 2.933 N/A ASN 162.A N TYR 149.A O no hydrogen 3.086 N/A PHE 163.A N HIS 179.A O no hydrogen 3.184 N/A LYS 164.A NZ ASP 178.A OD2 no hydrogen 2.665 N/A ILE 165.A N ALA 177.A O no hydrogen 2.903 N/A ARG 166.A N HIS 146.A NE2 no hydrogen 2.976 N/A HIS 167.A N GLN 175.A O no hydrogen 2.858 N/A ASN 168.A ND2 ASN 142.A OD1 no hydrogen 3.537 N/A ILE 169.A N SER 173.A O no hydrogen 2.900 N/A GLU 170.A N LYS 138.A O no hydrogen 2.904 N/A GLY 172.A N ILE 169.A O no hydrogen 2.931 N/A SER 173.A N ASP 171.A OD1 no hydrogen 2.969 N/A SER 173.A OG ASP 171.A OD1 no hydrogen 2.601 N/A GLN 175.A N HIS 167.A O no hydrogen 2.774 N/A GLN 175.A NE2 LYS 99.A O no hydrogen 2.853 N/A GLN 175.A NE2 LEU 176.A O no hydrogen 3.063 N/A ALA 177.A N ILE 165.A O no hydrogen 2.862 N/A ASP 178.A N PHE 97.A O no hydrogen 2.875 N/A HIS 179.A N PHE 163.A O no hydrogen 2.810 N/A HIS 179.A ND1 ALA 177.A O no hydrogen 2.944 N/A HIS 179.A NE2 THR 63.A OG1 no hydrogen 2.695 N/A TYR 180.A N THR 95.A O no hydrogen 2.995 N/A GLN 181.A N ALA 161.A O no hydrogen 2.831 N/A GLN 181.A NE2 GLN 67.A OE1 no hydrogen 2.899 N/A GLN 181.A NE2 ASN 183.A OD1 no hydrogen 2.845 N/A GLN 182.A N GLU 93.A O no hydrogen 2.889 N/A GLN 182.A NE2.A ASP 153.A OD2 no hydrogen 2.720 N/A GLN 182.A NE2.A ASN 183.A O no hydrogen 3.549 N/A ASN 183.A N ILE 159.A O no hydrogen 2.851 N/A ASN 183.A ND2 GLN 92.A OE1 no hydrogen 2.846 N/A THR 184.A N VAL 91.A O no hydrogen 3.031 N/A ILE 186.A N GLY 89.A O no hydrogen 2.825 N/A LEU 192.A N SER 84.A OG no hydrogen 2.856 N/A ASP 195.A N HIS 79.A ND1 no hydrogen 2.955 N/A HIS 197.A N ILE 150.A O no hydrogen 3.272 N/A HIS 197.A ND1 ASP 195.A O no hydrogen 2.859 N/A HIS 197.A NE2 TYR 72.A OH no hydrogen 2.699 N/A TYR 198.A N ALA 225.A O no hydrogen 2.906 N/A LEU 199.A N VAL 148.A O no hydrogen 2.878 N/A ASP 200.A N GLU 223.A O no hydrogen 2.804 N/A THR 201.A N HIS 146.A O no hydrogen 2.871 N/A THR 201.A OG1 LEU 199.A O no hydrogen 3.177 N/A GLU 202.A N GLU 221.A O no hydrogen 2.908 N/A SER 203.A OG GLU 220.A OE2.A no hydrogen 2.676 N/A ALA 204.A N LEU 219.A O no hydrogen 2.788 N/A SER 206.A N VAL 217.A O no hydrogen 2.858 N/A LYS 207.A NZ HIS 215.A O no hydrogen 2.733 N/A ASP 208.A N HIS 215.A NE2 no hydrogen 2.845 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 2.961 N/A GLU 211.A N ASP 208.A O no hydrogen 3.046 N/A ARG 213.A N GLU 211.A OE2 no hydrogen 2.891 N/A ARG 213.A NE GLU 211.A OE2 no hydrogen 2.864 N/A ARG 213.A NH2 GLU 211.A OE1 no hydrogen 2.965 N/A ARG 213.A NH2 GLU 211.A OE2 no hydrogen 3.566 N/A HIS 215.A ND1 ARG 213.A O no hydrogen 2.834 N/A MET 216.A N PHE 47.A O no hydrogen 2.916 N/A VAL 217.A N SER 206.A O no hydrogen 3.001 N/A LEU 218.A N LEU 45.A O no hydrogen 2.841 N/A LEU 219.A N ALA 204.A O no hydrogen 2.886 N/A GLU 220.A N LEU 43.A O no hydrogen 3.061 N/A GLU 221.A N GLU 202.A O no hydrogen 2.989 N/A VAL 222.A N GLY 41.A O no hydrogen 2.820 N/A GLU 223.A N ASP 200.A O no hydrogen 3.102 N/A ALA 224.A N ARG 71.A O no hydrogen 2.832 N/A ALA 225.A N TYR 198.A O no hydrogen 2.864 N/A