Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xkg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 7.A OE2.A no hydrogen 2.509 N/A THR 4.A N GLU 7.A OE1.B no hydrogen 3.250 N/A THR 4.A N GLU 7.A OE2.A no hydrogen 2.946 N/A THR 4.A OG1 GLU 7.A OE1.B no hydrogen 2.786 N/A GLU 7.A N.A THR 4.A OG1 no hydrogen 3.322 N/A GLU 7.A N.B THR 4.A OG1 no hydrogen 3.293 N/A TYR 8.A N THR 4.A O no hydrogen 2.918 N/A TYR 8.A OH ASN 44.A O no hydrogen 2.830 N/A LYS 9.A N PHE 5.A O no hydrogen 2.865 N/A LYS 9.A NZ GLU 22.A OE2.A no hydrogen 2.927 N/A LYS 9.A NZ GLU 22.A OE2.B no hydrogen 2.282 N/A LYS 10.A N GLU 6.A O no hydrogen 3.284 N/A LYS 10.A NZ GLU 6.A OE2 no hydrogen 3.306 N/A ALA 11.A N GLU 7.A O.A no hydrogen 2.937 N/A ALA 11.A N GLU 7.A O.B no hydrogen 2.842 N/A PHE 12.A N TYR 8.A O no hydrogen 2.997 N/A ASN 13.A N LYS 10.A O no hydrogen 3.089 N/A LYS 14.A N LYS 9.A O no hydrogen 2.817 N/A LYS 14.A NZ HIS 45.A O no hydrogen 2.829 N/A LYS 14.A NZ ASP 48.A OD1 no hydrogen 3.279 N/A LYS 14.A NZ ASP 48.A OD2 no hydrogen 2.904 N/A TYR 16.A OH ASP 48.A OD2 no hydrogen 2.669 N/A ASP 21.A N THR 18.A OG1 no hydrogen 2.977 N/A GLU 22.A N THR 18.A O no hydrogen 3.012 N/A GLU 23.A N PHE 19.A O no hydrogen 2.780 N/A ALA 24.A N GLU 20.A O no hydrogen 3.070 N/A ALA 25.A N ASP 21.A O no hydrogen 2.941 N/A ARG 26.A N GLU 22.A O no hydrogen 2.961 N/A ARG 26.A NH2 GLU 22.A OE2.A no hydrogen 3.056 N/A LYS 27.A N GLU 23.A O no hydrogen 3.049 N/A ASN 28.A N ALA 24.A O no hydrogen 2.837 N/A ASN 28.A ND2 ASP 48.A O no hydrogen 3.411 N/A PHE 29.A N ALA 25.A O no hydrogen 2.750 N/A LEU 30.A N ARG 26.A O no hydrogen 2.968 N/A GLU 31.A N LYS 27.A O no hydrogen 3.069 N/A SER 32.A N ASN 28.A O no hydrogen 2.876 N/A SER 32.A OG ASN 28.A O no hydrogen 3.136 N/A SER 32.A OG SER 47.A O no hydrogen 2.716 N/A VAL 33.A N PHE 29.A O no hydrogen 2.894 N/A LYS 34.A N LEU 30.A O no hydrogen 3.124 N/A LYS 34.A NZ GLU 31.A OE2 no hydrogen 3.038 N/A TYR 35.A N GLU 31.A O no hydrogen 2.913 N/A VAL 36.A N SER 32.A O no hydrogen 2.883 N/A GLN 37.A N VAL 33.A O no hydrogen 2.856 N/A SER 38.A N LYS 34.A O no hydrogen 3.419 N/A SER 38.A N TYR 35.A O no hydrogen 3.294 N/A ASN 39.A N TYR 35.A O no hydrogen 2.905 N/A ASN 39.A ND2 TYR 35.A O no hydrogen 3.038 N/A GLY 40.A N VAL 36.A O no hydrogen 2.891 N/A ALA 42.A N HIS 224.A O no hydrogen 2.847 N/A ASN 44.A N SER 47.A OG no hydrogen 2.880 N/A ASN 44.A ND2 ARG 223.A O no hydrogen 2.923 N/A HIS 45.A N HIS 45.A ND1 no hydrogen 2.804 N/A HIS 45.A NE2 TRP 264.A O no hydrogen 2.720 N/A LEU 46.A N ASN 44.A OD1 no hydrogen 2.844 N/A SER 47.A N ASN 44.A O no hydrogen 3.002 N/A SER 47.A OG ASN 44.A O no hydrogen 3.146 N/A SER 47.A OG HIS 224.A NE2 no hydrogen 2.768 N/A LEU 49.A N LEU 46.A O no hydrogen 3.301 N/A SER 50.A N GLU 53.A OE1 no hydrogen 2.940 N/A GLU 53.A N SER 50.A OG no hydrogen 2.943 N/A PHE 54.A N SER 50.A O no hydrogen 2.809 N/A LYS 55.A N LEU 51.A O no hydrogen 2.883 N/A LYS 55.A NZ ASP 52.A OD1.A no hydrogen 3.391 N/A ASN 56.A N ASP 52.A O no hydrogen 2.879 N/A ASN 56.A ND2 ASP 52.A OD2.B no hydrogen 3.126 N/A ARG 57.A N GLU 53.A O no hydrogen 2.876 N/A PHE 58.A N PHE 54.A O no hydrogen 2.933 N/A LEU 59.A N LYS 55.A O no hydrogen 3.183 N/A MET 60.A N TYR 241.A O no hydrogen 2.892 N/A ALA 64.A N SER 61.A OG no hydrogen 2.978 N/A PHE 65.A N SER 61.A O no hydrogen 2.915 N/A GLU 66.A N ALA 62.A O no hydrogen 2.807 N/A HIS 67.A N GLU 63.A O no hydrogen 3.003 N/A LEU 68.A N ALA 64.A O no hydrogen 3.400 N/A LEU 68.A N PHE 65.A O no hydrogen 2.986 N/A LYS 69.A N GLU 66.A O no hydrogen 3.201 N/A GLN 71.A N LEU 68.A O no hydrogen 2.888 N/A PHE 72.A N LYS 69.A O no hydrogen 2.996 N/A ASP 73.A N LYS 69.A O no hydrogen 3.147 N/A ASN 74.A ND2 TYR 188.A O no hydrogen 3.017 N/A CYS 76.A N GLN 190.A O no hydrogen 2.866 N/A ILE 86.A N TYR 249.A O no hydrogen 3.099 N/A LEU 88.A N VAL 247.A O no hydrogen 2.820 N/A ARG 89.A N ASP 87.A OD1 no hydrogen 2.853 N/A ARG 89.A NE ASP 87.A OD1 no hydrogen 3.079 N/A ARG 89.A NE ASP 87.A OD2 no hydrogen 3.358 N/A ARG 89.A NH1 TYR 275.A OH no hydrogen 2.947 N/A ARG 89.A NH2 ASP 87.A OD2 no hydrogen 2.869 N/A ARG 89.A NH2 TYR 275.A OH no hydrogen 3.566 N/A MET 91.A N ASP 87.A O no hydrogen 3.037 N/A ARG 92.A N ARG 89.A O no hydrogen 3.293 N/A THR 93.A N LEU 88.A O no hydrogen 3.048 N/A THR 93.A OG1 HIS 207.A O no hydrogen 2.853 N/A THR 95.A OG1 GLU 116.A OE1 no hydrogen 2.686 N/A ARG 98.A NH2 GLU 116.A OE1 no hydrogen 3.034 N/A GLN 100.A N SER 263.A O no hydrogen 2.841 N/A GLN 100.A NE2 PHE 58.A O no hydrogen 3.250 N/A GLN 100.A NE2 CYS 103.A O no hydrogen 2.826 N/A CYS 103.A N GLY 101.A O no hydrogen 2.835 N/A CYS 103.A SG TYR 168.A OH no hydrogen 3.648 N/A GLY 104.A N CYS 143.A O no hydrogen 2.750 N/A SER 105.A N CYS 103.A O no hydrogen 2.872 N/A SER 105.A OG CYS 103.A O no hydrogen 3.450 N/A SER 105.A OG TYR 168.A OH no hydrogen 2.892 N/A TRP 107.A NE1 GLY 142.A O no hydrogen 2.886 N/A ALA 108.A N SER 105.A O no hydrogen 2.828 N/A PHE 109.A N SER 105.A O no hydrogen 3.043 N/A SER 110.A N ALA 106.A O no hydrogen 2.770 N/A SER 110.A OG ALA 106.A O no hydrogen 3.408 N/A SER 110.A OG TRP 107.A O no hydrogen 2.908 N/A GLY 111.A N TRP 107.A O no hydrogen 3.306 N/A VAL 112.A N ALA 108.A O no hydrogen 2.916 N/A ALA 113.A N PHE 109.A O no hydrogen 2.818 N/A ALA 114.A N SER 110.A O no hydrogen 3.088 N/A THR 115.A N GLY 111.A O no hydrogen 3.068 N/A THR 115.A OG1 GLY 111.A O no hydrogen 2.903 N/A GLU 116.A N VAL 112.A O no hydrogen 2.801 N/A SER 117.A N ALA 113.A O no hydrogen 2.929 N/A SER 117.A OG THR 93.A O no hydrogen 2.641 N/A ALA 118.A N ALA 114.A O no hydrogen 2.902 N/A TYR 119.A N THR 115.A O no hydrogen 3.006 N/A TYR 119.A OH GLY 184.A O no hydrogen 2.686 N/A LEU 120.A N GLU 116.A O no hydrogen 3.087 N/A ALA 121.A N SER 117.A O no hydrogen 2.846 N/A TYR 122.A N ALA 118.A O no hydrogen 2.879 N/A ARG 123.A N TYR 119.A O no hydrogen 2.926 N/A ARG 123.A NH1 THR 297.A O no hydrogen 2.981 N/A ARG 123.A NH2 GLY 295.A O no hydrogen 3.141 N/A ARG 123.A NH2 THR 297.A O no hydrogen 2.715 N/A ASP 124.A N LEU 120.A O no hydrogen 3.079 N/A GLN 125.A N TYR 119.A O no hydrogen 3.132 N/A LEU 129.A N GLU 116.A OE2 no hydrogen 2.762 N/A ALA 130.A N VAL 161.A O no hydrogen 2.927 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.731 N/A GLN 132.A NE2 ASP 136.A OD1 no hydrogen 2.808 N/A GLN 132.A NE2 ASP 136.A OD2 no hydrogen 3.422 N/A GLN 132.A NE2 ARG 171.A O no hydrogen 2.902 N/A GLU 133.A N ALA 130.A O no hydrogen 2.974 N/A VAL 135.A N GLU 131.A O no hydrogen 2.962 N/A ASP 136.A N GLN 132.A O no hydrogen 2.933 N/A CYS 137.A N GLU 133.A O no hydrogen 2.797 N/A CYS 137.A SG TYR 166.A OH no hydrogen 3.832 N/A CYS 137.A SG ARG 176.A O no hydrogen 3.721 N/A ALA 138.A N LEU 134.A O no hydrogen 2.898 N/A SER 139.A OG ASP 146.A OD2 no hydrogen 2.645 N/A HIS 141.A N SER 139.A OG no hydrogen 2.951 N/A HIS 141.A ND1 HIS 141.A O no hydrogen 2.678 N/A CYS 143.A N GLU 172.A OE2 no hydrogen 2.856 N/A HIS 144.A N HIS 141.A O no hydrogen 2.901 N/A HIS 144.A ND1 GLU 172.A OE2 no hydrogen 2.732 N/A GLY 145.A N GLY 104.A O no hydrogen 2.953 N/A THR 147.A N ASP 146.A OD1 no hydrogen 2.821 N/A ARG 150.A N THR 147.A OG1 no hydrogen 2.940 N/A ARG 150.A NH1 GLN 71.A OE1 no hydrogen 2.874 N/A ARG 150.A NH1 ASP 146.A OD1 no hydrogen 2.857 N/A ARG 150.A NH2 GLN 71.A OE1 no hydrogen 3.256 N/A ILE 152.A N ILE 148.A O no hydrogen 3.080 N/A GLU 153.A N PRO 149.A O no hydrogen 2.756 N/A TYR 154.A N ARG 150.A O no hydrogen 3.272 N/A TYR 154.A OH GLU 133.A OE2 no hydrogen 2.669 N/A ILE 155.A N GLY 151.A O no hydrogen 3.029 N/A GLN 156.A N ILE 152.A O no hydrogen 2.912 N/A HIS 157.A N GLU 153.A O no hydrogen 2.892 N/A ASN 158.A N TYR 154.A O no hydrogen 2.798 N/A ASN 158.A ND2 TYR 154.A O no hydrogen 3.642 N/A GLY 159.A N TYR 154.A O no hydrogen 3.263 N/A GLY 159.A N ILE 155.A O no hydrogen 2.937 N/A VAL 160.A N PHE 183.A O no hydrogen 2.922 N/A VAL 161.A N GLU 133.A OE1 no hydrogen 2.881 N/A GLU 163.A N ASP 128.A O no hydrogen 2.780 N/A TYR 165.A N GLN 162.A O no hydrogen 3.016 N/A TYR 166.A N GLU 163.A O no hydrogen 2.942 N/A TYR 166.A OH ASP 136.A OD2 no hydrogen 2.589 N/A TYR 168.A N GLU 163.A OE2 no hydrogen 3.083 N/A TYR 168.A OH GLN 100.A O no hydrogen 2.500 N/A TYR 168.A OH SER 105.A OG no hydrogen 2.892 N/A VAL 169.A N GLN 132.A OE1 no hydrogen 2.796 N/A GLN 173.A N ASP 136.A OD1 no hydrogen 2.934 N/A GLN 173.A NE2 ASP 136.A OD2 no hydrogen 2.999 N/A CYS 175.A SG ARG 176.A O no hydrogen 3.625 N/A ARG 176.A N TYR 166.A OH no hydrogen 2.861 N/A ARG 176.A NH1 SER 174.A O no hydrogen 2.804 N/A ARG 182.A NH1 GLU 133.A OE2 no hydrogen 2.660 N/A ARG 182.A NH1 ASN 158.A O no hydrogen 3.425 N/A ARG 182.A NH1 GLY 159.A O no hydrogen 2.887 N/A ARG 182.A NH2 GLU 133.A OE2 no hydrogen 2.922 N/A PHE 183.A N VAL 160.A O no hydrogen 2.871 N/A SER 186.A N ILE 293.A O no hydrogen 2.929 N/A SER 186.A OG LEU 294.A O no hydrogen 2.143 N/A ASN 187.A N ILE 293.A O no hydrogen 3.080 N/A ASN 187.A ND2 GLN 156.A OE1 no hydrogen 3.261 N/A TYR 188.A OH GLU 153.A OE2 no hydrogen 2.742 N/A CYS 189.A N VAL 291.A O no hydrogen 2.941 N/A GLN 190.A N ASN 74.A O no hydrogen 2.974 N/A GLN 190.A NE2 PHE 72.A O no hydrogen 3.024 N/A ILE 191.A N PRO 289.A O no hydrogen 2.837 N/A LYS 198.A N ASN 195.A OD1 no hydrogen 2.814 N/A ILE 199.A N ASN 195.A O no hydrogen 3.142 N/A ARG 200.A N ALA 196.A O no hydrogen 2.905 N/A ARG 200.A NH1 ASN 197.A OD1 no hydrogen 2.928 N/A ARG 200.A NH1 ASN 279.A OD1 no hydrogen 3.433 N/A ARG 200.A NH2 ASN 279.A OD1 no hydrogen 2.836 N/A GLU 201.A N ASN 197.A O no hydrogen 2.926 N/A ALA 202.A N LYS 198.A O no hydrogen 2.923 N/A LEU 203.A N ILE 199.A O no hydrogen 3.027 N/A ALA 204.A N ARG 200.A O no hydrogen 2.895 N/A GLN 205.A N GLU 201.A O no hydrogen 2.904 N/A GLN 205.A NE2 GLU 201.A OE2 no hydrogen 2.967 N/A THR 206.A N ALA 202.A O no hydrogen 3.049 N/A THR 206.A OG1 ALA 202.A O no hydrogen 2.791 N/A HIS 207.A N LEU 203.A O no hydrogen 2.799 N/A SER 208.A N THR 206.A OG1 no hydrogen 3.284 N/A SER 208.A OG THR 206.A O no hydrogen 2.915 N/A ALA 209.A N SER 117.A OG no hydrogen 2.880 N/A ILE 210.A N ILE 246.A O no hydrogen 2.988 N/A ALA 211.A N TYR 290.A O no hydrogen 2.999 N/A VAL 212.A N VAL 244.A O no hydrogen 2.940 N/A ILE 214.A N HIS 242.A O no hydrogen 2.939 N/A GLY 215.A N MET 283.A O no hydrogen 2.842 N/A ILE 216.A N ASN 240.A O no hydrogen 2.805 N/A LYS 217.A N ASP 234.A OD1 no hydrogen 3.307 N/A LYS 217.A N ASP 234.A OD2 no hydrogen 2.759 N/A LYS 217.A NZ ASP 234.A O no hydrogen 3.225 N/A LYS 217.A NZ ASP 234.A OD2 no hydrogen 2.773 N/A ASP 218.A N ASP 234.A OD1 no hydrogen 2.905 N/A ALA 221.A N ASP 218.A OD1 no hydrogen 3.232 N/A PHE 222.A N ASP 218.A O no hydrogen 3.142 N/A ARG 223.A N LEU 219.A O no hydrogen 2.757 N/A ARG 223.A NE ASP 220.A OD1 no hydrogen 3.106 N/A ARG 223.A NH1 LEU 46.A O no hydrogen 2.934 N/A ARG 223.A NH1 LEU 49.A O no hydrogen 2.717 N/A ARG 223.A NH2 ASP 220.A OD1 no hydrogen 2.916 N/A HIS 224.A N ASP 220.A O no hydrogen 3.033 N/A HIS 224.A NE2 SER 47.A OG no hydrogen 2.768 N/A TYR 225.A N PHE 222.A O no hydrogen 3.299 N/A TYR 225.A OH THR 229.A O no hydrogen 2.627 N/A ARG 228.A N ASP 226.A OD1 no hydrogen 2.976 N/A ILE 231.A N TYR 275.A O no hydrogen 2.799 N/A ASN 240.A N ILE 216.A O no hydrogen 2.900 N/A TYR 241.A N MET 60.A O no hydrogen 2.856 N/A HIS 242.A N ILE 214.A O no hydrogen 2.926 N/A HIS 242.A NE2 ASN 262.A OD1 no hydrogen 2.810 N/A VAL 244.A N VAL 212.A O no hydrogen 2.929 N/A ASN 245.A N ARG 261.A O no hydrogen 3.049 N/A ASN 245.A ND2 SER 110.A O no hydrogen 2.931 N/A ILE 246.A N ILE 210.A O no hydrogen 2.830 N/A VAL 247.A N ILE 259.A O no hydrogen 2.811 N/A TYR 249.A N ILE 86.A O no hydrogen 2.816 N/A TYR 249.A OH PRO 83.A O no hydrogen 2.709 N/A SER 250.A N TYR 257.A O no hydrogen 3.113 N/A SER 250.A OG GLU 85.A OE1 no hydrogen 2.632 N/A ASN 251.A ND2 ASP 256.A OD1 no hydrogen 2.780 N/A ALA 252.A N VAL 255.A O no hydrogen 2.915 N/A VAL 255.A N ALA 252.A O no hydrogen 2.852 N/A TYR 257.A N SER 250.A O no hydrogen 2.910 N/A TRP 258.A N PHE 276.A O no hydrogen 2.716 N/A TRP 258.A NE1 GLU 286.A OE2 no hydrogen 2.836 N/A ILE 259.A N GLY 248.A O no hydrogen 2.888 N/A VAL 260.A N GLY 274.A O no hydrogen 2.777 N/A ARG 261.A N ASN 245.A O no hydrogen 2.752 N/A ARG 261.A NH1 THR 95.A O no hydrogen 2.860 N/A ARG 261.A NH2 THR 95.A O no hydrogen 3.535 N/A ARG 261.A NH2 PRO 96.A O no hydrogen 2.899 N/A ASN 262.A N GLY 272.A O no hydrogen 3.253 N/A SER 263.A N ASN 262.A OD1 no hydrogen 2.729 N/A SER 263.A OG GLN 100.A OE1 no hydrogen 2.773 N/A TRP 264.A NE1 GLN 100.A OE1 no hydrogen 3.022 N/A ASP 265.A N ARG 98.A O no hydrogen 2.900 N/A THR 266.A N ASP 265.A OD1 no hydrogen 2.892 N/A TRP 268.A NE1 PHE 222.A O no hydrogen 2.797 N/A GLY 269.A N TYR 225.A O no hydrogen 3.057 N/A ASP 270.A N TYR 273.A O no hydrogen 2.746 N/A GLY 272.A N TRP 268.A O no hydrogen 2.775 N/A TYR 273.A N ASP 270.A O no hydrogen 3.065 N/A GLY 274.A N VAL 260.A O no hydrogen 2.789 N/A TYR 275.A N TYR 225.A OH no hydrogen 3.070 N/A TYR 275.A OH ASP 270.A OD2 no hydrogen 2.602 N/A PHE 276.A N TRP 258.A O no hydrogen 3.001 N/A ALA 277.A N ILE 231.A O no hydrogen 2.809 N/A ALA 278.A N ASP 256.A O no hydrogen 2.875 N/A ASN 279.A N GLU 286.A OE2 no hydrogen 2.960 N/A ASN 279.A ND2 ASP 256.A OD2 no hydrogen 2.852 N/A ASP 281.A N GLU 286.A OE1 no hydrogen 2.839 N/A MET 284.A N ASP 281.A O no hydrogen 3.000 N/A ILE 285.A N LEU 282.A O no hydrogen 2.968 N/A GLU 286.A N ASP 281.A OD1 no hydrogen 3.142 N/A GLU 287.A N MET 284.A O no hydrogen 2.981 N/A TYR 290.A N ALA 211.A O no hydrogen 2.763 N/A TYR 290.A OH PHE 72.A O no hydrogen 3.135 N/A VAL 291.A N CYS 189.A O no hydrogen 2.936 N/A ILE 293.A N ASN 187.A O no hydrogen 2.863 N/A THR 297.A N LEU 294.A O no hydrogen 3.274 N/A