Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jkj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 197.A OD1 no hydrogen 2.796 N/A SER 1.A N ASP 197.A OD2 no hydrogen 2.549 N/A SER 1.A N GLN 199.A OE1 no hydrogen 2.811 N/A ILE 2.A N THR 173.A OG1 no hydrogen 2.809 N/A ILE 4.A N ILE 2.A O no hydrogen 2.586 N/A ASP 5.A N THR 8.A OG1 no hydrogen 3.136 N/A LYS 6.A N GLU 131.A OE1 no hydrogen 3.004 N/A ASN 7.A N ASP 5.A OD1 no hydrogen 2.635 N/A THR 8.A N ASP 5.A O no hydrogen 3.106 N/A THR 8.A OG1 ASP 5.A O no hydrogen 3.555 N/A LYS 9.A NZ GLY 64.A O no hydrogen 3.503 N/A VAL 10.A N LYS 33.A O no hydrogen 2.964 N/A ILE 11.A N ALA 67.A O no hydrogen 2.864 N/A CYS 12.A N GLY 36.A O no hydrogen 2.843 N/A CYS 12.A SG GLN 13.A O no hydrogen 3.802 N/A CYS 12.A SG SER 24.A OG no hydrogen 3.728 N/A CYS 12.A SG VAL 69.A O no hydrogen 3.734 N/A GLN 13.A N VAL 69.A O no hydrogen 2.727 N/A GLN 13.A NE2 SER 80.A O no hydrogen 2.927 N/A GLY 14.A N VAL 38.A O no hydrogen 2.937 N/A THR 16.A OG1 THR 39.A OG1 no hydrogen 2.564 N/A GLY 17.A N GLY 14.A O no hydrogen 2.995 N/A THR 21.A N GLY 17.A O no hydrogen 2.717 N/A THR 21.A OG1 PHE 15.A O no hydrogen 3.308 N/A THR 21.A OG1 GLY 17.A O no hydrogen 2.768 N/A THR 21.A OG1 HIS 47.A NE2 no hydrogen 2.814 N/A PHE 22.A N SER 18.A O no hydrogen 2.850 N/A HIS 23.A N GLN 19.A O no hydrogen 2.823 N/A SER 24.A N GLY 20.A O no hydrogen 3.025 N/A SER 24.A OG GLY 20.A O no hydrogen 2.755 N/A GLU 25.A N THR 21.A O no hydrogen 2.980 N/A GLN 26.A N PHE 22.A O no hydrogen 3.235 N/A GLN 26.A NE2 PHE 22.A O no hydrogen 3.657 N/A ALA 27.A N HIS 23.A O no hydrogen 2.900 N/A ILE 28.A N SER 24.A O no hydrogen 2.720 N/A ALA 29.A N GLU 25.A O no hydrogen 2.885 N/A TYR 30.A N GLN 26.A O no hydrogen 3.057 N/A GLY 31.A N ILE 28.A O no hydrogen 2.823 N/A THR 32.A N ALA 27.A O no hydrogen 2.961 N/A THR 32.A OG1 ALA 27.A O no hydrogen 3.451 N/A THR 32.A OG1 LYS 133.A O no hydrogen 2.667 N/A LYS 33.A NZ LYS 6.A O no hydrogen 3.251 N/A LYS 33.A NZ ASN 7.A OD1 no hydrogen 3.391 N/A MET 34.A N THR 32.A O no hydrogen 2.801 N/A VAL 35.A N VAL 10.A O no hydrogen 2.804 N/A GLY 37.A N PRO 51.A O no hydrogen 2.935 N/A VAL 38.A N CYS 12.A O no hydrogen 2.737 N/A THR 39.A N PHE 53.A O no hydrogen 2.898 N/A THR 39.A OG1 THR 16.A OG1 no hydrogen 2.564 N/A GLY 41.A N ASN 54.A OD1 no hydrogen 2.815 N/A LYS 42.A N THR 39.A O no hydrogen 2.800 N/A GLY 43.A N ASN 54.A OD1 no hydrogen 2.851 N/A GLY 44.A N VAL 52.A O no hydrogen 2.744 N/A THR 45.A N LYS 42.A O no hydrogen 3.341 N/A THR 45.A OG1 LYS 42.A O no hydrogen 2.790 N/A HIS 47.A N LEU 50.A O no hydrogen 2.861 N/A HIS 47.A NE2 THR 21.A OG1 no hydrogen 2.814 N/A LEU 50.A N HIS 47.A O no hydrogen 2.814 N/A VAL 52.A N THR 45.A O no hydrogen 2.882 N/A PHE 53.A N GLY 37.A O no hydrogen 2.657 N/A ASN 54.A N GLU 58.A OE1 no hydrogen 2.984 N/A THR 55.A N GLU 58.A OE1 no hydrogen 3.277 N/A VAL 56.A N GLU 83.A OE2 no hydrogen 2.848 N/A GLU 58.A N THR 55.A OG1 no hydrogen 2.996 N/A ALA 59.A N THR 55.A O no hydrogen 3.081 N/A VAL 60.A N VAL 56.A O no hydrogen 2.838 N/A ALA 61.A N ARG 57.A O no hydrogen 2.986 N/A ALA 62.A N GLU 58.A O no hydrogen 2.929 N/A THR 63.A N ALA 59.A O no hydrogen 2.910 N/A THR 63.A OG1 ALA 59.A O no hydrogen 2.674 N/A GLY 64.A N VAL 60.A O no hydrogen 2.781 N/A ALA 65.A N THR 63.A OG1 no hydrogen 3.146 N/A THR 66.A N LYS 9.A O no hydrogen 3.199 N/A ALA 67.A N LYS 9.A O no hydrogen 3.180 N/A SER 68.A N LEU 91.A O no hydrogen 2.751 N/A SER 68.A OG GLN 13.A OE1 no hydrogen 2.647 N/A VAL 69.A N ILE 11.A O no hydrogen 2.909 N/A ILE 70.A N ILE 93.A O no hydrogen 2.764 N/A TYR 71.A N GLN 13.A O no hydrogen 2.903 N/A PHE 76.A N PRO 73.A O no hydrogen 2.854 N/A CYS 77.A N ALA 74.A O no hydrogen 3.089 N/A CYS 77.A SG VAL 72.A O no hydrogen 3.317 N/A CYS 77.A SG THR 96.A OG1 no hydrogen 3.323 N/A SER 80.A N PHE 76.A O no hydrogen 2.915 N/A SER 80.A OG PHE 76.A O no hydrogen 3.301 N/A ILE 81.A N CYS 77.A O no hydrogen 2.677 N/A LEU 82.A N LYS 78.A O no hydrogen 2.899 N/A GLU 83.A N ASP 79.A O no hydrogen 2.824 N/A ALA 84.A N SER 80.A O no hydrogen 2.955 N/A ILE 85.A N ILE 81.A O no hydrogen 2.924 N/A ASP 86.A N LEU 82.A O no hydrogen 2.931 N/A ALA 87.A N GLU 83.A O no hydrogen 2.871 N/A ALA 87.A N ALA 84.A O no hydrogen 3.008 N/A GLY 88.A N ILE 85.A O no hydrogen 3.176 N/A ILE 89.A N ALA 84.A O no hydrogen 3.117 N/A LYS 90.A N THR 66.A O no hydrogen 2.913 N/A LYS 90.A NZ GLY 115.A O no hydrogen 3.172 N/A LEU 91.A N THR 66.A O no hydrogen 3.087 N/A ILE 92.A N ARG 117.A O no hydrogen 2.787 N/A ILE 93.A N SER 68.A O no hydrogen 2.757 N/A THR 94.A N ILE 119.A O no hydrogen 2.874 N/A ILE 95.A N ILE 70.A O no hydrogen 2.869 N/A THR 96.A OG1 VAL 72.A O no hydrogen 2.595 N/A ASP 103.A N PRO 100.A O no hydrogen 3.001 N/A MET 104.A N PRO 100.A O no hydrogen 3.162 N/A LEU 105.A N THR 101.A O no hydrogen 2.759 N/A THR 106.A N LEU 102.A O no hydrogen 3.234 N/A THR 106.A OG1 LEU 102.A O no hydrogen 3.568 N/A VAL 107.A N ASP 103.A O no hydrogen 2.865 N/A LYS 108.A N MET 104.A O no hydrogen 2.774 N/A LYS 108.A NZ ASP 112.A OD1 no hydrogen 3.019 N/A LYS 108.A NZ GLY 184.A O no hydrogen 2.678 N/A VAL 109.A N LEU 105.A O no hydrogen 3.373 N/A LYS 110.A N THR 106.A O no hydrogen 3.030 N/A LEU 111.A N VAL 107.A O no hydrogen 2.733 N/A ASP 112.A N LYS 108.A O no hydrogen 3.115 N/A GLU 113.A N VAL 109.A O no hydrogen 3.031 N/A ALA 114.A N LYS 110.A O no hydrogen 2.791 N/A GLY 115.A N ASP 112.A O no hydrogen 3.311 N/A VAL 116.A N LEU 111.A O no hydrogen 2.864 N/A ARG 117.A N LYS 90.A O no hydrogen 2.906 N/A ARG 117.A NE SER 185.A OG no hydrogen 3.067 N/A ARG 117.A NH2 SER 185.A OG no hydrogen 3.122 N/A ILE 119.A N ILE 92.A O no hydrogen 2.777 N/A ASN 122.A N THR 96.A O no hydrogen 2.679 N/A ASN 122.A ND2 ASP 180.A OD1 no hydrogen 2.968 N/A CYS 123.A SG THR 94.A O no hydrogen 3.506 N/A VAL 126.A N ILE 134.A O no hydrogen 2.786 N/A ILE 127.A N CYS 174.A O no hydrogen 2.930 N/A THR 128.A N CYS 132.A O no hydrogen 2.848 N/A THR 128.A OG1 ILE 4.A O no hydrogen 2.806 N/A THR 128.A OG1 THR 173.A OG1 no hydrogen 2.942 N/A GLY 130.A N TYR 30.A OH no hydrogen 2.848 N/A GLU 131.A N THR 128.A O no hydrogen 2.866 N/A CYS 132.A N THR 128.A O no hydrogen 2.838 N/A LYS 133.A N THR 32.A OG1 no hydrogen 2.745 N/A LYS 133.A NZ GLY 135.A O no hydrogen 3.354 N/A LYS 133.A NZ GLN 137.A O no hydrogen 2.790 N/A LYS 133.A NZ GLN 137.A OE1 no hydrogen 3.542 N/A ILE 134.A N VAL 126.A O no hydrogen 2.854 N/A ILE 136.A N PRO 124.A O no hydrogen 2.774 N/A GLN 137.A NE2 ILE 134.A O no hydrogen 3.369 N/A LYS 143.A N GLN 171.A OE1 no hydrogen 2.880 N/A LYS 143.A NZ GLY 168.A O no hydrogen 3.240 N/A GLY 145.A N GLN 171.A O no hydrogen 2.863 N/A LYS 146.A N PHE 169.A O no hydrogen 3.070 N/A VAL 147.A N GLY 170.A O no hydrogen 2.943 N/A GLY 148.A N ALA 202.A O no hydrogen 2.731 N/A ILE 149.A N THR 173.A O no hydrogen 3.009 N/A VAL 150.A N VAL 204.A O no hydrogen 2.816 N/A SER 151.A N VAL 175.A O no hydrogen 2.942 N/A SER 151.A OG SER 153.A O no hydrogen 2.747 N/A SER 151.A OG THR 157.A OG1 no hydrogen 2.759 N/A ARG 152.A N ILE 206.A O no hydrogen 2.958 N/A ARG 152.A NH1 ILE 209.A O no hydrogen 3.039 N/A ARG 152.A NH1 GLY 210.A O no hydrogen 3.123 N/A ARG 152.A NH1 GLU 214.A OE1 no hydrogen 3.422 N/A ARG 152.A NH1 GLU 214.A OE2 no hydrogen 2.844 N/A ARG 152.A NH2 ILE 209.A O no hydrogen 2.942 N/A SER 153.A N SER 151.A OG no hydrogen 2.869 N/A LEU 156.A N SER 153.A OG no hydrogen 3.305 N/A THR 157.A OG1 SER 153.A O no hydrogen 2.756 N/A TYR 158.A N GLY 154.A O no hydrogen 3.124 N/A GLU 159.A N THR 155.A O no hydrogen 3.200 N/A ALA 160.A N LEU 156.A O no hydrogen 3.103 N/A VAL 161.A N THR 157.A O no hydrogen 2.719 N/A LYS 162.A N TYR 158.A O no hydrogen 2.830 N/A LYS 162.A NZ ASP 166.A OD2 no hydrogen 2.819 N/A GLN 163.A N GLU 159.A O no hydrogen 2.981 N/A GLN 163.A NE2 LEU 276.A O no hydrogen 2.848 N/A THR 164.A N ALA 160.A O no hydrogen 2.957 N/A THR 164.A OG1 ALA 160.A O no hydrogen 3.072 N/A THR 164.A OG1 VAL 161.A O no hydrogen 3.059 N/A THR 165.A N VAL 161.A O no hydrogen 2.927 N/A THR 165.A N LYS 162.A O no hydrogen 3.272 N/A THR 165.A OG1 ILE 141.A O no hydrogen 2.779 N/A THR 165.A OG1 VAL 161.A O no hydrogen 3.426 N/A ASP 166.A N LYS 162.A O no hydrogen 2.745 N/A TYR 167.A N GLN 163.A O no hydrogen 2.960 N/A TYR 167.A OH GLU 281.A OE2 no hydrogen 2.711 N/A GLY 168.A N THR 165.A O no hydrogen 2.635 N/A GLY 170.A N THR 164.A O no hydrogen 2.695 N/A GLN 171.A N LYS 143.A O no hydrogen 2.664 N/A GLN 171.A NE2 THR 164.A OG1 no hydrogen 2.701 N/A GLN 171.A NE2 THR 165.A OG1 no hydrogen 2.950 N/A SER 172.A N VAL 147.A O no hydrogen 2.677 N/A SER 172.A OG VAL 147.A O no hydrogen 3.132 N/A SER 172.A OG THR 200.A OG1 no hydrogen 2.544 N/A THR 173.A N SER 172.A OG no hydrogen 2.834 N/A THR 173.A OG1 ILE 2.A O no hydrogen 3.433 N/A THR 173.A OG1 THR 128.A OG1 no hydrogen 2.942 N/A CYS 174.A N ILE 127.A O no hydrogen 2.833 N/A CYS 174.A SG HIS 142.A NE2 no hydrogen 3.594 N/A VAL 175.A N ILE 149.A O no hydrogen 2.770 N/A GLY 176.A N GLY 125.A O no hydrogen 2.989 N/A ILE 177.A N SER 151.A O no hydrogen 2.771 N/A GLY 179.A N ASN 122.A O no hydrogen 2.961 N/A GLY 184.A N GLY 120.A O no hydrogen 2.638 N/A SER 185.A OG MET 118.A O no hydrogen 2.552 N/A ASN 186.A N ASP 189.A OD2 no hydrogen 2.827 N/A ILE 190.A N ASN 186.A O no hydrogen 3.306 N/A LEU 191.A N PHE 187.A O no hydrogen 2.686 N/A GLU 192.A N ILE 188.A O no hydrogen 2.998 N/A PHE 194.A N ILE 190.A O no hydrogen 2.969 N/A GLU 195.A N LEU 191.A O no hydrogen 2.891 N/A LYS 196.A N GLU 192.A O no hydrogen 3.224 N/A ASP 197.A N PHE 194.A O no hydrogen 3.051 N/A GLN 199.A N ASP 197.A OD1 no hydrogen 3.085 N/A GLN 199.A NE2 GLY 145.A O no hydrogen 2.806 N/A THR 200.A N ASP 197.A O no hydrogen 2.809 N/A THR 200.A OG1 SER 172.A OG no hydrogen 2.544 N/A THR 200.A OG1 ASP 197.A OD2 no hydrogen 2.848 N/A GLU 201.A N LYS 146.A O no hydrogen 2.686 N/A ALA 202.A N LYS 146.A O no hydrogen 3.256 N/A ILE 203.A N PRO 228.A O no hydrogen 2.856 N/A VAL 204.A N GLY 148.A O no hydrogen 2.647 N/A MET 205.A N VAL 230.A O no hydrogen 2.840 N/A ILE 206.A N VAL 150.A O no hydrogen 2.685 N/A GLY 207.A N TYR 232.A O no hydrogen 2.942 N/A GLU 208.A N GLU 214.A OE2 no hydrogen 3.096 N/A GLY 210.A N GLY 256.A O no hydrogen 2.860 N/A SER 212.A OG GLU 216.A OE2 no hydrogen 2.841 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.681 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.785 N/A GLU 216.A N SER 212.A O no hydrogen 2.990 N/A ALA 217.A N ALA 213.A O no hydrogen 2.757 N/A ALA 218.A N GLU 214.A O no hydrogen 2.748 N/A ALA 219.A N GLU 215.A O no hydrogen 3.145 N/A TYR 220.A N GLU 216.A O no hydrogen 2.873 N/A ILE 221.A N ALA 217.A O no hydrogen 2.613 N/A LYS 222.A N ALA 218.A O no hydrogen 2.915 N/A GLU 223.A N ALA 219.A O no hydrogen 3.395 N/A HIS 224.A N TYR 220.A O no hydrogen 2.781 N/A VAL 225.A N ILE 221.A O no hydrogen 2.883 N/A THR 226.A N GLU 195.A OE1 no hydrogen 3.041 N/A THR 226.A N GLU 195.A OE2 no hydrogen 3.117 N/A THR 226.A OG1 GLU 195.A OE2 no hydrogen 2.781 N/A LYS 227.A N GLU 195.A OE1 no hydrogen 3.159 N/A LYS 227.A NZ PHE 194.A O no hydrogen 2.920 N/A LYS 227.A NZ GLU 195.A O no hydrogen 3.292 N/A LYS 227.A NZ THR 200.A O no hydrogen 2.628 N/A VAL 230.A N ILE 203.A O no hydrogen 2.764 N/A GLY 231.A N LYS 271.A O no hydrogen 2.889 N/A TYR 232.A N MET 205.A O no hydrogen 3.027 N/A ALA 234.A N GLY 207.A O no hydrogen 3.001 N/A ALA 238.A N GLY 235.A O no hydrogen 3.021 N/A GLY 241.A N ILE 251.A O no hydrogen 2.821 N/A MET 244.A N ALA 249.A O no hydrogen 2.755 N/A HIS 246.A ND1 GLU 208.A OE2 no hydrogen 2.563 N/A GLY 248.A N GLY 179.A O no hydrogen 2.828 N/A ALA 249.A N HIS 246.A O no hydrogen 2.686 N/A LYS 255.A N ALA 252.A O no hydrogen 3.198 N/A GLY 256.A N GLU 260.A OE1 no hydrogen 2.938 N/A THR 257.A N GLU 260.A OE1 no hydrogen 3.453 N/A GLU 260.A N THR 257.A OG1 no hydrogen 3.040 N/A LYS 261.A N THR 257.A O no hydrogen 3.030 N/A LYS 261.A NZ GLY 210.A O no hydrogen 3.095 N/A LYS 261.A NZ GLY 211.A O no hydrogen 2.986 N/A LYS 261.A NZ GLU 214.A OE1 no hydrogen 2.732 N/A LYS 261.A NZ GLU 215.A OE1 no hydrogen 3.035 N/A PHE 262.A N ALA 258.A O no hydrogen 2.755 N/A ALA 263.A N ASP 259.A O no hydrogen 2.817 N/A ALA 264.A N GLU 260.A O no hydrogen 2.911 N/A LEU 265.A N LYS 261.A O no hydrogen 2.969 N/A GLU 266.A N PHE 262.A O no hydrogen 2.930 N/A ALA 267.A N ALA 263.A O no hydrogen 3.030 N/A ALA 268.A N ALA 264.A O no hydrogen 3.212 N/A GLY 269.A N GLU 266.A O no hydrogen 2.787 N/A VAL 270.A N LEU 265.A O no hydrogen 2.847 N/A LYS 271.A N VAL 229.A O no hydrogen 2.867 N/A THR 272.A OG1 GLU 266.A OE2 no hydrogen 2.421 N/A VAL 273.A N GLY 231.A O no hydrogen 3.006 N/A ARG 274.A NH1 ASP 259.A OD1 no hydrogen 3.072 N/A ARG 274.A NH2 ASP 259.A OD1 no hydrogen 3.470 N/A ALA 277.A N SER 275.A OG no hydrogen 3.048 N/A ASP 278.A N SER 275.A O no hydrogen 3.019 N/A GLY 280.A N GLN 163.A OE1 no hydrogen 2.903 N/A ALA 282.A N ASP 278.A O no hydrogen 2.956 N/A LEU 283.A N ILE 279.A O no hydrogen 3.013 N/A LYS 284.A N GLY 280.A O no hydrogen 2.984 N/A THR 285.A N GLU 281.A O no hydrogen 3.031 N/A THR 285.A OG1 GLU 281.A O no hydrogen 3.460 N/A VAL 286.A N ALA 282.A O no hydrogen 3.227 N/A LEU 287.A N LYS 284.A O no hydrogen 3.325 N/A