Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zdd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N THR 42.A OG1 no hydrogen 2.817 N/A HIS 3.A NE2.A THR 118.A OG1 no hydrogen 2.794 N/A LEU 4.A N GLN 116.A O no hydrogen 2.843 N/A LEU 5.A N HIS 43.A O no hydrogen 2.863 N/A ILE 6.A N THR 118.A O no hydrogen 2.729 N/A VAL 7.A N VAL 45.A O no hydrogen 2.904 N/A ASP 8.A N VAL 120.A O no hydrogen 3.062 N/A ALA 9.A N VAL 47.A O no hydrogen 3.144 N/A ASN 11.A ND2 THR 122.A OG1 no hydrogen 3.060 N/A LEU 12.A N ASP 8.A O no hydrogen 3.161 N/A ILE 13.A N ALA 9.A O no hydrogen 2.840 N/A ARG 14.A N LEU 10.A O no hydrogen 2.795 N/A ILE 16.A N LEU 12.A O no hydrogen 3.185 N/A HIS 17.A N ILE 13.A O no hydrogen 2.927 N/A HIS 17.A NE2 SER 22.A OG no hydrogen 2.646 N/A ALA 18.A N ARG 14.A O no hydrogen 2.835 N/A VAL 19.A N ARG 15.A O no hydrogen 3.192 N/A VAL 19.A N ILE 16.A O no hydrogen 3.256 N/A GLN 20.A N ILE 16.A O no hydrogen 3.066 N/A GLN 20.A NE2 THR 27.A OG1 no hydrogen 2.819 N/A GLY 21.A N HIS 17.A O no hydrogen 2.862 N/A SER 22.A OG HIS 17.A NE2 no hydrogen 2.646 N/A SER 22.A OG GLU 77.A OE2 no hydrogen 2.710 N/A CYS 24.A N GLU 77.A OE1 no hydrogen 2.805 N/A CYS 24.A SG GLU 77.A OE2 no hydrogen 3.466 N/A CYS 28.A N CYS 24.A O no hydrogen 3.017 N/A CYS 28.A SG CYS 24.A O no hydrogen 3.266 N/A GLN 29.A N VAL 25.A O no hydrogen 2.824 N/A HIS 30.A N GLU 26.A O no hydrogen 2.991 N/A ALA 31.A N THR 27.A O no hydrogen 2.983 N/A LEU 32.A N CYS 28.A O no hydrogen 2.908 N/A ASP 33.A N GLN 29.A O no hydrogen 3.051 N/A GLN 34.A N HIS 30.A O no hydrogen 2.850 N/A LEU 35.A N ALA 31.A O no hydrogen 2.798 N/A ILE 36.A N LEU 32.A O no hydrogen 3.003 N/A MET 37.A N ASP 33.A O no hydrogen 2.869 N/A HIS 38.A N GLN 34.A O no hydrogen 2.906 N/A SER 39.A N LEU 35.A O no hydrogen 3.043 N/A GLN 40.A N ILE 36.A O no hydrogen 2.838 N/A GLN 40.A NE2 MET 37.A O no hydrogen 2.787 N/A THR 42.A N HIS 3.A O no hydrogen 2.884 N/A THR 42.A OG1 HIS 3.A O no hydrogen 3.221 N/A THR 42.A OG1 HIS 43.A ND1 no hydrogen 2.695 N/A HIS 43.A N HIS 3.A O no hydrogen 3.071 N/A HIS 43.A ND1 THR 42.A OG1 no hydrogen 2.695 N/A ALA 44.A N LEU 243.A O no hydrogen 2.837 N/A VAL 45.A N LEU 5.A O no hydrogen 2.914 N/A ALA 46.A N PRO 91.A O no hydrogen 2.880 N/A VAL 47.A N VAL 7.A O no hydrogen 2.933 N/A PHE 48.A N TRP 93.A O no hydrogen 2.888 N/A TRP 55.A NE1 ASP 101.A OD2 no hydrogen 3.065 N/A ARG 56.A NE ILE 227.A O no hydrogen 2.814 N/A ARG 56.A NH1 GLU 98.A OE1 no hydrogen 2.862 N/A ARG 56.A NH1 ASP 101.A OD2 no hydrogen 3.058 N/A ARG 56.A NH2 ASP 101.A OD1 no hydrogen 2.871 N/A ARG 56.A NH2 ARG 229.A O no hydrogen 2.965 N/A GLN 58.A N GLY 54.A O no hydrogen 3.112 N/A GLN 58.A NE2 SER 52.A O no hydrogen 3.493 N/A ARG 59.A N TRP 55.A O no hydrogen 2.983 N/A LEU 60.A N ARG 56.A O no hydrogen 2.847 N/A TYR 63.A N LEU 60.A O no hydrogen 2.948 N/A LYS 64.A N SER 173.A O no hydrogen 2.780 N/A LYS 64.A NZ TYR 63.A OH no hydrogen 3.548 N/A ALA 65.A N ASP 62.A O no hydrogen 3.065 N/A ARG 67.A NH2 SER 172.A O no hydrogen 2.783 N/A HIS 75.A N PRO 71.A O no hydrogen 2.952 N/A ASP 76.A N GLU 72.A O no hydrogen 2.860 N/A GLU 77.A N LEU 74.A O no hydrogen 2.870 N/A MET 78.A N HIS 75.A O no hydrogen 3.190 N/A LEU 81.A N GLU 77.A O no hydrogen 2.929 N/A ARG 82.A N.A MET 78.A O no hydrogen 2.880 N/A ARG 82.A N.B MET 78.A O no hydrogen 2.880 N/A ALA 83.A N PRO 79.A O no hydrogen 3.010 N/A ALA 84.A N ALA 80.A O no hydrogen 3.015 N/A PHE 85.A N LEU 81.A O no hydrogen 3.128 N/A GLU 86.A N ARG 82.A O.A no hydrogen 2.927 N/A GLU 86.A N ARG 82.A O.B no hydrogen 2.945 N/A GLN 87.A N ALA 83.A O no hydrogen 2.846 N/A ARG 88.A N ALA 84.A O no hydrogen 3.072 N/A ARG 88.A NE ASP 33.A OD1 no hydrogen 2.919 N/A ARG 88.A NH1 ARG 88.A O no hydrogen 2.743 N/A GLY 89.A N GLU 86.A O no hydrogen 2.854 N/A VAL 90.A N PHE 85.A O no hydrogen 3.017 N/A CYS 92.A N GLU 86.A OE2 no hydrogen 3.006 N/A CYS 92.A SG ARG 82.A O.A no hydrogen 3.736 N/A CYS 92.A SG ARG 82.A O.B no hydrogen 3.722 N/A CYS 92.A SG VAL 90.A O no hydrogen 3.958 N/A TRP 93.A N ALA 46.A O no hydrogen 2.801 N/A ASN 97.A N THR 95.A O no hydrogen 2.891 N/A ASN 97.A ND2 THR 95.A OG1 no hydrogen 3.067 N/A ALA 99.A N ASP 49.A OD1 no hydrogen 2.858 N/A ASP 101.A N ASP 100.A OD1 no hydrogen 2.879 N/A LEU 102.A N GLU 98.A O no hydrogen 3.321 N/A ALA 103.A N ALA 99.A O no hydrogen 2.825 N/A ALA 104.A N ASP 100.A O no hydrogen 2.876 N/A THR 105.A N ASP 101.A O no hydrogen 2.955 N/A THR 105.A OG1 ASP 101.A O no hydrogen 2.891 N/A THR 105.A OG1 GLN 231.A O no hydrogen 3.126 N/A LEU 106.A N LEU 102.A O no hydrogen 2.900 N/A ALA 107.A N ALA 103.A O no hydrogen 2.930 N/A VAL 108.A N ALA 104.A O no hydrogen 2.855 N/A LYS 109.A N THR 105.A O no hydrogen 2.913 N/A VAL 110.A N LEU 106.A O no hydrogen 3.013 N/A THR 111.A N ALA 107.A O no hydrogen 3.014 N/A THR 111.A OG1 ALA 107.A O no hydrogen 2.893 N/A THR 111.A OG1 VAL 108.A O no hydrogen 3.220 N/A GLN 112.A N VAL 108.A O no hydrogen 2.830 N/A GLN 112.A NE2 THR 111.A OG1 no hydrogen 3.422 N/A ALA 113.A N LYS 109.A O no hydrogen 3.223 N/A GLY 114.A N THR 111.A O no hydrogen 2.933 N/A HIS 115.A N VAL 110.A O no hydrogen 3.099 N/A GLN 116.A N VAL 2.A O no hydrogen 3.090 N/A GLN 116.A NE2 ALA 117.A O no hydrogen 3.151 N/A ALA 117.A N THR 133.A O no hydrogen 2.959 N/A THR 118.A N LEU 4.A O no hydrogen 2.962 N/A THR 118.A OG1 HIS 3.A NE2.A no hydrogen 2.794 N/A ILE 119.A N ARG 135.A O no hydrogen 2.939 N/A VAL 120.A N ILE 6.A O no hydrogen 2.844 N/A SER 121.A N ARG 137.A O no hydrogen 2.930 N/A SER 121.A OG ASP 8.A OD2 no hydrogen 3.023 N/A THR 122.A N ASN 11.A OD1 no hydrogen 3.006 N/A ASP 123.A N SER 121.A OG no hydrogen 3.050 N/A GLY 125.A N ASP 123.A OD1 no hydrogen 2.940 N/A TYR 126.A N ASP 123.A O no hydrogen 3.347 N/A TYR 126.A OH ASP 8.A OD2 no hydrogen 3.185 N/A CYS 127.A N LYS 124.A O no hydrogen 2.901 N/A CYS 127.A SG LEU 145.A O no hydrogen 3.865 N/A GLN 128.A N GLY 125.A O no hydrogen 3.309 N/A GLN 128.A NE2 GLY 125.A O no hydrogen 3.000 N/A GLN 128.A NE2 ALA 228.A O no hydrogen 2.812 N/A LEU 129.A N TYR 126.A O no hydrogen 2.934 N/A LEU 130.A N CYS 127.A O no hydrogen 3.156 N/A SER 131.A N LEU 134.A O no hydrogen 3.356 N/A THR 133.A N SER 131.A OG no hydrogen 3.068 N/A LEU 134.A N SER 131.A O no hydrogen 3.271 N/A ARG 135.A N ALA 117.A O no hydrogen 3.042 N/A ARG 135.A NE THR 118.A OG1 no hydrogen 2.743 N/A ARG 137.A N ILE 119.A O no hydrogen 2.789 N/A ASP 138.A N ARG 143.A O no hydrogen 2.891 N/A PHE 140.A N ASP 138.A OD1 no hydrogen 2.871 N/A GLN 141.A N ASP 138.A OD1 no hydrogen 2.907 N/A LYS 142.A NZ TYR 139.A O no hydrogen 2.687 N/A ARG 143.A N ASP 138.A O no hydrogen 3.116 N/A ARG 143.A NE GLN 141.A OE1 no hydrogen 3.023 N/A ARG 143.A NH2 GLN 141.A OE1 no hydrogen 2.714 N/A LEU 145.A N ILE 136.A O no hydrogen 2.848 N/A PHE 149.A N ASP 146.A OD1 no hydrogen 3.026 N/A ILE 150.A N ASP 146.A O no hydrogen 2.897 N/A ASP 151.A N ALA 147.A O no hydrogen 2.905 N/A LYS 152.A N PRO 148.A O no hydrogen 2.903 N/A GLU 153.A N PHE 149.A O no hydrogen 2.842 N/A PHE 154.A N ILE 150.A O no hydrogen 2.833 N/A GLY 155.A N ILE 150.A O no hydrogen 3.264 N/A GLY 155.A N ASP 151.A O no hydrogen 2.963 N/A GLN 157.A N GLN 160.A OE1 no hydrogen 2.838 N/A GLN 159.A N GLN 159.A OE1 no hydrogen 2.865 N/A GLN 160.A N GLN 157.A O no hydrogen 2.945 N/A GLN 160.A NE2 LEU 190.A O no hydrogen 3.282 N/A GLN 160.A NE2 GLN 194.A O no hydrogen 2.678 N/A LEU 161.A N PRO 158.A O no hydrogen 3.044 N/A TYR 164.A N GLN 160.A O no hydrogen 2.946 N/A TRP 165.A N LEU 161.A O no hydrogen 2.902 N/A GLY 166.A N PRO 162.A O no hydrogen 2.904 N/A LEU 167.A N ASP 163.A O no hydrogen 3.206 N/A LEU 167.A N TYR 164.A O no hydrogen 3.097 N/A ALA 168.A N TYR 164.A O no hydrogen 2.778 N/A GLY 169.A N TRP 165.A O no hydrogen 2.786 N/A ILE 170.A N VAL 175.A O no hydrogen 2.710 N/A SER 173.A N ILE 170.A O no hydrogen 3.101 N/A LYS 174.A N SER 171.A O no hydrogen 2.977 N/A VAL 175.A N ILE 170.A O no hydrogen 2.970 N/A VAL 178.A N LEU 167.A O no hydrogen 2.858 N/A ILE 181.A N VAL 178.A O no hydrogen 2.980 N/A ALA 186.A N GLY 182.A O no hydrogen 2.892 N/A THR 187.A N PRO 183.A O no hydrogen 2.995 N/A THR 187.A OG1 PHE 154.A O no hydrogen 2.651 N/A THR 187.A OG1 PRO 183.A O no hydrogen 3.086 N/A GLN 188.A N LYS 184.A O no hydrogen 3.061 N/A LEU 189.A N SER 185.A O no hydrogen 2.999 N/A LEU 190.A N ALA 186.A O no hydrogen 2.960 N/A VAL 191.A N THR 187.A O no hydrogen 2.881 N/A GLU 192.A N GLN 188.A O no hydrogen 3.123 N/A PHE 193.A N LEU 189.A O no hydrogen 2.821 N/A GLN 194.A N LEU 190.A O no hydrogen 2.824 N/A GLN 194.A NE2 GLN 157.A OE1.B no hydrogen 3.104 N/A SER 195.A N PHE 193.A O no hydrogen 2.810 N/A SER 195.A OG GLU 197.A OE1 no hydrogen 3.542 N/A LEU 196.A N ASP 163.A OD2 no hydrogen 2.838 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.785 N/A GLY 198.A N SER 195.A OG no hydrogen 2.954 N/A ILE 199.A N SER 195.A O no hydrogen 3.038 N/A TYR 200.A N LEU 196.A O no hydrogen 2.940 N/A TYR 200.A OH LEU 214.A O no hydrogen 2.620 N/A GLU 201.A N GLU 197.A O no hydrogen 2.995 N/A ASN 202.A N ILE 199.A O no hydrogen 3.306 N/A ALA 205.A N ASN 202.A O no hydrogen 3.246 N/A VAL 206.A N LEU 203.A O no hydrogen 3.084 N/A TRP 210.A N ALA 207.A O no hydrogen 2.969 N/A ARG 211.A N ALA 207.A O no hydrogen 3.104 N/A LEU 214.A N TRP 210.A O no hydrogen 2.930 N/A GLU 215.A N ARG 211.A O no hydrogen 2.951 N/A THR 216.A N LYS 212.A O no hydrogen 3.008 N/A THR 216.A OG1 LYS 212.A O no hydrogen 2.872 N/A HIS 217.A N LYS 213.A O no hydrogen 3.151 N/A ALA 221.A N HIS 217.A O no hydrogen 3.027 N/A PHE 222.A N LYS 218.A O no hydrogen 3.119 N/A LEU 223.A N GLU 219.A O no hydrogen 2.872 N/A CYS 224.A N MET 220.A O no hydrogen 2.771 N/A CYS 224.A SG MET 220.A O no hydrogen 3.265 N/A ARG 225.A N ALA 221.A O no hydrogen 3.011 N/A ARG 225.A NH1 ASP 163.A OD2 no hydrogen 2.869 N/A ARG 225.A NH1 GLU 197.A OE1 no hydrogen 2.921 N/A ARG 225.A NH1 GLU 197.A OE2 no hydrogen 3.493 N/A ARG 225.A NH2 GLU 197.A OE2 no hydrogen 2.919 N/A ASP 226.A N PHE 222.A O no hydrogen 3.029 N/A ILE 227.A N LEU 223.A O no hydrogen 2.959 N/A ALA 228.A N CYS 224.A O no hydrogen 2.945 N/A ARG 229.A N ARG 225.A O no hydrogen 3.063 N/A ARG 229.A N ASP 226.A O no hydrogen 3.352 N/A LEU 230.A N GLN 128.A OE1 no hydrogen 2.983 N/A GLN 231.A N ASP 101.A OD1 no hydrogen 2.815 N/A LEU 234.A N THR 105.A OG1 no hydrogen 3.358 N/A ASN 239.A N GLN 242.A OE1 no hydrogen 2.870 N/A GLN 242.A N ASN 239.A O no hydrogen 3.165 N/A GLN 242.A N ASN 239.A OD1 no hydrogen 3.022 N/A LEU 243.A N LEU 240.A O no hydrogen 2.814 N/A ARG 244.A N GLN 241.A O no hydrogen 3.355 N/A LEU 245.A N THR 42.A O no hydrogen 2.881 N/A