Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tti_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N VAL 15.A O no hydrogen 3.097 N/A TYR 4.A OH TYR 19.A O no hydrogen 2.425 N/A SER 5.A OG THR 14.A OG1 no hydrogen 2.563 N/A VAL 6.A N PHE 13.A O no hydrogen 2.713 N/A VAL 8.A N VAL 6.A O no hydrogen 3.193 N/A THR 12.A OG1 GLU 7.A OE2 no hydrogen 2.694 N/A PHE 13.A N VAL 6.A O no hydrogen 2.688 N/A THR 14.A N TYR 98.A OH no hydrogen 2.892 N/A THR 14.A OG1 SER 5.A OG no hydrogen 2.563 N/A VAL 15.A N TYR 4.A O no hydrogen 3.133 N/A LYS 17.A N GLN 2.A O no hydrogen 3.031 N/A LYS 17.A NZ ASN 1.A O no hydrogen 2.837 N/A ARG 18.A NE ASP 38.A OD1 no hydrogen 3.057 N/A ARG 18.A NH2 ASP 38.A OD1 no hydrogen 3.415 N/A ARG 18.A NH2 ASP 38.A OD2 no hydrogen 3.001 N/A TYR 19.A N LEU 16.A O no hydrogen 3.057 N/A GLN 20.A N TYR 37.A O no hydrogen 2.826 N/A LYS 23.A N ALA 35.A O no hydrogen 3.046 N/A ILE 25.A N VAL 33.A O no hydrogen 3.129 N/A GLY 26.A N VAL 33.A O no hydrogen 3.183 N/A ILE 32.A N LYS 49.A O no hydrogen 3.227 N/A VAL 33.A N GLY 26.A O no hydrogen 2.518 N/A CYS 34.A N ILE 47.A O no hydrogen 2.778 N/A ALA 35.A N LYS 23.A O no hydrogen 2.718 N/A ALA 36.A N VAL 45.A O no hydrogen 3.009 N/A TYR 37.A N GLN 20.A O no hydrogen 2.807 N/A TYR 37.A OH ASP 42.A OD1 no hydrogen 2.377 N/A ASP 38.A N ARG 43.A O no hydrogen 2.934 N/A ALA 39.A N ARG 18.A O no hydrogen 3.111 N/A VAL 40.A N ASP 38.A OD1 no hydrogen 2.954 N/A LEU 41.A N ASP 38.A OD1 no hydrogen 3.311 N/A ASP 42.A N ASP 38.A O no hydrogen 2.496 N/A VAL 45.A N ALA 36.A O no hydrogen 2.902 N/A ALA 46.A N MET 101.A O no hydrogen 2.609 N/A ILE 47.A N CYS 34.A O no hydrogen 2.765 N/A LYS 48.A N LEU 99.A O no hydrogen 2.638 N/A LYS 49.A N ILE 32.A O no hydrogen 2.790 N/A LYS 49.A NZ THR 12.A O no hydrogen 2.937 N/A LEU 50.A N VAL 97.A O no hydrogen 2.769 N/A ARG 52.A N GLN 95.A O no hydrogen 2.909 N/A GLN 55.A N ARG 52.A O no hydrogen 3.215 N/A GLN 55.A NE2 SER 51.A O no hydrogen 3.316 N/A GLN 55.A NE2 ARG 52.A O no hydrogen 3.074 N/A THR 58.A OG1 PHE 168.A O no hydrogen 3.062 N/A HIS 59.A N ASN 56.A OD1 no hydrogen 2.891 N/A ALA 60.A N ASN 56.A O no hydrogen 2.820 N/A LYS 61.A N GLN 57.A O no hydrogen 2.881 N/A ARG 62.A N THR 58.A O no hydrogen 3.296 N/A ARG 62.A NE GLU 66.A OE1 no hydrogen 2.830 N/A ARG 62.A NH2 GLU 66.A OE1 no hydrogen 3.098 N/A ALA 63.A N HIS 59.A O no hydrogen 2.920 N/A TYR 64.A N ALA 60.A O no hydrogen 2.873 N/A ARG 65.A N LYS 61.A O no hydrogen 2.951 N/A ARG 65.A NH1 PHE 163.A O no hydrogen 3.182 N/A GLU 66.A N ARG 62.A O no hydrogen 2.816 N/A LEU 67.A N ALA 63.A O no hydrogen 2.790 N/A VAL 68.A N TYR 64.A O no hydrogen 2.763 N/A LEU 69.A N ARG 65.A O no hydrogen 2.800 N/A MET 70.A N GLU 66.A O no hydrogen 2.815 N/A LYS 71.A NZ GLU 338.A O no hydrogen 3.021 N/A LYS 71.A NZ ASN 341.A OD1 no hydrogen 3.040 N/A CYS 72.A N LEU 69.A O no hydrogen 3.263 N/A CYS 72.A SG LEU 69.A O no hydrogen 3.530 N/A ASN 74.A N HIS 134.A NE2 no hydrogen 3.173 N/A HIS 75.A NE2 GLU 317.A O no hydrogen 2.976 N/A LYS 76.A NZ GLU 317.A OE2 no hydrogen 3.346 N/A ASN 77.A N HIS 75.A ND1 no hydrogen 2.940 N/A ASN 77.A ND2 GLN 127.A OE1 no hydrogen 3.281 N/A ASN 77.A ND2 LEU 158.A O no hydrogen 3.150 N/A ILE 78.A N HIS 75.A O no hydrogen 3.170 N/A ILE 79.A N ILE 160.A O no hydrogen 3.100 N/A LEU 82.A N VAL 100.A O no hydrogen 2.797 N/A ASN 83.A ND2 TYR 19.A OH no hydrogen 2.937 N/A PHE 85.A N TYR 98.A O no hydrogen 3.106 N/A THR 86.A OG1 ASP 96.A O no hydrogen 2.847 N/A GLN 88.A N THR 86.A OG1 no hydrogen 3.246 N/A GLU 93.A N THR 90.A O no hydrogen 3.316 N/A GLU 93.A N THR 90.A OG1 no hydrogen 3.057 N/A PHE 94.A N LEU 91.A O no hydrogen 3.203 N/A GLN 95.A N GLN 88.A OE1 no hydrogen 3.059 N/A ASP 96.A N GLN 88.A OE1 no hydrogen 2.902 N/A VAL 97.A N LEU 50.A O no hydrogen 3.192 N/A TYR 98.A N PHE 85.A O no hydrogen 2.827 N/A TYR 98.A OH THR 12.A O no hydrogen 3.219 N/A LEU 99.A N LYS 48.A O no hydrogen 2.590 N/A VAL 100.A N ASN 83.A O no hydrogen 3.033 N/A MET 101.A N ALA 46.A O no hydrogen 2.776 N/A LEU 103.A N ASN 44.A O no hydrogen 3.391 N/A ASP 105.A N VAL 152.A O no hydrogen 3.089 N/A ALA 106.A N VAL 152.A O no hydrogen 3.171 N/A ASN 107.A N GLN 110.A OE1 no hydrogen 2.795 N/A LEU 108.A N PRO 147.A O no hydrogen 3.110 N/A GLN 110.A N ASN 107.A OD1 no hydrogen 3.074 N/A VAL 111.A N ASN 107.A O no hydrogen 3.432 N/A ILE 112.A N LEU 108.A O no hydrogen 2.796 N/A GLN 113.A N CYS 109.A O no hydrogen 3.225 N/A GLN 113.A N GLN 110.A O no hydrogen 3.230 N/A GLN 113.A NE2 CYS 109.A O no hydrogen 3.699 N/A MET 114.A N VAL 111.A O no hydrogen 3.062 N/A HIS 118.A ND1 TYR 308.A OH no hydrogen 2.862 N/A HIS 118.A NE2 PRO 269.A O no hydrogen 3.169 N/A ARG 120.A N ASP 117.A OD2 no hydrogen 3.028 N/A ARG 120.A NH1 ASP 117.A OD1 no hydrogen 2.810 N/A MET 121.A N ASP 117.A O no hydrogen 3.057 N/A SER 122.A N HIS 118.A O no hydrogen 2.858 N/A SER 122.A OG HIS 118.A O no hydrogen 2.464 N/A SER 122.A OG GLU 119.A O no hydrogen 3.317 N/A TYR 123.A N GLU 119.A O no hydrogen 3.134 N/A TYR 123.A N ARG 120.A O no hydrogen 2.925 N/A LEU 124.A N ARG 120.A O no hydrogen 2.932 N/A LEU 125.A N MET 121.A O no hydrogen 3.183 N/A TYR 126.A N SER 122.A O no hydrogen 2.972 N/A TYR 126.A OH GLU 317.A OE1 no hydrogen 2.589 N/A GLN 127.A N TYR 123.A O no hydrogen 3.142 N/A GLN 127.A N LEU 124.A O no hydrogen 2.763 N/A GLN 127.A NE2 TYR 123.A O no hydrogen 3.089 N/A GLN 127.A NE2 CYS 156.A O no hydrogen 2.981 N/A MET 128.A N LEU 124.A O no hydrogen 2.809 N/A LEU 129.A N LEU 125.A O no hydrogen 2.908 N/A CYS 130.A N TYR 126.A O no hydrogen 2.999 N/A CYS 130.A SG TYR 126.A O no hydrogen 3.276 N/A CYS 130.A SG GLU 317.A O no hydrogen 3.857 N/A GLY 131.A N GLN 127.A O no hydrogen 3.065 N/A ILE 132.A N MET 128.A O no hydrogen 2.969 N/A LYS 133.A N LEU 129.A O no hydrogen 2.778 N/A LYS 133.A NZ ASP 301.A OD2 no hydrogen 2.738 N/A HIS 134.A N CYS 130.A O no hydrogen 2.895 N/A LEU 135.A N GLY 131.A O no hydrogen 2.750 N/A HIS 136.A N ILE 132.A O no hydrogen 2.764 N/A HIS 136.A NE2 ASP 195.A OD2 no hydrogen 2.566 N/A SER 137.A N LYS 133.A O no hydrogen 2.798 N/A SER 137.A OG LYS 133.A O no hydrogen 3.528 N/A SER 137.A OG HIS 134.A O no hydrogen 2.313 N/A ALA 138.A N LEU 135.A O no hydrogen 3.146 N/A GLY 139.A N HIS 136.A O no hydrogen 3.050 N/A ILE 140.A N LEU 135.A O no hydrogen 2.910 N/A HIS 142.A N ASP 195.A OD2 no hydrogen 3.309 N/A HIS 142.A NE2 ASP 162.A O no hydrogen 3.064 N/A HIS 142.A NE2 ASP 162.A OD1 no hydrogen 2.858 N/A ARG 143.A N ASP 195.A OD1 no hydrogen 2.726 N/A ARG 143.A NH1 LEU 165.A O no hydrogen 3.088 N/A ASP 144.A N HIS 142.A ND1 no hydrogen 3.105 N/A LYS 146.A NZ ASP 144.A OD1 no hydrogen 3.076 N/A LYS 146.A NZ ASP 144.A OD2 no hydrogen 2.817 N/A LYS 146.A NZ THR 176.A O no hydrogen 2.984 N/A ASN 149.A N LYS 146.A O no hydrogen 3.108 N/A VAL 151.A N LYS 159.A O no hydrogen 2.762 N/A VAL 152.A N ALA 106.A O no hydrogen 2.767 N/A LYS 153.A N THR 157.A O no hydrogen 2.767 N/A LYS 153.A NZ GLU 102.A OE1 no hydrogen 3.355 N/A SER 154.A N ASP 105.A OD2 no hydrogen 3.073 N/A CYS 156.A N LYS 153.A O no hydrogen 2.715 N/A THR 157.A N ASP 155.A OD1 no hydrogen 3.275 N/A THR 157.A OG1 ASP 155.A OD1 no hydrogen 2.642 N/A LEU 158.A N GLN 127.A OE1 no hydrogen 3.257 N/A LYS 159.A N VAL 151.A O no hydrogen 2.776 N/A LYS 159.A NZ LYS 76.A O no hydrogen 3.022 N/A ILE 160.A N ASN 77.A O no hydrogen 2.761 N/A LEU 161.A N ASN 149.A O no hydrogen 2.894 N/A PHE 163.A N GLU 66.A OE1 no hydrogen 3.437 N/A GLY 164.A N ASP 162.A OD2 no hydrogen 3.283 N/A LEU 165.A N HIS 142.A O no hydrogen 2.977 N/A TYR 179.A OH GLU 205.A OE1 no hydrogen 2.749 N/A ARG 180.A N ARG 177.A O no hydrogen 2.852 N/A ARG 180.A NE ASP 144.A OD1 no hydrogen 3.088 N/A ARG 180.A NH1 TYR 218.A OH no hydrogen 2.967 N/A ARG 180.A NH2 ASP 144.A OD2 no hydrogen 3.073 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.945 N/A ILE 185.A N ALA 181.A O no hydrogen 2.866 N/A LEU 186.A N PRO 182.A O no hydrogen 2.717 N/A MET 188.A N GLU 183.A O no hydrogen 2.717 N/A ASN 193.A ND2 PRO 294.A O no hydrogen 2.936 N/A ASN 193.A ND2 ARG 297.A O no hydrogen 3.295 N/A VAL 194.A N LYS 191.A O no hydrogen 3.023 N/A SER 198.A OG TYR 179.A O no hydrogen 2.605 N/A VAL 199.A N ASP 195.A O no hydrogen 3.038 N/A GLY 200.A N ILE 196.A O no hydrogen 3.056 N/A CYS 201.A N TRP 197.A O no hydrogen 3.099 N/A CYS 201.A SG TYR 178.A O no hydrogen 3.655 N/A ILE 202.A N SER 198.A O no hydrogen 3.119 N/A ILE 202.A N VAL 199.A O no hydrogen 2.950 N/A MET 203.A N VAL 199.A O no hydrogen 2.809 N/A GLY 204.A N GLY 200.A O no hydrogen 2.944 N/A GLU 205.A N CYS 201.A O no hydrogen 3.113 N/A MET 206.A N ILE 202.A O no hydrogen 2.874 N/A VAL 207.A N MET 203.A O no hydrogen 3.156 N/A ARG 208.A N GLY 204.A O no hydrogen 2.695 N/A HIS 209.A N GLU 205.A O no hydrogen 2.718 N/A HIS 209.A ND1 ILE 112.A O no hydrogen 2.891 N/A ARG 216.A NE ASP 220.A OD1 no hydrogen 3.384 N/A ARG 216.A NH2 ASP 220.A OD1 no hydrogen 2.789 N/A ILE 219.A N ASP 217.A OD1 no hydrogen 2.997 N/A GLN 221.A N ASP 217.A O no hydrogen 3.268 N/A TRP 222.A N TYR 218.A O no hydrogen 3.196 N/A ASN 223.A N ILE 219.A O no hydrogen 3.238 N/A LYS 224.A N ASP 220.A O no hydrogen 2.833 N/A VAL 225.A N GLN 221.A O no hydrogen 3.169 N/A ILE 226.A N TRP 222.A O no hydrogen 3.074 N/A GLU 227.A N ASN 223.A O no hydrogen 3.121 N/A GLN 228.A N VAL 225.A O no hydrogen 3.438 N/A GLN 228.A NE2 LEU 212.A O no hydrogen 3.256 N/A GLN 228.A NE2 LYS 224.A O no hydrogen 2.622 N/A LEU 229.A N VAL 225.A O no hydrogen 2.921 N/A GLY 230.A N ILE 226.A O no hydrogen 2.588 N/A THR 231.A N TYR 254.A O no hydrogen 2.934 N/A THR 231.A OG1 TYR 254.A O no hydrogen 3.319 N/A PHE 236.A N CYS 233.A O no hydrogen 2.938 N/A MET 237.A N CYS 233.A O no hydrogen 3.457 N/A LYS 238.A N PRO 234.A O no hydrogen 2.845 N/A LYS 239.A N PHE 236.A O no hydrogen 2.965 N/A LYS 239.A NZ ASP 293.A OD1 no hydrogen 2.792 N/A LEU 240.A N MET 237.A O no hydrogen 2.730 N/A ARG 245.A N GLN 241.A O no hydrogen 2.867 N/A ARG 245.A NE LEU 240.A O no hydrogen 3.256 N/A ASN 246.A N PRO 242.A O no hydrogen 2.852 N/A TYR 247.A N THR 243.A O no hydrogen 3.345 N/A VAL 248.A N VAL 244.A O no hydrogen 3.054 N/A GLU 249.A N ARG 245.A O no hydrogen 3.012 N/A ASN 250.A ND2 ASN 246.A O no hydrogen 3.360 N/A ARG 251.A N VAL 248.A O no hydrogen 2.963 N/A ARG 251.A NE ASN 223.A OD1 no hydrogen 3.421 N/A TYR 254.A N THR 231.A OG1 no hydrogen 2.885 N/A LEU 257.A N GLN 228.A O no hydrogen 2.894 N/A LYS 261.A N THR 258.A O no hydrogen 2.961 N/A LEU 262.A N THR 258.A O no hydrogen 2.896 N/A PHE 263.A N PHE 259.A O no hydrogen 2.823 N/A LEU 267.A N PRO 264.A O no hydrogen 3.206 N/A PHE 268.A N ASP 265.A O no hydrogen 3.220 N/A SER 272.A N ASP 271.A OD1 no hydrogen 2.630 N/A HIS 274.A N SER 272.A OG no hydrogen 3.121 N/A ASN 275.A N SER 272.A OG no hydrogen 3.403 N/A ASN 275.A ND2 ASP 271.A OD1 no hydrogen 3.138 N/A LYS 276.A N SER 272.A O no hydrogen 2.961 N/A LYS 276.A NZ ALA 270.A O no hydrogen 3.229 N/A LEU 277.A N GLU 273.A O no hydrogen 3.192 N/A LYS 278.A N HIS 274.A O no hydrogen 2.934 N/A LYS 278.A NZ GLN 281.A OE1 no hydrogen 2.683 N/A ALA 279.A N ASN 275.A O no hydrogen 2.885 N/A SER 280.A N LYS 276.A O no hydrogen 3.368 N/A SER 280.A OG LEU 277.A O no hydrogen 3.454 N/A GLN 281.A N LEU 277.A O no hydrogen 3.011 N/A ALA 282.A N LYS 278.A O no hydrogen 2.906 N/A ALA 282.A N ALA 279.A O no hydrogen 3.245 N/A ARG 283.A N ALA 279.A O no hydrogen 3.242 N/A ARG 283.A NE PHE 263.A O no hydrogen 3.014 N/A ASP 284.A N SER 280.A O no hydrogen 3.091 N/A LEU 285.A N GLN 281.A O no hydrogen 3.303 N/A LEU 286.A N ALA 282.A O no hydrogen 2.771 N/A SER 287.A N ARG 283.A O no hydrogen 2.923 N/A SER 287.A OG ARG 283.A O no hydrogen 3.378 N/A SER 287.A OG ASP 284.A O no hydrogen 2.904 N/A LYS 288.A N ASP 284.A O no hydrogen 3.176 N/A LYS 288.A N LEU 285.A O no hydrogen 2.910 N/A MET 289.A N LEU 286.A O no hydrogen 2.964 N/A LEU 290.A N LEU 286.A O no hydrogen 2.718 N/A ALA 295.A N ASP 293.A OD1 no hydrogen 3.000 N/A LYS 296.A N ASP 293.A O no hydrogen 2.824 N/A ARG 297.A NE VAL 291.A O no hydrogen 2.808 N/A ARG 297.A NH1 GLU 183.A OE1 no hydrogen 3.255 N/A ARG 297.A NH1 ASN 193.A O no hydrogen 3.408 N/A ARG 297.A NH2 GLU 183.A OE1 no hydrogen 2.858 N/A ARG 297.A NH2 VAL 291.A O no hydrogen 3.149 N/A ARG 297.A NH2 ILE 292.A O no hydrogen 2.788 N/A ILE 298.A N LYS 288.A O no hydrogen 3.017 N/A ASP 302.A N SER 299.A OG no hydrogen 3.035 N/A ALA 303.A N SER 299.A O no hydrogen 3.078 N/A LEU 304.A N VAL 300.A O no hydrogen 3.016 N/A GLN 305.A N ASP 302.A O no hydrogen 2.893 N/A HIS 306.A N ALA 303.A O no hydrogen 3.272 N/A HIS 306.A NE2 ASP 284.A OD2 no hydrogen 2.688 N/A TYR 308.A N HIS 306.A ND1 no hydrogen 3.381 N/A TYR 308.A OH HIS 118.A ND1 no hydrogen 2.862 N/A ASN 310.A N HIS 306.A O no hydrogen 2.447 N/A TRP 312.A N ILE 309.A O no hydrogen 3.169 N/A TRP 312.A NE1 SER 122.A OG no hydrogen 3.222 N/A TYR 313.A N ASN 310.A O no hydrogen 3.008 N/A ALA 316.A N ASP 314.A OD1 no hydrogen 2.909 N/A GLU 317.A N ASP 314.A O no hydrogen 3.113 N/A VAL 318.A N ASP 314.A O no hydrogen 2.819 N/A GLU 319.A N PRO 315.A O no hydrogen 2.563 N/A THR 327.A N GLU 330.A OE1 no hydrogen 3.104 N/A GLU 330.A N THR 327.A O no hydrogen 2.981 N/A TRP 331.A N THR 327.A O no hydrogen 3.077 N/A LYS 332.A N ILE 328.A O no hydrogen 3.096 N/A LYS 332.A NZ PHE 94.A O no hydrogen 3.398 N/A GLU 333.A N GLU 329.A O no hydrogen 3.335 N/A LEU 334.A N GLU 330.A O no hydrogen 3.022 N/A ILE 335.A N TRP 331.A O no hydrogen 2.696 N/A TYR 336.A N LYS 332.A O no hydrogen 2.841 N/A LYS 337.A N GLU 333.A O no hydrogen 2.928 N/A LYS 337.A NZ GLU 333.A OE2 no hydrogen 2.659 N/A GLU 338.A N LEU 334.A O no hydrogen 3.183 N/A VAL 339.A N ILE 335.A O no hydrogen 3.032 N/A MET 340.A N TYR 336.A O no hydrogen 3.120 N/A ASN 341.A N LYS 337.A O no hydrogen 2.682 N/A