Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k6k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 9.A N GLY 22.A O no hydrogen 3.025 N/A SER 11.A N ARG 20.A O no hydrogen 2.868 N/A ASP 13.A N GLU 18.A O no hydrogen 2.713 N/A SER 15.A OG ASP 13.A OD1 no hydrogen 3.434 N/A LYS 16.A N ASP 13.A OD1 no hydrogen 3.071 N/A GLU 18.A N ASP 13.A O no hydrogen 3.218 N/A ARG 20.A N SER 11.A O no hydrogen 3.063 N/A ARG 20.A NE CYS 21.A O no hydrogen 2.845 N/A ARG 20.A NH2 CYS 21.A O no hydrogen 3.137 N/A GLY 22.A N GLY 9.A O no hydrogen 2.974 N/A THR 23.A OG1 ASP 7.A O no hydrogen 2.940 N/A GLY 24.A N ASP 7.A O no hydrogen 2.971 N/A ASN 29.A ND2 GLU 32.A OE1 no hydrogen 2.894 N/A VAL 31.A N ASN 29.A OD1 no hydrogen 3.087 N/A GLU 32.A N ASN 29.A OD1 no hydrogen 2.995 N/A ARG 35.A NH1 PHE 161.A O no hydrogen 2.960 N/A LYS 39.A N THR 163.A O no hydrogen 3.108 N/A HIS 41.A N VAL 165.A O no hydrogen 2.830 N/A ASP 43.A N LEU 167.A O no hydrogen 2.696 N/A ARG 46.A NH1 GLU 87.A OE1 no hydrogen 2.534 N/A ARG 46.A NH1 GLU 87.A OE2 no hydrogen 3.068 N/A ARG 47.A N SER 44.A OG no hydrogen 3.170 N/A LEU 48.A N SER 44.A O no hydrogen 2.962 N/A ALA 49.A N PRO 45.A O no hydrogen 2.848 N/A ALA 50.A N ARG 46.A O no hydrogen 3.110 N/A ALA 51.A N ARG 47.A O no hydrogen 2.921 N/A VAL 52.A N LEU 48.A O no hydrogen 2.852 N/A LYS 53.A N ALA 49.A O no hydrogen 2.899 N/A LYS 53.A NZ GLU 57.A OE2 no hydrogen 2.812 N/A GLN 54.A N ALA 50.A O no hydrogen 3.052 N/A GLN 54.A NE2 GLU 58.A OE2 no hydrogen 3.023 N/A ALA 55.A N ALA 51.A O no hydrogen 2.813 N/A TRP 56.A N VAL 52.A O no hydrogen 2.799 N/A GLU 57.A N LYS 53.A O no hydrogen 3.045 N/A GLU 58.A N GLN 54.A O no hydrogen 2.995 N/A GLU 58.A N ALA 55.A O no hydrogen 2.956 N/A GLY 59.A N TRP 56.A O no hydrogen 3.033 N/A ILE 60.A N ALA 55.A O no hydrogen 2.996 N/A CYS 61.A N HIS 145.A O no hydrogen 3.075 N/A CYS 61.A SG HIS 145.A O no hydrogen 3.686 N/A ILE 63.A N VAL 132.A O no hydrogen 2.830 N/A SER 64.A N ALA 147.A O no hydrogen 2.978 N/A SER 65.A N ASP 134.A OD1 no hydrogen 2.904 N/A SER 65.A OG ASP 134.A OD2 no hydrogen 2.637 N/A VAL 66.A N.A GLU 70.A OE1 no hydrogen 2.998 N/A VAL 66.A N.B GLU 70.A OE1 no hydrogen 3.005 N/A ARG 68.A N GLU 217.A OE2 no hydrogen 2.800 N/A ARG 68.A NH1 ASP 36.A OD2 no hydrogen 3.239 N/A ARG 68.A NH2 ASP 36.A OD1 no hydrogen 3.113 N/A ARG 68.A NH2 ASP 36.A OD2 no hydrogen 3.345 N/A GLU 70.A N SER 67.A OG no hydrogen 3.128 N/A ASN 71.A N SER 67.A O no hydrogen 3.217 N/A ASN 71.A ND2 GLY 97.A O no hydrogen 2.935 N/A ASN 71.A ND2 ASP 134.A OD2 no hydrogen 2.615 N/A ILE 72.A N ARG 68.A O no hydrogen 3.059 N/A MET 73.A N.A MET 69.A O no hydrogen 3.050 N/A MET 73.A N.B MET 69.A O no hydrogen 3.044 N/A TRP 74.A N GLU 70.A O no hydrogen 2.969 N/A TRP 74.A NE1 GLU 70.A OE2 no hydrogen 2.959 N/A LYS 75.A N ASN 71.A O no hydrogen 3.056 N/A LYS 75.A NZ GLU 78.A OE1 no hydrogen 3.472 N/A LYS 75.A NZ VAL 96.A O no hydrogen 2.814 N/A SER 76.A N ILE 72.A O no hydrogen 3.076 N/A SER 76.A OG MET 73.A O.A no hydrogen 2.700 N/A SER 76.A OG MET 73.A O.B no hydrogen 2.677 N/A VAL 77.A N MET 73.A O.A no hydrogen 3.063 N/A VAL 77.A N MET 73.A O.B no hydrogen 3.056 N/A VAL 77.A N TRP 74.A O no hydrogen 3.228 N/A LEU 81.A N VAL 77.A O no hydrogen 2.829 N/A ASN 82.A N GLU 78.A O no hydrogen 3.023 N/A ASN 82.A ND2 VAL 94.A O no hydrogen 3.082 N/A ALA 83.A N GLY 79.A O no hydrogen 3.012 N/A ILE 84.A N GLU 80.A O no hydrogen 2.949 N/A LEU 85.A N LEU 81.A O no hydrogen 2.955 N/A GLU 86.A N ASN 82.A O no hydrogen 3.006 N/A GLU 87.A N ALA 83.A O no hydrogen 2.772 N/A ASN 88.A N ILE 84.A O no hydrogen 3.156 N/A ASN 88.A N LEU 85.A O no hydrogen 3.231 N/A ASN 88.A ND2 ILE 84.A O no hydrogen 2.869 N/A GLY 89.A N GLU 86.A O no hydrogen 3.070 N/A VAL 90.A N LEU 85.A O no hydrogen 2.904 N/A LEU 92.A N VAL 90.A O no hydrogen 2.802 N/A THR 93.A N ASN 129.A O no hydrogen 2.824 N/A THR 93.A OG1 THR 127.A OG1 no hydrogen 2.861 N/A VAL 94.A N ASN 82.A OD1 no hydrogen 2.621 N/A VAL 95.A N PHE 131.A O no hydrogen 2.891 N/A VAL 96.A N GLU 78.A OE2 no hydrogen 2.859 N/A GLY 97.A N VAL 133.A O no hydrogen 2.874 N/A MET 103.A N MET 218.A O no hydrogen 2.879 N/A ARG 105.A NE THR 220.A O no hydrogen 2.846 N/A ARG 105.A NH2 THR 220.A O no hydrogen 3.091 N/A GLN 108.A N ARG 146.A O no hydrogen 3.152 N/A GLN 108.A NE2 GLU 144.A O no hydrogen 2.893 N/A ARG 109.A NH1 GLY 106.A O no hydrogen 3.006 N/A ARG 109.A NH1 GLN 108.A O no hydrogen 2.845 N/A ARG 109.A NH2 SER 174.A O no hydrogen 2.990 N/A LEU 110.A N SER 150.A OG no hydrogen 2.912 N/A VAL 114.A N GLN 54.A OE1 no hydrogen 3.155 N/A LEU 117.A N GLU 116.A OE2 no hydrogen 2.564 N/A VAL 122.A N SER 119.A O no hydrogen 3.300 N/A ALA 125.A N GLU 86.A OE2 no hydrogen 2.991 N/A THR 127.A N THR 93.A OG1 no hydrogen 2.842 N/A THR 127.A OG1 THR 93.A OG1 no hydrogen 2.861 N/A ASN 129.A N THR 127.A OG1 no hydrogen 3.263 N/A ASN 129.A ND2 GLN 91.A O no hydrogen 2.827 N/A PHE 131.A N THR 93.A O no hydrogen 2.759 N/A VAL 132.A N CYS 61.A O no hydrogen 3.211 N/A VAL 133.A N VAL 95.A O no hydrogen 2.822 N/A ASP 134.A N ILE 63.A O no hydrogen 2.959 N/A GLY 135.A N SER 98.A O no hydrogen 2.840 N/A THR 137.A OG1 ASP 134.A O no hydrogen 2.814 N/A CYS 141.A N THR 137.A O no hydrogen 2.987 N/A CYS 141.A SG PRO 142.A O no hydrogen 3.940 N/A HIS 145.A N PRO 142.A O no hydrogen 3.039 N/A ARG 146.A N LEU 143.A O no hydrogen 3.153 N/A ARG 146.A NE CYS 141.A O no hydrogen 2.903 N/A ARG 146.A NH1 ILE 63.A O no hydrogen 3.175 N/A ARG 146.A NH1 ASP 134.A O no hydrogen 3.263 N/A ARG 146.A NH2 THR 137.A OG1 no hydrogen 2.608 N/A ARG 146.A NH2 CYS 141.A O no hydrogen 3.042 N/A ALA 147.A N GLY 62.A O no hydrogen 2.958 N/A TRP 148.A N GLN 108.A O no hydrogen 3.166 N/A ASN 149.A ND2 SER 174.A O no hydrogen 2.962 N/A ASN 149.A ND2 GLU 176.A O no hydrogen 3.050 N/A LEU 152.A N LYS 168.A O no hydrogen 2.862 N/A VAL 153.A N ASP 178.A OD2 no hydrogen 2.768 N/A GLU 154.A N TRP 166.A O no hydrogen 2.655 N/A HIS 156.A N ASP 155.A OD1 no hydrogen 2.699 N/A GLY 157.A N SER 164.A O no hydrogen 2.862 N/A THR 163.A N ARG 37.A O.A no hydrogen 2.792 N/A THR 163.A N ARG 37.A O.B no hydrogen 2.783 N/A SER 164.A N GLY 157.A O no hydrogen 2.818 N/A VAL 165.A N LYS 39.A O no hydrogen 2.884 N/A TRP 166.A N ASP 155.A O no hydrogen 2.932 N/A LEU 167.A N HIS 41.A O no hydrogen 2.830 N/A LYS 168.A N LEU 152.A O no hydrogen 2.897 N/A ARG 170.A N SER 150.A O no hydrogen 2.881 N/A ARG 170.A NE ASP 172.A OD1 no hydrogen 3.167 N/A ARG 170.A NH1 ASN 149.A O no hydrogen 3.503 N/A ASP 172.A N ASP 172.A OD1 no hydrogen 2.639 N/A GLU 176.A N SER 174.A OG no hydrogen 2.989 N/A CYS 177.A N GLU 222.A O no hydrogen 2.798 N/A ALA 180.A N ASP 178.A OD1 no hydrogen 2.987 N/A ILE 182.A N PRO 179.A O no hydrogen 3.204 N/A GLY 183.A N SER 194.A O no hydrogen 2.806 N/A THR 184.A OG1 HIS 227.A O no hydrogen 2.854 N/A ALA 185.A N ALA 192.A O no hydrogen 2.881 N/A LYS 187.A N GLU 190.A O no hydrogen 2.915 N/A LYS 187.A NZ ASP 13.A OD2 no hydrogen 2.476 N/A GLU 190.A N LYS 187.A O no hydrogen 3.221 N/A ALA 191.A N SER 202.A O no hydrogen 3.071 N/A ALA 192.A N ALA 185.A O no hydrogen 2.807 N/A HIS 193.A N ILE 200.A O no hydrogen 2.898 N/A SER 194.A N GLY 183.A O no hydrogen 2.795 N/A SER 194.A OG GLY 183.A O no hydrogen 2.624 N/A ASP 195.A N TYR 198.A O no hydrogen 2.993 N/A GLY 197.A N ASP 195.A OD1 no hydrogen 2.857 N/A TYR 198.A N ASP 195.A OD1 no hydrogen 2.754 N/A TYR 198.A OH LEU 245.A O no hydrogen 2.726 N/A TRP 199.A N HIS 214.A O no hydrogen 2.906 N/A TRP 199.A NE1 GLU 201.A OE1 no hydrogen 2.806 N/A ILE 200.A N HIS 193.A O no hydrogen 2.987 N/A GLU 201.A N ARG 212.A O no hydrogen 2.776 N/A SER 202.A N ALA 191.A O no hydrogen 2.947 N/A SER 202.A OG HIS 252.A ND1 no hydrogen 2.736 N/A GLU 203.A N ARG 209.A O no hydrogen 2.931 N/A LYS 204.A N ARG 189.A O no hydrogen 3.027 N/A ASN 205.A N THR 207.A O no hydrogen 2.833 N/A ARG 209.A N GLU 203.A O no hydrogen 2.916 N/A ARG 209.A NE GLU 203.A OE1 no hydrogen 2.898 N/A ARG 209.A NH2 GLU 203.A OE1 no hydrogen 2.944 N/A LEU 210.A N THR 254.A O no hydrogen 2.751 N/A LYS 211.A N GLU 201.A O no hydrogen 2.774 N/A LYS 211.A NZ GLU 190.A OE2 no hydrogen 2.930 N/A LYS 211.A NZ GLU 201.A OE2 no hydrogen 3.031 N/A ARG 212.A N GLU 201.A O no hydrogen 3.260 N/A ARG 212.A NH1 GLU 32.A OE2 no hydrogen 2.747 N/A ARG 212.A NH2 GLU 32.A OE1 no hydrogen 2.996 N/A ARG 212.A NH2 GLU 201.A OE1 no hydrogen 2.859 N/A ALA 213.A N ILE 273.A O no hydrogen 3.184 N/A HIS 214.A N TRP 199.A O no hydrogen 2.830 N/A HIS 214.A NE2 GLU 270.A OE2 no hydrogen 2.635 N/A LEU 215.A N LEU 271.A O no hydrogen 2.859 N/A ILE 216.A N GLY 197.A O no hydrogen 2.949 N/A MET 218.A N ASN 101.A OD1 no hydrogen 3.019 N/A LYS 219.A N TYR 198.A OH no hydrogen 2.993 N/A LYS 219.A NZ ASP 195.A OD1 no hydrogen 3.230 N/A LYS 219.A NZ ASP 195.A OD2 no hydrogen 2.790 N/A LYS 219.A NZ GLU 217.A OE1 no hydrogen 2.984 N/A THR 220.A OG1 MET 103.A O no hydrogen 2.808 N/A GLU 222.A N LEU 175.A O no hydrogen 2.758 N/A TRP 223.A NE1 HIS 227.A O no hydrogen 3.232 N/A SER 226.A OG HIS 227.A ND1 no hydrogen 2.727 N/A HIS 227.A N PRO 224.A O no hydrogen 3.052 N/A HIS 227.A ND1 SER 226.A OG no hydrogen 2.727 N/A THR 228.A N LYS 225.A O no hydrogen 3.012 N/A THR 228.A OG1 PRO 224.A O no hydrogen 2.716 N/A LEU 229.A N HIS 193.A NE2 no hydrogen 3.065 N/A ASP 238.A N GLU 235.A O no hydrogen 2.846 N/A LEU 239.A N GLU 236.A O no hydrogen 3.186 N/A ILE 240.A N ASN 253.A O no hydrogen 2.988 N/A ILE 241.A N ASN 253.A OD1 no hydrogen 3.059 N/A SER 244.A OG ALA 350.A O no hydrogen 2.705 N/A LEU 245.A N PRO 242.A O no hydrogen 2.893 N/A ALA 246.A N LYS 243.A O no hydrogen 3.130 N/A GLY 247.A N PRO 242.A O no hydrogen 2.917 N/A SER 250.A OG LEU 229.A O no hydrogen 2.617 N/A HIS 251.A N TRP 230.A O no hydrogen 3.160 N/A HIS 251.A NE2 ASP 232.A O no hydrogen 2.762 N/A HIS 252.A N SER 250.A OG no hydrogen 2.805 N/A HIS 252.A ND1 SER 202.A OG no hydrogen 2.736 N/A ASN 253.A N SER 250.A O no hydrogen 3.082 N/A ASN 253.A ND2 ILE 241.A O no hydrogen 2.929 N/A ASN 253.A ND2 PRO 248.A O no hydrogen 2.991 N/A THR 254.A OG1 HIS 251.A O no hydrogen 2.670 N/A ARG 255.A NH1 LEU 210.A O no hydrogen 2.834 N/A TYR 258.A N ARG 255.A O no hydrogen 3.080 N/A TYR 258.A OH THR 315.A O no hydrogen 2.687 N/A ARG 259.A N GLU 332.A OE2 no hydrogen 2.856 N/A THR 260.A N SER 237.A O no hydrogen 2.851 N/A THR 260.A OG1 LEU 239.A O no hydrogen 2.788 N/A GLN 261.A N ILE 240.A O no hydrogen 3.079 N/A GLN 261.A NE2 ARG 259.A O no hydrogen 2.793 N/A GLN 261.A NE2 GLU 332.A OE1 no hydrogen 3.011 N/A GLY 264.A N GLN 261.A O no hydrogen 3.298 N/A TRP 266.A N GLY 264.A O no hydrogen 2.808 N/A TRP 266.A NE1 GLN 261.A O no hydrogen 2.751 N/A SER 268.A N PRO 265.A O no hydrogen 3.089 N/A SER 268.A OG PRO 265.A O no hydrogen 2.761 N/A LEU 271.A N LEU 215.A O no hydrogen 2.907 N/A GLU 272.A N ARG 322.A O no hydrogen 2.938 N/A ILE 273.A N ALA 213.A O no hydrogen 2.797 N/A ARG 274.A N SER 320.A O no hydrogen 2.925 N/A ARG 274.A NE GLU 272.A OE2 no hydrogen 3.208 N/A ARG 274.A NH1 GLU 272.A OE1 no hydrogen 2.803 N/A ARG 274.A NH1 GLU 272.A OE2 no hydrogen 3.499 N/A ARG 274.A NH2 GLU 276.A OE2 no hydrogen 2.994 N/A GLU 276.A N PRO 318.A O no hydrogen 2.826 N/A GLU 277.A N GLU 277.A OE1 no hydrogen 2.693 N/A CYS 278.A N TYR 329.A OH no hydrogen 2.911 N/A CYS 278.A SG TRP 328.A O no hydrogen 4.014 N/A THR 281.A N CYS 278.A O no hydrogen 3.045 N/A THR 281.A OG1 CYS 278.A O no hydrogen 2.671 N/A THR 281.A OG1 TYR 329.A OH no hydrogen 2.527 N/A LYS 282.A N GLU 307.A O no hydrogen 2.943 N/A TYR 284.A N TRP 309.A O no hydrogen 2.905 N/A GLU 286.A N CYS 311.A O no hydrogen 2.842 N/A CYS 289.A N GLU 286.A O no hydrogen 3.174 N/A CYS 289.A SG GLY 290.A O no hydrogen 3.667 N/A ARG 292.A NH1 THR 260.A O no hydrogen 2.903 N/A ARG 292.A NH2 THR 260.A O no hydrogen 3.194 N/A ARG 292.A NH2 GLU 332.A OE2 no hydrogen 2.790 N/A GLY 293.A N MET 331.A O no hydrogen 3.160 N/A SER 295.A N LYS 263.A O no hydrogen 3.012 N/A SER 295.A OG TYR 329.A O no hydrogen 2.662 N/A ARG 297.A N VAL 344.A O no hydrogen 2.936 N/A ARG 297.A NE THR 299.A O no hydrogen 3.304 N/A ARG 297.A NE THR 299.A OG1 no hydrogen 3.180 N/A ARG 297.A NH1 ASP 325.A OD2 no hydrogen 2.867 N/A ARG 297.A NH2 THR 299.A O no hydrogen 3.501 N/A ARG 297.A NH2 THR 300.A O no hydrogen 2.856 N/A SER 298.A N CYS 327.A O no hydrogen 2.751 N/A SER 298.A OG CYS 327.A O no hydrogen 3.228 N/A THR 300.A N ARG 304.A O no hydrogen 2.857 N/A SER 302.A N THR 300.A OG1 no hydrogen 3.293 N/A GLY 303.A N THR 300.A O no hydrogen 2.856 N/A ARG 304.A N THR 300.A OG1 no hydrogen 3.141 N/A ARG 304.A NH1 GLU 338.A OE2 no hydrogen 2.925 N/A ARG 304.A NH2 GLU 338.A OE1 no hydrogen 2.820 N/A ILE 306.A N SER 298.A O no hydrogen 2.962 N/A TRP 309.A N LYS 282.A O no hydrogen 2.819 N/A TRP 309.A NE1 ILE 306.A O no hydrogen 2.732 N/A CYS 310.A N ARG 334.A O no hydrogen 2.727 N/A CYS 310.A SG ARG 334.A O no hydrogen 3.745 N/A CYS 310.A SG PRO 335.A O no hydrogen 3.957 N/A CYS 311.A N TYR 284.A O no hydrogen 3.000 N/A ARG 312.A NE CYS 289.A O no hydrogen 2.739 N/A ARG 312.A NH2 CYS 289.A O no hydrogen 3.494 N/A CYS 314.A SG TYR 258.A OH no hydrogen 3.350 N/A THR 315.A OG1 GLU 256.A O no hydrogen 2.630 N/A LEU 319.A N TYR 258.A OH no hydrogen 3.277 N/A SER 320.A N ARG 274.A O no hydrogen 2.914 N/A SER 320.A OG ARG 274.A O no hydrogen 2.808 N/A SER 320.A OG GLU 276.A O no hydrogen 3.279 N/A PHE 321.A N TRP 328.A O no hydrogen 2.734 N/A ARG 322.A N GLU 272.A O no hydrogen 2.767 N/A ARG 322.A NE SER 320.A OG no hydrogen 2.905 N/A ARG 322.A NH2 GLU 276.A O no hydrogen 3.076 N/A ARG 322.A NH2 GLU 277.A O no hydrogen 3.022 N/A ARG 322.A NH2 SER 320.A OG no hydrogen 3.202 N/A ALA 323.A N GLY 326.A O no hydrogen 2.954 N/A LYS 324.A NZ GLU 269.A OE1 no hydrogen 2.878 N/A GLY 326.A N ALA 323.A O no hydrogen 3.073 N/A TRP 328.A N PHE 321.A O no hydrogen 2.746 N/A TRP 328.A NE1 ASP 325.A OD1 no hydrogen 3.105 N/A TYR 329.A N LEU 296.A O no hydrogen 2.993 N/A TYR 329.A OH THR 281.A OG1 no hydrogen 2.527 N/A GLY 330.A N LEU 319.A O no hydrogen 2.889 N/A MET 331.A N GLN 261.A OE1 no hydrogen 2.737 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.660 N/A ILE 333.A N GLY 330.A O no hydrogen 2.977 N/A ARG 334.A N CYS 310.A O no hydrogen 2.820 N/A ARG 334.A NE GLU 340.A OE2 no hydrogen 2.987 N/A ARG 334.A NH1 PRO 294.A O no hydrogen 2.816 N/A ARG 334.A NH1 MET 331.A O no hydrogen 2.923 N/A ARG 334.A NH2 PRO 294.A O no hydrogen 2.915 N/A ARG 334.A NH2 GLU 340.A OE1 no hydrogen 3.018 N/A ARG 336.A N GLU 308.A O no hydrogen 2.834 N/A ARG 336.A NE GLU 286.A OE2 no hydrogen 2.809 N/A ARG 336.A NH1 GLU 308.A OE1 no hydrogen 2.938 N/A ARG 336.A NH2 GLU 286.A OE1 no hydrogen 2.994 N/A ASN 342.A N PRO 339.A O no hydrogen 3.196 N/A LEU 343.A N GLU 340.A O no hydrogen 2.855 N/A SER 346.A N SER 295.A O no hydrogen 2.811 N/A SER 346.A OG LYS 263.A O no hydrogen 3.511 N/A SER 346.A OG GLY 264.A O no hydrogen 2.827 N/A VAL 348.A N SER 346.A OG no hydrogen 3.317 N/A ALA 350.A N VAL 262.A O no hydrogen 2.749 N/A