Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4auo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASP 152.A OD1 no hydrogen 2.923 N/A PHE 1.A N ASP 152.A OD2 no hydrogen 3.266 N/A THR 4.A N GLY 126.A O no hydrogen 3.148 N/A THR 4.A OG1 GLY 126.A O no hydrogen 3.116 N/A THR 4.A OG1 SER 128.A OG no hydrogen 2.819 N/A ASN 7.A N THR 4.A O no hydrogen 3.213 N/A ARG 9.A NH2 ILE 160.A O no hydrogen 3.116 N/A TRP 10.A N TYR 161.A OH no hydrogen 3.381 N/A TRP 10.A NE1 SER 124.A O no hydrogen 2.920 N/A HIS 14.A ND1 THR 49.A OG1 no hydrogen 3.079 N/A LEU 15.A N THR 49.A O no hydrogen 3.208 N/A THR 16.A N ASP 59.A OD2 no hydrogen 2.875 N/A TYR 17.A N THR 51.A O no hydrogen 2.732 N/A ARG 18.A N ILE 60.A O no hydrogen 2.893 N/A ARG 18.A NH1 GLY 56.A O no hydrogen 2.505 N/A ASN 21.A ND2 TYR 22.A O no hydrogen 3.609 N/A ASN 21.A ND2 PHE 64.A O no hydrogen 2.910 N/A TYR 22.A OH ASP 32.A OD1 no hydrogen 3.008 N/A THR 23.A OG1 GLU 100.A OE1 no hydrogen 3.283 N/A THR 23.A OG1 GLU 100.A OE2 no hydrogen 2.849 N/A ASP 25.A N THR 23.A OG1 no hydrogen 3.198 N/A VAL 31.A N PRO 27.A O no hydrogen 3.305 N/A ASP 32.A N ARG 28.A O no hydrogen 2.991 N/A HIS 33.A N ALA 29.A O no hydrogen 2.807 N/A ALA 34.A N ASP 30.A O no hydrogen 2.879 N/A ILE 35.A N VAL 31.A O no hydrogen 2.882 N/A GLU 36.A N ASP 32.A O no hydrogen 2.703 N/A LYS 37.A N HIS 33.A O no hydrogen 2.660 N/A ALA 38.A N ALA 34.A O no hydrogen 3.084 N/A PHE 39.A N ILE 35.A O no hydrogen 2.979 N/A GLN 40.A N GLU 36.A O no hydrogen 3.152 N/A GLN 40.A N LYS 37.A O no hydrogen 2.935 N/A LEU 41.A N LYS 37.A O no hydrogen 3.298 N/A LEU 41.A N ALA 38.A O no hydrogen 2.869 N/A TRP 42.A NE1 ALA 118.A O no hydrogen 3.026 N/A SER 43.A N PHE 39.A O no hydrogen 3.233 N/A SER 43.A OG PHE 39.A O no hydrogen 2.992 N/A SER 43.A OG GLN 40.A O no hydrogen 3.108 N/A ASN 44.A N GLN 40.A O no hydrogen 2.707 N/A VAL 45.A N TRP 42.A O no hydrogen 3.283 N/A THR 46.A N SER 43.A O no hydrogen 3.478 N/A THR 46.A OG1 TRP 42.A O no hydrogen 2.598 N/A THR 49.A N THR 13.A O no hydrogen 3.427 N/A THR 49.A OG1 HIS 14.A ND1 no hydrogen 3.079 N/A THR 51.A N LEU 15.A O no hydrogen 2.987 N/A LYS 52.A NZ ASP 32.A OD1 no hydrogen 2.615 N/A VAL 53.A N TYR 17.A O no hydrogen 3.072 N/A ASP 59.A N THR 16.A O no hydrogen 2.737 N/A ILE 60.A N THR 16.A O no hydrogen 3.264 N/A MET 61.A N ASP 95.A OD1 no hydrogen 2.741 N/A ILE 62.A N ARG 18.A O no hydrogen 2.674 N/A SER 63.A N ALA 96.A O no hydrogen 3.014 N/A PHE 64.A N ASN 21.A OD1 no hydrogen 2.762 N/A VAL 65.A N PHE 98.A O no hydrogen 3.127 N/A GLY 67.A N ASP 101.A OD2 no hydrogen 3.370 N/A HIS 69.A ND1 GLY 67.A O no hydrogen 3.004 N/A SER 73.A N ASP 71.A OD1 no hydrogen 3.192 N/A SER 73.A OG HIS 84.A ND1 no hydrogen 3.412 N/A PHE 75.A N GLY 67.A O no hydrogen 2.630 N/A GLY 79.A N GLU 102.A OE1 no hydrogen 3.301 N/A ASN 81.A N ASP 76.A OD2 no hydrogen 3.033 N/A HIS 84.A N HIS 97.A O no hydrogen 3.097 N/A HIS 84.A NE2 ASP 71.A OD2 no hydrogen 2.893 N/A HIS 84.A NE2 HIS 97.A ND1 no hydrogen 3.090 N/A PHE 86.A N ASP 95.A O no hydrogen 2.841 N/A GLY 93.A N PRO 90.A O no hydrogen 2.930 N/A GLY 94.A N GLN 87.A O no hydrogen 2.838 N/A ASP 95.A N ILE 92.A O no hydrogen 3.207 N/A ALA 96.A N MET 61.A O no hydrogen 3.118 N/A HIS 97.A N HIS 84.A O no hydrogen 2.943 N/A HIS 97.A ND1 ASP 71.A OD2 no hydrogen 3.104 N/A HIS 97.A ND1 HIS 84.A NE2 no hydrogen 3.090 N/A PHE 98.A N SER 63.A O no hydrogen 2.927 N/A ASP 99.A N LEU 82.A O no hydrogen 2.816 N/A GLU 100.A N VAL 65.A O no hydrogen 2.603 N/A ASP 101.A N ASP 99.A OD1 no hydrogen 3.128 N/A GLU 102.A N ASP 99.A O no hydrogen 2.841 N/A TRP 104.A NE1 ASP 99.A O no hydrogen 3.196 N/A THR 105.A N TYR 111.A O no hydrogen 3.056 N/A THR 105.A OG1 ARG 109.A O no hydrogen 3.355 N/A ASN 112.A N TYR 141.A OH no hydrogen 3.080 N/A ASN 112.A ND2 ASN 107.A O no hydrogen 2.957 N/A LEU 113.A N THR 105.A O no hydrogen 2.727 N/A HIS 114.A ND1 ALA 34.A O no hydrogen 3.053 N/A ARG 115.A N ASN 112.A OD1 no hydrogen 2.929 N/A ARG 115.A NE THR 142.A O no hydrogen 3.059 N/A ARG 115.A NH1 ARG 115.A O no hydrogen 2.809 N/A VAL 116.A N ASN 112.A O no hydrogen 3.353 N/A ALA 117.A N LEU 113.A O no hydrogen 2.901 N/A ALA 118.A N HIS 114.A O no hydrogen 3.008 N/A HIS 119.A ND1 LEU 136.A O no hydrogen 3.172 N/A HIS 119.A NE2 HIS 123.A NE2 no hydrogen 2.968 N/A ALA 120.A N VAL 116.A O no hydrogen 3.273 N/A LEU 121.A N ALA 117.A O no hydrogen 2.907 N/A GLY 122.A N HIS 119.A O no hydrogen 2.581 N/A HIS 123.A N ALA 120.A O no hydrogen 2.847 N/A HIS 123.A ND1 LEU 127.A O no hydrogen 3.093 N/A HIS 123.A NE2 HIS 119.A NE2 no hydrogen 2.968 N/A HIS 123.A NE2 HIS 129.A NE2 no hydrogen 3.045 N/A SER 124.A N ALA 120.A O no hydrogen 3.163 N/A SER 124.A OG GLY 94.A O no hydrogen 3.400 N/A LEU 125.A N GLY 122.A O no hydrogen 3.298 N/A GLY 126.A N HIS 123.A O no hydrogen 3.254 N/A LEU 127.A N GLY 122.A O no hydrogen 2.873 N/A SER 128.A N VAL 2.A O no hydrogen 2.812 N/A SER 128.A OG THR 4.A OG1 no hydrogen 2.819 N/A SER 130.A N MET 137.A O no hydrogen 2.625 N/A SER 130.A OG ASP 152.A OD2 no hydrogen 2.779 N/A ASP 132.A N SER 130.A OG no hydrogen 3.005 N/A GLY 134.A N ASP 132.A OD1 no hydrogen 2.680 N/A ALA 135.A N ASP 132.A O no hydrogen 3.062 N/A LEU 136.A N ASP 153.A OD2 no hydrogen 2.642 N/A MET 137.A N ASP 153.A OD1 no hydrogen 3.070 N/A SER 140.A N TYR 138.A O no hydrogen 2.409 N/A ALA 150.A N ASP 153.A OD2 no hydrogen 2.993 N/A GLN 151.A N PRO 173.A O no hydrogen 3.217 N/A GLN 151.A NE2 ASP 155.A OD1 no hydrogen 2.933 N/A ILE 154.A N ALA 150.A O no hydrogen 3.037 N/A ASP 155.A N GLN 151.A O no hydrogen 2.965 N/A GLY 156.A N ASP 152.A O no hydrogen 3.074 N/A ILE 157.A N ASP 153.A O no hydrogen 2.978 N/A GLN 158.A N ILE 154.A O no hydrogen 3.052 N/A GLN 158.A NE2 VAL 45.A O no hydrogen 3.159 N/A ALA 159.A N GLY 156.A O no hydrogen 3.215 N/A ILE 160.A N ILE 157.A O no hydrogen 3.259 N/A TYR 161.A N ILE 157.A O no hydrogen 3.144 N/A TYR 161.A OH LEU 125.A O no hydrogen 2.276 N/A GLY 162.A N GLN 158.A O no hydrogen 3.099 N/A SER 164.A OG ASN 44.A O no hydrogen 3.285 N/A ASN 166.A N SER 164.A OG no hydrogen 3.279 N/A VAL 168.A N ASN 166.A OD1 no hydrogen 3.087 N/A GLY 172.A N GLN 151.A OE1 no hydrogen 2.947 N/A THR 175.A OG1 ASP 132.A OD1 no hydrogen 2.870 N/A CYS 179.A SG ASN 366.A O no hydrogen 3.307 N/A LEU 183.A N ASP 180.A O no hydrogen 3.119 N/A ASP 186.A N PHE 198.A O no hydrogen 2.919 N/A THR 189.A N MET 196.A O no hydrogen 2.974 N/A THR 190.A OG1 GLU 234.A OE1 no hydrogen 3.475 N/A ARG 192.A N GLU 234.A OE2 no hydrogen 2.664 N/A ARG 192.A NE ASP 239.A OD1 no hydrogen 3.172 N/A ARG 192.A NE ASP 239.A OD2 no hydrogen 3.176 N/A ARG 192.A NH2 ASP 239.A OD2 no hydrogen 2.638 N/A GLU 194.A N ILE 191.A O no hydrogen 3.048 N/A VAL 195.A N THR 206.A O no hydrogen 2.961 N/A MET 196.A N THR 189.A O no hydrogen 2.889 N/A PHE 197.A N MET 204.A O no hydrogen 3.270 N/A PHE 198.A N ALA 187.A O no hydrogen 2.771 N/A LYS 199.A N PHE 202.A O no hydrogen 2.885 N/A LYS 199.A NZ ASP 186.A OD1 no hydrogen 3.004 N/A ASP 200.A N ASP 186.A OD2 no hydrogen 3.034 N/A PHE 202.A N LYS 199.A O no hydrogen 3.152 N/A TYR 203.A N ASN 216.A O no hydrogen 2.815 N/A TYR 203.A OH GLU 214.A OE2 no hydrogen 3.083 N/A MET 204.A N PHE 197.A O no hydrogen 2.834 N/A ARG 205.A N GLU 214.A O no hydrogen 2.879 N/A ARG 205.A NE GLU 194.A OE1 no hydrogen 3.219 N/A ARG 205.A NE GLU 194.A OE2 no hydrogen 2.912 N/A THR 206.A N VAL 195.A O no hydrogen 2.941 N/A TYR 210.A N ASN 207.A O no hydrogen 3.066 N/A GLU 214.A N ARG 205.A O no hydrogen 3.081 N/A ASN 216.A N TYR 203.A O no hydrogen 3.143 N/A ASN 216.A ND2 GLU 214.A OE2 no hydrogen 3.062 N/A ILE 218.A N ARG 201.A O no hydrogen 2.812 N/A VAL 220.A N PHE 217.A O no hydrogen 2.889 N/A PHE 221.A N ILE 218.A O no hydrogen 3.397 N/A TRP 222.A N ILE 218.A O no hydrogen 3.231 N/A TRP 222.A NE1 GLY 254.A O no hydrogen 3.129 N/A LEU 225.A N TRP 222.A O no hydrogen 3.306 N/A ASN 227.A ND2 SER 144.A OG no hydrogen 3.162 N/A GLU 230.A N PHE 244.A O no hydrogen 2.696 N/A TYR 233.A N ARG 242.A O no hydrogen 3.068 N/A TYR 233.A OH GLU 303.A OE1 no hydrogen 3.378 N/A TYR 233.A OH GLU 303.A OE2 no hydrogen 3.106 N/A PHE 235.A N GLU 240.A O no hydrogen 2.735 N/A ARG 238.A N PHE 235.A O no hydrogen 3.125 N/A ASP 239.A N ALA 236.A O no hydrogen 2.621 N/A GLU 240.A N PHE 235.A O no hydrogen 3.261 N/A VAL 241.A N VAL 252.A O no hydrogen 2.932 N/A ARG 242.A N TYR 233.A O no hydrogen 3.039 N/A ARG 242.A NE GLU 240.A OE1 no hydrogen 2.990 N/A ARG 242.A NH1 TYR 233.A OH no hydrogen 2.843 N/A ARG 242.A NH1 GLU 303.A OE1 no hydrogen 3.165 N/A ARG 242.A NH2 GLU 240.A OE1 no hydrogen 3.055 N/A PHE 243.A N TRP 250.A O no hydrogen 2.745 N/A PHE 244.A N ALA 231.A O no hydrogen 2.843 N/A LYS 245.A N LYS 248.A O no hydrogen 3.110 N/A LYS 245.A NZ ASN 227.A O no hydrogen 3.340 N/A LYS 248.A N LYS 245.A O no hydrogen 3.515 N/A LYS 248.A NZ ASN 247.A OD1 no hydrogen 2.564 N/A TYR 249.A N LYS 263.A O no hydrogen 2.732 N/A TRP 250.A N PHE 243.A O no hydrogen 2.829 N/A VAL 252.A N VAL 241.A O no hydrogen 2.814 N/A GLN 253.A N ASN 256.A O no hydrogen 2.984 N/A ASN 256.A N GLN 253.A O no hydrogen 3.359 N/A LEU 258.A N ALA 251.A O no hydrogen 3.099 N/A LYS 263.A N TYR 249.A O no hydrogen 2.811 N/A ILE 265.A N ASN 247.A O no hydrogen 2.859 N/A TYR 266.A OH VAL 275.A O no hydrogen 2.761 N/A SER 267.A N ASP 264.A OD1 no hydrogen 2.559 N/A SER 267.A OG ASP 264.A OD2 no hydrogen 2.772 N/A SER 268.A N ASP 264.A O no hydrogen 3.389 N/A SER 268.A OG ASP 264.A O no hydrogen 3.213 N/A PHE 269.A N ILE 265.A O no hydrogen 2.968 N/A VAL 275.A N PRO 272.A O no hydrogen 2.978 N/A LYS 276.A NZ ARG 273.A O no hydrogen 2.982 N/A ASP 279.A N PHE 293.A O no hydrogen 2.827 N/A LEU 282.A N TYR 291.A O no hydrogen 3.109 N/A SER 283.A OG GLU 234.A O no hydrogen 2.805 N/A GLU 284.A N LYS 289.A O no hydrogen 2.894 N/A LYS 289.A NZ ASP 302.A OD2 no hydrogen 3.019 N/A LYS 289.A NZ ASP 309.A OD2 no hydrogen 3.264 N/A THR 290.A N TYR 301.A O no hydrogen 2.837 N/A TYR 291.A N LEU 282.A O no hydrogen 2.713 N/A PHE 292.A N TRP 299.A O no hydrogen 3.000 N/A PHE 293.A N ALA 280.A O no hydrogen 2.974 N/A VAL 294.A N LYS 297.A O no hydrogen 2.757 N/A ALA 295.A N ASP 279.A OD2 no hydrogen 3.002 N/A LYS 297.A N VAL 294.A O no hydrogen 3.143 N/A LYS 297.A NZ ASN 296.A OD1 no hydrogen 3.382 N/A TYR 298.A N LYS 314.A O no hydrogen 2.772 N/A TYR 298.A OH ASP 319.A OD2 no hydrogen 2.636 N/A TRP 299.A N PHE 292.A O no hydrogen 2.929 N/A ARG 300.A NH1 TYR 291.A OH no hydrogen 3.536 N/A ARG 300.A NH2 ASP 309.A OD2 no hydrogen 3.161 N/A TYR 301.A N THR 290.A O no hydrogen 2.685 N/A ASP 302.A N SER 307.A O no hydrogen 3.160 N/A GLU 303.A N GLY 288.A O no hydrogen 2.919 N/A TYR 304.A OH ASN 286.A O no hydrogen 2.993 N/A LYS 305.A N ASP 302.A OD1 no hydrogen 2.906 N/A SER 307.A N ASP 302.A O no hydrogen 3.491 N/A SER 307.A OG MET 308.A O no hydrogen 3.064 N/A ASP 309.A N ARG 300.A O no hydrogen 3.061 N/A LYS 314.A N TYR 298.A O no hydrogen 3.312 N/A LYS 314.A NZ GLY 311.A O no hydrogen 3.062 N/A ILE 316.A N ASN 296.A O no hydrogen 2.743 N/A PHE 320.A N ILE 316.A O no hydrogen 2.976 N/A HIS 325.A N HIS 325.A ND1 no hydrogen 2.727 N/A ASP 328.A N PHE 340.A O no hydrogen 2.759 N/A ALA 329.A N PHE 340.A O no hydrogen 3.148 N/A LYS 333.A N PHE 336.A O no hydrogen 3.088 N/A PHE 336.A N LYS 333.A O no hydrogen 3.397 N/A PHE 337.A N PHE 348.A O no hydrogen 2.959 N/A TYR 338.A N PHE 331.A O no hydrogen 2.897 N/A PHE 339.A N TYR 346.A O no hydrogen 2.941 N/A PHE 340.A N ALA 329.A O no hydrogen 2.765 N/A HIS 341.A N ARG 344.A O no hydrogen 3.040 N/A ARG 344.A N HIS 341.A O no hydrogen 2.920 N/A ARG 344.A NH1 TYR 346.A OH no hydrogen 2.516 N/A GLN 345.A N GLN 359.A O no hydrogen 2.677 N/A GLN 345.A NE2 LYS 360.A O no hydrogen 3.084 N/A TYR 346.A N PHE 339.A O no hydrogen 2.815 N/A LYS 347.A N THR 357.A O no hydrogen 3.084 N/A PHE 348.A N PHE 337.A O no hydrogen 2.785 N/A ASP 349.A N ARG 354.A O no hydrogen 2.994 N/A THR 352.A OG1 ASP 349.A OD2 no hydrogen 2.830 N/A LYS 353.A N PRO 350.A O no hydrogen 3.285 N/A LYS 353.A NZ ASP 319.A O no hydrogen 2.645 N/A ARG 354.A N ASP 349.A O no hydrogen 3.328 N/A LEU 356.A N LYS 347.A O no hydrogen 3.039 N/A GLN 359.A N GLN 345.A O no hydrogen 2.888 N/A ALA 361.A N THR 343.A O no hydrogen 2.746 N/A ASN 362.A ND2 ALA 178.A O no hydrogen 3.670 N/A SER 363.A N LYS 360.A O no hydrogen 2.954 N/A PHE 365.A N ASN 362.A O no hydrogen 2.920 N/A