Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zgg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG LEU 5.A O no hydrogen 2.758 N/A THR 17.A N LYS 14.A O no hydrogen 3.120 N/A ARG 20.A NE ASP 22.A OD1 no hydrogen 2.899 N/A ARG 20.A NH1 GLU 36.A O no hydrogen 2.965 N/A ARG 20.A NH2 ASP 22.A OD1 no hydrogen 3.326 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 2.836 N/A ARG 20.A NH2 VAL 264.A O no hydrogen 3.005 N/A ASP 22.A N ASP 22.A OD1 no hydrogen 2.543 N/A THR 27.A N ALA 31.A O no hydrogen 2.738 N/A THR 27.A OG1 ALA 31.A O no hydrogen 3.535 N/A TRP 29.A N THR 27.A OG1 no hydrogen 3.125 N/A TRP 29.A NE1 PRO 244.A O no hydrogen 2.728 N/A LEU 30.A N THR 27.A O no hydrogen 2.912 N/A ALA 31.A N THR 27.A OG1 no hydrogen 3.039 N/A ILE 33.A N VAL 25.A O no hydrogen 2.881 N/A VAL 34.A N VAL 247.A O no hydrogen 2.863 N/A TRP 35.A NE1 LEU 24.A O no hydrogen 3.041 N/A GLU 36.A N GLU 251.A OE1 no hydrogen 3.186 N/A GLU 36.A N GLU 251.A OE2 no hydrogen 2.798 N/A THR 38.A N TRP 35.A O no hydrogen 3.027 N/A THR 38.A OG1 TRP 35.A O no hydrogen 2.697 N/A ASP 42.A N ASN 40.A OD1 no hydrogen 2.823 N/A ILE 43.A N ASN 40.A OD1 no hydrogen 3.328 N/A LEU 44.A N ASN 40.A O no hydrogen 3.319 N/A ASN 45.A N ILE 41.A O no hydrogen 2.891 N/A GLU 46.A N ASP 42.A O no hydrogen 3.126 N/A GLN 47.A N ILE 43.A O no hydrogen 3.051 N/A PHE 48.A N LEU 44.A O no hydrogen 2.880 N/A ARG 49.A N ASN 45.A O no hydrogen 2.833 N/A ARG 49.A NH1 ASN 52.A OD1 no hydrogen 3.119 N/A LEU 50.A N GLU 46.A O no hydrogen 2.960 N/A GLN 51.A N PHE 48.A O no hydrogen 3.134 N/A ASN 52.A N ARG 49.A O no hydrogen 2.886 N/A THR 53.A N PHE 48.A O no hydrogen 3.344 N/A THR 53.A OG1 PHE 48.A O no hydrogen 2.808 N/A THR 54.A N ASP 134.A OD2 no hydrogen 2.806 N/A ILE 55.A N ARG 85.A O no hydrogen 2.880 N/A GLY 56.A N TYR 135.A O no hydrogen 2.886 N/A LEU 57.A N HIS 87.A O no hydrogen 2.915 N/A THR 58.A N VAL 137.A O no hydrogen 2.781 N/A VAL 59.A N TYR 89.A O no hydrogen 3.079 N/A ALA 61.A N PHE 91.A O no hydrogen 2.775 N/A LYS 63.A N ASP 93.A OD1 no hydrogen 3.106 N/A TYR 65.A N ILE 62.A O no hydrogen 3.242 N/A VAL 66.A N LYS 63.A O no hydrogen 3.533 N/A ALA 67.A N LYS 64.A O no hydrogen 3.198 N/A PHE 68.A N TYR 65.A O no hydrogen 3.135 N/A LEU 69.A N VAL 66.A O no hydrogen 3.110 N/A LYS 70.A NZ GLU 74.A OE2 no hydrogen 2.727 N/A PHE 72.A N PHE 68.A O no hydrogen 3.218 N/A LEU 73.A N LEU 69.A O no hydrogen 2.875 N/A GLU 74.A N LYS 70.A O no hydrogen 2.940 N/A THR 75.A N LEU 71.A O no hydrogen 3.018 N/A THR 75.A OG1 LEU 71.A O no hydrogen 2.805 N/A THR 75.A OG1 PHE 72.A O no hydrogen 3.170 N/A ALA 76.A N PHE 72.A O no hydrogen 2.923 N/A GLU 77.A N LEU 73.A O no hydrogen 2.849 N/A LYS 78.A N THR 75.A O no hydrogen 3.178 N/A HIS 79.A N THR 75.A O no hydrogen 3.015 N/A HIS 79.A N ALA 76.A O no hydrogen 3.236 N/A PHE 80.A N ALA 76.A O no hydrogen 2.779 N/A MET 81.A N VAL 149.A O no hydrogen 2.916 N/A HIS 84.A N MET 81.A O no hydrogen 2.996 N/A VAL 86.A N GLY 106.A O no hydrogen 3.199 N/A HIS 87.A N ILE 55.A O no hydrogen 2.919 N/A HIS 87.A NE2 SER 110.A OG no hydrogen 2.669 N/A TYR 88.A N GLN 108.A O no hydrogen 2.875 N/A TYR 88.A OH GLU 77.A OE2 no hydrogen 2.753 N/A TYR 89.A N LEU 57.A O no hydrogen 2.865 N/A TYR 89.A OH GLU 132.A OE1 no hydrogen 2.679 N/A VAL 90.A N SER 110.A O no hydrogen 2.903 N/A PHE 91.A N VAL 59.A O no hydrogen 2.826 N/A THR 92.A N LEU 112.A O no hydrogen 2.969 N/A THR 92.A OG1 ALA 61.A O no hydrogen 2.736 N/A THR 92.A OG1 ASP 93.A OD1 no hydrogen 3.528 N/A GLN 94.A N THR 92.A OG1 no hydrogen 2.974 N/A GLN 94.A NE2 LYS 63.A O no hydrogen 2.734 N/A GLN 94.A NE2 ASP 93.A OD1 no hydrogen 3.155 N/A ALA 97.A N GLN 94.A O no hydrogen 2.937 N/A VAL 98.A N PRO 95.A O no hydrogen 3.271 N/A GLY 104.A N GLU 77.A OE1 no hydrogen 2.758 N/A ARG 107.A NE GLU 77.A OE2 no hydrogen 2.749 N/A ARG 107.A NH1 PHE 80.A O no hydrogen 2.912 N/A ARG 107.A NH1 MET 81.A O no hydrogen 3.358 N/A ARG 107.A NH2 GLU 77.A OE2 no hydrogen 3.527 N/A ARG 107.A NH2 PHE 80.A O no hydrogen 2.853 N/A ARG 107.A NH2 TYR 88.A OH no hydrogen 2.909 N/A GLN 108.A N VAL 86.A O no hydrogen 2.942 N/A SER 110.A N TYR 88.A O no hydrogen 2.857 N/A SER 110.A OG HIS 87.A NE2 no hydrogen 2.669 N/A LEU 112.A N VAL 90.A O no hydrogen 2.854 N/A VAL 114.A N THR 92.A O no hydrogen 2.854 N/A SER 117.A OG ASP 231.A OD1 no hydrogen 2.797 N/A SER 117.A OG ASP 231.A OD2 no hydrogen 3.308 N/A ARG 119.A N ASP 115.A O no hydrogen 2.913 N/A ARG 119.A NH1 GLU 122.A OE1 no hydrogen 2.755 N/A ARG 120.A N SER 117.A O no hydrogen 3.441 N/A ARG 120.A NE SER 117.A O no hydrogen 3.138 N/A ARG 120.A NH1 ASP 140.A OD1 no hydrogen 2.760 N/A ARG 120.A NH2 ASP 140.A OD1 no hydrogen 3.236 N/A ARG 120.A NH2 ASP 231.A OD2 no hydrogen 3.076 N/A MET 121.A N MET 118.A O no hydrogen 3.351 N/A MET 123.A N ARG 119.A O no hydrogen 3.146 N/A ILE 124.A N ARG 120.A O no hydrogen 2.866 N/A SER 125.A N MET 121.A O no hydrogen 2.964 N/A ASP 126.A N GLU 122.A O no hydrogen 3.071 N/A PHE 127.A N MET 123.A O no hydrogen 3.143 N/A CYS 128.A N ILE 124.A O no hydrogen 3.066 N/A CYS 128.A N SER 125.A O no hydrogen 3.074 N/A CYS 128.A SG ILE 124.A O no hydrogen 3.282 N/A GLU 132.A N PHE 129.A O no hydrogen 3.124 N/A VAL 133.A N PHE 129.A O no hydrogen 3.072 N/A ASP 134.A N THR 54.A O no hydrogen 2.788 N/A TYR 135.A N THR 54.A O no hydrogen 3.297 N/A LEU 136.A N GLY 201.A O no hydrogen 2.836 N/A VAL 137.A N GLY 56.A O no hydrogen 2.916 N/A CYS 138.A N PHE 199.A O no hydrogen 2.808 N/A CYS 138.A SG THR 58.A OG1 no hydrogen 3.396 N/A VAL 139.A N THR 58.A O no hydrogen 3.169 N/A ASP 140.A N ALA 197.A O no hydrogen 3.078 N/A MET 143.A N VAL 141.A O no hydrogen 2.797 N/A GLU 144.A N THR 271.A O no hydrogen 2.919 N/A PHE 145.A N THR 75.A OG1 no hydrogen 2.928 N/A ARG 146.A N ARG 269.A O no hydrogen 2.748 N/A ARG 146.A NH1 GLN 256.A OE1 no hydrogen 2.507 N/A ARG 146.A NH2 GLN 256.A OE1 no hydrogen 3.442 N/A ASP 147.A N ARG 269.A O no hydrogen 3.280 N/A HIS 148.A N ASP 147.A OD1 no hydrogen 2.717 N/A HIS 148.A NE2 GLU 152.A OE1 no hydrogen 2.787 N/A VAL 149.A N HIS 79.A O no hydrogen 3.020 N/A GLY 150.A N GLU 152.A OE2 no hydrogen 2.874 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.910 N/A ILE 153.A N GLY 150.A O no hydrogen 3.156 N/A LEU 154.A N VAL 151.A O no hydrogen 3.021 N/A THR 155.A OG1 THR 245.A OG1 no hydrogen 2.645 N/A LEU 157.A N THR 245.A OG1 no hydrogen 3.058 N/A PHE 158.A N GLY 200.A O no hydrogen 2.837 N/A THR 160.A OG1 PHE 198.A O no hydrogen 2.842 N/A LEU 161.A N LEU 248.A O no hydrogen 2.915 N/A HIS 162.A N TYR 193.A O no hydrogen 2.905 N/A PHE 165.A N HIS 162.A O no hydrogen 3.333 N/A SER 168.A N PHE 165.A O no hydrogen 2.947 N/A ARG 170.A NE GLY 190.A O no hydrogen 2.973 N/A ARG 170.A NH2 GLY 190.A O no hydrogen 2.939 N/A ALA 172.A N SER 169.A O no hydrogen 2.925 N/A PHE 173.A N ARG 170.A O no hydrogen 3.093 N/A THR 174.A OG1 TYR 193.A OH no hydrogen 3.265 N/A TYR 175.A OH PHE 192.A O no hydrogen 2.580 N/A ARG 177.A NH1 ILE 185.A O no hydrogen 2.813 N/A ARG 177.A NH2 ARG 170.A O no hydrogen 2.873 N/A ARG 177.A NH2 PHE 173.A O no hydrogen 3.038 N/A ARG 178.A N GLU 176.A OE2 no hydrogen 2.722 N/A ARG 178.A NE GLU 176.A OE2 no hydrogen 2.808 N/A ARG 178.A NH2 GLU 176.A OE1 no hydrogen 3.053 N/A ARG 178.A NH2 GLU 226.A O no hydrogen 2.752 N/A SER 181.A N ARG 178.A O no hydrogen 3.030 N/A SER 181.A OG ASP 220.A OD2 no hydrogen 2.624 N/A GLN 182.A N ASP 220.A OD1 no hydrogen 2.816 N/A ALA 183.A N SER 181.A OG no hydrogen 3.115 N/A TYR 184.A N SER 181.A O no hydrogen 3.051 N/A ILE 185.A N GLU 176.A O no hydrogen 2.934 N/A LYS 187.A NZ GLU 171.A O no hydrogen 2.971 N/A GLU 189.A N PRO 186.A O no hydrogen 3.126 N/A TYR 193.A OH GLU 232.A OE2 no hydrogen 2.592 N/A TYR 194.A N ASN 236.A OD1 no hydrogen 2.828 N/A GLY 195.A N THR 160.A O no hydrogen 2.876 N/A GLY 196.A N GLU 232.A OE1 no hydrogen 2.904 N/A PHE 199.A N CYS 138.A O no hydrogen 3.130 N/A GLY 200.A N PHE 158.A O no hydrogen 3.099 N/A GLY 201.A N LEU 136.A O no hydrogen 3.011 N/A SER 202.A N PRO 156.A O no hydrogen 2.930 N/A GLU 205.A N SER 202.A OG no hydrogen 3.231 N/A VAL 206.A N SER 202.A O no hydrogen 2.930 N/A GLN 207.A N VAL 203.A O no hydrogen 2.789 N/A ARG 208.A N GLN 204.A O no hydrogen 3.058 N/A LEU 209.A N GLU 205.A O no hydrogen 2.873 N/A THR 210.A N VAL 206.A O no hydrogen 2.830 N/A THR 210.A OG1 VAL 206.A O no hydrogen 2.920 N/A THR 210.A OG1 GLN 207.A O no hydrogen 3.133 N/A ARG 211.A N GLN 207.A O no hydrogen 2.889 N/A ALA 212.A N ARG 208.A O no hydrogen 2.939 N/A CYS 213.A N LEU 209.A O no hydrogen 2.991 N/A CYS 213.A SG LEU 209.A O no hydrogen 3.408 N/A HIS 214.A N THR 210.A O no hydrogen 2.949 N/A GLN 215.A N ARG 211.A O no hydrogen 2.882 N/A ALA 216.A N ALA 212.A O no hydrogen 2.905 N/A MET 217.A N CYS 213.A O no hydrogen 2.868 N/A MET 218.A N HIS 214.A O no hydrogen 2.962 N/A VAL 219.A N GLN 215.A O no hydrogen 3.096 N/A ASP 220.A N ALA 216.A O no hydrogen 3.064 N/A GLN 221.A N MET 217.A O no hydrogen 2.866 N/A ALA 222.A N MET 218.A O no hydrogen 2.886 N/A ASN 223.A N VAL 219.A O no hydrogen 2.878 N/A GLY 224.A N GLN 221.A O no hydrogen 2.928 N/A ILE 225.A N ASP 220.A O no hydrogen 2.914 N/A VAL 228.A N GLU 176.A OE1 no hydrogen 2.977 N/A TRP 229.A N SER 233.A OG no hydrogen 2.913 N/A HIS 230.A N ALA 227.A O no hydrogen 2.895 N/A HIS 230.A ND1 GLU 226.A OE2 no hydrogen 2.485 N/A SER 233.A N TRP 229.A O no hydrogen 3.447 N/A SER 233.A N HIS 230.A O no hydrogen 3.055 N/A HIS 234.A N HIS 230.A O no hydrogen 3.361 N/A LEU 235.A N ASP 231.A O no hydrogen 2.748 N/A ASN 236.A N GLU 232.A O no hydrogen 3.044 N/A ASN 236.A ND2 TYR 194.A O no hydrogen 2.803 N/A ASN 236.A ND2 GLU 232.A O no hydrogen 2.924 N/A LYS 237.A N SER 233.A O no hydrogen 3.103 N/A LYS 237.A NZ GLN 182.A O no hydrogen 2.942 N/A LYS 237.A NZ TYR 184.A O no hydrogen 2.828 N/A TYR 238.A N HIS 234.A O no hydrogen 2.924 N/A LEU 239.A N LEU 235.A O no hydrogen 2.972 N/A LEU 240.A N ASN 236.A O no hydrogen 3.074 N/A ARG 241.A N LYS 237.A O no hydrogen 3.278 N/A HIS 242.A N TYR 238.A O no hydrogen 2.822 N/A HIS 242.A ND1 TYR 238.A O no hydrogen 3.028 N/A LYS 243.A NZ ASP 191.A OD2 no hydrogen 2.744 N/A LYS 243.A NZ LEU 240.A O no hydrogen 2.890 N/A THR 245.A N LEU 157.A O no hydrogen 2.772 N/A THR 245.A OG1 THR 155.A OG1 no hydrogen 2.645 N/A THR 245.A OG1 LEU 157.A O no hydrogen 3.091 N/A LYS 246.A N LEU 157.A O no hydrogen 3.368 N/A LYS 246.A NZ GLU 152.A O no hydrogen 2.780 N/A LYS 246.A NZ LEU 154.A O no hydrogen 2.709 N/A VAL 247.A N PRO 32.A O no hydrogen 2.874 N/A LEU 248.A N GLY 159.A O no hydrogen 2.828 N/A SER 249.A N VAL 34.A O no hydrogen 3.162 N/A SER 249.A OG VAL 34.A O no hydrogen 2.877 N/A GLU 251.A N SER 249.A OG no hydrogen 3.361 N/A TYR 252.A N SER 249.A O no hydrogen 2.993 N/A TYR 252.A OH GLU 152.A OE2 no hydrogen 2.709 N/A LEU 253.A N PRO 250.A O no hydrogen 3.103 N/A TRP 254.A N PHE 270.A O no hydrogen 3.015 N/A TRP 254.A NE1 GLY 260.A O no hydrogen 2.769 N/A LEU 258.A N ASP 255.A OD1 no hydrogen 3.268 N/A LEU 259.A N ASP 255.A O no hydrogen 2.915 N/A GLY 260.A N GLN 256.A O no hydrogen 2.829 N/A TRP 261.A NE1 LEU 265.A O no hydrogen 2.764 N/A LEU 265.A N PRO 262.A O no hydrogen 3.085 N/A ARG 269.A N GLU 251.A O no hydrogen 2.912 N/A ARG 269.A NE GLU 251.A OE1 no hydrogen 2.879 N/A ARG 269.A NH1 HIS 148.A O no hydrogen 2.866 N/A ARG 269.A NH2 GLU 36.A OE1 no hydrogen 2.841 N/A ARG 269.A NH2 GLU 251.A OE1 no hydrogen 2.876 N/A THR 271.A N GLU 144.A O no hydrogen 2.894 N/A THR 271.A OG1 ALA 272.A O no hydrogen 3.381 N/A ALA 272.A N TRP 254.A O no hydrogen 2.844 N/A