Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3d1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N PRO 65.A O no hydrogen 3.543 N/A LYS 2.A N GLU 64.A O no hydrogen 2.896 N/A PHE 3.A N VAL 90.A O no hydrogen 2.898 N/A VAL 5.A N ILE 88.A O no hydrogen 3.003 N/A ARG 7.A N ALA 86.A O no hydrogen 2.802 N/A ARG 7.A NE CYS 79.A O no hydrogen 2.868 N/A ARG 7.A NH2 ARG 80.A O no hydrogen 2.909 N/A GLU 8.A N GLU 8.A OE2 no hydrogen 2.500 N/A HIS 9.A N GLU 6.A O no hydrogen 2.995 N/A LEU 10.A N ARG 7.A O no hydrogen 2.932 N/A LEU 11.A N ARG 7.A O no hydrogen 3.183 N/A LYS 12.A NZ GLN 16.A OE1 no hydrogen 3.412 N/A LYS 12.A NZ ASP 208.A OD1 no hydrogen 2.995 N/A LYS 12.A NZ ASP 208.A OD2 no hydrogen 2.614 N/A LEU 14.A N LEU 10.A O no hydrogen 2.774 N/A GLN 15.A N LEU 11.A O no hydrogen 2.767 N/A GLN 16.A N LYS 12.A O no hydrogen 2.778 N/A VAL 17.A N PRO 13.A O no hydrogen 2.911 N/A SER 18.A N LEU 14.A O no hydrogen 3.097 N/A SER 18.A OG LEU 14.A O no hydrogen 2.723 N/A GLY 19.A N GLN 16.A O no hydrogen 3.081 N/A LEU 21.A N SER 18.A O no hydrogen 3.389 N/A LEU 30.A N LEU 27.A O no hydrogen 3.063 N/A GLY 31.A N PRO 28.A O no hydrogen 2.974 N/A ASN 32.A N ILE 29.A O no hydrogen 2.986 N/A LEU 33.A N VAL 70.A O no hydrogen 2.681 N/A LEU 34.A N THR 45.A O no hydrogen 2.862 N/A LEU 35.A N THR 68.A O no hydrogen 2.836 N/A GLN 36.A N SER 43.A O no hydrogen 3.001 N/A VAL 37.A N GLY 66.A O no hydrogen 2.892 N/A ALA 38.A N THR 41.A O no hydrogen 3.110 N/A THR 41.A N ALA 38.A O no hydrogen 3.036 N/A LEU 42.A N VAL 57.A O no hydrogen 2.763 N/A SER 43.A N GLN 36.A O no hydrogen 2.790 N/A LEU 44.A N ALA 55.A O no hydrogen 2.793 N/A THR 45.A N LEU 34.A O no hydrogen 2.981 N/A GLY 46.A N MET 53.A O no hydrogen 3.097 N/A THR 47.A OG1 MET 51.A O no hydrogen 2.607 N/A ASP 48.A N MET 51.A O no hydrogen 3.323 N/A LEU 49.A N THR 47.A OG1 no hydrogen 3.050 N/A MET 51.A N ASP 48.A OD1 no hydrogen 2.655 N/A GLU 52.A N THR 233.A O no hydrogen 2.774 N/A MET 53.A N GLY 46.A O no hydrogen 2.983 N/A VAL 54.A N ILE 231.A O no hydrogen 2.790 N/A ALA 55.A N LEU 44.A O no hydrogen 2.791 N/A ARG 56.A N ASP 229.A O no hydrogen 3.030 N/A VAL 57.A N LEU 42.A O no hydrogen 2.661 N/A LEU 59.A N GLY 40.A O no hydrogen 2.766 N/A GLN 61.A NE2 GLU 87.A OE1 no hydrogen 2.803 N/A HIS 63.A ND1 GLN 61.A O no hydrogen 2.885 N/A GLU 64.A N LYS 2.A O no hydrogen 2.886 N/A GLY 66.A N VAL 37.A O no hydrogen 3.167 N/A THR 68.A N LEU 35.A O no hydrogen 3.046 N/A THR 69.A OG1 ASN 32.A OD1 no hydrogen 3.305 N/A THR 69.A OG1 LEU 111.A O no hydrogen 2.623 N/A VAL 70.A N LEU 33.A O no hydrogen 3.070 N/A ALA 72.A N GLY 31.A O no hydrogen 2.961 N/A ARG 73.A NE ARG 73.A O no hydrogen 3.511 N/A PHE 75.A N PRO 71.A O no hydrogen 3.122 N/A PHE 76.A N ALA 72.A O no hydrogen 2.934 N/A ASP 77.A N ARG 73.A O no hydrogen 2.878 N/A ILE 78.A N LYS 74.A O no hydrogen 2.832 N/A CYS 79.A N PHE 75.A O no hydrogen 3.019 N/A CYS 79.A SG PHE 75.A O no hydrogen 3.277 N/A ARG 80.A N PHE 76.A O no hydrogen 2.813 N/A ARG 80.A NH1 ASP 77.A OD1 no hydrogen 2.684 N/A ARG 80.A NH2 ASP 77.A OD1 no hydrogen 2.792 N/A GLY 81.A N ASP 77.A O no hydrogen 2.756 N/A LEU 82.A N ILE 78.A O no hydrogen 3.150 N/A LEU 82.A N CYS 79.A O no hydrogen 3.380 N/A GLY 85.A N GLU 8.A OE1 no hydrogen 3.268 N/A GLY 85.A N GLU 8.A OE2 no hydrogen 3.402 N/A ALA 86.A N PRO 83.A O no hydrogen 3.124 N/A ILE 88.A N VAL 5.A O no hydrogen 2.893 N/A ALA 89.A N ARG 100.A O no hydrogen 2.853 N/A VAL 90.A N PHE 3.A O no hydrogen 2.696 N/A GLN 91.A N LEU 98.A O no hydrogen 2.993 N/A GLN 91.A NE2 GLU 93.A OE2 no hydrogen 2.413 N/A LEU 92.A N MET 1.A O no hydrogen 3.103 N/A GLU 93.A N ARG 96.A O no hydrogen 2.710 N/A ARG 96.A N GLU 93.A O no hydrogen 3.069 N/A MET 97.A N LEU 108.A O no hydrogen 2.749 N/A LEU 98.A N GLN 91.A O no hydrogen 2.851 N/A VAL 99.A N PHE 106.A O no hydrogen 2.701 N/A ARG 100.A N ALA 89.A O no hydrogen 2.785 N/A SER 101.A N SER 104.A O no hydrogen 3.039 N/A SER 101.A OG GLU 87.A O no hydrogen 2.749 N/A SER 104.A N SER 101.A O no hydrogen 2.778 N/A PHE 106.A N VAL 99.A O no hydrogen 2.843 N/A LEU 108.A N MET 97.A O no hydrogen 2.830 N/A THR 110.A N GLU 95.A O no hydrogen 3.173 N/A THR 110.A OG1 GLU 95.A O no hydrogen 2.586 N/A LEU 111.A N THR 69.A O no hydrogen 3.382 N/A ASP 115.A N PRO 112.A O no hydrogen 2.990 N/A PHE 116.A N ALA 113.A O no hydrogen 3.141 N/A ASN 118.A ND2 PHE 116.A O no hydrogen 3.697 N/A SER 124.A OG GLU 127.A OE2 no hydrogen 2.446 N/A GLU 125.A N ILE 218.A O no hydrogen 2.571 N/A VAL 126.A N ILE 218.A O no hydrogen 3.119 N/A PHE 128.A N VAL 216.A O no hydrogen 3.161 N/A LEU 130.A N LEU 214.A O no hydrogen 2.980 N/A GLN 132.A NE2 ASN 212.A O no hydrogen 2.874 N/A THR 134.A N PRO 131.A O no hydrogen 3.117 N/A MET 135.A N PRO 131.A O no hydrogen 3.373 N/A LYS 136.A N GLN 132.A O no hydrogen 2.919 N/A LYS 136.A NZ GLU 140.A OE1 no hydrogen 2.814 N/A ARG 137.A N ALA 133.A O no hydrogen 2.875 N/A ARG 137.A NH2 SER 356.A OG no hydrogen 3.197 N/A LEU 138.A N THR 134.A O no hydrogen 2.955 N/A ILE 139.A N MET 135.A O no hydrogen 3.112 N/A GLU 140.A N LYS 136.A O no hydrogen 2.992 N/A ALA 141.A N ARG 137.A O no hydrogen 2.949 N/A THR 142.A N ILE 139.A O no hydrogen 3.066 N/A THR 142.A OG1 LEU 138.A O no hydrogen 3.367 N/A THR 142.A OG1 THR 169.A OG1 no hydrogen 3.396 N/A GLN 143.A N ILE 139.A O no hydrogen 2.764 N/A SER 145.A N THR 142.A O no hydrogen 3.021 N/A MET 146.A N GLN 143.A O no hydrogen 3.142 N/A ALA 147.A N LEU 155.A O no hydrogen 3.055 N/A ARG 152.A N ASP 150.A OD1 no hydrogen 2.580 N/A LEU 155.A N ARG 152.A O no hydrogen 2.768 N/A ASN 156.A N TYR 153.A O no hydrogen 2.826 N/A MET 158.A N VAL 195.A O no hydrogen 2.905 N/A LEU 159.A N VAL 170.A O no hydrogen 2.820 N/A PHE 160.A N VAL 193.A O no hydrogen 2.800 N/A GLU 161.A N ARG 168.A O no hydrogen 2.693 N/A THR 162.A N HIS 191.A O no hydrogen 2.915 N/A THR 162.A OG1 PRO 189.A O no hydrogen 2.580 N/A THR 162.A OG1 HIS 191.A O no hydrogen 3.451 N/A GLU 163.A N GLU 166.A O no hydrogen 3.001 N/A GLU 166.A N GLU 163.A O no hydrogen 3.180 N/A LEU 167.A N MET 182.A O no hydrogen 2.827 N/A ARG 168.A N GLU 161.A O no hydrogen 2.670 N/A ARG 168.A NE GLU 161.A OE2 no hydrogen 3.114 N/A ARG 168.A NH2 GLU 161.A OE2 no hydrogen 3.092 N/A THR 169.A N CYS 180.A O no hydrogen 2.825 N/A THR 169.A OG1 LEU 138.A O no hydrogen 2.863 N/A THR 169.A OG1 THR 142.A OG1 no hydrogen 3.396 N/A VAL 170.A N LEU 159.A O no hydrogen 2.894 N/A ALA 171.A N ALA 178.A O no hydrogen 2.921 N/A THR 172.A OG1 ARG 176.A O no hydrogen 2.712 N/A ASP 173.A N ARG 176.A O no hydrogen 3.270 N/A GLY 174.A N THR 172.A OG1 no hydrogen 3.317 N/A HIS 175.A N ASP 173.A OD1 no hydrogen 2.924 N/A ARG 176.A N ASP 173.A OD1 no hydrogen 2.979 N/A ARG 176.A NE ASP 173.A OD2 no hydrogen 2.907 N/A ARG 176.A NH1 ASP 326.A OD2 no hydrogen 3.054 N/A ARG 176.A NH2 ASP 326.A OD2 no hydrogen 3.560 N/A LEU 177.A N VAL 360.A O no hydrogen 2.719 N/A ALA 178.A N ALA 171.A O no hydrogen 2.764 N/A VAL 179.A N ALA 358.A O no hydrogen 3.009 N/A CYS 180.A N THR 169.A O no hydrogen 3.022 N/A CYS 180.A SG SER 356.A O no hydrogen 3.967 N/A SER 181.A N SER 356.A O no hydrogen 2.971 N/A SER 181.A OG GLU 166.A OE2 no hydrogen 3.532 N/A MET 182.A N LEU 167.A O no hydrogen 2.981 N/A ILE 184.A N GLU 165.A O no hydrogen 2.993 N/A GLN 186.A NE2 THR 129.A O no hydrogen 3.318 N/A LEU 188.A N GLY 164.A O no hydrogen 3.075 N/A HIS 191.A N THR 162.A O no hydrogen 3.232 N/A VAL 193.A N PHE 160.A O no hydrogen 3.062 N/A VAL 195.A N MET 158.A O no hydrogen 2.801 N/A ARG 197.A N ASN 156.A O no hydrogen 3.256 N/A ARG 197.A NH2 ALA 147.A O no hydrogen 2.861 N/A VAL 200.A N PRO 196.A O no hydrogen 3.064 N/A ILE 201.A N ARG 197.A O no hydrogen 3.211 N/A GLU 202.A N LYS 198.A O no hydrogen 2.980 N/A LEU 203.A N GLY 199.A O no hydrogen 2.822 N/A MET 204.A N VAL 200.A O no hydrogen 2.900 N/A ARG 205.A N ILE 201.A O no hydrogen 2.830 N/A MET 206.A N GLU 202.A O no hydrogen 2.929 N/A MET 206.A N LEU 203.A O no hydrogen 3.115 N/A LEU 207.A N MET 204.A O no hydrogen 3.103 N/A ASP 208.A N GLN 132.A OE1 no hydrogen 2.975 N/A LEU 214.A N LEU 130.A O no hydrogen 2.886 N/A ARG 215.A N HIS 226.A O no hydrogen 3.062 N/A VAL 216.A N PHE 128.A O no hydrogen 2.864 N/A GLN 217.A N ARG 224.A O no hydrogen 2.779 N/A GLN 217.A NE2 GLU 127.A OE2 no hydrogen 3.000 N/A ILE 218.A N VAL 126.A O no hydrogen 2.853 N/A GLY 219.A N ASN 222.A O no hydrogen 2.858 N/A ILE 223.A N SER 234.A O no hydrogen 2.900 N/A ARG 224.A N GLN 217.A O no hydrogen 2.773 N/A ALA 225.A N PHE 232.A O no hydrogen 2.826 N/A HIS 226.A N ARG 215.A O no hydrogen 2.813 N/A HIS 226.A ND1 ARG 215.A O no hydrogen 3.317 N/A VAL 227.A N PHE 230.A O no hydrogen 2.879 N/A PHE 230.A N VAL 227.A O no hydrogen 2.749 N/A ILE 231.A N VAL 54.A O no hydrogen 2.837 N/A PHE 232.A N ALA 225.A O no hydrogen 2.843 N/A THR 233.A N GLU 52.A O no hydrogen 2.938 N/A THR 233.A OG1 ILE 223.A O no hydrogen 3.485 N/A SER 234.A N ILE 223.A O no hydrogen 2.902 N/A SER 234.A OG LYS 235.A O no hydrogen 2.829 N/A LYS 235.A N GLU 50.A O no hydrogen 2.999 N/A LYS 235.A NZ LEU 49.A O no hydrogen 3.274 N/A LEU 236.A N ASN 221.A O no hydrogen 3.112 N/A VAL 237.A N ILE 194.A O no hydrogen 2.846 N/A ARG 245.A N ASP 243.A OD1 no hydrogen 2.828 N/A ARG 246.A N ASP 243.A O no hydrogen 2.923 N/A VAL 247.A N TYR 244.A O no hydrogen 2.943 N/A LEU 248.A N TYR 244.A O no hydrogen 2.974 N/A ASP 253.A N ASN 251.A O no hydrogen 2.842 N/A LYS 254.A N LEU 340.A O no hydrogen 3.264 N/A LYS 254.A NZ THR 341.A O no hydrogen 3.252 N/A LEU 256.A N MET 338.A O no hydrogen 2.854 N/A GLU 257.A N THR 309.A O no hydrogen 3.061 N/A ALA 258.A N VAL 336.A O no hydrogen 3.149 N/A CYS 260.A N GLU 334.A O no hydrogen 2.955 N/A CYS 260.A SG LEU 328.A O no hydrogen 3.619 N/A LEU 263.A N GLY 259.A O no hydrogen 3.050 N/A LYS 264.A N CYS 260.A O no hydrogen 2.853 N/A GLN 265.A N ASP 261.A O no hydrogen 2.930 N/A GLN 265.A NE2 ASP 261.A OD1 no hydrogen 3.424 N/A ALA 266.A N LEU 262.A O no hydrogen 3.008 N/A PHE 267.A N LEU 263.A O no hydrogen 2.980 N/A ALA 268.A N LYS 264.A O no hydrogen 2.846 N/A ARG 269.A N GLN 265.A O no hydrogen 3.056 N/A ARG 269.A NE GLU 304.A OE2 no hydrogen 2.804 N/A ARG 269.A NH2 GLU 304.A OE1 no hydrogen 2.922 N/A ALA 270.A N ALA 266.A O no hydrogen 2.984 N/A ALA 271.A N PHE 267.A O no hydrogen 2.878 N/A ILE 272.A N ARG 269.A O no hydrogen 3.184 N/A LEU 273.A N ALA 270.A O no hydrogen 3.127 N/A SER 274.A N ALA 271.A O no hydrogen 3.121 N/A SER 274.A OG ALA 271.A O no hydrogen 2.793 N/A LYS 277.A N ASN 275.A OD1 no hydrogen 2.540 N/A PHE 278.A N ASN 275.A OD1 no hydrogen 2.975 N/A ARG 279.A N ASN 275.A O no hydrogen 2.775 N/A ARG 279.A NE GLU 276.A O no hydrogen 2.805 N/A VAL 281.A N PHE 319.A O no hydrogen 2.916 N/A ARG 282.A N THR 293.A O no hydrogen 2.821 N/A LEU 283.A N ILE 317.A O no hydrogen 2.869 N/A TYR 284.A N LYS 291.A O no hydrogen 2.781 N/A VAL 285.A N MET 315.A O no hydrogen 2.936 N/A SER 286.A N GLN 289.A O no hydrogen 3.057 N/A ASN 288.A N TYR 310.A O no hydrogen 2.759 N/A ASN 288.A ND2 VAL 308.A O no hydrogen 3.594 N/A GLN 289.A N SER 286.A O no hydrogen 2.965 N/A LEU 290.A N LEU 306.A O no hydrogen 3.032 N/A LYS 291.A N TYR 284.A O no hydrogen 2.988 N/A ILE 292.A N GLU 304.A O no hydrogen 2.812 N/A THR 293.A N ARG 282.A O no hydrogen 2.908 N/A ALA 294.A N ALA 302.A O no hydrogen 2.943 N/A ASN 296.A ND2 GLU 300.A OE1 no hydrogen 2.852 N/A GLU 298.A N GLU 298.A OE2 no hydrogen 2.827 N/A GLN 299.A N ASN 296.A O no hydrogen 2.939 N/A GLU 300.A N ASN 296.A OD1 no hydrogen 2.824 N/A ALA 302.A N ALA 294.A O no hydrogen 2.841 N/A GLU 304.A N ILE 292.A O no hydrogen 2.826 N/A LEU 306.A N LEU 290.A O no hydrogen 2.937 N/A VAL 308.A N ASN 288.A O no hydrogen 3.152 N/A THR 309.A N GLU 257.A O no hydrogen 2.857 N/A TYR 310.A OH ALA 313.A O no hydrogen 2.483 N/A MET 315.A N VAL 285.A O no hydrogen 3.305 N/A ILE 317.A N LEU 283.A O no hydrogen 2.982 N/A PHE 319.A N VAL 281.A O no hydrogen 3.007 N/A VAL 321.A N ARG 279.A O no hydrogen 2.707 N/A SER 322.A N ASN 320.A OD1 no hydrogen 2.717 N/A TYR 323.A N ASN 320.A OD1 no hydrogen 3.255 N/A VAL 324.A N ASN 320.A O no hydrogen 3.361 N/A LEU 325.A N VAL 321.A O no hydrogen 2.908 N/A ASP 326.A N SER 322.A O no hydrogen 2.809 N/A VAL 327.A N TYR 323.A O no hydrogen 3.334 N/A LEU 328.A N VAL 324.A O no hydrogen 3.028 N/A ASN 329.A N LEU 325.A O no hydrogen 2.846 N/A ALA 330.A N ASP 326.A O no hydrogen 3.054 N/A LEU 331.A N VAL 327.A O no hydrogen 2.985 N/A LYS 332.A N LEU 328.A O no hydrogen 3.479 N/A CYS 333.A SG ASN 335.A O no hydrogen 3.265 N/A VAL 336.A N ALA 258.A O no hydrogen 2.982 N/A ARG 337.A N GLU 350.A O no hydrogen 2.750 N/A ARG 337.A NH1 ALA 352.A O no hydrogen 2.993 N/A ARG 337.A NH2 ALA 352.A O no hydrogen 3.382 N/A MET 338.A N LEU 256.A O no hydrogen 2.731 N/A MET 339.A N GLN 348.A O no hydrogen 2.879 N/A LEU 340.A N LYS 254.A O no hydrogen 2.866 N/A THR 341.A OG1 ASN 251.A O no hydrogen 3.190 N/A VAL 344.A N ASP 342.A OD1 no hydrogen 2.806 N/A SER 345.A N ASP 342.A O no hydrogen 3.400 N/A SER 345.A OG ASP 342.A OD1 no hydrogen 2.624 N/A SER 345.A OG ASP 342.A OD2 no hydrogen 2.990 N/A VAL 347.A N VAL 361.A O no hydrogen 2.904 N/A GLN 348.A N MET 339.A O no hydrogen 3.191 N/A GLN 348.A NE2 GLU 350.A OE1 no hydrogen 2.584 N/A ILE 349.A N TYR 359.A O no hydrogen 2.684 N/A GLU 350.A N ARG 337.A O no hydrogen 3.123 N/A ALA 352.A N ASN 335.A O no hydrogen 2.924 N/A ALA 353.A N ASP 351.A OD1 no hydrogen 2.622 N/A SER 354.A N ASP 351.A O no hydrogen 3.301 N/A SER 354.A OG SER 356.A OG no hydrogen 3.149 N/A SER 356.A OG SER 354.A OG no hydrogen 3.149 N/A ALA 358.A N VAL 179.A O no hydrogen 2.853 N/A TYR 359.A N ILE 349.A O no hydrogen 2.793 N/A TYR 359.A OH ALA 141.A O no hydrogen 2.626 N/A VAL 360.A N LEU 177.A O no hydrogen 2.891 N/A VAL 361.A N VAL 347.A O no hydrogen 2.920 N/A MET 362.A N HIS 175.A O no hydrogen 3.025 N/A MET 364.A N GLY 318.A O no hydrogen 2.863 N/A