Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a3j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 8.A N GLU 241.A OE1 no hydrogen 2.703 N/A GLN 10.A N MET 230.A O no hydrogen 2.866 N/A GLN 10.A N GLY 231.A O no hydrogen 3.312 N/A THR 11.A N MET 230.A O no hydrogen 3.244 N/A THR 11.A OG1 ASN 27.A O no hydrogen 3.534 N/A TYR 12.A N LEU 26.A O no hydrogen 3.051 N/A VAL 13.A N VAL 228.A O no hydrogen 2.863 N/A LEU 14.A N THR 24.A O no hydrogen 3.161 N/A MET 15.A N ILE 226.A O no hydrogen 2.958 N/A ASP 16.A N ALA 21.A O no hydrogen 3.044 N/A TYR 17.A N ARG 224.A O no hydrogen 2.808 N/A ASN 18.A N ASP 16.A OD2 no hydrogen 2.592 N/A SER 19.A N ASP 16.A OD2 no hydrogen 2.856 N/A SER 19.A OG ASP 16.A OD2 no hydrogen 3.349 N/A SER 19.A OG THR 289.A OG1 no hydrogen 2.666 N/A GLY 20.A N ASP 16.A O no hydrogen 2.907 N/A ALA 21.A N SER 19.A OG no hydrogen 3.272 N/A LEU 23.A N LEU 14.A O no hydrogen 2.985 N/A LEU 26.A N TYR 12.A O no hydrogen 3.084 N/A ASN 27.A ND2 GLN 10.A O no hydrogen 3.212 N/A GLN 30.A N ASN 27.A O no hydrogen 3.146 N/A ARG 31.A NE ASN 133.A OD1 no hydrogen 3.036 N/A ARG 31.A NH2 LYS 132.A O no hydrogen 3.227 N/A ARG 31.A NH2 ASN 133.A OD1 no hydrogen 3.536 N/A GLN 32.A N SER 149.A O no hydrogen 2.722 N/A GLN 32.A NE2 GLN 10.A OE1 no hydrogen 3.179 N/A GLN 32.A NE2 GLN 30.A OE1 no hydrogen 3.399 N/A LEU 37.A N PRO 34.A O no hydrogen 2.922 N/A THR 38.A N ALA 35.A O no hydrogen 3.051 N/A THR 38.A OG1 ALA 35.A O no hydrogen 2.951 N/A LYS 39.A N SER 36.A O no hydrogen 3.027 N/A LYS 39.A NZ SER 36.A OG no hydrogen 2.714 N/A LYS 39.A NZ ASN 101.A OD1 no hydrogen 2.753 N/A LYS 39.A NZ HIS 140.A O no hydrogen 2.678 N/A MET 40.A N LEU 37.A O no hydrogen 2.848 N/A THR 42.A N THR 38.A O no hydrogen 3.249 N/A THR 42.A OG1 PRO 139.A O no hydrogen 2.509 N/A SER 43.A N LYS 39.A O no hydrogen 2.867 N/A SER 43.A OG LYS 39.A O no hydrogen 2.423 N/A TYR 44.A N MET 40.A O no hydrogen 2.868 N/A TYR 44.A OH ASP 164.A OD2 no hydrogen 2.703 N/A VAL 45.A N MET 41.A O no hydrogen 2.901 N/A VAL 46.A N THR 42.A O no hydrogen 3.041 N/A GLY 47.A N SER 43.A O no hydrogen 2.696 N/A VAL 48.A N TYR 44.A O no hydrogen 2.784 N/A ALA 49.A N VAL 45.A O no hydrogen 2.917 N/A LEU 50.A N VAL 46.A O no hydrogen 2.946 N/A LYS 51.A N GLY 47.A O no hydrogen 2.877 N/A LYS 51.A NZ ASP 164.A O no hydrogen 2.962 N/A GLN 52.A N VAL 48.A O no hydrogen 2.744 N/A GLY 53.A N LEU 50.A O no hydrogen 3.321 N/A LYS 54.A N ALA 49.A O no hydrogen 3.010 N/A LYS 54.A NZ GLN 52.A OE1 no hydrogen 2.800 N/A HIS 56.A N ASP 59.A OD2 no hydrogen 2.861 N/A ASP 59.A N HIS 56.A O no hydrogen 2.964 N/A VAL 61.A N VAL 86.A O no hydrogen 2.847 N/A ILE 63.A N THR 84.A O no hydrogen 2.766 N/A SER 66.A OG GLU 109.A OE1 no hydrogen 2.996 N/A SER 66.A OG GLU 109.A OE2 no hydrogen 2.801 N/A ALA 67.A N GLY 64.A O no hydrogen 3.270 N/A GLY 69.A N LEU 80.A O no hydrogen 2.768 N/A ASN 71.A N TRP 68.A O no hydrogen 2.893 N/A ASN 71.A ND2 GLU 65.A O no hydrogen 2.399 N/A ASN 71.A ND2 SER 66.A O no hydrogen 3.186 N/A PHE 72.A N GLY 69.A O no hydrogen 2.846 N/A SER 76.A OG SER 99.A O no hydrogen 2.453 N/A LYS 77.A NZ GLY 69.A O no hydrogen 2.955 N/A LYS 77.A NZ PHE 72.A O no hydrogen 3.117 N/A MET 78.A N ASP 102.A OD1 no hydrogen 2.879 N/A LEU 80.A N ASP 102.A OD2 no hydrogen 2.969 N/A ASN 83.A N ILE 63.A O no hydrogen 2.788 N/A THR 84.A N ASP 81.A O no hydrogen 3.320 N/A THR 84.A OG1 ASP 81.A O no hydrogen 2.755 N/A GLN 85.A NE2 THR 62.A OG1 no hydrogen 2.732 N/A VAL 86.A N VAL 61.A O no hydrogen 2.804 N/A VAL 88.A N ASP 59.A O no hydrogen 2.926 N/A ALA 89.A N ASN 57.A O no hydrogen 3.112 N/A ASP 90.A N SER 87.A OG no hydrogen 3.035 N/A LEU 91.A N SER 87.A O no hydrogen 2.908 N/A ASN 92.A N VAL 88.A O no hydrogen 2.872 N/A ASN 92.A ND2 GLU 168.A OE2 no hydrogen 3.230 N/A ARG 93.A N ALA 89.A O no hydrogen 2.904 N/A ARG 93.A NH1 GLU 174.A OE2 no hydrogen 2.824 N/A GLY 94.A N ASP 90.A O no hydrogen 2.780 N/A VAL 95.A N LEU 91.A O no hydrogen 2.924 N/A ILE 96.A N ASN 92.A O no hydrogen 2.740 N/A VAL 97.A N ARG 93.A O no hydrogen 2.746 N/A VAL 98.A N GLY 94.A O no hydrogen 3.200 N/A SER 99.A N VAL 95.A O no hydrogen 3.104 N/A GLY 100.A N GLY 94.A O no hydrogen 2.902 N/A ASN 101.A N SER 76.A O no hydrogen 2.758 N/A ASN 101.A ND2 SER 75.A OG no hydrogen 2.929 N/A ALA 103.A N ASP 102.A OD1 no hydrogen 2.654 N/A THR 104.A N GLY 100.A O no hydrogen 3.173 N/A THR 104.A N ASN 101.A O no hydrogen 3.262 N/A THR 104.A OG1 ASN 101.A O no hydrogen 2.760 N/A VAL 105.A N ASN 101.A O no hydrogen 3.315 N/A ALA 106.A N ASP 102.A O no hydrogen 2.992 N/A LEU 107.A N ALA 103.A O no hydrogen 3.012 N/A ALA 108.A N THR 104.A O no hydrogen 2.753 N/A GLU 109.A N VAL 105.A O no hydrogen 2.993 N/A HIS 110.A N ALA 106.A O no hydrogen 3.017 N/A HIS 110.A NE2 ASP 59.A OD2 no hydrogen 3.107 N/A ILE 111.A N LEU 107.A O no hydrogen 2.997 N/A SER 112.A N ALA 108.A O no hydrogen 2.737 N/A GLY 113.A N GLU 109.A O no hydrogen 2.867 N/A ASN 117.A N ASN 114.A OD1 no hydrogen 2.909 N/A PHE 118.A N ASN 114.A O no hydrogen 3.356 N/A VAL 119.A N VAL 115.A O no hydrogen 2.958 N/A GLU 120.A N ASN 117.A O no hydrogen 2.931 N/A THR 121.A N ASN 117.A O no hydrogen 3.415 N/A MET 122.A N PHE 118.A O no hydrogen 3.287 N/A ASN 123.A N VAL 119.A O no hydrogen 3.017 N/A ASN 123.A ND2 PHE 136.A O no hydrogen 3.011 N/A LYS 124.A N GLU 120.A O no hydrogen 2.735 N/A TYR 125.A N THR 121.A O no hydrogen 3.089 N/A VAL 126.A N MET 122.A O no hydrogen 3.161 N/A GLN 127.A N ASN 123.A O no hydrogen 3.303 N/A GLN 127.A N LYS 124.A O no hydrogen 2.907 N/A GLN 128.A N LYS 124.A O no hydrogen 2.928 N/A PHE 129.A N TYR 125.A O no hydrogen 2.749 N/A GLY 130.A N GLN 127.A O no hydrogen 2.988 N/A LEU 131.A N VAL 126.A O no hydrogen 3.124 N/A ASN 133.A N ASP 153.A OD2 no hydrogen 2.893 N/A THR 134.A OG1 SER 149.A OG no hydrogen 2.907 N/A THR 134.A OG1 ASP 153.A OD2 no hydrogen 2.663 N/A ASN 135.A N TYR 148.A O no hydrogen 2.847 N/A ASN 135.A ND2 ASN 146.A O no hydrogen 2.811 N/A PHE 136.A N ASN 123.A OD1 no hydrogen 3.059 N/A THR 137.A N GLN 147.A OE1 no hydrogen 2.906 N/A THR 137.A OG1 ASP 144.A OD2 no hydrogen 3.018 N/A THR 138.A OG1 GLN 147.A OE1 no hydrogen 2.845 N/A GLY 141.A N THR 138.A OG1 no hydrogen 2.809 N/A LEU 142.A N HIS 140.A ND1 no hydrogen 3.208 N/A ASN 146.A N ASP 144.A OD1 no hydrogen 2.827 N/A GLN 147.A N ASP 144.A O no hydrogen 2.848 N/A TYR 148.A N ASN 135.A O no hydrogen 3.072 N/A SER 149.A N GLN 32.A O no hydrogen 2.790 N/A SER 149.A OG THR 134.A OG1 no hydrogen 2.907 N/A SER 150.A OG PRO 28.A O no hydrogen 3.295 N/A ARG 152.A N PRO 28.A O no hydrogen 2.980 N/A ARG 152.A NE ASP 29.A OD1 no hydrogen 2.790 N/A ARG 152.A NH1 ASP 29.A OD1 no hydrogen 3.508 N/A ARG 152.A NH1 ASP 29.A OD2 no hydrogen 3.051 N/A ASP 153.A N SER 150.A OG no hydrogen 3.147 N/A MET 154.A N SER 150.A O no hydrogen 2.748 N/A ALA 155.A N ALA 151.A O no hydrogen 2.883 N/A ILE 156.A N ARG 152.A O no hydrogen 2.851 N/A ILE 157.A N ASP 153.A O no hydrogen 2.738 N/A GLY 158.A N MET 154.A O no hydrogen 2.920 N/A ALA 159.A N ALA 155.A O no hydrogen 2.899 N/A HIS 160.A N ILE 156.A O no hydrogen 3.109 N/A HIS 160.A ND1 ASP 164.A OD2 no hydrogen 2.724 N/A ILE 161.A N ILE 157.A O no hydrogen 3.079 N/A ILE 162.A N GLY 158.A O no hydrogen 2.988 N/A ARG 163.A N ALA 159.A O no hydrogen 2.606 N/A ARG 163.A NH2 TYR 17.A O no hydrogen 3.097 N/A ASP 164.A N HIS 160.A O no hydrogen 2.622 N/A LEU 165.A N ILE 161.A O no hydrogen 3.019 N/A TYR 169.A N LEU 165.A O no hydrogen 2.819 N/A TYR 169.A OH ASP 199.A OD1 no hydrogen 2.541 N/A LYS 170.A NZ GLU 167.A OE1 no hydrogen 2.913 N/A ILE 171.A N GLU 168.A O no hydrogen 2.845 N/A TYR 172.A N TYR 169.A O no hydrogen 2.991 N/A SER 173.A N LYS 170.A O no hydrogen 3.338 N/A SER 173.A OG LYS 170.A O no hydrogen 3.011 N/A GLU 174.A N ILE 171.A O no hydrogen 3.000 N/A LYS 175.A NZ LEU 191.A O no hydrogen 2.874 N/A PHE 177.A N GLN 184.A O no hydrogen 2.759 N/A PHE 179.A N ILE 182.A O no hydrogen 2.760 N/A ASN 180.A ND2 PHE 79.A O no hydrogen 2.999 N/A ASN 180.A ND2 ASP 81.A OD2 no hydrogen 2.947 N/A ILE 182.A N PHE 179.A O no hydrogen 2.852 N/A GLN 184.A N PHE 177.A O no hydrogen 2.988 N/A GLN 184.A NE2 LYS 77.A O no hydrogen 2.796 N/A ASN 186.A N LYS 175.A O no hydrogen 2.643 N/A ASN 186.A ND2 TYR 172.A O no hydrogen 3.404 N/A ASN 186.A ND2 GLU 174.A O no hydrogen 2.943 N/A ASN 188.A N ASN 186.A OD1 no hydrogen 2.973 N/A GLY 189.A N GLU 239.A OE2 no hydrogen 2.788 N/A LEU 190.A N ASN 188.A OD1 no hydrogen 3.045 N/A LEU 191.A N ASN 188.A O no hydrogen 3.151 N/A TRP 192.A N GLY 189.A O no hydrogen 2.814 N/A ASP 193.A N LEU 190.A O no hydrogen 3.067 N/A THR 195.A N ASP 193.A OD1 no hydrogen 3.029 N/A THR 195.A OG1 ASP 193.A OD1 no hydrogen 2.952 N/A ILE 196.A N ASP 193.A O no hydrogen 3.372 N/A ASN 197.A ND2 THR 218.A O no hydrogen 3.015 N/A ASP 199.A N SER 216.A O no hydrogen 2.983 N/A MET 201.A N VAL 214.A O no hydrogen 2.665 N/A LYS 202.A N VAL 214.A O no hydrogen 3.074 N/A LYS 202.A NZ VAL 95.A O no hydrogen 3.076 N/A LYS 202.A NZ ILE 96.A O no hydrogen 3.054 N/A LYS 202.A NZ SER 99.A OG no hydrogen 3.222 N/A GLY 204.A N ASN 212.A O no hydrogen 3.069 N/A THR 206.A N GLY 210.A O no hydrogen 2.772 N/A THR 206.A OG1 ASP 143.A OD1 no hydrogen 3.407 N/A THR 206.A OG1 ASP 143.A OD2 no hydrogen 2.514 N/A GLN 208.A N THR 206.A OG1 no hydrogen 2.910 N/A ALA 209.A N THR 206.A O no hydrogen 3.175 N/A GLY 210.A N THR 206.A O no hydrogen 3.003 N/A TYR 211.A N VAL 232.A O no hydrogen 2.795 N/A ASN 212.A N GLY 204.A O no hydrogen 2.804 N/A ASN 212.A ND2 PRO 34.A O no hydrogen 3.291 N/A LEU 213.A N VAL 229.A O no hydrogen 3.074 N/A VAL 214.A N LYS 202.A O no hydrogen 2.877 N/A ALA 215.A N SER 227.A O no hydrogen 2.890 N/A SER 216.A N GLY 200.A O no hydrogen 3.082 N/A SER 216.A OG LEU 225.A O no hydrogen 2.766 N/A ALA 217.A N LEU 225.A O no hydrogen 3.091 N/A THR 218.A N ASN 197.A O no hydrogen 3.174 N/A THR 219.A N MET 223.A O no hydrogen 2.909 N/A ASN 222.A N THR 219.A O no hydrogen 2.416 N/A MET 223.A N ASN 221.A OD1 no hydrogen 3.149 N/A ARG 224.A NH1 ASP 199.A OD1 no hydrogen 2.903 N/A ARG 224.A NH1 ASP 199.A OD2 no hydrogen 3.540 N/A ARG 224.A NH1 SER 216.A OG no hydrogen 2.878 N/A ARG 224.A NH2 ASP 199.A OD2 no hydrogen 3.031 N/A LEU 225.A N ALA 217.A O no hydrogen 2.956 N/A ILE 226.A N MET 15.A O no hydrogen 3.008 N/A SER 227.A N ALA 215.A O no hydrogen 2.730 N/A SER 227.A OG ALA 215.A O no hydrogen 3.567 N/A VAL 228.A N VAL 13.A O no hydrogen 2.878 N/A VAL 229.A N LEU 213.A O no hydrogen 3.192 N/A MET 230.A N THR 11.A O no hydrogen 2.838 N/A VAL 232.A N TYR 211.A O no hydrogen 2.960 N/A GLY 237.A N THR 234.A OG1 no hydrogen 2.725 N/A ARG 238.A N THR 234.A O no hydrogen 3.234 N/A ARG 238.A NH1 ASN 212.A O no hydrogen 3.296 N/A VAL 240.A N LYS 236.A O no hydrogen 3.311 N/A GLU 241.A N GLY 237.A O no hydrogen 2.871 N/A SER 242.A N ARG 238.A O no hydrogen 3.056 N/A SER 242.A OG ARG 238.A O no hydrogen 3.035 N/A LYS 243.A N GLU 239.A O no hydrogen 2.925 N/A LYS 243.A NZ ASP 193.A OD1 no hydrogen 3.372 N/A LYS 243.A NZ ASP 193.A OD2 no hydrogen 2.518 N/A LYS 244.A N VAL 240.A O no hydrogen 2.885 N/A LYS 244.A NZ GLU 241.A OE2 no hydrogen 2.872 N/A LEU 245.A N GLU 241.A O no hydrogen 3.055 N/A LEU 246.A N SER 242.A O no hydrogen 2.889 N/A GLN 247.A N LYS 243.A O no hydrogen 2.971 N/A TRP 248.A N LYS 244.A O no hydrogen 3.073 N/A TRP 248.A NE1 THR 3.A O no hydrogen 2.587 N/A GLY 249.A N LEU 245.A O no hydrogen 2.892 N/A PHE 250.A N LEU 246.A O no hydrogen 2.750 N/A ALA 251.A N GLN 247.A O no hydrogen 2.780 N/A ASN 252.A N TRP 248.A O no hydrogen 3.036 N/A ASN 252.A N GLY 249.A O no hydrogen 3.235 N/A GLU 254.A N ILE 290.A O no hydrogen 2.967 N/A THR 255.A OG1 ASP 16.A OD1 no hydrogen 2.509 N/A THR 255.A OG1 THR 289.A OG1 no hydrogen 2.799 N/A PHE 256.A N ILE 288.A O no hydrogen 2.963 N/A LYS 257.A NZ ASP 285.A OD2 no hydrogen 3.328 N/A THR 258.A N HIS 286.A O no hydrogen 2.921 N/A THR 258.A OG1 TYR 324.A OH no hydrogen 2.785 N/A LEU 259.A N HIS 286.A O no hydrogen 3.397 N/A ALA 261.A N ASP 285.A OD1 no hydrogen 2.881 N/A GLY 262.A N ALA 282.A O no hydrogen 2.699 N/A LYS 263.A N GLU 260.A O no hydrogen 3.029 N/A ILE 265.A N LEU 280.A O no hydrogen 2.832 N/A GLN 268.A N VAL 278.A O no hydrogen 2.613 N/A VAL 270.A N ASN 276.A O no hydrogen 2.958 N/A TYR 271.A N LEU 309.A O no hydrogen 2.705 N/A ASP 274.A N GLY 343.A O no hydrogen 3.116 N/A LYS 275.A NZ ASP 341.A O no hydrogen 3.452 N/A SER 277.A OG GLU 267.A OE2 no hydrogen 2.430 N/A VAL 278.A N GLN 268.A O no hydrogen 2.682 N/A LYS 279.A N ASN 340.A OD1 no hydrogen 3.412 N/A LYS 279.A NZ GLU 267.A OE1 no hydrogen 3.548 N/A LEU 280.A N SER 266.A O no hydrogen 2.783 N/A GLY 281.A N GLN 337.A O no hydrogen 2.953 N/A PHE 283.A N GLN 337.A OE1 no hydrogen 2.896 N/A HIS 286.A N LEU 259.A O no hydrogen 2.832 N/A ILE 288.A N PHE 256.A O no hydrogen 2.833 N/A THR 289.A OG1 SER 19.A OG no hydrogen 2.666 N/A THR 289.A OG1 THR 255.A OG1 no hydrogen 2.799 N/A ILE 290.A N GLU 254.A O no hydrogen 2.910 N/A LYS 292.A N ASN 252.A O no hydrogen 3.097 N/A GLY 293.A N GLU 254.A OE1 no hydrogen 3.054 N/A LYS 294.A N PRO 291.A O no hydrogen 3.313 N/A GLU 297.A N LYS 294.A O no hydrogen 3.159 N/A VAL 298.A N GLN 295.A O no hydrogen 3.192 N/A LYS 299.A N ALA 325.A O no hydrogen 2.787 N/A ARG 301.A N VAL 323.A O no hydrogen 2.838 N/A ARG 301.A NE GLU 303.A OE2 no hydrogen 2.547 N/A ARG 301.A NH1 ASP 330.A OD1 no hydrogen 3.202 N/A ARG 301.A NH1 ASP 330.A OD2 no hydrogen 3.494 N/A ARG 301.A NH2 ASP 330.A OD2 no hydrogen 2.771 N/A GLU 303.A N LYS 321.A O no hydrogen 3.134 N/A ALA 305.A N ILE 319.A O no hydrogen 2.803 N/A ALA 311.A N TYR 271.A O no hydrogen 3.110 N/A LEU 313.A N VAL 342.A O no hydrogen 2.435 N/A ALA 314.A N GLN 317.A OE1 no hydrogen 2.895 N/A LYS 315.A N ASP 341.A OD1 no hydrogen 2.607 N/A GLY 316.A N VAL 338.A O no hydrogen 2.777 N/A GLN 317.A N ALA 314.A O no hydrogen 2.899 N/A ILE 319.A N LEU 336.A O no hydrogen 3.133 N/A LYS 321.A NZ ASN 335.A OD1 no hydrogen 2.934 N/A VAL 322.A N ALA 334.A O no hydrogen 2.739 N/A VAL 323.A N ARG 301.A O no hydrogen 2.642 N/A TYR 324.A N ALA 332.A O no hydrogen 2.742 N/A ALA 325.A N LYS 299.A O no hydrogen 2.880 N/A LEU 326.A N LYS 329.A O no hydrogen 2.899 N/A LYS 329.A N LEU 326.A O no hydrogen 2.738 N/A ILE 331.A N TYR 324.A O no hydrogen 2.707 N/A ALA 334.A N VAL 322.A O no hydrogen 3.102 N/A LEU 336.A N GLY 320.A O no hydrogen 2.905 N/A GLN 337.A N GLY 281.A O no hydrogen 2.648 N/A GLN 337.A NE2 GLY 316.A O no hydrogen 2.819 N/A VAL 338.A N GLN 317.A O no hydrogen 2.778 N/A MET 339.A N LYS 279.A O no hydrogen 3.049 N/A ASN 340.A ND2 GLU 264.A OE2 no hydrogen 3.263 N/A VAL 342.A N LEU 313.A O no hydrogen 2.610 N/A GLY 343.A N ASP 274.A OD2 no hydrogen 2.291 N/A