Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j3a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N GLN 280.A OE1 no hydrogen 3.180 N/A LYS 3.A NZ GLU 269.A OE1 no hydrogen 2.990 N/A PHE 6.A N SER 94.A OG no hydrogen 2.836 N/A SER 8.A OG GLU 12.A OE1 no hydrogen 2.678 N/A LYS 10.A NZ ASP 136.A OD1 no hydrogen 3.036 N/A VAL 11.A N SER 8.A O no hydrogen 2.917 N/A GLU 12.A N SER 8.A O no hydrogen 2.812 N/A GLY 13.A N GLY 9.A O no hydrogen 3.322 N/A CYS 14.A N VAL 11.A O no hydrogen 2.947 N/A CYS 14.A SG LYS 10.A O no hydrogen 3.453 N/A MET 15.A N GLU 12.A O no hydrogen 3.243 N/A VAL 16.A N GLY 27.A O no hydrogen 2.966 N/A GLN 17.A N GLN 50.A O no hydrogen 2.873 N/A GLN 17.A NE2 GLY 52.A O no hydrogen 3.329 N/A VAL 18.A N LEU 25.A O no hydrogen 2.894 N/A THR 19.A N LEU 48.A O no hydrogen 2.895 N/A THR 19.A OG1 THR 24.A OG1 no hydrogen 2.499 N/A CYS 20.A N THR 23.A O no hydrogen 2.829 N/A CYS 20.A SG ASN 46.A O no hydrogen 3.741 N/A THR 23.A N CYS 20.A O no hydrogen 2.968 N/A THR 23.A OG1 CYS 20.A O no hydrogen 3.484 N/A THR 23.A OG1 CYS 42.A O no hydrogen 2.952 N/A THR 24.A OG1 THR 19.A OG1 no hydrogen 2.499 N/A LEU 25.A N VAL 18.A O no hydrogen 2.897 N/A ASN 26.A N CYS 126.A O no hydrogen 2.990 N/A ASN 26.A ND2 CYS 98.A O no hydrogen 2.897 N/A ASN 26.A ND2 GLY 124.A O no hydrogen 3.234 N/A ASN 26.A ND2 CYS 126.A O no hydrogen 2.951 N/A GLY 27.A N VAL 16.A O no hydrogen 2.814 N/A LEU 28.A N TYR 35.A O no hydrogen 2.806 N/A TRP 29.A N CYS 14.A O no hydrogen 2.733 N/A TRP 29.A NE1 THR 74.A O no hydrogen 2.996 N/A LEU 30.A N VAL 33.A O no hydrogen 2.955 N/A ASP 31.A N THR 79.A OG1 no hydrogen 2.812 N/A VAL 33.A N LEU 30.A O no hydrogen 3.123 N/A VAL 34.A N LEU 70.A O no hydrogen 2.797 N/A TYR 35.A N LEU 28.A O no hydrogen 2.825 N/A CYS 36.A N LEU 68.A O no hydrogen 3.065 N/A CYS 36.A SG PRO 37.A O no hydrogen 3.747 N/A ARG 38.A N CYS 66.A O no hydrogen 2.982 N/A ARG 38.A NE ASP 168.A OD2 no hydrogen 2.785 N/A ARG 38.A NH2 ASP 168.A OD1 no hydrogen 2.889 N/A VAL 40.A N PRO 37.A O no hydrogen 3.305 N/A ILE 41.A N ARG 38.A O no hydrogen 3.350 N/A CYS 42.A N HIS 39.A O no hydrogen 3.031 N/A CYS 42.A SG HIS 39.A O no hydrogen 3.506 N/A ASN 46.A N SER 43.A O no hydrogen 2.898 N/A PHE 47.A N ASN 44.A O no hydrogen 3.321 N/A LEU 48.A N THR 19.A O no hydrogen 2.972 N/A GLN 50.A N GLN 17.A O no hydrogen 2.870 N/A ALA 51.A N VAL 54.A O no hydrogen 2.785 N/A VAL 54.A N ALA 51.A O no hydrogen 2.946 N/A LEU 56.A N VAL 49.A O no hydrogen 2.728 N/A ILE 59.A N LYS 71.A O no hydrogen 2.668 N/A GLY 60.A N LYS 71.A O no hydrogen 3.331 N/A HIS 61.A ND1 ASN 44.A OD1 no hydrogen 2.933 N/A SER 62.A N LYS 69.A O no hydrogen 3.067 N/A GLN 64.A N VAL 67.A O no hydrogen 2.926 N/A ASN 65.A ND2 GLU 159.A O no hydrogen 2.618 N/A CYS 66.A N GLY 160.A O no hydrogen 2.929 N/A CYS 66.A SG ASP 168.A OD1 no hydrogen 3.707 N/A CYS 66.A SG ASP 168.A OD2 no hydrogen 3.864 N/A VAL 67.A N GLN 64.A O no hydrogen 2.969 N/A LEU 68.A N CYS 36.A O no hydrogen 2.756 N/A LYS 69.A N SER 62.A O no hydrogen 2.863 N/A LYS 69.A NZ GLN 64.A OE1 no hydrogen 3.142 N/A LEU 70.A N VAL 34.A O no hydrogen 2.795 N/A LYS 71.A N GLY 60.A O no hydrogen 2.751 N/A VAL 72.A N ASP 32.A O no hydrogen 2.953 N/A ASP 73.A N ARG 57.A O no hydrogen 3.111 N/A THR 74.A OG1 ASP 73.A OD1 no hydrogen 3.053 N/A ASN 76.A N ASP 31.A O no hydrogen 2.833 N/A ASN 76.A ND2 GLY 13.A O no hydrogen 3.056 N/A ASN 76.A ND2 TRP 29.A O no hydrogen 2.846 N/A LYS 78.A N ASN 76.A OD1 no hydrogen 2.875 N/A THR 79.A N ASN 76.A O no hydrogen 3.059 N/A THR 79.A OG1 ASN 76.A O no hydrogen 2.645 N/A LYS 83.A N VAL 138.A O no hydrogen 2.962 N/A VAL 85.A N PHE 140.A O no hydrogen 3.094 N/A ARG 86.A NH1 ASP 157.A OD2 no hydrogen 3.146 N/A ARG 86.A NH1 ASN 161.A O no hydrogen 3.043 N/A ARG 86.A NH1 PHE 162.A O no hydrogen 3.420 N/A ARG 86.A NH2 PHE 162.A O no hydrogen 2.720 N/A ILE 87.A N TYR 163.A OH no hydrogen 3.146 N/A GLN 88.A N GLN 91.A OE1 no hydrogen 2.601 N/A GLY 90.A N MET 111.A O no hydrogen 2.675 N/A GLN 91.A N GLN 88.A O no hydrogen 3.020 N/A THR 92.A OG1 ASP 276.A OD2 no hydrogen 2.902 N/A PHE 93.A N CYS 109.A O no hydrogen 2.999 N/A SER 94.A N PHE 131.A O no hydrogen 2.837 N/A SER 94.A OG GLN 108.A OE1 no hydrogen 2.722 N/A VAL 95.A N TYR 107.A O no hydrogen 2.783 N/A LEU 96.A N VAL 129.A O no hydrogen 3.264 N/A ALA 97.A N GLY 105.A O no hydrogen 2.852 N/A CYS 98.A N SER 128.A OG no hydrogen 2.904 N/A CYS 98.A SG LEU 96.A O no hydrogen 3.578 N/A TYR 99.A N SER 102.A O no hydrogen 2.984 N/A GLY 101.A N ASN 26.A OD1 no hydrogen 2.765 N/A SER 102.A N TYR 99.A O no hydrogen 2.913 N/A SER 104.A N ALA 97.A O no hydrogen 2.634 N/A GLY 105.A N ALA 97.A O no hydrogen 3.387 N/A TYR 107.A N VAL 95.A O no hydrogen 3.110 N/A TYR 107.A OH SER 120.A O no hydrogen 3.056 N/A CYS 109.A N PHE 93.A O no hydrogen 2.805 N/A CYS 109.A SG LYS 118.A O no hydrogen 3.814 N/A MET 111.A N GLN 91.A O no hydrogen 3.031 N/A ARG 112.A N THR 116.A O no hydrogen 2.827 N/A ARG 112.A NE ASP 178.A OD2 no hydrogen 2.801 N/A ARG 112.A NH1 ASP 270.A OD1 no hydrogen 3.116 N/A ARG 112.A NH1 ASP 270.A OD2 no hydrogen 3.386 N/A ARG 112.A NH1 GLU 271.A OE2 no hydrogen 2.892 N/A ARG 112.A NH2 ASP 178.A OD2 no hydrogen 3.510 N/A ARG 112.A NH2 THR 179.A O no hydrogen 3.146 N/A ARG 112.A NH2 ASP 270.A OD2 no hydrogen 2.755 N/A ASN 114.A ND2 GLY 176.A O no hydrogen 2.731 N/A PHE 115.A N ARG 112.A O no hydrogen 2.851 N/A THR 116.A N ASN 114.A OD1 no hydrogen 3.278 N/A THR 116.A OG1 ASN 114.A OD1 no hydrogen 2.961 N/A ILE 117.A N HIS 153.A O no hydrogen 2.925 N/A GLY 119.A N HIS 153.A ND1 no hydrogen 3.145 N/A SER 120.A N TYR 107.A OH no hydrogen 2.911 N/A LEU 122.A N TYR 99.A OH no hydrogen 2.760 N/A SER 125.A N LEU 122.A O no hydrogen 3.204 N/A SER 125.A OG LEU 122.A O no hydrogen 2.653 N/A CYS 126.A SG HIS 39.A NE2 no hydrogen 3.762 N/A CYS 126.A SG HIS 144.A O no hydrogen 3.696 N/A CYS 126.A SG HIS 145.A O no hydrogen 3.030 N/A GLY 127.A N HIS 144.A O no hydrogen 3.011 N/A SER 128.A N SER 125.A O no hydrogen 3.105 N/A SER 128.A OG SER 125.A O no hydrogen 2.869 N/A GLY 130.A N TYR 142.A O no hydrogen 2.812 N/A PHE 131.A N SER 94.A O no hydrogen 2.812 N/A ASN 132.A N SER 139.A O no hydrogen 2.945 N/A ASN 132.A ND2 THR 92.A O no hydrogen 3.115 N/A ASP 134.A N CYS 137.A O no hydrogen 2.924 N/A CYS 137.A N ASP 134.A O no hydrogen 2.935 N/A VAL 138.A N LYS 81.A O no hydrogen 2.942 N/A SER 139.A N ASN 132.A O no hydrogen 2.716 N/A PHE 140.A N LYS 83.A O no hydrogen 2.888 N/A CYS 141.A N GLY 130.A O no hydrogen 2.924 N/A TYR 142.A N GLY 130.A O no hydrogen 3.288 N/A TYR 142.A OH HIS 144.A ND1 no hydrogen 2.742 N/A MET 143.A N THR 156.A O no hydrogen 2.800 N/A HIS 144.A N SER 128.A O no hydrogen 2.872 N/A HIS 144.A ND1 TYR 142.A OH no hydrogen 2.742 N/A HIS 145.A N ALA 154.A O no hydrogen 3.155 N/A HIS 145.A ND1 MET 143.A O no hydrogen 3.041 N/A MET 146.A N ALA 154.A O no hydrogen 2.901 N/A LEU 148.A N VAL 152.A O no hydrogen 2.849 N/A GLY 151.A N LEU 148.A O no hydrogen 2.815 N/A HIS 153.A N ILE 117.A O no hydrogen 2.839 N/A HIS 153.A NE2 GLU 147.A OE2 no hydrogen 2.885 N/A ALA 154.A N MET 146.A O no hydrogen 2.858 N/A THR 156.A N MET 143.A O no hydrogen 3.042 N/A THR 156.A OG1 ASP 157.A O no hydrogen 2.787 N/A ASP 157.A N ASN 161.A O no hydrogen 2.963 N/A GLU 159.A N ASP 157.A OD1 no hydrogen 2.941 N/A GLY 160.A N ASP 157.A O no hydrogen 2.985 N/A ASN 161.A N ASP 157.A OD1 no hydrogen 3.018 N/A TYR 163.A N GLY 155.A O no hydrogen 2.957 N/A TYR 163.A OH CYS 141.A O no hydrogen 2.620 N/A VAL 167.A N GLN 173.A OE1 no hydrogen 2.989 N/A ARG 169.A N VAL 167.A O no hydrogen 2.989 N/A GLN 173.A NE2 VAL 167.A O no hydrogen 3.132 N/A GLN 173.A NE2 THR 171.A O no hydrogen 3.266 N/A THR 179.A OG1 GLU 221.A OE1 no hydrogen 2.655 N/A THR 180.A N ASN 219.A O no hydrogen 2.959 N/A ILE 181.A N ASP 270.A OD2 no hydrogen 2.933 N/A THR 182.A OG1 GLU 221.A O no hydrogen 2.339 N/A ASN 184.A ND2 GLY 90.A O no hydrogen 2.990 N/A ASN 184.A ND2 ASP 270.A O no hydrogen 2.854 N/A VAL 185.A N ILE 181.A O no hydrogen 3.114 N/A LEU 186.A N THR 182.A O no hydrogen 2.935 N/A ALA 187.A N VAL 183.A O no hydrogen 2.996 N/A TRP 188.A N ASN 184.A O no hydrogen 2.979 N/A LEU 189.A N VAL 185.A O no hydrogen 2.876 N/A TYR 190.A N LEU 186.A O no hydrogen 2.897 N/A TYR 190.A OH ILE 240.A O no hydrogen 2.826 N/A ALA 191.A N ALA 187.A O no hydrogen 2.916 N/A ALA 192.A N TRP 188.A O no hydrogen 2.967 N/A VAL 193.A N LEU 189.A O no hydrogen 2.989 N/A ILE 194.A N TYR 190.A O no hydrogen 2.799 N/A ASN 195.A N ALA 191.A O no hydrogen 3.179 N/A ASN 195.A N ALA 192.A O no hydrogen 2.987 N/A ASN 195.A ND2 ALA 191.A O no hydrogen 2.721 N/A GLY 196.A N VAL 193.A O no hydrogen 2.930 N/A ASP 197.A N ALA 192.A O no hydrogen 2.947 N/A TRP 199.A NE1 THR 261.A O no hydrogen 3.060 N/A LEU 201.A N ARG 198.A O no hydrogen 3.134 N/A ASN 202.A N SER 248.A OG no hydrogen 3.410 N/A ASN 202.A ND2 ALA 247.A O no hydrogen 3.365 N/A PHE 204.A N ASN 202.A OD1 no hydrogen 2.922 N/A THR 205.A OG1 ASP 244.A OD1 no hydrogen 2.791 N/A THR 206.A N THR 205.A OG1 no hydrogen 2.820 N/A THR 206.A OG1 THR 207.A O no hydrogen 2.929 N/A ASP 210.A N THR 207.A OG1 no hydrogen 3.114 N/A PHE 211.A N THR 207.A O no hydrogen 3.059 N/A ASN 212.A N LEU 208.A O no hydrogen 2.857 N/A ASN 212.A ND2 LEU 223.A O no hydrogen 2.972 N/A LEU 213.A N ASN 209.A O no hydrogen 3.027 N/A VAL 214.A N ASP 210.A O no hydrogen 3.240 N/A ALA 215.A N PHE 211.A O no hydrogen 2.743 N/A MET 216.A N ASN 212.A O no hydrogen 3.053 N/A LYS 217.A N VAL 214.A O no hydrogen 3.002 N/A TYR 218.A N ALA 215.A O no hydrogen 2.873 N/A ASN 219.A N MET 216.A O no hydrogen 3.280 N/A ASN 219.A ND2 ASP 178.A O no hydrogen 2.534 N/A TYR 220.A N ALA 215.A O no hydrogen 2.935 N/A GLU 221.A N THR 180.A O no hydrogen 2.811 N/A LEU 223.A N ASN 212.A OD1 no hydrogen 2.792 N/A THR 224.A N HIS 227.A ND1 no hydrogen 3.185 N/A GLN 225.A NE2 ASP 229.A OD1 no hydrogen 3.133 N/A HIS 227.A N THR 224.A OG1 no hydrogen 3.062 N/A VAL 228.A N THR 224.A O no hydrogen 3.097 N/A ASP 229.A N GLN 225.A O no hydrogen 2.920 N/A ILE 230.A N ASP 226.A O no hydrogen 2.983 N/A LEU 231.A N HIS 227.A O no hydrogen 3.183 N/A GLY 232.A N ASP 229.A O no hydrogen 2.895 N/A SER 235.A N LEU 231.A O no hydrogen 2.990 N/A SER 235.A OG ILE 240.A O no hydrogen 2.515 N/A ALA 236.A N GLY 232.A O no hydrogen 2.902 N/A GLN 237.A N PRO 233.A O no hydrogen 2.983 N/A THR 238.A N LEU 234.A O no hydrogen 3.095 N/A THR 238.A OG1 LEU 234.A O no hydrogen 2.930 N/A THR 238.A OG1 SER 235.A O no hydrogen 3.500 N/A GLY 239.A N SER 235.A O no hydrogen 2.795 N/A ILE 240.A N THR 238.A OG1 no hydrogen 3.279 N/A MET 245.A N ALA 241.A O no hydrogen 3.036 N/A CYS 246.A N VAL 242.A O no hydrogen 2.924 N/A CYS 246.A SG VAL 242.A O no hydrogen 3.276 N/A ALA 247.A N LEU 243.A O no hydrogen 3.119 N/A SER 248.A N ASP 244.A O no hydrogen 3.108 N/A SER 248.A OG PHE 200.A O no hydrogen 3.482 N/A SER 248.A OG ASP 244.A O no hydrogen 3.301 N/A LEU 249.A N MET 245.A O no hydrogen 2.917 N/A LYS 250.A N CYS 246.A O no hydrogen 2.868 N/A GLU 251.A N ALA 247.A O no hydrogen 3.179 N/A LEU 252.A N SER 248.A O no hydrogen 3.067 N/A LEU 253.A N LEU 249.A O no hydrogen 2.799 N/A GLN 254.A N LYS 250.A O no hydrogen 2.916 N/A GLN 254.A N GLU 251.A O no hydrogen 3.097 N/A GLY 256.A N LEU 252.A O no hydrogen 2.866 N/A ARG 260.A N MET 257.A O no hydrogen 2.590 N/A ILE 262.A N SER 265.A O no hydrogen 2.843 N/A LEU 263.A N ASP 197.A OD2 no hydrogen 2.911 N/A SER 265.A N ILE 262.A O no hydrogen 3.005 N/A SER 265.A OG LEU 267.A O no hydrogen 3.130 N/A LEU 267.A N SER 265.A OG no hydrogen 3.090 N/A GLU 271.A N GLU 269.A OE1 no hydrogen 2.990 N/A THR 273.A N ASP 276.A OD2 no hydrogen 2.969 N/A ASP 276.A N THR 273.A OG1 no hydrogen 2.836 N/A VAL 277.A N THR 273.A O no hydrogen 3.031 N/A VAL 278.A N PRO 274.A O no hydrogen 3.104 N/A ARG 279.A N PHE 275.A O no hydrogen 2.556 N/A GLN 280.A N ASP 276.A O no hydrogen 2.929 N/A GLN 280.A NE2 ARG 2.A O no hydrogen 2.651 N/A CYS 281.A N VAL 277.A O no hydrogen 2.807 N/A