Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6q4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 9.A N LYS 21.A O no hydrogen 3.409 N/A LYS 10.A NZ GLU 13.A OE2 no hydrogen 3.032 N/A ILE 11.A N VAL 19.A O no hydrogen 2.730 N/A GLY 12.A N VAL 19.A O no hydrogen 3.224 N/A GLY 14.A N GLY 17.A O no hydrogen 2.911 N/A TYR 16.A OH GLY 147.A O no hydrogen 2.744 N/A VAL 19.A N GLY 12.A O no hydrogen 2.908 N/A TYR 20.A N LEU 33.A O.A no hydrogen 2.849 N/A TYR 20.A N LEU 33.A O.B no hydrogen 2.739 N/A LYS 21.A N GLU 9.A O no hydrogen 2.800 N/A ALA 22.A N VAL 31.A O no hydrogen 2.913 N/A ARG 23.A N GLN 6.A O no hydrogen 2.912 N/A ARG 23.A NH2 GLY 28.A O no hydrogen 3.010 N/A ASN 24.A N GLU 29.A O no hydrogen 2.737 N/A THR 27.A N ASN 24.A OD1 no hydrogen 2.903 N/A THR 27.A OG1 GLU 29.A OE1.B no hydrogen 2.766 N/A GLY 28.A N ASN 24.A O no hydrogen 2.712 N/A GLU 29.A N THR 27.A OG1 no hydrogen 3.139 N/A VAL 30.A N GLU 29.A OE2.A no hydrogen 2.842 N/A VAL 31.A N ALA 22.A O no hydrogen 2.852 N/A ALA 32.A N PHE 74.A O no hydrogen 2.882 N/A LEU 33.A N.A TYR 20.A O no hydrogen 2.850 N/A LEU 33.A N.B TYR 20.A O no hydrogen 2.803 N/A LYS 34.A N LEU 72.A O no hydrogen 2.832 N/A LYS 34.A NZ ASP 139.A OD1 no hydrogen 2.898 N/A LYS 34.A NZ ASP 139.A OD2 no hydrogen 3.425 N/A LYS 35.A N VAL 18.A O no hydrogen 2.977 N/A ILE 36.A N LEU 70.A O no hydrogen 2.817 N/A ARG 37.A N TYR 16.A O no hydrogen 2.549 N/A ILE 43.A N PRO 39.A O no hydrogen 3.278 N/A ARG 44.A N SER 40.A O no hydrogen 2.958 N/A GLU 45.A N THR 41.A O no hydrogen 3.054 N/A ILE 46.A N ALA 42.A O no hydrogen 2.935 N/A SER 47.A N ILE 43.A O no hydrogen 2.902 N/A SER 47.A OG ILE 43.A O no hydrogen 2.763 N/A LEU 48.A N ARG 44.A O no hydrogen 3.311 N/A LEU 49.A N ILE 46.A O no hydrogen 2.913 N/A LYS 50.A N SER 47.A O no hydrogen 3.171 N/A GLU 51.A N LEU 48.A O no hydrogen 3.339 N/A LEU 52.A N LEU 49.A O no hydrogen 3.044 N/A ASN 53.A ND2 LYS 50.A O no hydrogen 3.330 N/A ASN 56.A N HIS 54.A ND1 no hydrogen 2.898 N/A ASN 56.A ND2 GLN 104.A OE1 no hydrogen 3.065 N/A ASN 56.A ND2 ILE 135.A O no hydrogen 2.873 N/A ILE 57.A N HIS 54.A O no hydrogen 3.025 N/A VAL 58.A N LEU 137.A O no hydrogen 2.885 N/A LYS 59.A N GLU 75.A OE2 no hydrogen 2.937 N/A LEU 61.A N VAL 73.A O no hydrogen 2.704 N/A ASP 62.A N VAL 73.A O no hydrogen 3.237 N/A ILE 64.A N TYR 71.A O no hydrogen 2.827 N/A THR 66.A N LYS 69.A O no hydrogen 2.907 N/A LYS 69.A N THR 66.A O no hydrogen 2.854 N/A TYR 71.A N ILE 64.A O no hydrogen 2.808 N/A LEU 72.A N LYS 34.A O no hydrogen 2.835 N/A VAL 73.A N ASP 62.A O no hydrogen 2.899 N/A PHE 74.A N ALA 32.A O no hydrogen 2.795 N/A GLU 75.A N LYS 59.A O no hydrogen 2.886 N/A ASP 80.A N GLN 79.A OE1 no hydrogen 2.917 N/A LEU 81.A N LEU 127.A O no hydrogen 2.813 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 2.854 N/A PHE 84.A N ASP 80.A O no hydrogen 3.060 N/A MET 85.A N.A LEU 81.A O no hydrogen 2.858 N/A MET 85.A N.B LEU 81.A O no hydrogen 2.803 N/A ASP 86.A N LYS 82.A O no hydrogen 2.952 N/A ALA 87.A N LYS 83.A O no hydrogen 2.900 N/A SER 88.A N PHE 84.A O no hydrogen 3.006 N/A SER 88.A N MET 85.A O.B no hydrogen 2.879 N/A SER 88.A OG PHE 84.A O no hydrogen 2.755 N/A ALA 89.A N ASP 86.A O no hydrogen 3.212 N/A THR 91.A N SER 88.A O no hydrogen 3.109 N/A THR 91.A OG1 SER 88.A O no hydrogen 3.254 N/A THR 91.A OG1 GLY 92.A O no hydrogen 2.814 N/A GLY 92.A N SER 88.A O no hydrogen 2.669 N/A LEU 97.A N PRO 94.A O no hydrogen 2.943 N/A ILE 98.A N PRO 94.A O no hydrogen 2.990 N/A LYS 99.A N LEU 95.A O no hydrogen 2.874 N/A LYS 99.A NZ PHE 279.A O no hydrogen 2.898 N/A LYS 99.A NZ ASP 282.A OD1 no hydrogen 2.596 N/A SER 100.A N PRO 96.A O no hydrogen 2.965 N/A SER 100.A OG THR 284.A O no hydrogen 3.373 N/A TYR 101.A N LEU 97.A O no hydrogen 2.859 N/A LEU 102.A N ILE 98.A O no hydrogen 2.876 N/A PHE 103.A N LYS 99.A O no hydrogen 2.914 N/A GLN 104.A N SER 100.A O no hydrogen 2.936 N/A GLN 104.A NE2 SER 100.A O no hydrogen 3.458 N/A GLN 104.A NE2 SER 100.A OG no hydrogen 3.040 N/A GLN 104.A NE2 GLY 133.A O no hydrogen 2.940 N/A LEU 105.A N TYR 101.A O no hydrogen 2.886 N/A LEU 106.A N LEU 102.A O no hydrogen 2.889 N/A GLN 107.A N PHE 103.A O no hydrogen 2.998 N/A GLN 107.A NE2 PHE 103.A O no hydrogen 3.639 N/A GLY 108.A N GLN 104.A O no hydrogen 2.993 N/A LEU 109.A N LEU 105.A O no hydrogen 2.906 N/A ALA 110.A N LEU 106.A O no hydrogen 2.785 N/A PHE 111.A N GLN 107.A O no hydrogen 3.014 N/A CYS 112.A N GLY 108.A O no hydrogen 3.033 N/A CYS 112.A SG GLY 108.A O no hydrogen 3.572 N/A HIS 113.A N LEU 109.A O no hydrogen 2.767 N/A HIS 113.A NE2 ASP 179.A OD2 no hydrogen 2.847 N/A SER 114.A N ALA 110.A O no hydrogen 2.984 N/A SER 114.A OG ALA 110.A O no hydrogen 3.563 N/A SER 114.A OG PHE 111.A O no hydrogen 2.705 N/A HIS 115.A N PHE 111.A O no hydrogen 3.356 N/A HIS 115.A N CYS 112.A O no hydrogen 2.947 N/A ARG 116.A N HIS 113.A O no hydrogen 2.911 N/A VAL 117.A N CYS 112.A O no hydrogen 2.993 N/A HIS 119.A N ASP 179.A OD2 no hydrogen 2.857 N/A HIS 119.A NE2 ALA 138.A O no hydrogen 2.787 N/A ARG 120.A N ASP 179.A OD1 no hydrogen 2.811 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 2.921 N/A LYS 123.A N ASN 126.A OD1 no hydrogen 3.032 N/A LYS 123.A NZ ASP 121.A OD2 no hydrogen 2.735 N/A GLN 125.A N GLN 125.A OE1 no hydrogen 2.866 N/A ASN 126.A N LYS 123.A O no hydrogen 2.939 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.887 N/A LEU 127.A N PRO 124.A O no hydrogen 3.118 N/A LEU 128.A N LYS 136.A O no hydrogen 2.838 N/A ILE 129.A N GLN 79.A O no hydrogen 2.896 N/A ASN 130.A N ALA 134.A O no hydrogen 3.259 N/A GLU 132.A N ASN 130.A OD1 no hydrogen 2.977 N/A GLY 133.A N ASN 130.A O no hydrogen 3.464 N/A ALA 134.A N ASN 130.A OD1 no hydrogen 3.095 N/A ILE 135.A N GLN 104.A OE1 no hydrogen 3.161 N/A LYS 136.A N LEU 128.A O no hydrogen 2.818 N/A LYS 136.A NZ GLU 75.A OE1 no hydrogen 2.654 N/A LYS 136.A NZ GLU 75.A OE2 no hydrogen 3.422 N/A LEU 137.A N ASN 56.A O no hydrogen 2.874 N/A ALA 138.A N ASN 126.A O no hydrogen 2.799 N/A LEU 142.A N ASP 139.A O no hydrogen 3.336 N/A ALA 145.A N LEU 142.A O no hydrogen 2.981 N/A PHE 146.A N LEU 142.A O no hydrogen 2.812 N/A GLY 147.A N ALA 143.A O no hydrogen 2.784 N/A ARG 151.A NH2 HIS 155.A O no hydrogen 3.058 N/A THR 152.A N GLU 156.A O no hydrogen 2.802 N/A THR 152.A OG1 THR 154.A OG1 no hydrogen 2.850 N/A TYR 153.A N THR 15.A O no hydrogen 3.260 N/A THR 154.A N THR 152.A OG1 no hydrogen 3.173 N/A THR 154.A OG1 THR 152.A OG1 no hydrogen 2.850 N/A HIS 155.A N THR 152.A O no hydrogen 2.807 N/A GLU 156.A N THR 152.A OG1 no hydrogen 3.267 N/A VAL 158.A N VAL 150.A O no hydrogen 3.045 N/A TRP 161.A N THR 159.A OG1 no hydrogen 3.276 N/A TYR 162.A OH GLU 189.A OE1 no hydrogen 2.626 N/A ARG 163.A N LEU 160.A O no hydrogen 3.064 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.751 N/A ILE 167.A N ALA 164.A O no hydrogen 3.025 N/A LEU 168.A N ALA 164.A O no hydrogen 3.297 N/A LEU 169.A N PRO 165.A O no hydrogen 2.858 N/A GLY 170.A N ILE 167.A O no hydrogen 3.003 N/A CYS 171.A N.A GLU 166.A O no hydrogen 2.976 N/A CYS 171.A N.B GLU 166.A O no hydrogen 2.964 N/A CYS 171.A SG.B GLU 166.A O no hydrogen 3.078 N/A CYS 171.A SG.B TYR 173.A O no hydrogen 3.319 N/A CYS 171.A SG.C TYR 173.A O no hydrogen 3.269 N/A ALA 177.A N SER 175.A OG no hydrogen 3.138 N/A VAL 178.A N SER 175.A O no hydrogen 2.992 N/A ASP 179.A N THR 176.A O no hydrogen 3.040 N/A TRP 181.A N ALA 177.A O no hydrogen 3.092 N/A SER 182.A N VAL 178.A O no hydrogen 3.218 N/A SER 182.A OG TYR 162.A O no hydrogen 2.718 N/A SER 182.A OG VAL 178.A O no hydrogen 3.136 N/A LEU 183.A N ASP 179.A O no hydrogen 2.947 N/A GLY 184.A N ILE 180.A O no hydrogen 2.855 N/A CYS 185.A N TRP 181.A O no hydrogen 2.999 N/A CYS 185.A SG TRP 181.A O no hydrogen 3.550 N/A ILE 186.A N SER 182.A O no hydrogen 3.002 N/A PHE 187.A N LEU 183.A O no hydrogen 2.815 N/A ALA 188.A N GLY 184.A O no hydrogen 3.030 N/A GLU 189.A N CYS 185.A O no hydrogen 3.105 N/A MET 190.A N ILE 186.A O no hydrogen 2.868 N/A VAL 191.A N PHE 187.A O no hydrogen 3.134 N/A THR 192.A N ALA 188.A O no hydrogen 2.940 N/A THR 192.A OG1 ALA 188.A O no hydrogen 3.003 N/A ARG 193.A N GLU 189.A O no hydrogen 2.876 N/A ARG 193.A NH2 ALA 89.A O no hydrogen 2.991 N/A ARG 193.A NH2 LEU 90.A O no hydrogen 3.163 N/A ARG 194.A N THR 192.A OG1 no hydrogen 3.332 N/A GLY 199.A N PHE 197.A O no hydrogen 2.903 N/A GLY 199.A N GLN 205.A OE1 no hydrogen 2.887 N/A ASP 200.A N ASP 204.A OD2 no hydrogen 3.171 N/A ASP 204.A N SER 201.A OG no hydrogen 3.070 N/A GLN 205.A N SER 201.A O no hydrogen 2.877 N/A GLN 205.A NE2 TRP 161.A O no hydrogen 3.225 N/A GLN 205.A NE2 PHE 197.A O no hydrogen 2.930 N/A LEU 206.A N.A GLU 202.A O no hydrogen 3.001 N/A LEU 206.A N.B GLU 202.A O no hydrogen 2.949 N/A PHE 207.A N ILE 203.A O no hydrogen 2.856 N/A ARG 208.A N ASP 204.A O no hydrogen 2.883 N/A ARG 208.A NE ASP 204.A OD2 no hydrogen 2.994 N/A ILE 209.A N GLN 205.A O no hydrogen 3.097 N/A PHE 210.A N LEU 206.A O.A no hydrogen 2.869 N/A PHE 210.A N LEU 206.A O.B no hydrogen 3.012 N/A ARG 211.A N.A PHE 207.A O no hydrogen 2.870 N/A ARG 211.A N.B PHE 207.A O no hydrogen 2.852 N/A THR 212.A N ARG 208.A O no hydrogen 3.354 N/A THR 212.A N ILE 209.A O no hydrogen 3.198 N/A LEU 213.A N ILE 209.A O no hydrogen 2.871 N/A GLY 214.A N PHE 210.A O no hydrogen 2.763 N/A THR 215.A N TRP 237.A O no hydrogen 2.929 N/A THR 215.A OG1 PRO 235.A O no hydrogen 2.707 N/A VAL 219.A N ASP 217.A OD1 no hydrogen 3.013 N/A VAL 220.A N ASP 217.A OD1 no hydrogen 3.268 N/A TRP 221.A N ASP 217.A O no hydrogen 2.915 N/A GLY 223.A N GLU 218.A OE1 no hydrogen 2.796 N/A VAL 224.A N TRP 221.A O no hydrogen 2.964 N/A THR 225.A N GLU 218.A OE2 no hydrogen 3.001 N/A THR 225.A OG1 GLU 218.A OE2 no hydrogen 2.637 N/A SER 226.A N GLY 223.A O no hydrogen 3.006 N/A MET 227.A N VAL 224.A O no hydrogen 3.120 N/A ASP 229.A N LEU 169.A O no hydrogen 2.906 N/A TYR 230.A N MET 227.A O no hydrogen 3.119 N/A PHE 234.A N LYS 231.A O no hydrogen 2.981 N/A LYS 236.A NZ PHE 234.A O no hydrogen 2.733 N/A TRP 237.A N THR 215.A OG1 no hydrogen 2.905 N/A ARG 239.A NH1 LEU 213.A O no hydrogen 2.964 N/A GLN 240.A N THR 212.A O no hydrogen 2.793 N/A LYS 244.A N ASP 241.A O no hydrogen 2.943 N/A VAL 245.A N PHE 242.A O no hydrogen 2.992 N/A VAL 246.A N PHE 242.A O no hydrogen 2.949 N/A LEU 249.A N VAL 246.A O no hydrogen 2.899 N/A GLY 253.A N ASP 250.A OD1 no hydrogen 2.914 N/A ARG 254.A N ASP 250.A O no hydrogen 2.828 N/A ARG 254.A NH1 LEU 249.A O no hydrogen 2.817 N/A SER 255.A N GLU 251.A O no hydrogen 2.927 N/A SER 255.A OG HIS 277.A NE2 no hydrogen 3.186 N/A LEU 256.A N ASP 252.A O no hydrogen 3.036 N/A LEU 257.A N GLY 253.A O no hydrogen 2.869 N/A SER 258.A N ARG 254.A O no hydrogen 2.885 N/A SER 258.A OG.B SER 255.A O no hydrogen 2.700 N/A GLN 259.A N SER 255.A O no hydrogen 3.135 N/A MET 260.A N LEU 256.A O no hydrogen 2.991 N/A LEU 261.A N LEU 257.A O no hydrogen 3.001 N/A LEU 261.A N SER 258.A O no hydrogen 3.322 N/A TYR 263.A OH GLY 214.A O no hydrogen 2.630 N/A ASN 266.A N ASP 264.A OD1 no hydrogen 2.940 N/A LYS 267.A N ASP 264.A O no hydrogen 2.960 N/A LYS 267.A NZ VAL 220.A O no hydrogen 3.158 N/A LYS 267.A NZ ASP 264.A OD2 no hydrogen 2.883 N/A ARG 268.A N ASP 264.A O no hydrogen 3.130 N/A ARG 268.A NE HIS 262.A O no hydrogen 2.828 N/A ARG 268.A NH1 GLU 166.A OE1 no hydrogen 3.390 N/A ARG 268.A NH1 GLU 166.A OE2 no hydrogen 2.851 N/A ARG 268.A NH1 ALA 177.A O no hydrogen 2.988 N/A ARG 268.A NH2 GLU 166.A OE1 no hydrogen 2.850 N/A ARG 268.A NH2 HIS 262.A O no hydrogen 3.184 N/A ARG 268.A NH2 TYR 263.A O no hydrogen 2.953 N/A ILE 269.A N GLN 259.A O no hydrogen 3.037 N/A ALA 273.A N SER 270.A OG no hydrogen 2.978 N/A ALA 274.A N SER 270.A O no hydrogen 2.891 N/A LEU 275.A N ALA 271.A O no hydrogen 3.045 N/A ALA 276.A N ALA 273.A O no hydrogen 3.077 N/A HIS 277.A N ALA 274.A O no hydrogen 2.977 N/A HIS 277.A NE2 SER 255.A OG no hydrogen 3.186 N/A PHE 279.A N HIS 277.A ND1 no hydrogen 2.909 N/A PHE 280.A N HIS 277.A O no hydrogen 3.006 N/A GLN 281.A N PRO 278.A O no hydrogen 3.046 N/A VAL 283.A N PHE 280.A O no hydrogen 3.103 N/A