Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pca_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N GLU 212.A OE2 no hydrogen 2.554 N/A ASP 13.A N SER 10.A OG no hydrogen 2.883 N/A GLU 14.A N SER 10.A O no hydrogen 3.155 N/A TYR 15.A N LYS 11.A O no hydrogen 3.013 N/A LEU 16.A N GLN 12.A O no hydrogen 2.922 N/A ASN 17.A N ASP 13.A O no hydrogen 2.844 N/A LYS 18.A N GLU 14.A O no hydrogen 2.978 N/A LEU 19.A N TYR 15.A O no hydrogen 2.949 N/A PHE 20.A N LEU 16.A O no hydrogen 2.886 N/A VAL 22.A N THR 45.A O no hydrogen 2.986 N/A LEU 28.A N THR 24.A O no hydrogen 3.140 N/A LYS 29.A N GLU 25.A O no hydrogen 2.884 N/A LYS 29.A NZ GLU 25.A OE2 no hydrogen 2.749 N/A ALA 30.A N GLY 26.A O no hydrogen 2.913 N/A HIS 31.A N ALA 27.A O no hydrogen 2.991 N/A HIS 31.A NE2 LEU 43.A O no hydrogen 3.012 N/A LYS 32.A N LEU 28.A O no hydrogen 3.400 N/A LYS 32.A N LYS 29.A O no hydrogen 3.116 N/A THR 33.A N ALA 30.A O no hydrogen 3.038 N/A THR 33.A OG1 ALA 30.A O no hydrogen 2.679 N/A ALA 34.A N HIS 31.A O no hydrogen 3.476 N/A SER 36.A OG.B GLU 37.A OE1 no hydrogen 2.987 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.772 N/A LEU 38.A N PRO 35.A O no hydrogen 2.871 N/A ARG 39.A N SER 36.A O no hydrogen 3.289 N/A ALA 41.A N LEU 38.A O no hydrogen 2.987 N/A GLN 42.A N LEU 38.A O no hydrogen 3.272 N/A GLN 42.A NE2 HIS 31.A O no hydrogen 2.990 N/A GLN 42.A NE2 ARG 39.A O no hydrogen 3.222 N/A GLY 44.A N GLU 47.A OE1 no hydrogen 3.031 N/A GLY 48.A N GLY 44.A O no hydrogen 2.909 N/A GLN 49.A N THR 45.A O no hydrogen 3.160 N/A MET 50.A N VAL 46.A O no hydrogen 2.959 N/A LEU 51.A N GLU 47.A O no hydrogen 3.104 N/A GLN 52.A N GLY 48.A O no hydrogen 3.118 N/A GLN 52.A NE2 CYS 76.A O no hydrogen 2.907 N/A LEU 53.A N GLN 49.A O no hydrogen 2.945 N/A LEU 54.A N MET 50.A O no hydrogen 3.032 N/A ILE 55.A N LEU 51.A O no hydrogen 2.987 N/A ARG 56.A N GLN 52.A O no hydrogen 2.959 N/A ARG 56.A NE.A ALA 80.A O no hydrogen 2.694 N/A MET 57.A N LEU 53.A O no hydrogen 2.863 N/A ALA 58.A N LEU 54.A O no hydrogen 2.983 N/A GLY 59.A N ARG 56.A O no hydrogen 3.237 N/A ILE 60.A N ILE 55.A O no hydrogen 3.034 N/A HIS 61.A N ASP 134.A OD2 no hydrogen 2.860 N/A HIS 61.A ND1 GLY 59.A O no hydrogen 3.072 N/A SER 62.A N ASP 134.A OD2 no hydrogen 2.963 N/A ILE 63.A N HIS 86.A O no hydrogen 2.981 N/A VAL 64.A N MET 135.A O no hydrogen 2.932 N/A GLU 65.A N TYR 88.A O no hydrogen 2.850 N/A VAL 66.A N PHE 137.A O no hydrogen 2.887 N/A GLY 67.A N ILE 90.A O no hydrogen 2.857 N/A THR 68.A N ILE 90.A O no hydrogen 2.988 N/A THR 68.A OG1 THR 89.A OG1 no hydrogen 2.704 N/A CYS 69.A N GLU 91.A OE1 no hydrogen 2.814 N/A GLY 71.A N THR 68.A O no hydrogen 3.013 N/A SER 73.A OG GLU 65.A OE2 no hydrogen 2.516 N/A ILE 75.A N GLY 71.A O no hydrogen 2.823 N/A CYS 76.A N PHE 72.A O no hydrogen 2.956 N/A CYS 76.A SG PHE 72.A O no hydrogen 3.437 N/A MET 77.A N SER 73.A O no hydrogen 2.941 N/A ALA 78.A N ALA 74.A O no hydrogen 2.784 N/A HIS 79.A N ILE 75.A O no hydrogen 3.217 N/A ALA 80.A N MET 77.A O no hydrogen 2.925 N/A LEU 81.A N ALA 78.A O no hydrogen 3.124 N/A GLY 85.A N PRO 82.A O no hydrogen 2.906 N/A HIS 86.A N HIS 61.A O no hydrogen 2.929 N/A HIS 86.A NE2 THR 114.A OG1 no hydrogen 2.708 N/A ILE 87.A N LYS 112.A O no hydrogen 2.763 N/A TYR 88.A N ILE 63.A O no hydrogen 2.867 N/A THR 89.A N THR 114.A O no hydrogen 2.916 N/A THR 89.A OG1 GLU 65.A OE1 no hydrogen 2.470 N/A THR 89.A OG1 THR 68.A OG1 no hydrogen 2.704 N/A ILE 90.A N GLU 65.A O no hydrogen 2.904 N/A GLU 91.A N LEU 116.A O no hydrogen 2.963 N/A ASP 93.A N GLU 91.A OE2 no hydrogen 2.994 N/A GLU 95.A N GLU 95.A OE1.B no hydrogen 2.789 N/A ASN 96.A N ASP 93.A OD1 no hydrogen 2.908 N/A ASN 96.A ND2 GLU 91.A OE2 no hydrogen 3.240 N/A VAL 97.A N ASP 93.A O no hydrogen 2.992 N/A VAL 98.A N TYR 94.A O no hydrogen 2.876 N/A THR 99.A N GLU 95.A O no hydrogen 3.104 N/A THR 99.A OG1 GLU 95.A O no hydrogen 3.098 N/A ALA 100.A N ASN 96.A O no hydrogen 2.751 N/A ASN 101.A N VAL 97.A O no hydrogen 2.933 N/A ASN 101.A ND2.A VAL 97.A O no hydrogen 2.938 N/A GLN 102.A N VAL 98.A O no hydrogen 3.188 N/A GLN 102.A NE2 GLN 102.A O no hydrogen 3.313 N/A GLN 102.A NE2 ASN 106.A OD1 no hydrogen 2.967 N/A ASN 103.A N THR 99.A O no hydrogen 2.888 N/A ASN 103.A ND2 THR 33.A OG1 no hydrogen 2.861 N/A ASN 103.A ND2 VAL 70.A O no hydrogen 2.887 N/A ILE 104.A N ALA 100.A O no hydrogen 2.836 N/A VAL 105.A N ASN 101.A O no hydrogen 3.094 N/A ASN 106.A N GLN 102.A O no hydrogen 2.865 N/A CYS 107.A N ASN 103.A O no hydrogen 2.998 N/A CYS 107.A SG ASN 103.A O no hydrogen 3.480 N/A LYS 108.A N VAL 105.A O no hydrogen 2.981 N/A LEU 109.A N ILE 104.A O no hydrogen 2.987 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.707 N/A LYS 112.A N LEU 109.A O no hydrogen 2.818 N/A LYS 112.A NZ ALA 78.A O no hydrogen 3.382 N/A LYS 112.A NZ LEU 81.A O no hydrogen 3.000 N/A ILE 113.A N LEU 109.A O no hydrogen 3.122 N/A THR 114.A N ILE 87.A O no hydrogen 2.856 N/A THR 114.A OG1 HIS 86.A NE2 no hydrogen 2.708 N/A LEU 116.A N THR 89.A O no hydrogen 2.766 N/A GLY 118.A N GLU 91.A O no hydrogen 2.948 N/A LEU 121.A N GLU 119.A OE2.A no hydrogen 2.771 N/A LEU 121.A N GLU 119.A OE2.B no hydrogen 2.923 N/A ALA 122.A N GLU 119.A OE1.B no hydrogen 3.114 N/A GLN 123.A N GLU 119.A O no hydrogen 3.077 N/A LEU 124.A N ALA 120.A O no hydrogen 2.856 N/A ASN 125.A N LEU 121.A O no hydrogen 2.952 N/A THR 126.A N ALA 122.A O no hydrogen 3.282 N/A THR 126.A OG1.A GLN 123.A O no hydrogen 2.692 N/A LEU 127.A N GLN 123.A O no hydrogen 3.089 N/A LYS 128.A N LEU 124.A O no hydrogen 3.054 N/A LYS 128.A NZ GLU 129.A OE2 no hydrogen 2.581 N/A GLU 129.A N THR 126.A O no hydrogen 3.497 N/A MET 130.A N LEU 127.A O no hydrogen 2.814 N/A ALA 131.A N LYS 128.A O no hydrogen 3.051 N/A PHE 133.A N TYR 155.A O no hydrogen 2.897 N/A ASP 134.A N SER 62.A O no hydrogen 3.133 N/A ASP 134.A N SER 62.A OG no hydrogen 2.982 N/A ILE 136.A N LEU 161.A O no hydrogen 2.965 N/A PHE 137.A N VAL 64.A O no hydrogen 2.880 N/A ILE 138.A N VAL 163.A O no hydrogen 2.836 N/A ASP 139.A N VAL 66.A O no hydrogen 2.892 N/A ASN 141.A ND2.A TYR 148.A OH no hydrogen 2.495 N/A LYS 142.A NZ ALA 140.A O no hydrogen 2.796 N/A LYS 142.A NZ TYR 145.A OH no hydrogen 2.954 N/A LYS 142.A NZ ASN 166.A OD1 no hydrogen 2.929 N/A SER 143.A OG ASN 141.A OD1.B no hydrogen 2.640 N/A SER 144.A N ASN 141.A O no hydrogen 3.071 N/A SER 144.A OG ASN 141.A OD1.A no hydrogen 2.223 N/A SER 144.A OG ASN 141.A OD1.B no hydrogen 3.186 N/A TYR 145.A N LYS 142.A O no hydrogen 3.144 N/A TYR 145.A OH ASP 165.A O no hydrogen 2.678 N/A LEU 146.A N SER 189.A OG no hydrogen 3.252 N/A TYR 148.A N SER 144.A O no hydrogen 3.004 N/A LEU 149.A N TYR 145.A O no hydrogen 2.842 N/A ASN 150.A N LEU 146.A O no hydrogen 2.974 N/A TRP 151.A N ALA 147.A O no hydrogen 3.174 N/A TRP 151.A NE1 LEU 124.A O no hydrogen 3.087 N/A ALA 152.A N TYR 148.A O no hydrogen 3.007 N/A LYS 153.A N LEU 149.A O no hydrogen 2.835 N/A LYS 153.A NZ.A GLU 196.A OE2 no hydrogen 2.962 N/A MET 154.A N TRP 151.A O no hydrogen 3.021 N/A TYR 155.A N TRP 151.A O no hydrogen 3.002 N/A TYR 155.A N ALA 152.A O no hydrogen 3.280 N/A ILE 156.A N ALA 152.A O no hydrogen 3.017 N/A ARG 157.A N PHE 133.A O no hydrogen 2.899 N/A ARG 157.A NE ASP 134.A OD1 no hydrogen 2.836 N/A ARG 157.A NH1 LYS 158.A O no hydrogen 3.022 N/A GLY 159.A N LYS 219.A O no hydrogen 2.626 N/A GLY 160.A N ARG 157.A O no hydrogen 2.807 N/A LEU 161.A N ASP 134.A O no hydrogen 2.931 N/A ILE 162.A N SER 217.A O no hydrogen 2.806 N/A VAL 163.A N ILE 136.A O no hydrogen 2.895 N/A ALA 164.A N MET 215.A O no hydrogen 3.015 N/A ASP 165.A N ILE 138.A O no hydrogen 3.255 N/A ASN 166.A ND2 GLU 212.A OE1 no hydrogen 2.880 N/A THR 167.A N GLY 213.A O no hydrogen 2.968 N/A THR 167.A OG1 GLY 213.A O no hydrogen 2.976 N/A PHE 168.A N GLU 212.A O no hydrogen 3.039 N/A LEU 169.A N ASN 166.A O no hydrogen 2.853 N/A GLY 171.A N PHE 168.A O no hydrogen 3.004 N/A SER 172.A N LEU 169.A O no hydrogen 2.997 N/A SER 172.A OG LEU 169.A O no hydrogen 2.791 N/A VAL 173.A N PHE 168.A O no hydrogen 3.206 N/A SER 184.A OG.B ASN 185.A OD1 no hydrogen 3.150 N/A HIS 187.A N SER 183.A O no hydrogen 3.103 N/A HIS 187.A NE2 SER 172.A O no hydrogen 2.930 N/A ALA 188.A N SER 184.A O no hydrogen 2.988 N/A SER 189.A N ASN 185.A O no hydrogen 2.880 N/A SER 189.A OG LYS 142.A O no hydrogen 2.850 N/A MET 190.A N ALA 186.A O no hydrogen 2.928 N/A ARG 191.A N HIS 187.A O no hydrogen 2.994 N/A ARG 191.A NH1 VAL 173.A O no hydrogen 2.812 N/A ALA 192.A N ALA 188.A O no hydrogen 3.097 N/A PHE 193.A N SER 189.A O no hydrogen 2.829 N/A ASN 194.A N MET 190.A O no hydrogen 2.927 N/A ASN 194.A ND2 THR 167.A O no hydrogen 2.882 N/A ASP 195.A N ARG 191.A O no hydrogen 3.011 N/A GLU 196.A N ALA 192.A O no hydrogen 2.944 N/A LEU 197.A N PHE 193.A O no hydrogen 3.154 N/A ALA 198.A N ASP 195.A O no hydrogen 3.159 N/A ASN 199.A N GLU 196.A O no hydrogen 3.052 N/A GLU 201.A N ASN 199.A OD1 no hydrogen 2.908 N/A LYS 202.A N ASN 199.A O no hydrogen 3.043 N/A TYR 203.A N ASN 199.A O no hydrogen 2.938 N/A TYR 203.A OH GLU 196.A OE2 no hydrogen 2.801 N/A LEU 204.A N ILE 218.A O no hydrogen 3.006 N/A SER 205.A OG LEU 197.A O no hydrogen 2.718 N/A SER 205.A OG SER 217.A OG no hydrogen 2.686 N/A THR 206.A N VAL 216.A O no hydrogen 2.885 N/A ILE 208.A N MET 214.A O no hydrogen 2.798 N/A THR 210.A N ILE 208.A O no hydrogen 2.801 N/A GLY 213.A N THR 210.A OG1 no hydrogen 2.895 N/A MET 214.A N ILE 208.A O no hydrogen 3.053 N/A MET 215.A N ALA 164.A O no hydrogen 2.849 N/A VAL 216.A N THR 206.A O no hydrogen 2.841 N/A SER 217.A N ILE 162.A O no hydrogen 2.908 N/A SER 217.A OG SER 205.A OG no hydrogen 2.686 N/A ILE 218.A N LEU 204.A O no hydrogen 2.890 N/A LYS 219.A N GLY 160.A O no hydrogen 2.940 N/A LYS 219.A NZ.A ILE 156.A O no hydrogen 2.830 N/A LYS 219.A NZ.A THR 221.A O no hydrogen 2.687 N/A LYS 219.A NZ.B ALA 152.A O no hydrogen 3.407 N/A LYS 219.A NZ.B LYS 153.A O no hydrogen 3.024 N/A LYS 219.A NZ.B ILE 156.A O no hydrogen 2.728 N/A LEU 220.A N LYS 202.A O no hydrogen 2.908 N/A