Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 ASP 54.A OD1 no hydrogen 2.872 N/A LYS 3.A N ASP 54.A OD2 no hydrogen 2.701 N/A LEU 4.A N ASP 54.A O no hydrogen 2.873 N/A VAL 5.A N TYR 134.A O no hydrogen 2.571 N/A VAL 6.A N GLY 56.A O no hydrogen 2.834 N/A LEU 7.A N LEU 136.A O no hydrogen 2.915 N/A GLY 8.A N ILE 58.A O no hydrogen 2.984 N/A SER 9.A OG GLU 140.A OE1 no hydrogen 2.310 N/A VAL 10.A N ASN 114.A OD1 no hydrogen 2.830 N/A ASN 11.A N GLY 38.A O no hydrogen 3.170 N/A ALA 12.A N GLY 93.A O no hydrogen 2.719 N/A ASP 13.A N ILE 36.A O no hydrogen 2.752 N/A HIS 14.A N ALA 95.A O no hydrogen 2.536 N/A HIS 14.A ND1 TYR 33.A OH no hydrogen 2.638 N/A VAL 15.A N GLN 34.A O no hydrogen 2.806 N/A LEU 16.A N ILE 97.A O no hydrogen 2.688 N/A GLN 17.A N ARG 31.A O no hydrogen 2.814 N/A VAL 18.A N VAL 99.A O no hydrogen 3.040 N/A ARG 31.A N GLN 17.A O no hydrogen 2.865 N/A ASN 32.A ND2 GLN 17.A OE1 no hydrogen 2.422 N/A TYR 33.A OH HIS 14.A ND1 no hydrogen 2.638 N/A GLN 34.A N VAL 15.A O no hydrogen 2.968 N/A ILE 36.A N ASP 13.A O no hydrogen 2.702 N/A GLY 38.A N ASN 11.A O no hydrogen 2.946 N/A LYS 40.A N GLU 140.A OE1 no hydrogen 2.855 N/A GLY 41.A N SER 9.A OG no hydrogen 3.354 N/A ALA 42.A N SER 9.A O no hydrogen 2.656 N/A ASN 43.A N GLY 39.A O no hydrogen 2.785 N/A ASN 43.A ND2 ASP 252.A OD2 no hydrogen 3.123 N/A GLN 44.A N LYS 40.A O no hydrogen 2.967 N/A GLN 44.A NE2 ASN 163.A OD1 no hydrogen 2.800 N/A GLN 44.A NE2 ASP 252.A OD1 no hydrogen 2.567 N/A ALA 45.A N GLY 41.A O no hydrogen 3.052 N/A VAL 46.A N ALA 42.A O no hydrogen 2.684 N/A ALA 47.A N ASN 43.A O no hydrogen 2.738 N/A ALA 48.A N GLN 44.A O no hydrogen 2.715 N/A ALA 49.A N ALA 45.A O no hydrogen 2.851 N/A ARG 50.A N VAL 46.A O no hydrogen 2.915 N/A ARG 50.A NE ASP 77.A OD1 no hydrogen 2.851 N/A ARG 50.A NE ASP 77.A OD2 no hydrogen 3.442 N/A ARG 50.A NH1 GLN 289.A O no hydrogen 2.992 N/A ARG 50.A NH1 ILE 292.A O no hydrogen 2.711 N/A ARG 50.A NH2 ASP 77.A OD2 no hydrogen 2.977 N/A MET 51.A N ALA 47.A O no hydrogen 2.999 N/A GLN 52.A N ALA 49.A O no hydrogen 2.658 N/A ALA 53.A N ALA 48.A O no hydrogen 2.895 N/A GLY 56.A N LEU 4.A O no hydrogen 3.002 N/A PHE 57.A N ASN 80.A O no hydrogen 2.972 N/A ILE 58.A N VAL 6.A O no hydrogen 2.746 N/A ALA 59.A N GLY 83.A O no hydrogen 3.199 N/A VAL 61.A N LYS 85.A O no hydrogen 2.676 N/A GLY 62.A N THR 92.A OG1 no hydrogen 2.884 N/A ASP 63.A N CYS 90.A O no hydrogen 3.116 N/A GLY 67.A N ASP 64.A OD1 no hydrogen 2.825 N/A ILE 68.A N ASP 64.A O no hydrogen 3.303 N/A ASN 69.A N SER 65.A O no hydrogen 3.094 N/A ILE 70.A N PHE 66.A O no hydrogen 2.872 N/A ARG 71.A N GLY 67.A O no hydrogen 3.199 N/A ARG 71.A NH1 VAL 84.A O no hydrogen 3.129 N/A GLU 72.A N ILE 68.A O no hydrogen 3.426 N/A SER 73.A N ASN 69.A O no hydrogen 3.136 N/A SER 73.A OG ASN 69.A O no hydrogen 2.935 N/A PHE 74.A N ILE 70.A O no hydrogen 2.979 N/A PHE 74.A N ARG 71.A O no hydrogen 3.052 N/A LYS 75.A N GLU 72.A O no hydrogen 2.792 N/A LYS 75.A NZ GLU 72.A OE1 no hydrogen 2.698 N/A LYS 75.A NZ GLU 72.A OE2 no hydrogen 2.992 N/A LEU 76.A N SER 73.A O no hydrogen 3.019 N/A ASP 77.A N PHE 74.A O no hydrogen 3.007 N/A GLY 78.A N LYS 75.A O no hydrogen 2.926 N/A ILE 79.A N PHE 74.A O no hydrogen 3.161 N/A ASN 80.A N VAL 55.A O no hydrogen 2.939 N/A ASN 80.A ND2 ASN 2.A OD1 no hydrogen 3.043 N/A ALA 82.A N ASN 80.A OD1 no hydrogen 2.870 N/A VAL 84.A N THR 81.A O no hydrogen 2.704 N/A LYS 85.A N ALA 59.A O no hydrogen 2.755 N/A LYS 85.A NZ GLY 83.A O no hydrogen 2.747 N/A LYS 85.A NZ ASP 125.A OD1 no hydrogen 3.489 N/A LYS 85.A NZ ASP 125.A OD2 no hydrogen 2.773 N/A GLN 87.A N VAL 61.A O no hydrogen 2.706 N/A ASN 89.A N ASP 63.A OD2 no hydrogen 2.790 N/A THR 92.A N ASP 64.A OD2 no hydrogen 2.648 N/A THR 92.A OG1 ASP 64.A OD1 no hydrogen 2.868 N/A ILE 94.A N SER 110.A O no hydrogen 2.879 N/A ALA 95.A N ALA 12.A O no hydrogen 2.737 N/A MET 96.A N CYS 108.A O no hydrogen 2.718 N/A ILE 97.A N HIS 14.A O no hydrogen 2.589 N/A GLN 98.A N SER 106.A O no hydrogen 3.030 N/A VAL 99.A N LEU 16.A O no hydrogen 2.964 N/A SER 100.A N GLU 104.A O no hydrogen 2.942 N/A SER 100.A OG SER 102.A OG no hydrogen 2.657 N/A SER 102.A OG SER 100.A OG no hydrogen 2.657 N/A SER 102.A OG GLU 104.A OE1 no hydrogen 3.258 N/A GLY 103.A N SER 100.A O no hydrogen 2.937 N/A GLU 104.A N SER 102.A OG no hydrogen 3.383 N/A ASN 105.A ND2 ASN 105.A O no hydrogen 2.849 N/A SER 106.A N GLN 98.A O no hydrogen 2.984 N/A CYS 108.A N MET 96.A O no hydrogen 2.926 N/A SER 110.A N ILE 94.A O no hydrogen 2.769 N/A SER 110.A OG GLU 112.A OE2 no hydrogen 2.847 N/A ALA 113.A N PRO 91.A O no hydrogen 3.175 N/A ASN 114.A N ALA 111.A O no hydrogen 3.011 N/A ASN 114.A ND2 VAL 10.A O no hydrogen 2.707 N/A ASN 114.A ND2 ASN 11.A OD1 no hydrogen 2.799 N/A ASN 114.A ND2 ALA 111.A O no hydrogen 3.119 N/A ALA 115.A N GLU 112.A O no hydrogen 2.805 N/A LYS 116.A N ALA 113.A O no hydrogen 2.804 N/A LEU 117.A N ASN 114.A O no hydrogen 3.106 N/A THR 118.A N LYS 116.A O no hydrogen 2.703 N/A ALA 119.A N ASP 144.A OD2 no hydrogen 2.398 N/A ALA 121.A N THR 118.A OG1 no hydrogen 3.107 N/A ILE 122.A N THR 118.A O no hydrogen 3.134 N/A ILE 122.A N ALA 119.A O no hydrogen 3.034 N/A GLU 123.A N ALA 120.A O no hydrogen 3.085 N/A ASP 125.A N ILE 122.A O no hydrogen 2.785 N/A LEU 126.A N GLU 123.A O no hydrogen 3.412 N/A ILE 129.A N ASP 125.A O no hydrogen 3.151 N/A ARG 130.A N LEU 126.A O no hydrogen 2.876 N/A ARG 130.A NH1 GLU 152.A OE1 no hydrogen 3.309 N/A ASP 131.A N ALA 127.A O no hydrogen 2.743 N/A ALA 132.A N ALA 128.A O no hydrogen 2.993 N/A ALA 132.A N ILE 129.A O no hydrogen 3.330 N/A ARG 133.A N LYS 3.A O no hydrogen 2.863 N/A TYR 134.A N LYS 3.A O no hydrogen 2.890 N/A LEU 135.A N ASN 159.A O no hydrogen 2.862 N/A LEU 136.A N VAL 5.A O no hydrogen 2.841 N/A MET 137.A N ILE 161.A O no hydrogen 2.970 N/A GLN 138.A NE2 GLN 44.A OE1 no hydrogen 2.946 N/A LEU 139.A N ALA 165.A O no hydrogen 2.676 N/A GLY 145.A N PRO 142.A O no hydrogen 3.080 N/A ILE 146.A N PRO 142.A O no hydrogen 3.183 N/A LEU 147.A N LEU 143.A O no hydrogen 2.820 N/A LYS 148.A N ASP 144.A O no hydrogen 3.112 N/A LYS 148.A NZ GLU 152.A OE2 no hydrogen 3.482 N/A ALA 149.A N GLY 145.A O no hydrogen 3.276 N/A ALA 150.A N ILE 146.A O no hydrogen 3.137 N/A GLN 151.A N LEU 147.A O no hydrogen 3.161 N/A GLU 152.A N LYS 148.A O no hydrogen 3.147 N/A ALA 153.A N ALA 149.A O no hydrogen 3.070 N/A LYS 154.A N ALA 150.A O no hydrogen 3.371 N/A LYS 154.A N GLN 151.A O no hydrogen 3.200 N/A THR 155.A OG1 GLU 152.A O no hydrogen 3.212 N/A ALA 156.A N ALA 153.A O no hydrogen 3.247 N/A THR 158.A N ALA 153.A O no hydrogen 3.011 N/A THR 158.A OG1 ILE 129.A O no hydrogen 3.164 N/A THR 158.A OG1 ALA 132.A O no hydrogen 3.033 N/A THR 158.A OG1 ALA 153.A O no hydrogen 3.140 N/A THR 158.A OG1 ALA 156.A O no hydrogen 3.210 N/A ASN 159.A N ARG 133.A O no hydrogen 2.680 N/A ASN 159.A ND2 ARG 133.A O no hydrogen 3.299 N/A VAL 160.A N ASP 179.A OD2 no hydrogen 2.823 N/A ILE 161.A N LEU 135.A O no hydrogen 2.722 N/A LEU 162.A N LEU 180.A O no hydrogen 3.060 N/A ASN 163.A N MET 137.A O no hydrogen 2.723 N/A ASN 163.A ND2 THR 182.A O no hydrogen 3.193 N/A ASN 163.A ND2 THR 182.A OG1 no hydrogen 3.381 N/A ALA 165.A N ASN 163.A O no hydrogen 2.513 N/A ARG 168.A NE GLU 169.A O no hydrogen 2.652 N/A ARG 168.A NH2 GLU 169.A O no hydrogen 2.959 N/A LEU 174.A N PRO 171.A O no hydrogen 3.069 N/A LEU 175.A N PRO 171.A O no hydrogen 3.320 N/A LYS 176.A N ASP 172.A O no hydrogen 2.911 N/A CYS 177.A N LEU 174.A O no hydrogen 3.084 N/A VAL 178.A N LEU 175.A O no hydrogen 2.902 N/A ASP 179.A N VAL 160.A O no hydrogen 2.817 N/A LEU 180.A N VAL 160.A O no hydrogen 3.000 N/A ILE 181.A N ILE 216.A O no hydrogen 3.238 N/A THR 182.A N LEU 162.A O no hydrogen 2.928 N/A THR 182.A OG1 LEU 162.A O no hydrogen 3.233 N/A THR 182.A OG1 ASN 255.A OD1 no hydrogen 2.340 N/A ASN 184.A N GLU 187.A OE1 no hydrogen 2.834 N/A GLU 187.A N ASN 184.A OD1 no hydrogen 2.625 N/A ALA 188.A N ASN 184.A O no hydrogen 3.072 N/A GLU 189.A N GLU 185.A O no hydrogen 3.087 N/A VAL 190.A N THR 186.A O no hydrogen 2.983 N/A LEU 191.A N GLU 187.A O no hydrogen 2.925 N/A LEU 191.A N ALA 188.A O no hydrogen 3.191 N/A THR 192.A N ALA 188.A O no hydrogen 3.022 N/A THR 192.A N GLU 189.A O no hydrogen 3.274 N/A THR 192.A OG1 ALA 188.A O no hydrogen 2.660 N/A THR 192.A OG1 ILE 194.A O no hydrogen 3.490 N/A GLY 193.A N GLU 189.A O no hydrogen 2.613 N/A ILE 194.A N THR 192.A OG1 no hydrogen 3.260 N/A TYR 197.A N SER 201.A OG no hydrogen 2.747 N/A ASP 198.A N SER 201.A OG no hydrogen 2.673 N/A SER 200.A OG ASP 198.A OD1 no hydrogen 3.086 N/A SER 200.A OG ASP 198.A OD2 no hydrogen 3.458 N/A SER 201.A N ASP 198.A OD1 no hydrogen 3.001 N/A SER 201.A OG ASP 198.A O no hydrogen 2.841 N/A SER 201.A OG ASP 198.A OD1 no hydrogen 2.520 N/A ALA 202.A N ASP 198.A O no hydrogen 2.655 N/A GLN 203.A N ASP 199.A O no hydrogen 3.191 N/A GLN 203.A N SER 200.A O no hydrogen 2.985 N/A GLN 203.A NE2 SER 229.A OG no hydrogen 3.157 N/A GLN 204.A N SER 200.A O no hydrogen 2.883 N/A ALA 205.A N SER 201.A O no hydrogen 3.019 N/A ALA 206.A N ALA 202.A O no hydrogen 3.219 N/A ASP 207.A N GLN 203.A O no hydrogen 2.887 N/A ALA 208.A N GLN 204.A O no hydrogen 2.969 N/A LEU 209.A N ALA 205.A O no hydrogen 3.187 N/A HIS 210.A N ALA 206.A O no hydrogen 2.844 N/A HIS 210.A ND1 ILE 214.A O no hydrogen 2.791 N/A HIS 210.A NE2 SER 229.A OG no hydrogen 2.331 N/A CYS 211.A N ASP 207.A O no hydrogen 2.840 N/A CYS 211.A SG ASP 207.A O no hydrogen 3.469 N/A CYS 211.A SG ASP 207.A OD2 no hydrogen 3.775 N/A LYS 212.A N LEU 209.A O no hydrogen 3.055 N/A LYS 212.A NZ ASP 172.A OD1 no hydrogen 3.213 N/A GLY 213.A N HIS 210.A O no hydrogen 3.085 N/A ILE 214.A N LEU 209.A O no hydrogen 3.103 N/A ILE 216.A N ASP 179.A O no hydrogen 3.128 N/A VAL 217.A N SER 229.A O no hydrogen 3.131 N/A ILE 218.A N ILE 181.A O no hydrogen 2.874 N/A ILE 219.A N TRP 227.A O no hydrogen 2.764 N/A THR 220.A N PRO 183.A O no hydrogen 2.851 N/A THR 220.A OG1 PRO 183.A O no hydrogen 3.344 N/A LEU 221.A N GLY 225.A O no hydrogen 2.550 N/A LYS 224.A N LEU 221.A O no hydrogen 3.053 N/A GLY 225.A N GLY 222.A O no hydrogen 3.017 N/A VAL 226.A N ILE 237.A O no hydrogen 3.051 N/A TRP 227.A N ILE 219.A O no hydrogen 2.633 N/A TRP 227.A NE1 GLN 203.A OE1 no hydrogen 2.751 N/A LEU 228.A N GLN 235.A O no hydrogen 2.687 N/A SER 229.A N VAL 217.A O no hydrogen 3.057 N/A SER 229.A OG HIS 210.A NE2 no hydrogen 2.331 N/A GLN 230.A N ARG 233.A O no hydrogen 3.272 N/A GLN 235.A N LEU 228.A O no hydrogen 2.678 N/A GLN 235.A NE2 GLU 269.A OE1 no hydrogen 3.119 N/A ARG 236.A NH1 LYS 224.A O no hydrogen 2.996 N/A ILE 237.A N VAL 226.A O no hydrogen 2.829 N/A LYS 243.A NZ ALA 244.A O no hydrogen 3.208 N/A THR 245.A N VAL 283.A O no hydrogen 2.948 N/A THR 245.A OG1 THR 284.A O no hydrogen 2.964 N/A ASP 246.A N VAL 283.A O no hydrogen 3.237 N/A THR 247.A N GLY 103.A O no hydrogen 3.088 N/A THR 247.A OG1 GLY 103.A O no hydrogen 3.279 N/A THR 247.A OG1 ASN 105.A OD1 no hydrogen 2.952 N/A THR 248.A N ASP 246.A OD1 no hydrogen 2.820 N/A THR 248.A OG1 ASN 105.A OD1 no hydrogen 3.092 N/A THR 248.A OG1 ASP 246.A OD1 no hydrogen 2.698 N/A THR 248.A OG1 ASP 246.A OD2 no hydrogen 3.523 N/A ALA 250.A N THR 247.A O no hydrogen 3.076 N/A THR 253.A N ALA 249.A O no hydrogen 3.025 N/A THR 253.A OG1 ALA 249.A O no hydrogen 2.801 N/A PHE 254.A N ALA 250.A O no hydrogen 2.881 N/A ASN 255.A N GLY 251.A O no hydrogen 2.906 N/A ASN 255.A ND2 GLY 251.A O no hydrogen 2.607 N/A GLY 256.A N ASP 252.A O no hydrogen 3.004 N/A ALA 257.A N THR 253.A O no hydrogen 2.961 N/A LEU 258.A N PHE 254.A O no hydrogen 2.813 N/A VAL 259.A N ASN 255.A O no hydrogen 3.162 N/A THR 260.A N GLY 256.A O no hydrogen 3.319 N/A THR 260.A OG1 GLY 256.A O no hydrogen 2.789 N/A GLY 261.A N ALA 257.A O no hydrogen 2.887 N/A LEU 262.A N LEU 258.A O no hydrogen 2.935 N/A LEU 263.A N VAL 259.A O no hydrogen 2.846 N/A GLN 264.A N THR 260.A O no hydrogen 2.835 N/A GLN 264.A NE2 MET 51.A O no hydrogen 3.525 N/A GLN 264.A NE2 GLN 52.A O no hydrogen 3.353 N/A GLU 265.A N LEU 262.A O no hydrogen 2.898 N/A MET 266.A N GLY 261.A O no hydrogen 2.957 N/A SER 270.A N PRO 267.A O no hydrogen 2.768 N/A ALA 271.A N PRO 267.A O no hydrogen 3.082 N/A ILE 272.A N LEU 268.A O no hydrogen 3.217 N/A LYS 273.A N GLU 269.A O no hydrogen 3.209 N/A LYS 273.A NZ SER 306.A O no hydrogen 3.521 N/A PHE 274.A N SER 270.A O no hydrogen 2.776 N/A ALA 275.A N ALA 271.A O no hydrogen 2.716 N/A HIS 276.A N ILE 272.A O no hydrogen 2.719 N/A HIS 276.A NE2 ILE 237.A O no hydrogen 2.887 N/A ALA 277.A N LYS 273.A O no hydrogen 3.148 N/A ALA 278.A N PHE 274.A O no hydrogen 3.186 N/A ALA 279.A N ALA 275.A O no hydrogen 2.988 N/A ALA 280.A N HIS 276.A O no hydrogen 2.868 N/A ILE 281.A N ALA 277.A O no hydrogen 3.118 N/A SER 282.A N ALA 278.A O no hydrogen 2.968 N/A SER 282.A OG ALA 279.A O no hydrogen 2.571 N/A VAL 283.A N ALA 279.A O no hydrogen 2.871 N/A THR 284.A N ILE 281.A O no hydrogen 3.118 N/A THR 284.A OG1 ILE 281.A O no hydrogen 2.482 N/A ARG 285.A N SER 282.A O no hydrogen 2.910 N/A ARG 285.A NH1 GLU 297.A OE1 no hydrogen 3.161 N/A ARG 285.A NH1 GLU 297.A OE2 no hydrogen 3.119 N/A ARG 285.A NH2 GLU 297.A OE1 no hydrogen 2.813 N/A GLY 287.A N ASP 246.A OD2 no hydrogen 2.743 N/A GLN 289.A N PRO 37.A O no hydrogen 2.940 N/A GLN 289.A NE2 ASN 43.A OD1 no hydrogen 2.960 N/A THR 290.A OG1 PHE 286.A O no hydrogen 2.822 N/A SER 291.A N ALA 288.A O no hydrogen 3.167 N/A SER 291.A OG GLY 287.A O no hydrogen 3.114 N/A SER 291.A OG ALA 288.A O no hydrogen 2.912 N/A ILE 292.A N GLN 289.A O no hydrogen 3.166 N/A THR 294.A N GLU 297.A OE2 no hydrogen 2.681 N/A THR 294.A OG1 GLU 297.A OE2 no hydrogen 3.416 N/A ARG 295.A N ARG 50.A O no hydrogen 3.036 N/A ARG 295.A NE GLU 299.A OE2 no hydrogen 2.889 N/A ARG 295.A NH1 MET 51.A O no hydrogen 2.950 N/A ARG 295.A NH1 GLN 264.A OE1 no hydrogen 2.685 N/A ARG 295.A NH2 GLN 264.A OE1 no hydrogen 3.354 N/A ARG 295.A NH2 GLU 299.A OE2 no hydrogen 3.298 N/A GLU 297.A N THR 294.A OG1 no hydrogen 2.970 N/A VAL 298.A N THR 294.A O no hydrogen 3.157 N/A GLU 299.A N ARG 295.A O no hydrogen 2.916 N/A ALA 300.A N ALA 296.A O no hydrogen 2.867 N/A PHE 301.A N GLU 297.A O no hydrogen 2.907 N/A LEU 302.A N VAL 298.A O no hydrogen 2.678 N/A ALA 303.A N GLU 299.A O no hydrogen 2.564 N/A GLU 304.A N ALA 300.A O no hydrogen 2.868 N/A HIS 305.A N LEU 302.A O no hydrogen 3.299 N/A