Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l7u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 125.A O no hydrogen 3.338 N/A LYS 1.A NZ LYS 126.A O no hydrogen 2.933 N/A LYS 1.A NZ VAL 128.A O no hydrogen 2.614 N/A GLN 4.A N VAL 131.A O no hydrogen 2.972 N/A GLN 4.A NE2 GLU 130.A OE1 no hydrogen 3.199 N/A SER 7.A N ASP 136.A OD2 no hydrogen 2.740 N/A SER 7.A OG ASP 136.A OD1 no hydrogen 2.606 N/A SER 7.A OG ASP 136.A OD2 no hydrogen 3.036 N/A THR 12.A N ASP 9.A OD1 no hydrogen 3.133 N/A THR 12.A OG1 ASP 9.A OD1 no hydrogen 2.737 N/A THR 12.A OG1 ASP 9.A OD2 no hydrogen 3.087 N/A GLN 13.A N ASP 9.A O no hydrogen 2.829 N/A LYS 14.A N PRO 10.A O no hydrogen 2.879 N/A LEU 15.A N ALA 11.A O no hydrogen 3.157 N/A ILE 16.A N THR 12.A O no hydrogen 3.178 N/A THR 17.A N GLN 13.A O no hydrogen 2.935 N/A THR 17.A OG1 GLN 13.A O no hydrogen 2.716 N/A ASN 18.A N LYS 14.A O no hydrogen 2.855 N/A ASN 18.A ND2 TYR 258.A OH no hydrogen 2.788 N/A ILE 19.A N LEU 15.A O no hydrogen 2.979 N/A PHE 20.A N ILE 16.A O no hydrogen 3.144 N/A SER 21.A N ASN 18.A O no hydrogen 3.110 N/A MET 24.A N SER 21.A OG no hydrogen 3.097 N/A PHE 25.A N SER 21.A O no hydrogen 3.042 N/A LYS 26.A N LYS 22.A O no hydrogen 2.805 N/A ASN 27.A N GLU 23.A O no hydrogen 2.695 N/A THR 28.A N MET 24.A O no hydrogen 2.837 N/A THR 28.A OG1 MET 24.A O no hydrogen 2.710 N/A MET 29.A N PHE 25.A O no hydrogen 3.064 N/A ALA 30.A N LYS 26.A O no hydrogen 3.037 N/A LEU 31.A N ASN 27.A O no hydrogen 3.052 N/A MET 32.A N THR 28.A O no hydrogen 3.169 N/A ASP 33.A N ALA 30.A O no hydrogen 3.142 N/A LEU 34.A N MET 29.A O no hydrogen 2.877 N/A ASP 35.A N PRO 82.A O no hydrogen 2.785 N/A LYS 38.A N ASP 35.A O no hydrogen 3.292 N/A MET 39.A N ASP 35.A O no hydrogen 2.918 N/A LYS 43.A N PRO 40.A O no hydrogen 2.762 N/A LEU 44.A N PRO 40.A O no hydrogen 2.979 N/A LYS 46.A NZ GLU 113.A OE1 no hydrogen 3.081 N/A LYS 46.A NZ GLU 113.A OE2 no hydrogen 2.944 N/A GLN 48.A N SER 45.A OG no hydrogen 3.382 N/A GLN 48.A NE2 VAL 80.A O no hydrogen 3.313 N/A ILE 49.A N SER 45.A O no hydrogen 3.295 N/A ALA 50.A N LYS 46.A O no hydrogen 3.193 N/A ARG 51.A N GLN 47.A O no hydrogen 3.034 N/A GLY 52.A N GLN 48.A O no hydrogen 2.998 N/A PHE 53.A N ILE 49.A O no hydrogen 2.788 N/A GLU 54.A N ALA 50.A O no hydrogen 2.799 N/A ALA 55.A N ARG 51.A O no hydrogen 2.885 N/A LEU 56.A N GLY 52.A O no hydrogen 3.026 N/A GLU 57.A N PHE 53.A O no hydrogen 2.829 N/A ALA 58.A N GLU 54.A O no hydrogen 3.225 N/A LEU 59.A N ALA 55.A O no hydrogen 3.451 N/A GLU 60.A N LEU 56.A O no hydrogen 3.012 N/A ALA 62.A N LEU 59.A O no hydrogen 3.103 N/A LEU 63.A N LEU 59.A O no hydrogen 3.280 N/A LYS 64.A N GLU 60.A O no hydrogen 3.379 N/A GLU 72.A N SER 69.A OG no hydrogen 3.028 N/A LEU 73.A N SER 69.A O no hydrogen 3.084 N/A SER 74.A OG LEU 70.A O no hydrogen 2.547 N/A SER 75.A N GLU 71.A O no hydrogen 3.425 N/A TYR 78.A N SER 74.A O no hydrogen 3.099 N/A THR 79.A N SER 75.A O no hydrogen 3.019 N/A THR 79.A OG1 SER 75.A O no hydrogen 2.653 N/A VAL 80.A N HIS 76.A O no hydrogen 2.938 N/A ILE 81.A N PHE 77.A O no hydrogen 2.783 N/A HIS 83.A ND1 ILE 81.A O no hydrogen 3.141 N/A ASN 84.A N ASP 33.A O no hydrogen 2.837 N/A ILE 93.A N SER 74.A OG no hydrogen 3.081 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 3.109 N/A LEU 98.A N SER 95.A OG no hydrogen 3.272 N/A LEU 99.A N SER 95.A O no hydrogen 3.026 N/A GLN 100.A N PRO 96.A O no hydrogen 3.083 N/A GLN 100.A NE2 ASP 104.A OD1 no hydrogen 3.479 N/A GLN 100.A NE2 HIS 224.A O no hydrogen 3.180 N/A ALA 101.A N GLU 97.A O no hydrogen 2.981 N/A LYS 102.A N LEU 98.A O no hydrogen 2.886 N/A LYS 103.A N GLN 100.A O no hydrogen 3.199 N/A LYS 103.A NZ GLU 60.A OE1 no hydrogen 2.785 N/A ASP 104.A N GLN 100.A O no hydrogen 2.837 N/A MET 105.A N ALA 101.A O no hydrogen 3.119 N/A LEU 107.A N LYS 103.A O no hydrogen 3.137 N/A VAL 108.A N MET 105.A O no hydrogen 3.297 N/A LEU 109.A N MET 105.A O no hydrogen 3.176 N/A ALA 110.A N LEU 106.A O no hydrogen 3.064 N/A ASP 111.A N VAL 108.A O no hydrogen 2.879 N/A ILE 112.A N VAL 108.A O no hydrogen 2.890 N/A GLU 113.A N LEU 109.A O no hydrogen 2.762 N/A LEU 114.A N ALA 110.A O no hydrogen 2.888 N/A ALA 115.A N ASP 111.A O no hydrogen 3.199 N/A GLN 116.A N ILE 112.A O no hydrogen 3.328 N/A ALA 117.A N GLU 113.A O no hydrogen 2.873 N/A LEU 118.A N LEU 114.A O no hydrogen 2.808 N/A GLN 119.A N ALA 115.A O no hydrogen 3.330 N/A GLN 119.A N GLN 116.A O no hydrogen 3.039 N/A GLN 119.A NE2 ASP 138.A OD1 no hydrogen 3.327 N/A ALA 120.A N ALA 117.A O no hydrogen 3.282 N/A SER 122.A N GLU 125.A OE1 no hydrogen 3.157 N/A GLU 125.A N SER 122.A O no hydrogen 3.195 N/A LYS 126.A N GLU 123.A O no hydrogen 3.240 N/A LYS 126.A NZ VAL 121.A O no hydrogen 3.532 N/A THR 127.A N GLU 123.A O no hydrogen 2.976 N/A THR 127.A OG1 GLN 124.A O no hydrogen 3.361 N/A VAL 131.A N ARG 2.A O no hydrogen 2.804 N/A LEU 135.A N HIS 133.A ND1 no hydrogen 3.023 N/A ARG 137.A N HIS 133.A O no hydrogen 3.031 N/A ARG 137.A N PRO 134.A O no hydrogen 3.108 N/A ARG 137.A NE GLU 125.A OE2 no hydrogen 2.899 N/A ARG 137.A NH1 GLN 119.A O no hydrogen 3.561 N/A ARG 137.A NH1 ALA 120.A O no hydrogen 3.181 N/A ARG 137.A NH1 GLU 125.A OE1 no hydrogen 2.816 N/A ARG 137.A NH2 GLN 119.A O no hydrogen 3.375 N/A ASP 138.A N PRO 134.A O no hydrogen 3.044 N/A TYR 139.A N LEU 135.A O no hydrogen 3.033 N/A GLN 140.A N ASP 136.A O no hydrogen 3.153 N/A LEU 141.A N ARG 137.A O no hydrogen 2.921 N/A LYS 143.A N GLN 140.A O no hydrogen 3.263 N/A CYS 144.A SG ASN 182.A O no hydrogen 3.930 N/A GLN 145.A N ASN 182.A O no hydrogen 3.079 N/A LEU 146.A N TYR 139.A OH no hydrogen 3.441 N/A GLN 147.A N LYS 180.A O no hydrogen 2.721 N/A LEU 149.A N ILE 178.A O no hydrogen 2.813 N/A GLY 152.A N ASP 150.A OD2 no hydrogen 2.968 N/A TYR 156.A N ALA 153.A O no hydrogen 3.314 N/A ILE 159.A N GLU 155.A O no hydrogen 3.289 N/A GLN 160.A N TYR 156.A O no hydrogen 3.018 N/A THR 161.A N LYS 157.A O no hydrogen 3.426 N/A THR 161.A OG1 LYS 157.A O no hydrogen 2.850 N/A TYR 162.A N VAL 158.A O no hydrogen 3.225 N/A TYR 162.A OH LEU 201.A O no hydrogen 2.355 N/A LEU 163.A N ILE 159.A O no hydrogen 2.922 N/A GLU 164.A N GLN 160.A O no hydrogen 3.030 N/A GLN 165.A N THR 161.A O no hydrogen 2.897 N/A THR 166.A N TYR 162.A O no hydrogen 3.340 N/A THR 166.A OG1 TYR 162.A O no hydrogen 2.675 N/A SER 168.A OG ARG 171.A O no hydrogen 2.647 N/A THR 174.A N HIS 352.A O no hydrogen 2.874 N/A GLN 176.A N GLU 350.A O no hydrogen 2.759 N/A TRP 179.A N LEU 348.A O no hydrogen 2.682 N/A TRP 179.A NE1 THR 12.A OG1 no hydrogen 3.034 N/A LYS 180.A N GLN 147.A O no hydrogen 2.612 N/A LYS 180.A NZ GLU 155.A OE2 no hydrogen 2.761 N/A VAL 181.A N ARG 346.A O no hydrogen 2.960 N/A ASN 182.A N GLN 145.A O no hydrogen 2.952 N/A GLN 183.A NE2 LEU 215.A O no hydrogen 2.758 N/A GLU 186.A N GLN 183.A O no hydrogen 3.378 N/A GLN 191.A N GLU 187.A O no hydrogen 3.079 N/A HIS 193.A N PHE 190.A O no hydrogen 3.030 N/A HIS 193.A NE2 SER 341.A OG no hydrogen 3.287 N/A LEU 196.A N HIS 193.A O no hydrogen 3.065 N/A ASN 198.A ND2 GLY 267.A O no hydrogen 2.790 N/A ASN 198.A ND2 GLU 269.A OE2 no hydrogen 3.004 N/A ARG 199.A NH2 SER 194.A O no hydrogen 3.384 N/A LYS 200.A N VAL 264.A O no hydrogen 2.943 N/A LYS 200.A NZ TYR 335.A OH no hydrogen 3.555 N/A LEU 201.A N VAL 313.A O no hydrogen 2.940 N/A LEU 202.A N GLY 262.A O no hydrogen 3.022 N/A TRP 203.A N ALA 236.A O no hydrogen 3.153 N/A HIS 204.A N PHE 260.A O no hydrogen 3.189 N/A HIS 204.A ND1 TYR 234.A O no hydrogen 2.687 N/A VAL 210.A N ASN 207.A O no hydrogen 3.123 N/A ILE 214.A N VAL 210.A O no hydrogen 3.010 N/A LEU 215.A N VAL 211.A O no hydrogen 2.856 N/A THR 216.A N ALA 213.A O no hydrogen 3.045 N/A THR 216.A OG1 ALA 212.A O no hydrogen 2.714 N/A SER 217.A N ALA 213.A O no hydrogen 2.728 N/A GLY 218.A N ILE 214.A O no hydrogen 2.911 N/A ARG 220.A NE GLY 218.A O no hydrogen 3.214 N/A ARG 220.A NH2 GLY 218.A O no hydrogen 3.563 N/A ILE 221.A N GLU 340.A OE2 no hydrogen 2.982 N/A HIS 224.A NE2 GLU 57.A OE2 no hydrogen 2.979 N/A SER 225.A N MET 222.A O no hydrogen 2.983 N/A SER 225.A OG MET 222.A O no hydrogen 2.947 N/A ARG 228.A NE ASP 275.A OD2 no hydrogen 2.534 N/A ARG 228.A NH2 ASP 275.A OD1 no hydrogen 2.949 N/A ARG 228.A NH2 ASP 275.A OD2 no hydrogen 3.078 N/A ARG 228.A NH2 THR 329.A O no hydrogen 2.652 N/A VAL 229.A N TYR 234.A OH no hydrogen 3.110 N/A GLY 230.A N GLY 227.A O no hydrogen 3.332 N/A LYS 231.A N LEU 279.A O no hydrogen 2.962 N/A ILE 233.A N ILE 337.A O no hydrogen 2.962 N/A TYR 234.A OH GLY 230.A O no hydrogen 2.880 N/A PHE 235.A N TYR 335.A O no hydrogen 2.946 N/A SER 237.A OG GLU 296.A OE2 no hydrogen 2.707 N/A SER 237.A OG TYR 335.A OH no hydrogen 3.289 N/A ASN 239.A N THR 166.A OG1 no hydrogen 3.063 N/A SER 240.A N THR 166.A O no hydrogen 3.099 N/A LYS 241.A NZ TYR 245.A OH no hydrogen 3.458 N/A LYS 241.A NZ GLU 334.A OE2 no hydrogen 3.311 N/A ALA 243.A N ASN 239.A O no hydrogen 3.055 N/A TYR 245.A N SER 242.A O no hydrogen 3.198 N/A VAL 246.A N ALA 243.A O no hydrogen 3.366 N/A MET 249.A N VAL 256.A O no hydrogen 3.036 N/A CYS 251.A N HIS 254.A O no hydrogen 2.985 N/A CYS 251.A SG LYS 250.A O no hydrogen 3.586 N/A VAL 256.A N MET 249.A O no hydrogen 2.695 N/A GLY 257.A N VAL 351.A O no hydrogen 3.060 N/A TYR 258.A OH GLU 350.A OE1 no hydrogen 3.255 N/A MET 259.A N LEU 349.A O no hydrogen 3.105 N/A PHE 260.A N HIS 204.A O no hydrogen 2.958 N/A LEU 261.A N TYR 347.A O no hydrogen 2.874 N/A GLY 262.A N LEU 202.A O no hydrogen 3.126 N/A GLU 263.A N ARG 344.A O no hydrogen 2.743 N/A VAL 264.A N LYS 200.A O no hydrogen 2.893 N/A ALA 265.A N GLN 342.A O no hydrogen 3.235 N/A LEU 266.A N ASN 198.A O no hydrogen 3.390 N/A GLY 267.A N GLY 197.A O no hydrogen 3.183 N/A ARG 268.A N ASP 287.A OD2 no hydrogen 2.931 N/A HIS 270.A N SER 288.A O no hydrogen 2.882 N/A ILE 272.A N ILE 290.A O no hydrogen 3.030 N/A THR 274.A OG1 ASN 273.A OD1 no hydrogen 3.009 N/A ASN 276.A N ARG 228.A O no hydrogen 2.934 N/A SER 278.A OG ASN 276.A OD1 no hydrogen 2.615 N/A LEU 279.A N ASN 276.A O no hydrogen 3.395 N/A LYS 280.A NZ SER 278.A O no hydrogen 2.961 N/A PHE 286.A N PRO 283.A O no hydrogen 3.210 N/A ASP 287.A N ARG 268.A O no hydrogen 3.253 N/A SER 288.A OG LEU 266.A O no hydrogen 2.645 N/A VAL 289.A N LEU 336.A O no hydrogen 3.078 N/A ILE 290.A N HIS 270.A O no hydrogen 2.922 N/A ALA 291.A N GLU 334.A O no hydrogen 2.816 N/A ARG 292.A N ILE 272.A O no hydrogen 2.818 N/A GLY 293.A N SER 333.A OG no hydrogen 3.221 N/A HIS 294.A N PHE 330.A O no hydrogen 3.286 N/A HIS 294.A N SER 331.A O no hydrogen 2.939 N/A HIS 294.A NE2 SER 328.A O no hydrogen 2.472 N/A THR 295.A N SER 331.A O no hydrogen 3.273 N/A THR 295.A OG1 GLU 238.A OE1 no hydrogen 3.486 N/A THR 295.A OG1 SER 331.A O no hydrogen 3.495 N/A GLU 296.A N VAL 320.A O no hydrogen 3.046 N/A ASP 298.A N GLN 318.A O no hydrogen 3.418 N/A GLN 301.A N ASP 298.A O no hydrogen 2.991 N/A THR 303.A N VAL 314.A O no hydrogen 2.854 N/A LEU 305.A N VAL 312.A O no hydrogen 3.047 N/A LEU 307.A N GLN 310.A O no hydrogen 3.140 N/A GLN 310.A N LEU 307.A O no hydrogen 3.310 N/A GLN 311.A NE2 GLU 304.A OE1 no hydrogen 2.743 N/A VAL 312.A N LEU 305.A O no hydrogen 3.013 N/A VAL 313.A N ARG 199.A O no hydrogen 2.662 N/A VAL 314.A N THR 303.A O no hydrogen 2.731 N/A GLN 316.A NE2 VAL 158.A O no hydrogen 2.807 N/A GLN 316.A NE2 PRO 315.A O no hydrogen 3.648 N/A GLN 318.A NE2 GLN 165.A OE1 no hydrogen 3.382 N/A VAL 320.A N GLU 296.A O no hydrogen 2.726 N/A CYS 322.A N HIS 294.A O no hydrogen 2.686 N/A CYS 322.A SG VAL 320.A O no hydrogen 3.957 N/A PHE 325.A N CYS 322.A O no hydrogen 3.218 N/A SER 326.A N PRO 323.A O no hydrogen 3.465 N/A SER 326.A OG PRO 323.A O no hydrogen 3.199 N/A SER 328.A N PHE 325.A O no hydrogen 3.043 N/A SER 328.A OG ARG 292.A O no hydrogen 2.477 N/A THR 329.A N ASN 273.A O no hydrogen 2.868 N/A THR 329.A OG1 ASN 273.A O no hydrogen 2.872 N/A THR 329.A OG1 ASP 275.A OD1 no hydrogen 2.828 N/A GLN 332.A NE2 GLU 238.A OE1 no hydrogen 2.698 N/A GLN 332.A NE2 SER 240.A OG no hydrogen 2.614 N/A SER 333.A OG GLU 296.A OE1 no hydrogen 2.576 N/A GLU 334.A N ALA 291.A O no hydrogen 3.053 N/A TYR 335.A N PHE 235.A O no hydrogen 2.621 N/A TYR 335.A OH SER 237.A OG no hydrogen 3.289 N/A LEU 336.A N VAL 289.A O no hydrogen 2.940 N/A TYR 338.A OH VAL 229.A O no hydrogen 2.737 N/A SER 341.A OG HIS 193.A NE2 no hydrogen 3.287 N/A GLN 342.A N GLN 339.A O no hydrogen 3.155 N/A CYS 343.A N GLU 340.A O no hydrogen 2.879 N/A CYS 343.A SG GLU 263.A O no hydrogen 3.856 N/A ARG 344.A NH2 ASN 182.A OD1 no hydrogen 2.754 N/A LEU 345.A N GLU 186.A OE1 no hydrogen 3.112 N/A ARG 346.A N LEU 261.A O no hydrogen 2.722 N/A ARG 346.A NE GLU 263.A OE1 no hydrogen 2.631 N/A TYR 347.A N LEU 261.A O no hydrogen 2.991 N/A TYR 347.A OH GLU 155.A OE2 no hydrogen 3.380 N/A LEU 348.A N TRP 179.A O no hydrogen 2.875 N/A LEU 349.A N MET 259.A O no hydrogen 2.892 N/A GLU 350.A N HIS 177.A O no hydrogen 2.764 N/A VAL 351.A N GLY 257.A O no hydrogen 2.791 N/A HIS 352.A N THR 174.A O no hydrogen 2.666 N/A HIS 352.A ND1 HIS 254.A ND1 no hydrogen 2.979 N/A HIS 352.A NE2 GLU 350.A OE2 no hydrogen 2.915 N/A