Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a3q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N VAL 350.A O no hydrogen 2.867 N/A ARG 6.A NH1 ASP 260.A OD1 no hydrogen 3.379 N/A ARG 6.A NH1 ASP 260.A OD2 no hydrogen 2.926 N/A ARG 6.A NH2 ASP 260.A OD1 no hydrogen 2.734 N/A ALA 8.A N ARG 6.A O no hydrogen 2.803 N/A TYR 9.A N ILE 240.A O no hydrogen 2.944 N/A MET 10.A N PRO 339.A O no hydrogen 2.915 N/A ASN 11.A N GLN 238.A O no hydrogen 2.959 N/A ASN 11.A ND2 GLN 238.A OE1 no hydrogen 3.014 N/A VAL 12.A N ILE 341.A O no hydrogen 2.771 N/A ASP 13.A N SER 236.A O no hydrogen 2.878 N/A LEU 14.A N HIS 343.A O no hydrogen 2.889 N/A ASN 15.A ND2 ASP 344.A OD1 no hydrogen 2.809 N/A ALA 16.A N ASP 13.A OD1 no hydrogen 3.042 N/A VAL 17.A N ASP 13.A O no hydrogen 3.305 N/A ALA 18.A N LEU 14.A O no hydrogen 2.954 N/A SER 19.A N ASN 15.A O no hydrogen 2.906 N/A ASN 20.A N ALA 16.A O no hydrogen 2.873 N/A ASN 20.A ND2 LEU 216.A O no hydrogen 2.843 N/A ASN 20.A ND2 LYS 234.A O no hydrogen 3.077 N/A PHE 21.A N VAL 17.A O no hydrogen 2.935 N/A LYS 22.A N ALA 18.A O no hydrogen 2.959 N/A VAL 23.A N SER 19.A O no hydrogen 3.056 N/A PHE 24.A N ASN 20.A O no hydrogen 3.365 N/A SER 25.A N PHE 21.A O no hydrogen 3.152 N/A SER 25.A OG LYS 22.A O no hydrogen 3.311 N/A THR 26.A N LYS 22.A O no hydrogen 2.830 N/A THR 26.A OG1 LYS 22.A O no hydrogen 2.850 N/A LEU 27.A N VAL 23.A O no hydrogen 2.849 N/A HIS 28.A N PHE 24.A O no hydrogen 2.977 N/A HIS 28.A NE2 SER 199.A O no hydrogen 2.757 N/A LYS 31.A N HIS 28.A O no hydrogen 3.243 N/A LYS 31.A NZ CYS 204.A O no hydrogen 3.205 N/A LYS 31.A NZ CYS 207.A O no hydrogen 2.939 N/A THR 32.A N ASN 208.A O no hydrogen 2.978 N/A MET 34.A N ILE 210.A O no hydrogen 2.774 N/A ALA 35.A N PHE 60.A O no hydrogen 3.074 N/A VAL 36.A N PRO 212.A O no hydrogen 3.015 N/A VAL 37.A N ALA 62.A O no hydrogen 3.001 N/A ALA 39.A N GLU 68.A OE2 no hydrogen 2.699 N/A ALA 41.A N VAL 37.A O no hydrogen 2.964 N/A TYR 42.A N LYS 38.A O no hydrogen 3.166 N/A GLY 43.A N ALA 39.A O no hydrogen 3.156 N/A GLY 43.A N ASN 40.A O no hydrogen 3.099 N/A LEU 44.A N ALA 41.A O no hydrogen 2.929 N/A GLY 45.A N ASN 40.A O no hydrogen 2.754 N/A SER 46.A N ASN 40.A OD1 no hydrogen 2.905 N/A SER 46.A OG ASN 40.A OD1 no hydrogen 3.496 N/A VAL 49.A N GLY 45.A O no hydrogen 3.083 N/A ALA 50.A N SER 46.A O no hydrogen 2.779 N/A ARG 51.A N VAL 47.A O no hydrogen 2.864 N/A ARG 51.A NH1 HIS 75.A O no hydrogen 2.961 N/A HIS 52.A N LYS 48.A O no hydrogen 2.981 N/A LEU 53.A N VAL 49.A O no hydrogen 2.838 N/A MET 54.A N ALA 50.A O no hydrogen 2.824 N/A GLU 55.A N ARG 51.A O no hydrogen 3.153 N/A ASN 56.A N LEU 53.A O no hydrogen 2.825 N/A GLY 57.A N MET 54.A O no hydrogen 3.202 N/A ALA 58.A N LEU 53.A O no hydrogen 2.986 N/A PHE 61.A N LYS 80.A O no hydrogen 2.884 N/A ALA 62.A N ALA 35.A O no hydrogen 3.019 N/A VAL 63.A N LEU 82.A O no hydrogen 2.747 N/A ALA 64.A N GLU 68.A OE1 no hydrogen 2.644 N/A THR 65.A OG1 ASP 67.A OD1 no hydrogen 3.558 N/A GLU 68.A N THR 65.A OG1 no hydrogen 3.238 N/A ALA 69.A N THR 65.A O no hydrogen 3.217 N/A ILE 70.A N LEU 66.A O no hydrogen 2.830 N/A GLU 71.A N ASP 67.A O no hydrogen 2.898 N/A LEU 72.A N GLU 68.A O no hydrogen 3.285 N/A ARG 73.A N ALA 69.A O no hydrogen 3.111 N/A ARG 73.A NE HIS 98.A O no hydrogen 2.738 N/A ARG 73.A NH1 ILE 77.A O no hydrogen 2.867 N/A ARG 73.A NH1 ALA 79.A O no hydrogen 2.769 N/A ARG 73.A NH2 ALA 79.A O no hydrogen 3.158 N/A ARG 73.A NH2 ARG 99.A O no hydrogen 2.747 N/A MET 74.A N ILE 70.A O no hydrogen 2.816 N/A HIS 75.A N LEU 72.A O no hydrogen 2.963 N/A HIS 75.A ND1 GLU 71.A O no hydrogen 2.714 N/A ILE 77.A N LEU 72.A O no hydrogen 3.109 N/A LYS 80.A N THR 59.A O no hydrogen 3.112 N/A LYS 80.A NZ GLU 162.A OE2 no hydrogen 2.645 N/A LEU 82.A N PHE 61.A O no hydrogen 2.812 N/A VAL 83.A N ALA 101.A O no hydrogen 2.944 N/A LEU 84.A N VAL 63.A O no hydrogen 2.763 N/A GLY 85.A N ALA 64.A O no hydrogen 3.099 N/A ASP 91.A N PRO 88.A O no hydrogen 2.990 N/A ILE 92.A N ALA 89.A O no hydrogen 3.246 N/A LYS 94.A N ASP 91.A O no hydrogen 2.993 N/A LYS 94.A NZ GLN 97.A OE1 no hydrogen 2.848 N/A ILE 96.A N ILE 92.A O no hydrogen 3.204 N/A GLN 97.A N ASP 93.A O no hydrogen 2.835 N/A HIS 98.A N LYS 94.A O no hydrogen 3.223 N/A ARG 99.A N ILE 96.A O no hydrogen 3.132 N/A VAL 100.A N ALA 95.A O no hydrogen 2.995 N/A ALA 101.A N ILE 81.A O no hydrogen 2.795 N/A LEU 102.A N TRP 126.A O no hydrogen 3.000 N/A THR 103.A OG1 VAL 83.A O no hydrogen 2.665 N/A VAL 104.A N HIS 128.A O no hydrogen 2.883 N/A LYS 107.A NZ GLU 148.A OE1 no hydrogen 3.091 N/A TRP 109.A N SER 106.A OG no hydrogen 2.985 N/A TRP 109.A NE1 LEU 87.A O no hydrogen 2.702 N/A LEU 110.A N SER 106.A O no hydrogen 3.256 N/A LYS 111.A N LYS 107.A O no hydrogen 3.026 N/A GLU 112.A N GLN 108.A O no hydrogen 3.096 N/A ALA 113.A N TRP 109.A O no hydrogen 2.859 N/A ILE 114.A N LEU 110.A O no hydrogen 3.004 N/A LYS 115.A N LYS 111.A O no hydrogen 3.128 N/A LYS 115.A NZ GLU 112.A OE2 no hydrogen 3.506 N/A ASN 116.A N ALA 113.A O no hydrogen 3.097 N/A ASN 116.A ND2 GLU 112.A O no hydrogen 2.774 N/A ILE 117.A N ILE 114.A O no hydrogen 3.180 N/A SER 118.A N ASP 93.A OD1 no hydrogen 2.909 N/A SER 118.A OG ASP 93.A OD2 no hydrogen 2.727 N/A LYS 123.A NZ GLN 97.A O no hydrogen 3.024 N/A LEU 125.A N GLN 158.A O no hydrogen 2.882 N/A LEU 127.A N VAL 160.A O no hydrogen 2.755 N/A HIS 128.A N LEU 102.A O no hydrogen 2.810 N/A HIS 128.A ND1 HIS 192.A NE2 no hydrogen 3.074 N/A HIS 128.A NE2 GLU 162.A OE1 no hydrogen 2.721 N/A ILE 129.A N GLY 163.A O no hydrogen 2.777 N/A LYS 130.A N VAL 104.A O no hydrogen 2.982 N/A LYS 130.A NZ LEU 131.A O no hydrogen 3.479 N/A LYS 130.A NZ LEU 138.A O no hydrogen 3.175 N/A LEU 131.A N PHE 165.A O no hydrogen 2.779 N/A ASP 132.A N ILE 140.A O no hydrogen 2.856 N/A THR 133.A OG1 THR 166.A OG1 no hydrogen 2.807 N/A THR 133.A OG1 GLN 174.A OE1 no hydrogen 3.361 N/A GLY 134.A N ASP 132.A OD1 no hydrogen 3.191 N/A GLY 136.A N ASP 132.A OD1 no hydrogen 3.057 N/A ILE 140.A N LYS 130.A O no hydrogen 2.953 N/A LYS 141.A NZ ASP 142.A OD2 no hydrogen 3.548 N/A ASN 144.A ND2 GLU 148.A OE2 no hydrogen 3.124 N/A TYR 146.A N ASP 142.A O no hydrogen 3.090 N/A GLN 147.A N THR 143.A O no hydrogen 3.045 N/A GLN 147.A NE2 GLU 184.A O no hydrogen 3.016 N/A GLU 148.A N ASN 144.A O no hydrogen 2.875 N/A VAL 149.A N THR 145.A O no hydrogen 2.816 N/A ILE 150.A N TYR 146.A O no hydrogen 3.078 N/A GLU 151.A N GLN 147.A O no hydrogen 2.936 N/A ILE 152.A N GLU 148.A O no hydrogen 3.043 N/A ILE 153.A N VAL 149.A O no hydrogen 3.062 N/A GLN 154.A N ILE 150.A O no hydrogen 2.898 N/A GLN 155.A N ILE 152.A O no hydrogen 3.019 N/A TYR 156.A N ILE 153.A O no hydrogen 3.122 N/A GLN 158.A NE2 GLN 121.A O no hydrogen 2.931 N/A GLN 158.A NE2 LYS 123.A O no hydrogen 2.899 N/A LEU 159.A N TYR 156.A O no hydrogen 2.827 N/A VAL 160.A N LEU 125.A O no hydrogen 2.834 N/A GLU 162.A N LEU 127.A O no hydrogen 2.796 N/A GLY 163.A N LEU 127.A O no hydrogen 3.079 N/A VAL 164.A N TYR 190.A O no hydrogen 2.894 N/A PHE 165.A N ILE 129.A O no hydrogen 2.869 N/A THR 166.A N HIS 192.A O no hydrogen 3.189 N/A THR 166.A OG1 LEU 131.A O no hydrogen 2.858 N/A THR 166.A OG1 THR 133.A OG1 no hydrogen 2.807 N/A GLU 173.A N ASP 169.A O no hydrogen 3.500 N/A TYR 175.A N THR 171.A O no hydrogen 3.050 N/A GLN 176.A N THR 172.A O no hydrogen 3.083 N/A GLN 176.A NE2 ASP 180.A OD1 no hydrogen 2.936 N/A ARG 177.A N GLU 173.A O no hydrogen 2.721 N/A ARG 177.A NH2 LYS 141.A O no hydrogen 2.960 N/A PHE 178.A N GLN 174.A O no hydrogen 2.720 N/A LYS 179.A N TYR 175.A O no hydrogen 2.927 N/A ASP 180.A N GLN 176.A O no hydrogen 2.886 N/A MET 181.A N ARG 177.A O no hydrogen 2.992 N/A VAL 182.A N PHE 178.A O no hydrogen 3.083 N/A ASN 183.A N LYS 179.A O no hydrogen 2.934 N/A GLU 184.A N MET 181.A O no hydrogen 3.022 N/A ALA 185.A N VAL 182.A O no hydrogen 3.217 N/A LYS 187.A NZ ASN 183.A OD1 no hydrogen 2.786 N/A TYR 190.A N GLU 162.A O no hydrogen 2.988 N/A ILE 191.A N ASN 208.A OD1 no hydrogen 2.811 N/A HIS 192.A N VAL 164.A O no hydrogen 3.171 N/A HIS 192.A NE2 HIS 128.A ND1 no hydrogen 3.074 N/A GLN 194.A NE2 GLY 198.A O no hydrogen 2.982 N/A GLN 194.A NE2 ASP 203.A O no hydrogen 3.527 N/A GLY 198.A N ASN 195.A OD1 no hydrogen 2.941 N/A SER 199.A N ASN 195.A O no hydrogen 2.836 N/A SER 199.A OG ASN 195.A O no hydrogen 2.680 N/A LEU 200.A N SER 196.A O no hydrogen 2.913 N/A LEU 201.A N ALA 197.A O no hydrogen 2.938 N/A MET 202.A N GLY 198.A O no hydrogen 3.037 N/A GLN 205.A N GLN 205.A OE1 no hydrogen 2.969 N/A CYS 207.A N CYS 204.A O no hydrogen 3.110 N/A ASN 208.A N ILE 191.A O no hydrogen 2.889 N/A ASN 208.A ND2 GLU 189.A O no hydrogen 2.775 N/A ALA 209.A N ILE 191.A O no hydrogen 3.324 N/A ILE 210.A N THR 32.A O no hydrogen 2.936 N/A ARG 211.A N GLN 194.A O no hydrogen 2.733 N/A ARG 211.A NH1 THR 166.A O no hydrogen 3.319 N/A ARG 211.A NH1 HIS 192.A ND1 no hydrogen 3.026 N/A ARG 211.A NH1 HIS 192.A O no hydrogen 3.127 N/A ARG 211.A NH2 THR 166.A O no hydrogen 2.841 N/A GLY 213.A N SER 196.A OG no hydrogen 3.036 N/A SER 215.A N SER 196.A OG no hydrogen 3.171 N/A SER 215.A OG TYR 219.A O no hydrogen 2.932 N/A LEU 216.A N GLY 213.A O no hydrogen 2.984 N/A TYR 217.A N ILE 214.A O no hydrogen 3.070 N/A TYR 217.A OH VAL 36.A O no hydrogen 2.607 N/A GLY 218.A N SER 215.A O no hydrogen 3.001 N/A TYR 220.A OH VAL 231.A O no hydrogen 3.202 N/A VAL 225.A N SER 222.A OG no hydrogen 3.141 N/A GLN 226.A N SER 222.A O no hydrogen 3.015 N/A GLN 227.A N GLU 223.A O no hydrogen 2.766 N/A LYS 228.A N TYR 224.A O no hydrogen 3.008 N/A VAL 229.A N VAL 225.A O no hydrogen 3.098 N/A LYS 234.A N ASN 20.A OD1 no hydrogen 2.924 N/A LYS 234.A NZ SER 19.A OG no hydrogen 2.855 N/A SER 236.A N TYR 217.A O no hydrogen 3.145 N/A SER 236.A OG TYR 217.A O no hydrogen 2.661 N/A VAL 237.A N TYR 219.A OH no hydrogen 3.145 N/A GLN 238.A N ASN 11.A O no hydrogen 3.113 N/A GLN 238.A NE2 ASP 307.A OD1 no hydrogen 3.160 N/A GLN 238.A NE2 ASN 308.A OD1 no hydrogen 3.162 N/A LEU 239.A N ILE 306.A O no hydrogen 2.801 N/A ILE 240.A N TYR 9.A O no hydrogen 2.966 N/A ALA 241.A N VAL 303.A O no hydrogen 3.117 N/A ASN 242.A N SER 7.A O no hydrogen 2.915 N/A VAL 243.A N ASP 301.A O no hydrogen 2.874 N/A VAL 244.A N LEU 253.A O no hydrogen 2.831 N/A LYS 247.A N ILE 251.A O no hydrogen 2.950 N/A THR 250.A OG1 ASP 295.A OD1 no hydrogen 2.793 N/A ILE 251.A N LYS 247.A O no hydrogen 2.736 N/A ALA 252.A N VAL 291.A O no hydrogen 2.797 N/A LEU 253.A N GLN 245.A O no hydrogen 2.893 N/A LEU 254.A N THR 289.A O no hydrogen 2.733 N/A GLY 257.A N ASP 260.A OD2 no hydrogen 3.081 N/A TYR 258.A N CYS 285.A O no hydrogen 3.050 N/A ALA 259.A N MET 286.A O no hydrogen 2.954 N/A ASP 260.A N GLY 257.A O no hydrogen 3.007 N/A GLY 261.A N TYR 258.A O no hydrogen 3.034 N/A TYR 262.A N GLY 257.A O no hydrogen 3.363 N/A MET 266.A N LEU 263.A O no hydrogen 2.966 N/A GLN 267.A N ARG 264.A O no hydrogen 3.202 N/A GLY 268.A N VAL 280.A O no hydrogen 2.775 N/A SER 269.A N MET 266.A O no hydrogen 2.953 N/A SER 269.A OG MET 266.A O no hydrogen 2.646 N/A VAL 271.A N CYS 278.A O no hydrogen 2.865 N/A ASN 272.A N ILE 304.A O no hydrogen 3.023 N/A VAL 273.A N HIS 276.A O no hydrogen 2.999 N/A GLY 275.A N ASN 272.A OD1 no hydrogen 2.713 N/A HIS 276.A N VAL 273.A O no hydrogen 2.957 N/A GLN 277.A NE2 GLN 314.A OE1 no hydrogen 3.325 N/A CYS 278.A N VAL 271.A O no hydrogen 2.869 N/A CYS 278.A SG HIS 276.A O no hydrogen 3.394 N/A VAL 280.A N SER 269.A O no hydrogen 2.747 N/A ILE 281.A N ILE 290.A O no hydrogen 2.997 N/A CYS 285.A N GLN 288.A O no hydrogen 2.943 N/A CYS 285.A SG ARG 283.A O no hydrogen 3.994 N/A THR 289.A N LEU 254.A O no hydrogen 2.984 N/A THR 289.A OG1 ILE 256.A O no hydrogen 2.615 N/A VAL 291.A N ALA 252.A O no hydrogen 2.828 N/A LYS 292.A N GLU 279.A O no hydrogen 2.836 N/A VAL 293.A N THR 250.A O no hydrogen 3.096 N/A GLN 296.A N GLN 296.A OE1 no hydrogen 2.479 N/A VAL 297.A N PRO 294.A O no hydrogen 3.152 N/A LYS 298.A N ASP 301.A OD2 no hydrogen 3.309 N/A GLY 300.A N VAL 243.A O no hydrogen 2.830 N/A ASP 301.A N LYS 298.A O no hydrogen 3.118 N/A VAL 303.A N ALA 241.A O no hydrogen 2.796 N/A ILE 304.A N ASN 272.A O no hydrogen 2.827 N/A LEU 305.A N LEU 239.A O no hydrogen 2.796 N/A ILE 306.A N LEU 239.A O no hydrogen 3.284 N/A ASP 307.A N GLN 314.A O no hydrogen 2.783 N/A ASN 308.A N ASP 307.A OD1 no hydrogen 3.014 N/A GLN 314.A N SER 312.A OG no hydrogen 2.858 N/A GLN 314.A NE2 PHE 270.A O no hydrogen 2.705 N/A GLN 314.A NE2 GLN 277.A OE1 no hydrogen 2.789 N/A SER 315.A N SER 312.A O no hydrogen 3.218 N/A VAL 318.A N SER 315.A OG no hydrogen 3.122 N/A VAL 319.A N SER 315.A O no hydrogen 3.067 N/A ALA 320.A N VAL 316.A O no hydrogen 2.863 N/A GLU 321.A N GLU 317.A O no hydrogen 2.909 N/A LYS 322.A N VAL 318.A O no hydrogen 2.948 N/A LYS 322.A NZ ILE 265.A O no hydrogen 3.084 N/A LYS 322.A NZ GLN 267.A O no hydrogen 2.790 N/A GLN 323.A N VAL 319.A O no hydrogen 2.905 N/A HIS 324.A N GLU 321.A O no hydrogen 3.048 N/A THR 325.A N ALA 320.A O no hydrogen 2.846 N/A THR 325.A OG1 GLU 329.A OE1 no hydrogen 2.673 N/A ILE 326.A N THR 325.A OG1 no hydrogen 2.713 N/A ASN 327.A ND2 TYR 220.A O no hydrogen 2.817 N/A ASN 327.A ND2 GLU 317.A OE2 no hydrogen 2.962 N/A GLU 329.A N ILE 326.A O no hydrogen 2.961 N/A VAL 330.A N ILE 326.A O no hydrogen 3.380 N/A LEU 331.A N ASN 327.A O no hydrogen 3.245 N/A CYS 332.A N TYR 328.A O no hydrogen 3.108 N/A CYS 332.A SG TYR 328.A O no hydrogen 3.371 N/A ASN 333.A N GLU 329.A O no hydrogen 2.862 N/A ASN 333.A ND2 GLN 323.A OE1 no hydrogen 3.241 N/A LEU 334.A N LEU 331.A O no hydrogen 3.158 N/A SER 335.A N ASP 260.A O no hydrogen 2.952 N/A SER 335.A OG ALA 259.A O no hydrogen 3.102 N/A ARG 337.A N SER 335.A OG no hydrogen 2.964 N/A ARG 337.A NE ASP 260.A OD1 no hydrogen 2.836 N/A ARG 337.A NH1 ASP 287.A OD1 no hydrogen 3.013 N/A ARG 337.A NH2 ASP 260.A OD2 no hydrogen 2.950 N/A ARG 337.A NH2 ASP 287.A OD1 no hydrogen 2.836 N/A LEU 338.A N SER 335.A O no hydrogen 3.201 N/A ARG 340.A N THR 351.A O no hydrogen 2.917 N/A ARG 340.A NE GLY 43.A O no hydrogen 2.928 N/A ARG 340.A NH1 SER 335.A O no hydrogen 2.848 N/A ARG 340.A NH1 LEU 338.A O no hydrogen 2.878 N/A ARG 340.A NH2 GLY 43.A O no hydrogen 2.864 N/A ARG 340.A NH2 LEU 334.A O no hydrogen 2.990 N/A ILE 341.A N MET 10.A O no hydrogen 2.735 N/A TYR 342.A N PHE 349.A O no hydrogen 2.764 N/A TYR 342.A OH LEU 44.A O no hydrogen 2.482 N/A HIS 343.A N VAL 12.A O no hydrogen 2.765 N/A HIS 343.A NE2 ASN 11.A OD1 no hydrogen 2.863 N/A ASP 344.A N GLN 347.A O no hydrogen 3.017 N/A GLY 345.A N ASN 15.A OD1 no hydrogen 2.817 N/A GLN 347.A N ASP 344.A O no hydrogen 3.119 N/A PHE 349.A N TYR 342.A O no hydrogen 3.126 N/A THR 351.A N ARG 340.A O no hydrogen 2.895 N/A ASN 352.A N ASP 2.A OD2 no hydrogen 2.848 N/A ASN 352.A ND2 LYS 3.A O no hydrogen 3.004 N/A LEU 355.A N ASN 352.A O no hydrogen 2.950 N/A LYS 356.A N GLU 353.A O no hydrogen 3.250 N/A