Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i3l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLU 33.A O no hydrogen 2.609 N/A SER 6.A OG HIS 37.A NE2 no hydrogen 2.834 N/A SER 6.A OG HIS 64.A ND1 no hydrogen 2.789 N/A VAL 7.A N ASP 35.A O no hydrogen 3.322 N/A VAL 8.A N VAL 66.A O no hydrogen 2.787 N/A GLU 9.A N HIS 37.A O no hydrogen 2.920 N/A MET 10.A N VAL 68.A O no hydrogen 3.048 N/A GLN 11.A N TYR 39.A O no hydrogen 3.136 N/A ASP 13.A N ALA 71.A O no hydrogen 3.013 N/A MET 15.A N THR 267.A O no hydrogen 3.081 N/A THR 16.A OG1 ASP 13.A O no hydrogen 2.576 N/A THR 16.A OG1 ALA 71.A O no hydrogen 3.514 N/A ARG 17.A N ASP 13.A O no hydrogen 3.091 N/A ARG 17.A NH1 GLY 12.A O no hydrogen 2.927 N/A ARG 17.A NH1 ASP 40.A OD1 no hydrogen 3.199 N/A ILE 18.A N GLU 14.A O no hydrogen 3.477 N/A ILE 19.A N MET 15.A O no hydrogen 3.096 N/A TRP 20.A N THR 16.A O no hydrogen 2.830 N/A TRP 20.A NE1 GLU 9.A OE2 no hydrogen 2.740 N/A GLU 21.A N ARG 17.A O no hydrogen 3.163 N/A LEU 22.A N ILE 18.A O no hydrogen 3.244 N/A ILE 23.A N ILE 19.A O no hydrogen 2.809 N/A LYS 24.A N TRP 20.A O no hydrogen 3.056 N/A LYS 24.A NZ GLU 9.A OE2 no hydrogen 2.935 N/A LYS 24.A NZ GLU 21.A OE1 no hydrogen 3.430 N/A GLU 25.A N GLU 21.A O no hydrogen 2.808 N/A LYS 26.A N LEU 22.A O no hydrogen 2.762 N/A LYS 26.A NZ ASP 355.A OD1 no hydrogen 2.836 N/A LEU 27.A N ILE 23.A O no hydrogen 3.143 N/A ILE 28.A N ILE 23.A O no hydrogen 3.176 N/A ILE 28.A N LYS 24.A O no hydrogen 3.396 N/A PHE 29.A N LYS 24.A O no hydrogen 2.999 N/A TYR 31.A N ILE 28.A O no hydrogen 2.905 N/A VAL 32.A N ILE 28.A O no hydrogen 2.971 N/A GLU 33.A N ILE 2.A O no hydrogen 2.648 N/A ASP 35.A N GLY 5.A O no hydrogen 2.950 N/A HIS 37.A N VAL 7.A O no hydrogen 2.799 N/A HIS 37.A NE2 SER 6.A OG no hydrogen 2.834 N/A SER 38.A OG GLU 9.A OE1 no hydrogen 2.337 N/A LEU 41.A N GLN 11.A O no hydrogen 2.834 N/A GLY 42.A N ASP 40.A OD1 no hydrogen 2.765 N/A ILE 43.A N ASP 13.A OD1 no hydrogen 2.766 N/A GLU 44.A N GLU 44.A OE2 no hydrogen 2.810 N/A ASN 45.A ND2 ASP 40.A O no hydrogen 2.567 N/A ARG 46.A N GLY 42.A O no hydrogen 3.033 N/A ARG 46.A NE LEU 41.A O no hydrogen 2.686 N/A ARG 46.A NE GLY 42.A O no hydrogen 3.459 N/A ARG 46.A NH2 ILE 73.A O no hydrogen 2.686 N/A ASP 47.A N ILE 43.A O no hydrogen 3.081 N/A ALA 48.A N GLU 44.A O no hydrogen 2.832 N/A THR 49.A N ASN 45.A O no hydrogen 3.077 N/A THR 49.A OG1 ASN 45.A O no hydrogen 3.168 N/A ASN 50.A N ASP 47.A O no hydrogen 2.730 N/A ASP 51.A N ARG 46.A O no hydrogen 2.622 N/A GLN 52.A N THR 49.A O no hydrogen 3.033 N/A GLN 52.A NE2 ASP 56.A OD1 no hydrogen 2.952 N/A VAL 53.A N THR 49.A OG1 no hydrogen 3.311 N/A THR 54.A OG1 ASP 51.A OD1 no hydrogen 2.654 N/A ASP 56.A N GLN 52.A O no hydrogen 2.868 N/A ALA 57.A N VAL 53.A O no hydrogen 2.782 N/A ALA 58.A N THR 54.A O no hydrogen 2.975 N/A GLU 59.A N LYS 55.A O no hydrogen 3.116 N/A ALA 60.A N ASP 56.A O no hydrogen 2.932 N/A ILE 61.A N ALA 57.A O no hydrogen 3.100 N/A ILE 61.A N ALA 58.A O no hydrogen 2.762 N/A LYS 62.A N ALA 58.A O no hydrogen 3.052 N/A LYS 63.A N GLU 59.A O no hydrogen 3.073 N/A HIS 64.A N ALA 60.A O no hydrogen 2.919 N/A ASN 65.A N ILE 61.A O no hydrogen 2.703 N/A GLY 67.A N VAL 259.A O no hydrogen 3.244 N/A VAL 68.A N VAL 8.A O no hydrogen 2.853 N/A LYS 69.A N ALA 261.A O no hydrogen 2.995 N/A LYS 69.A NZ CYS 70.A O no hydrogen 3.163 N/A LYS 69.A NZ THR 72.A OG1 no hydrogen 2.771 N/A LYS 69.A NZ ASN 93.A OD1 no hydrogen 3.243 N/A LYS 69.A NZ GLU 262.A OE1 no hydrogen 3.321 N/A CYS 70.A N MET 10.A O no hydrogen 2.829 N/A CYS 70.A SG ALA 71.A O no hydrogen 3.641 N/A ILE 73.A N ASP 13.A OD2 no hydrogen 2.976 N/A ARG 79.A N ASP 76.A OD1 no hydrogen 3.053 N/A ARG 79.A NH1 GLU 14.A OE2 no hydrogen 2.979 N/A ARG 79.A NH2 THR 269.A OG1 no hydrogen 2.808 N/A VAL 80.A N ASP 76.A O no hydrogen 3.100 N/A GLU 81.A N GLU 77.A O no hydrogen 3.483 N/A GLU 82.A N LYS 78.A O no hydrogen 3.414 N/A PHE 83.A N ARG 79.A O no hydrogen 3.136 N/A LYS 84.A NZ GLU 81.A O no hydrogen 3.107 N/A LEU 85.A N VAL 80.A O no hydrogen 3.255 N/A LYS 86.A N ASP 47.A OD1 no hydrogen 3.189 N/A LYS 86.A NZ ASP 47.A O no hydrogen 2.794 N/A LYS 86.A NZ ASN 50.A OD1 no hydrogen 2.545 N/A TRP 89.A NE1 ASP 47.A OD1 no hydrogen 2.669 N/A ASN 93.A ND2 SER 91.A OG no hydrogen 2.959 N/A THR 95.A N SER 91.A O no hydrogen 3.179 N/A THR 95.A OG1 SER 91.A O no hydrogen 2.859 N/A ILE 96.A N PRO 92.A O no hydrogen 2.638 N/A ARG 97.A N ASN 93.A O no hydrogen 2.552 N/A ASN 98.A N GLY 94.A O no hydrogen 3.165 N/A ILE 99.A N THR 95.A O no hydrogen 3.270 N/A LEU 100.A N ILE 96.A O no hydrogen 3.255 N/A GLY 101.A N ARG 97.A O no hydrogen 2.700 N/A THR 103.A N VAL 252.A O no hydrogen 2.987 N/A ARG 106.A N ILE 117.A O no hydrogen 3.218 N/A GLU 107.A N THR 248.A O no hydrogen 3.166 N/A ILE 109.A N MET 246.A O no hydrogen 2.929 N/A LYS 112.A N GLU 324.A OE2 no hydrogen 2.784 N/A LYS 112.A NZ GLU 324.A OE1 no hydrogen 3.568 N/A ASN 113.A ND2 ILE 323.A O no hydrogen 3.288 N/A ILE 116.A N PHE 237.A O no hydrogen 3.264 N/A ILE 117.A N ARG 106.A O no hydrogen 3.038 N/A GLY 118.A N TRP 239.A O no hydrogen 2.951 N/A HIS 120.A NE2 ASN 164.A OD1 no hydrogen 3.192 N/A PHE 124.A N ALA 159.A O no hydrogen 3.145 N/A VAL 126.A N GLY 157.A O no hydrogen 3.136 N/A GLY 130.A N PHE 152.A O no hydrogen 2.835 N/A VAL 132.A N HIS 150.A O no hydrogen 2.872 N/A ILE 134.A N TYR 147.A O no hydrogen 3.092 N/A TYR 136.A N VAL 145.A O no hydrogen 2.946 N/A GLY 141.A N PRO 138.A O no hydrogen 3.185 N/A THR 142.A OG1 ASP 140.A O no hydrogen 3.498 N/A THR 142.A OG1 ASP 140.A OD1 no hydrogen 2.585 N/A LYS 144.A N GLN 143.A OE1 no hydrogen 2.749 N/A VAL 145.A N TYR 136.A O no hydrogen 3.054 N/A TYR 147.A N ILE 134.A O no hydrogen 2.899 N/A VAL 149.A N VAL 132.A O no hydrogen 2.918 N/A HIS 150.A N VAL 132.A O no hydrogen 3.047 N/A PHE 152.A N GLY 130.A O no hydrogen 2.904 N/A GLY 157.A N VAL 126.A O no hydrogen 2.953 N/A ALA 159.A N PHE 124.A O no hydrogen 3.105 N/A ASN 164.A ND2 TYR 163.A O no hydrogen 2.572 N/A SER 168.A OG HIS 120.A NE2 no hydrogen 3.289 N/A ILE 169.A N GLN 165.A O no hydrogen 3.420 N/A GLU 170.A N ASP 166.A O no hydrogen 3.023 N/A ASP 171.A N LYS 167.A O no hydrogen 2.973 N/A PHE 172.A N SER 168.A O no hydrogen 2.932 N/A ALA 173.A N ILE 169.A O no hydrogen 2.684 N/A HIS 174.A N GLU 170.A O no hydrogen 2.825 N/A HIS 174.A ND1 TYR 215.A OH no hydrogen 2.454 N/A SER 175.A N ASP 171.A O no hydrogen 3.014 N/A SER 175.A OG ASP 171.A O no hydrogen 3.210 N/A SER 175.A OG VAL 252.A O no hydrogen 2.851 N/A SER 176.A N PHE 172.A O no hydrogen 3.271 N/A SER 176.A OG PHE 172.A O no hydrogen 2.516 N/A PHE 177.A N ALA 173.A O no hydrogen 2.861 N/A GLN 178.A N HIS 174.A O no hydrogen 2.677 N/A MET 179.A N SER 175.A O no hydrogen 2.739 N/A ALA 180.A N SER 176.A O no hydrogen 2.853 N/A LEU 181.A N PHE 177.A O no hydrogen 3.300 N/A SER 182.A N GLN 178.A O no hydrogen 2.967 N/A LYS 183.A N MET 179.A O no hydrogen 3.142 N/A GLY 184.A N LEU 181.A O no hydrogen 3.125 N/A LEU 187.A N TRP 225.A O no hydrogen 3.016 N/A TYR 188.A N ILE 238.A O no hydrogen 2.679 N/A LEU 189.A N GLU 227.A O no hydrogen 3.248 N/A SER 190.A N ALA 240.A O no hydrogen 2.797 N/A LYS 192.A N ASP 200.A OD2 no hydrogen 2.664 N/A LEU 196.A N LYS 192.A O no hydrogen 2.835 N/A ASP 200.A N LEU 196.A O no hydrogen 2.864 N/A GLY 201.A N LEU 196.A O no hydrogen 3.479 N/A ARG 202.A N TYR 199.A O no hydrogen 2.824 N/A ARG 202.A NE ASP 166.A OD1 no hydrogen 2.884 N/A ARG 202.A NH2 ASP 166.A OD1 no hydrogen 2.737 N/A ARG 202.A NH2 ASP 166.A OD2 no hydrogen 3.081 N/A LYS 204.A N ASP 200.A O no hydrogen 3.149 N/A ILE 206.A N ARG 202.A O no hydrogen 3.036 N/A PHE 207.A N PHE 203.A O no hydrogen 2.894 N/A GLN 208.A N LYS 204.A O no hydrogen 3.026 N/A GLU 209.A N ASP 205.A O no hydrogen 2.642 N/A ILE 210.A N ILE 206.A O no hydrogen 2.865 N/A TYR 211.A N PHE 207.A O no hydrogen 2.823 N/A ASP 212.A N GLN 208.A O no hydrogen 3.047 N/A LYS 213.A N GLU 209.A O no hydrogen 3.307 N/A GLN 214.A N ILE 210.A O no hydrogen 3.013 N/A TYR 215.A N TYR 211.A O no hydrogen 2.805 N/A TYR 215.A OH HIS 174.A ND1 no hydrogen 2.454 N/A LYS 216.A N TYR 211.A O no hydrogen 2.657 N/A GLN 218.A NE2 GLN 214.A O no hydrogen 2.536 N/A PHE 219.A N TYR 215.A O no hydrogen 3.162 N/A GLU 220.A N LYS 216.A O no hydrogen 3.482 N/A ALA 221.A N SER 217.A O no hydrogen 3.059 N/A GLN 222.A N PHE 219.A O no hydrogen 2.880 N/A LYS 223.A N GLU 220.A O no hydrogen 2.808 N/A ILE 224.A N PHE 219.A O no hydrogen 2.913 N/A TYR 226.A N TYR 211.A OH no hydrogen 3.270 N/A GLU 227.A N LEU 187.A O no hydrogen 3.093 N/A ARG 229.A N LEU 189.A O no hydrogen 3.100 N/A ARG 229.A NE GLU 227.A OE2 no hydrogen 3.225 N/A ARG 229.A NH2 GLU 227.A OE2 no hydrogen 3.172 N/A MET 234.A N LEU 230.A O no hydrogen 3.141 N/A PHE 237.A N PRO 114.A O no hydrogen 3.421 N/A ILE 238.A N PRO 186.A O no hydrogen 2.877 N/A TRP 239.A N ILE 116.A O no hydrogen 2.915 N/A TRP 239.A NE1 SER 190.A OG no hydrogen 3.168 N/A ALA 240.A N TYR 188.A O no hydrogen 2.686 N/A CYS 241.A N GLY 118.A O no hydrogen 3.019 N/A LYS 242.A N SER 190.A O no hydrogen 3.336 N/A ASN 243.A ND2 LYS 242.A O no hydrogen 2.495 N/A THR 248.A N GLU 107.A O no hydrogen 3.314 N/A SER 249.A N GLU 262.A O no hydrogen 2.804 N/A SER 249.A OG GLU 262.A O no hydrogen 3.407 N/A VAL 250.A N PHE 105.A O no hydrogen 2.921 N/A VAL 252.A N THR 103.A O no hydrogen 2.856 N/A CYS 253.A N THR 258.A O no hydrogen 3.320 N/A CYS 253.A SG LEU 100.A O no hydrogen 3.607 N/A GLY 256.A N CYS 253.A O no hydrogen 3.258 N/A LYS 257.A N ASP 255.A OD1 no hydrogen 2.780 N/A THR 258.A N ASP 255.A OD1 no hydrogen 2.982 N/A THR 258.A OG1 ASN 65.A OD1 no hydrogen 2.895 N/A THR 258.A OG1 ASP 255.A OD2 no hydrogen 3.141 N/A VAL 259.A N ASN 65.A O no hydrogen 2.979 N/A GLU 260.A N LEU 251.A O no hydrogen 2.798 N/A ALA 261.A N GLY 67.A O no hydrogen 2.926 N/A GLU 262.A N SER 249.A O no hydrogen 2.940 N/A ALA 264.A N MET 247.A O no hydrogen 2.970 N/A THR 267.A OG1 GLU 14.A OE1 no hydrogen 2.983 N/A THR 269.A OG1 GLU 14.A OE1 no hydrogen 2.693 N/A TYR 272.A N VAL 268.A O no hydrogen 3.329 N/A TYR 272.A N THR 269.A O no hydrogen 3.054 N/A ARG 273.A N THR 269.A O no hydrogen 2.885 N/A ARG 273.A NH1 GLN 276.A OE1 no hydrogen 2.736 N/A MET 274.A N ARG 270.A O no hydrogen 3.067 N/A TYR 275.A N TYR 272.A O no hydrogen 2.967 N/A GLN 276.A N TYR 272.A O no hydrogen 2.628 N/A LYS 277.A N ARG 273.A O no hydrogen 2.856 N/A GLY 278.A N TYR 275.A O no hydrogen 2.929 N/A THR 281.A OG1 THR 350.A OG1 no hydrogen 3.168 N/A SER 282.A OG LEU 348.A O no hydrogen 2.678 N/A THR 283.A N THR 350.A OG1 no hydrogen 2.884 N/A THR 283.A OG1 HIS 271.A ND1 no hydrogen 2.762 N/A ASN 284.A ND2 ASP 331.A OD2 no hydrogen 3.072 N/A ILE 286.A N ASN 284.A OD1 no hydrogen 3.373 N/A ALA 287.A N GLY 245.A O no hydrogen 3.161 N/A SER 288.A N PRO 285.A O no hydrogen 2.591 N/A ILE 289.A N PRO 285.A O no hydrogen 2.949 N/A PHE 290.A N ILE 286.A O no hydrogen 2.738 N/A ALA 291.A N ALA 287.A O no hydrogen 3.238 N/A ALA 291.A N SER 288.A O no hydrogen 2.973 N/A TRP 292.A N SER 288.A O no hydrogen 3.406 N/A THR 293.A N ILE 289.A O no hydrogen 3.028 N/A THR 293.A OG1 ILE 289.A O no hydrogen 3.389 N/A THR 293.A OG1 PHE 290.A O no hydrogen 3.111 N/A THR 293.A OG1 GLU 316.A OE2 no hydrogen 3.240 N/A ARG 294.A N PHE 290.A O no hydrogen 3.024 N/A GLY 295.A N ALA 291.A O no hydrogen 2.997 N/A LEU 296.A N TRP 292.A O no hydrogen 2.693 N/A ALA 297.A N THR 293.A O no hydrogen 3.239 N/A HIS 298.A N ARG 294.A O no hydrogen 2.644 N/A HIS 298.A NE2 LYS 257.A O no hydrogen 2.450 N/A ARG 299.A N GLY 295.A O no hydrogen 3.050 N/A ARG 299.A NH1 SER 6.A O no hydrogen 2.757 N/A ARG 299.A NH1 HIS 64.A O no hydrogen 2.748 N/A ARG 299.A NH2 ASP 303.A OD1 no hydrogen 3.197 N/A ALA 300.A N LEU 296.A O no hydrogen 2.785 N/A LYS 301.A N ALA 297.A O no hydrogen 2.967 N/A LEU 302.A N HIS 298.A O no hydrogen 2.887 N/A ASP 303.A N ARG 299.A O no hydrogen 2.909 N/A ASN 305.A N ALA 300.A O no hydrogen 2.937 N/A ASN 305.A ND2 SER 3.A O no hydrogen 3.090 N/A LEU 308.A N ASN 305.A O no hydrogen 3.143 N/A LEU 308.A N ASN 305.A OD1 no hydrogen 3.433 N/A ALA 309.A N ASN 305.A O no hydrogen 2.870 N/A PHE 310.A N LYS 306.A O no hydrogen 3.123 N/A PHE 311.A N GLU 307.A O no hydrogen 3.165 N/A ALA 312.A N LEU 308.A O no hydrogen 2.977 N/A ASN 313.A N ALA 309.A O no hydrogen 3.356 N/A ALA 314.A N PHE 310.A O no hydrogen 2.798 N/A LEU 315.A N PHE 311.A O no hydrogen 2.819 N/A GLU 316.A N ALA 312.A O no hydrogen 2.846 N/A GLU 317.A N ASN 313.A O no hydrogen 2.950 N/A VAL 318.A N ALA 314.A O no hydrogen 3.193 N/A SER 319.A N LEU 315.A O no hydrogen 3.057 N/A SER 319.A OG LEU 315.A O no hydrogen 3.310 N/A ILE 320.A N GLU 316.A O no hydrogen 3.263 N/A GLU 321.A N GLU 317.A O no hydrogen 2.738 N/A THR 322.A N VAL 318.A O no hydrogen 2.945 N/A THR 322.A N SER 319.A O no hydrogen 3.265 N/A THR 322.A OG1 VAL 318.A O no hydrogen 2.574 N/A ILE 323.A N SER 319.A O no hydrogen 3.464 N/A GLU 324.A N ILE 320.A O no hydrogen 2.873 N/A GLY 326.A N ILE 323.A O no hydrogen 2.536 N/A PHE 327.A N THR 322.A O no hydrogen 2.998 N/A THR 329.A OG1 ASP 331.A OD1 no hydrogen 3.012 N/A LYS 330.A N SER 282.A OG no hydrogen 3.034 N/A LEU 332.A N THR 329.A O no hydrogen 2.875 N/A ALA 333.A N THR 329.A O no hydrogen 3.061 N/A ALA 334.A N LYS 330.A O no hydrogen 2.685 N/A ILE 336.A N LEU 332.A O no hydrogen 3.165 N/A LYS 337.A N ALA 333.A O no hydrogen 2.847 N/A GLY 338.A N ALA 334.A O no hydrogen 3.112 N/A ASN 341.A N GLY 338.A O no hydrogen 2.800 N/A GLN 343.A N ASP 346.A OD1 no hydrogen 3.294 N/A ARG 344.A NE ARG 344.A O no hydrogen 3.135 N/A ARG 344.A NH2 TYR 347.A O no hydrogen 3.561 N/A ARG 344.A NH2 GLU 352.A OE1 no hydrogen 3.083 N/A ASP 346.A N GLN 343.A O no hydrogen 2.975 N/A TYR 347.A N ARG 344.A O no hydrogen 3.271 N/A LEU 348.A N MET 328.A O no hydrogen 2.652 N/A THR 350.A N THR 281.A O no hydrogen 2.991 N/A THR 350.A OG1 THR 281.A OG1 no hydrogen 3.168 N/A GLU 352.A N ASN 349.A OD1 no hydrogen 3.430 N/A PHE 353.A N ASN 349.A O no hydrogen 3.002 N/A MET 354.A N THR 350.A O no hydrogen 3.487 N/A ASP 355.A N PHE 351.A O no hydrogen 3.164 N/A LYS 356.A N GLU 352.A O no hydrogen 3.129 N/A LEU 357.A N PHE 353.A O no hydrogen 2.794 N/A GLY 358.A N MET 354.A O no hydrogen 2.611 N/A GLU 359.A N ASP 355.A O no hydrogen 2.666 N/A ASN 360.A N LYS 356.A O no hydrogen 2.896 N/A ASN 360.A ND2 THR 322.A OG1 no hydrogen 3.399 N/A LEU 361.A N LEU 357.A O no hydrogen 3.232 N/A LEU 361.A N GLY 358.A O no hydrogen 3.027 N/A LYS 362.A N GLY 358.A O no hydrogen 3.306 N/A ILE 363.A N GLU 359.A O no hydrogen 3.348 N/A LYS 364.A N ASN 360.A O no hydrogen 2.756 N/A LYS 364.A NZ GLU 321.A OE1 no hydrogen 2.696 N/A LEU 365.A N LEU 361.A O no hydrogen 3.000 N/A ALA 366.A N LYS 362.A O no hydrogen 2.774 N/A GLN 367.A N LYS 364.A O no hydrogen 3.313 N/A