Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tgt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A NE1 GLU 48.A OE2 no hydrogen 2.578 N/A LYS 3.A N GLN 340.A O no hydrogen 3.053 N/A ALA 5.A N VAL 338.A O no hydrogen 3.283 N/A LEU 9.A N GLN 60.A OE1 no hydrogen 2.821 N/A PHE 10.A N CYS 102.A O no hydrogen 2.958 N/A CYS 11.A SG ALA 30.A O no hydrogen 3.155 N/A ALA 12.A N HIS 100.A O no hydrogen 2.988 N/A SER 13.A N VAL 32.A O no hydrogen 3.071 N/A ALA 15.A N SER 13.A OG no hydrogen 3.055 N/A LYS 16.A N ASN 24.A OD1 no hydrogen 2.872 N/A LYS 16.A NZ ASP 14.A O no hydrogen 3.486 N/A GLU 19.A N LYS 16.A O no hydrogen 3.234 N/A GLU 21.A N GLU 19.A OE2 no hydrogen 3.002 N/A VAL 22.A N SER 93.A O no hydrogen 2.929 N/A HIS 23.A N GLU 21.A OE2 no hydrogen 2.963 N/A HIS 23.A ND1 GLU 21.A OE2 no hydrogen 2.769 N/A ASN 24.A N GLU 21.A OE1 no hydrogen 2.758 N/A ASN 24.A ND2 GLU 21.A OE1 no hydrogen 2.725 N/A VAL 25.A N GLU 21.A O no hydrogen 3.025 N/A TRP 26.A N VAL 22.A O no hydrogen 2.910 N/A ALA 27.A N HIS 23.A O no hydrogen 2.868 N/A THR 28.A N ASN 24.A O no hydrogen 2.812 N/A THR 28.A OG1 ASN 24.A O no hydrogen 2.799 N/A HIS 29.A N VAL 25.A O no hydrogen 3.366 N/A HIS 29.A N TRP 26.A O no hydrogen 3.195 N/A ALA 30.A N TRP 26.A O no hydrogen 2.787 N/A CYS 31.A N ALA 27.A O no hydrogen 2.977 N/A VAL 32.A N CYS 11.A O no hydrogen 2.965 N/A THR 34.A OG1 ASP 14.A OD1 no hydrogen 2.732 N/A ASN 37.A N ASP 35.A OD1 no hydrogen 2.888 N/A GLN 39.A NE2 ASN 37.A O no hydrogen 3.470 N/A ILE 41.A N SER 128.A O no hydrogen 3.097 N/A LEU 43.A N VAL 126.A O no hydrogen 2.920 N/A VAL 46.A N LEU 43.A O no hydrogen 3.290 N/A GLU 48.A N CYS 123.A O no hydrogen 3.122 N/A PHE 50.A N GLY 121.A O no hydrogen 2.922 N/A MET 52.A N GLY 119.A O no hydrogen 2.705 N/A TRP 53.A N ASN 51.A OD1 no hydrogen 3.151 N/A LYS 54.A N ASN 51.A O no hydrogen 3.066 N/A MET 57.A N ASN 55.A OD1 no hydrogen 3.169 N/A VAL 58.A N ASN 55.A O no hydrogen 2.927 N/A GLN 60.A N ASN 56.A O no hydrogen 3.067 N/A GLN 60.A NE2 THR 7.A O no hydrogen 2.674 N/A GLN 60.A NE2 ASN 56.A OD1 no hydrogen 2.921 N/A MET 61.A N MET 57.A O no hydrogen 2.976 N/A GLN 62.A N VAL 58.A O no hydrogen 2.963 N/A GLU 63.A N GLU 59.A O no hydrogen 2.967 N/A ASP 64.A N GLN 60.A O no hydrogen 3.069 N/A VAL 65.A N MET 61.A O no hydrogen 2.922 N/A ILE 66.A N GLN 62.A O no hydrogen 2.934 N/A SER 67.A N GLU 63.A O no hydrogen 3.109 N/A SER 67.A OG GLN 71.A OE1 no hydrogen 3.220 N/A LEU 68.A N ASP 64.A O no hydrogen 2.782 N/A TRP 69.A N VAL 65.A O no hydrogen 2.863 N/A ASP 70.A N ILE 66.A O no hydrogen 2.788 N/A GLN 71.A N SER 67.A O no hydrogen 3.074 N/A SER 72.A N TRP 69.A O no hydrogen 3.193 N/A SER 72.A OG LEU 68.A O no hydrogen 2.626 N/A LEU 73.A N TRP 69.A O no hydrogen 2.923 N/A CYS 76.A N MET 284.A O no hydrogen 2.744 N/A CYS 76.A SG MET 284.A O no hydrogen 3.606 N/A VAL 77.A N MET 284.A O no hydrogen 3.355 N/A LYS 78.A N ILE 85.A O no hydrogen 2.899 N/A LEU 79.A N GLN 282.A O no hydrogen 2.706 N/A THR 80.A N SER 83.A O no hydrogen 3.042 N/A THR 80.A OG1 THR 280.A O no hydrogen 2.633 N/A SER 83.A N THR 80.A O no hydrogen 2.812 N/A SER 83.A OG THR 80.A O no hydrogen 2.836 N/A ILE 85.A N LYS 78.A O no hydrogen 2.918 N/A GLN 87.A N CYS 76.A O no hydrogen 3.056 N/A LYS 91.A NZ GLU 242.A OE1 no hydrogen 3.284 N/A LYS 91.A NZ GLU 242.A OE2 no hydrogen 2.957 N/A LYS 91.A NZ ALA 286.A O no hydrogen 3.167 N/A LYS 91.A NZ PRO 287.A O no hydrogen 2.833 N/A ASP 95.A N GLU 21.A OE2 no hydrogen 2.910 N/A ILE 99.A N ILE 135.A O no hydrogen 2.835 N/A HIS 100.A N ALA 12.A O no hydrogen 2.775 N/A HIS 100.A ND1 THR 132.A O no hydrogen 3.064 N/A TYR 101.A N THR 132.A OG1 no hydrogen 2.825 N/A TYR 101.A OH ASP 64.A OD2 no hydrogen 2.687 N/A CYS 102.A N PHE 10.A O no hydrogen 2.824 N/A THR 103.A N GLN 130.A O no hydrogen 2.950 N/A THR 103.A OG1 TYR 107.A O no hydrogen 3.427 N/A THR 103.A OG1 GLN 130.A O no hydrogen 3.337 N/A TYR 107.A N PRO 104.A O no hydrogen 3.155 N/A VAL 108.A N VAL 339.A O no hydrogen 3.005 N/A ILE 109.A N VAL 129.A O no hydrogen 2.990 N/A LEU 110.A N LYS 337.A O no hydrogen 2.784 N/A LYS 111.A N SER 127.A O no hydrogen 2.702 N/A CYS 112.A N LYS 335.A O no hydrogen 2.694 N/A ASN 113.A N ASN 125.A O no hydrogen 2.719 N/A ASN 113.A ND2 ASN 125.A O no hydrogen 3.314 N/A ASN 113.A ND2 SER 127.A OG no hydrogen 2.865 N/A ASN 116.A ND2 GLU 152.A OE1 no hydrogen 2.916 N/A PHE 117.A N ASP 114.A O no hydrogen 3.126 N/A THR 120.A N ASN 118.A OD1 no hydrogen 3.018 N/A GLY 121.A N PHE 50.A O no hydrogen 2.867 N/A CYS 123.A N GLU 48.A O no hydrogen 2.719 N/A CYS 123.A SG ASN 125.A O no hydrogen 3.624 N/A LYS 124.A N ASP 114.A OD2 no hydrogen 2.816 N/A LYS 124.A NZ THR 47.A OG1 no hydrogen 3.094 N/A ASN 125.A N ASP 114.A OD1 no hydrogen 2.793 N/A SER 127.A N LYS 111.A O no hydrogen 2.989 N/A SER 127.A OG GLU 40.A OE2 no hydrogen 2.716 N/A SER 128.A N ILE 41.A O no hydrogen 2.859 N/A VAL 129.A N ILE 109.A O no hydrogen 2.855 N/A THR 132.A N TYR 101.A O no hydrogen 2.702 N/A THR 132.A OG1 HIS 133.A O no hydrogen 2.831 N/A HIS 133.A N TYR 336.A OH no hydrogen 3.080 N/A HIS 133.A ND1 TYR 336.A OH no hydrogen 2.596 N/A HIS 133.A NE2 GLU 332.A OE1 no hydrogen 2.876 N/A ILE 135.A N ILE 99.A O no hydrogen 2.824 N/A VAL 138.A N LYS 136.A O no hydrogen 2.894 N/A SER 140.A OG LEU 143.A O no hydrogen 2.631 N/A THR 141.A N HIS 236.A O no hydrogen 2.953 N/A THR 141.A OG1 GLU 231.A O no hydrogen 2.680 N/A THR 141.A OG1 MET 234.A O no hydrogen 2.927 N/A GLN 142.A NE2 ILE 232.A O no hydrogen 2.766 N/A LEU 143.A N THR 141.A O no hydrogen 2.669 N/A LEU 144.A N GLY 301.A O no hydrogen 2.894 N/A ASN 146.A N ASN 298.A O no hydrogen 2.788 N/A GLY 147.A N THR 300.A OG1 no hydrogen 3.100 N/A SER 148.A N GLU 332.A OE2 no hydrogen 2.683 N/A SER 148.A OG HIS 133.A NE2 no hydrogen 3.384 N/A SER 148.A OG GLU 332.A OE1 no hydrogen 2.690 N/A ALA 150.A N LEU 172.A O no hydrogen 2.821 N/A GLU 153.A N ASN 116.A OD1 no hydrogen 3.196 N/A ILE 155.A N HIS 171.A O no hydrogen 2.988 N/A ARG 157.A N ILE 169.A O no hydrogen 2.865 N/A ARG 157.A NH1 PHE 117.A O no hydrogen 2.827 N/A ARG 157.A NH2 HIS 171.A ND1 no hydrogen 2.983 N/A ASN 160.A N SER 158.A OG no hydrogen 3.003 N/A THR 162.A N ASN 160.A OD1 no hydrogen 3.145 N/A ASN 163.A N ASN 160.A O no hydrogen 2.928 N/A ALA 165.A N ASN 163.A OD1 no hydrogen 2.888 N/A LYS 166.A N ASN 163.A O no hydrogen 3.055 N/A LYS 166.A NZ GLU 159.A OE1 no hydrogen 3.284 N/A ILE 168.A N LEU 304.A O no hydrogen 2.827 N/A ILE 169.A N ARG 157.A O no hydrogen 2.894 N/A VAL 170.A N ILE 302.A O no hydrogen 2.761 N/A HIS 171.A N ILE 155.A O no hydrogen 2.727 N/A HIS 171.A NE2 SER 148.A O no hydrogen 2.755 N/A LEU 172.A N THR 300.A O no hydrogen 3.032 N/A ASN 173.A ND2 GLU 152.A O no hydrogen 2.564 N/A VAL 176.A N ILE 299.A O no hydrogen 3.163 N/A ILE 178.A N SER 297.A O no hydrogen 2.772 N/A ASN 179.A N GLU 194.A O no hydrogen 2.986 N/A CYS 180.A N CYS 295.A O no hydrogen 2.848 N/A THR 181.A N TYR 192.A O no hydrogen 2.799 N/A THR 181.A OG1 ASN 294.A OD1 no hydrogen 2.923 N/A ARG 182.A N ILE 293.A O no hydrogen 2.774 N/A ARG 182.A NE ARG 182.A O no hydrogen 3.056 N/A ARG 182.A NE PRO 183.A O no hydrogen 3.023 N/A ARG 182.A NH1 ILE 188.A O no hydrogen 2.779 N/A ARG 182.A NH2 ILE 289.A O no hydrogen 2.771 N/A ARG 182.A NH2 GLY 291.A O no hydrogen 2.721 N/A ARG 189.A N ASP 187.A OD1 no hydrogen 2.847 N/A ARG 189.A NE GLN 272.A OE1 no hydrogen 2.881 N/A ARG 189.A NH2 GLN 272.A OE1 no hydrogen 2.848 N/A LYS 190.A N ASP 187.A O no hydrogen 3.162 N/A ALA 191.A N CYS 268.A O no hydrogen 3.033 N/A TYR 192.A N THR 181.A O no hydrogen 3.034 N/A CYS 193.A N LEU 266.A O no hydrogen 3.033 N/A GLU 194.A N ASN 179.A O no hydrogen 2.779 N/A ILE 195.A N ILE 264.A O no hydrogen 2.715 N/A GLY 197.A N GLY 262.A O no hydrogen 2.945 N/A THR 198.A OG1 ASN 261.A O no hydrogen 2.505 N/A LYS 199.A N ASN 196.A OD1 no hydrogen 3.021 N/A TRP 200.A N ASN 196.A O no hydrogen 2.799 N/A TRP 200.A NE1 LEU 251.A O no hydrogen 2.610 N/A ASN 201.A N GLY 197.A O no hydrogen 2.901 N/A ASN 201.A ND2 CYS 260.A O no hydrogen 3.510 N/A LYS 202.A N THR 198.A O no hydrogen 3.161 N/A VAL 203.A N LYS 199.A O no hydrogen 3.109 N/A LEU 204.A N TRP 200.A O no hydrogen 2.853 N/A LYS 205.A N ASN 201.A O no hydrogen 2.900 N/A LYS 205.A NZ GLU 209.A OE2 no hydrogen 3.029 N/A GLN 206.A N LYS 202.A O no hydrogen 3.119 N/A VAL 207.A N VAL 203.A O no hydrogen 2.821 N/A THR 208.A N LEU 204.A O no hydrogen 2.886 N/A THR 208.A OG1 LEU 204.A O no hydrogen 3.040 N/A GLU 209.A N LYS 205.A O no hydrogen 2.911 N/A LYS 210.A N GLN 206.A O no hydrogen 2.892 N/A LYS 210.A NZ GLU 213.A OE1 no hydrogen 2.692 N/A LEU 211.A N VAL 207.A O no hydrogen 2.837 N/A LYS 212.A N THR 208.A O no hydrogen 3.024 N/A LYS 212.A NZ LYS 218.A O no hydrogen 3.127 N/A GLU 213.A N GLU 209.A O no hydrogen 3.319 N/A GLU 213.A N LYS 210.A O no hydrogen 3.019 N/A HIS 214.A N LEU 211.A O no hydrogen 3.055 N/A PHE 215.A N LYS 212.A O no hydrogen 3.177 N/A ASN 217.A N LYS 212.A O no hydrogen 2.916 N/A LYS 218.A N PHE 215.A O no hydrogen 2.868 N/A LYS 218.A NZ ALA 310.A O no hydrogen 3.036 N/A LYS 218.A NZ THR 313.A O no hydrogen 3.147 N/A LYS 218.A NZ ASN 315.A O no hydrogen 3.172 N/A LYS 218.A NZ GLU 316.A OE2 no hydrogen 3.235 N/A THR 219.A N SER 314.A O no hydrogen 2.930 N/A ILE 221.A N GLU 316.A O no hydrogen 2.767 N/A PHE 222.A N ASN 254.A OD1 no hydrogen 2.711 N/A GLN 223.A N PHE 318.A O no hydrogen 2.816 N/A ILE 232.A N ASP 229.A O no hydrogen 2.949 N/A THR 233.A N ASP 229.A O no hydrogen 3.003 N/A THR 233.A OG1 ASP 229.A O no hydrogen 3.526 N/A MET 234.A N LEU 230.A O no hydrogen 3.002 N/A HIS 235.A N CYS 246.A O no hydrogen 2.851 N/A HIS 236.A N THR 141.A OG1 no hydrogen 2.930 N/A PHE 237.A N PHE 244.A O no hydrogen 3.130 N/A CYS 239.A N GLU 242.A O no hydrogen 2.814 N/A ARG 240.A NE ASN 294.A O no hydrogen 3.007 N/A ARG 240.A NH2 ASN 294.A O no hydrogen 3.032 N/A GLU 242.A N CYS 239.A O no hydrogen 2.913 N/A PHE 244.A N PHE 237.A O no hydrogen 2.775 N/A TYR 245.A N LYS 269.A O no hydrogen 2.845 N/A TYR 245.A OH GLU 231.A OE2 no hydrogen 2.542 N/A CYS 246.A N HIS 235.A O no hydrogen 2.861 N/A ASN 247.A N PRO 267.A O no hydrogen 2.960 N/A THR 248.A OG1 GLN 142.A OE1 no hydrogen 2.628 N/A THR 249.A N ASN 247.A OD1 no hydrogen 2.889 N/A THR 249.A OG1 ASN 247.A OD1 no hydrogen 2.999 N/A GLN 250.A NE2 THR 265.A O no hydrogen 2.622 N/A LEU 251.A N THR 248.A O no hydrogen 2.865 N/A PHE 252.A N THR 249.A O no hydrogen 3.284 N/A ASN 254.A ND2 PHE 222.A O no hydrogen 2.617 N/A THR 255.A N ASN 253.A OD1 no hydrogen 3.254 N/A THR 255.A OG1 ASN 253.A OD1 no hydrogen 2.559 N/A CYS 256.A N ASN 253.A O no hydrogen 3.157 N/A CYS 256.A SG CYS 260.A O no hydrogen 3.689 N/A ILE 257.A N ASN 254.A O no hydrogen 3.204 N/A CYS 260.A SG LYS 258.A O no hydrogen 4.005 N/A ILE 264.A N ILE 195.A O no hydrogen 2.709 N/A LEU 266.A N CYS 193.A O no hydrogen 2.778 N/A CYS 268.A N ALA 191.A O no hydrogen 2.855 N/A CYS 268.A SG LEU 266.A O no hydrogen 3.737 N/A LYS 269.A N TYR 245.A O no hydrogen 2.937 N/A ILE 270.A N ARG 189.A O no hydrogen 2.834 N/A LYS 271.A N PHE 243.A O no hydrogen 2.923 N/A LYS 271.A NZ ILE 273.A O no hydrogen 3.120 N/A GLN 272.A NE2 TYR 285.A O no hydrogen 2.944 N/A ILE 274.A N ALA 283.A O no hydrogen 2.902 N/A ASN 275.A N GLU 231.A OE2 no hydrogen 2.892 N/A ASN 275.A ND2 GLU 231.A OE1 no hydrogen 3.021 N/A MET 276.A N GLY 281.A O no hydrogen 2.840 N/A GLN 278.A N GLN 278.A OE1 no hydrogen 2.719 N/A GLY 279.A N MET 276.A O no hydrogen 2.856 N/A GLN 282.A N LEU 79.A O no hydrogen 2.824 N/A GLN 282.A NE2 ASN 275.A OD1 no hydrogen 2.897 N/A ALA 283.A N ILE 274.A O no hydrogen 2.961 N/A MET 284.A N VAL 77.A O no hydrogen 2.775 N/A TYR 285.A N GLN 272.A O no hydrogen 2.743 N/A TYR 285.A OH LEU 73.A O no hydrogen 2.994 N/A ILE 289.A N GLU 242.A OE2 no hydrogen 3.130 N/A ILE 293.A N ARG 182.A O no hydrogen 3.058 N/A CYS 295.A N CYS 180.A O no hydrogen 2.963 N/A SER 297.A N ILE 178.A O no hydrogen 2.848 N/A ASN 298.A N ASN 146.A OD1 no hydrogen 3.146 N/A ILE 299.A N VAL 176.A O no hydrogen 2.744 N/A THR 300.A N LEU 144.A O no hydrogen 2.912 N/A THR 300.A OG1 LEU 144.A O no hydrogen 3.439 N/A GLY 301.A N LEU 144.A O no hydrogen 3.395 N/A ILE 302.A N VAL 170.A O no hydrogen 2.996 N/A LEU 303.A N GLN 142.A O no hydrogen 2.841 N/A LEU 304.A N ILE 168.A O no hydrogen 2.756 N/A THR 305.A N ARG 319.A O no hydrogen 2.896 N/A THR 305.A OG1 GLY 321.A O no hydrogen 2.924 N/A ARG 306.A NH1 GLU 316.A OE1 no hydrogen 2.967 N/A ARG 306.A NH2 LEU 161.A O no hydrogen 2.950 N/A ARG 306.A NH2 THR 162.A O no hydrogen 2.996 N/A ASP 307.A N THR 317.A O no hydrogen 2.829 N/A THR 313.A N ALA 310.A O no hydrogen 3.293 N/A THR 313.A OG1 ALA 310.A O no hydrogen 2.688 N/A THR 313.A OG1 ASN 315.A O no hydrogen 3.174 N/A ASN 315.A N THR 313.A OG1 no hydrogen 3.385 N/A GLU 316.A N THR 219.A O no hydrogen 2.741 N/A PHE 318.A N ILE 221.A O no hydrogen 2.635 N/A ARG 319.A N THR 305.A O no hydrogen 2.911 N/A ARG 319.A NE ASP 307.A OD1 no hydrogen 2.819 N/A ARG 319.A NE ASP 307.A OD2 no hydrogen 3.436 N/A ARG 319.A NH1 PRO 224.A O no hydrogen 2.796 N/A ARG 319.A NH2 ASP 307.A OD2 no hydrogen 2.879 N/A GLY 321.A N LEU 303.A O no hydrogen 2.709 N/A LYS 326.A N ASN 324.A OD1 no hydrogen 2.911 N/A LYS 326.A NZ GLU 59.A OE1 no hydrogen 2.789 N/A ASP 327.A N ASN 324.A O no hydrogen 2.819 N/A ASN 328.A ND2 VAL 138.A O no hydrogen 3.385 N/A ASN 328.A ND2 SER 140.A O no hydrogen 3.170 N/A TRP 329.A NE1 GLN 62.A OE1 no hydrogen 2.800 N/A ARG 330.A N LYS 326.A O no hydrogen 2.897 N/A ARG 330.A NH1 ASP 327.A OD1 no hydrogen 2.462 N/A SER 331.A N ASP 327.A O no hydrogen 2.915 N/A SER 331.A OG ASN 328.A O no hydrogen 2.684 N/A GLU 332.A N TRP 329.A O no hydrogen 2.921 N/A LEU 333.A N TRP 329.A O no hydrogen 2.790 N/A LEU 333.A N ARG 330.A O no hydrogen 3.232 N/A TYR 336.A N LEU 333.A O no hydrogen 2.931 N/A TYR 336.A OH HIS 133.A ND1 no hydrogen 2.596 N/A LYS 337.A N LEU 110.A O no hydrogen 3.030 N/A LYS 337.A NZ ASP 4.A OD1 no hydrogen 2.725 N/A LYS 337.A NZ GLU 48.A OE1 no hydrogen 2.832 N/A LYS 337.A NZ ASN 49.A O no hydrogen 2.697 N/A VAL 339.A N VAL 108.A O no hydrogen 2.981 N/A GLN 340.A N LYS 3.A O no hydrogen 2.792 N/A ILE 341.A N GLY 106.A O no hydrogen 2.907 N/A GLU 342.A N VAL 1.A O no hydrogen 2.805 N/A