Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wkr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 THR 3.A O no hydrogen 3.400 N/A THR 3.A OG1 GLU 5.A OE1 no hydrogen 3.013 N/A THR 3.A OG1 GLU 5.A OE2 no hydrogen 2.679 N/A LEU 4.A N ASN 191.A OD1 no hydrogen 2.791 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.554 N/A ARG 6.A N THR 3.A O no hydrogen 3.232 N/A ILE 7.A N LEU 4.A O no hydrogen 3.123 N/A LYS 9.A N ILE 7.A O no hydrogen 2.959 N/A LYS 9.A NZ THR 131.A OG1 no hydrogen 3.304 N/A ASN 10.A ND2 GLN 109.A O no hydrogen 3.051 N/A ASN 10.A ND2 ASP 111.A OD1 no hydrogen 3.378 N/A PHE 11.A N SER 27.A OG no hydrogen 3.305 N/A VAL 12.A N GLY 107.A O no hydrogen 2.953 N/A ILE 13.A N PHE 25.A O no hydrogen 2.813 N/A THR 14.A N PHE 105.A O no hydrogen 2.989 N/A THR 14.A OG1 ASN 21.A OD1 no hydrogen 2.641 N/A ASP 15.A N PRO 22.A O no hydrogen 2.972 N/A ARG 17.A N ASP 15.A OD1 no hydrogen 2.915 N/A LEU 18.A N ASP 15.A O no hydrogen 3.200 N/A ASN 21.A N LEU 18.A O no hydrogen 3.051 N/A ILE 23.A N ARG 44.A O no hydrogen 2.927 N/A ILE 24.A N ILE 13.A O no hydrogen 2.682 N/A PHE 25.A N ILE 13.A O no hydrogen 3.179 N/A SER 27.A N PHE 11.A O no hydrogen 3.059 N/A SER 27.A OG LYS 9.A O no hydrogen 2.694 N/A SER 29.A OG LYS 9.A O no hydrogen 3.444 N/A PHE 30.A N SER 27.A OG no hydrogen 3.171 N/A LEU 31.A N SER 27.A O no hydrogen 3.123 N/A GLN 32.A N ASP 28.A O no hydrogen 2.848 N/A LEU 33.A N SER 29.A O no hydrogen 2.718 N/A THR 34.A N PHE 30.A O no hydrogen 2.900 N/A THR 34.A OG1 PHE 30.A O no hydrogen 2.954 N/A THR 34.A OG1 LEU 31.A O no hydrogen 3.565 N/A GLU 35.A N LEU 31.A O no hydrogen 2.688 N/A SER 37.A N GLU 40.A OE1 no hydrogen 2.778 N/A SER 37.A OG GLU 40.A OE1 no hydrogen 3.161 N/A ARG 38.A NH1 ASP 28.A OD1 no hydrogen 3.495 N/A ARG 38.A NH2 ALA 26.A O no hydrogen 2.930 N/A ARG 38.A NH2 ASP 28.A OD1 no hydrogen 2.836 N/A GLU 40.A N SER 37.A O no hydrogen 2.841 N/A GLU 40.A N SER 37.A OG no hydrogen 3.082 N/A ILE 41.A N ARG 38.A O no hydrogen 3.079 N/A LEU 42.A N ARG 38.A O no hydrogen 3.049 N/A GLY 43.A N ILE 23.A O no hydrogen 2.846 N/A ARG 44.A N ILE 41.A O no hydrogen 3.128 N/A ARG 44.A NE GLU 40.A O no hydrogen 2.885 N/A ASN 45.A ND2 ASP 20.A O no hydrogen 2.922 N/A ARG 47.A N ASN 45.A OD1 no hydrogen 2.910 N/A ARG 47.A NH1 ASP 20.A OD2 no hydrogen 2.837 N/A ARG 47.A NH2 ASP 20.A OD1 no hydrogen 3.054 N/A LEU 49.A N MET 46.A O no hydrogen 3.202 N/A GLN 50.A N ARG 47.A O no hydrogen 2.944 N/A GLY 51.A N THR 54.A OG1 no hydrogen 2.947 N/A GLU 53.A N TYR 79.A OH no hydrogen 2.856 N/A THR 54.A N GLY 51.A O no hydrogen 3.056 N/A THR 54.A OG1 GLY 51.A O no hydrogen 3.341 N/A THR 54.A OG1 ILE 77.A O no hydrogen 2.669 N/A ALA 57.A N ASP 55.A OD1 no hydrogen 2.829 N/A THR 58.A N ASP 55.A OD1 no hydrogen 3.374 N/A VAL 59.A N ASP 55.A O no hydrogen 3.167 N/A ARG 60.A N ARG 56.A O no hydrogen 3.017 N/A LYS 61.A N ALA 57.A O no hydrogen 3.260 N/A ILE 62.A N THR 58.A O no hydrogen 3.289 N/A ARG 63.A N VAL 59.A O no hydrogen 2.964 N/A ASP 64.A N ARG 60.A O no hydrogen 2.781 N/A ALA 65.A N LYS 61.A O no hydrogen 3.026 N/A ILE 66.A N ILE 62.A O no hydrogen 2.980 N/A ASP 67.A N ARG 63.A O no hydrogen 2.913 N/A ASN 68.A N ASP 64.A O no hydrogen 2.932 N/A GLN 69.A N ILE 66.A O no hydrogen 2.960 N/A THR 70.A N ALA 65.A O no hydrogen 2.983 N/A VAL 72.A N LEU 92.A O no hydrogen 2.974 N/A THR 73.A OG1 HIS 91.A ND1 no hydrogen 2.700 N/A VAL 74.A N PHE 90.A O no hydrogen 2.906 N/A GLN 75.A NE2 VAL 116.A O no hydrogen 2.829 N/A LEU 76.A N ASN 88.A O no hydrogen 3.028 N/A ASN 78.A N PHE 86.A O no hydrogen 2.893 N/A ASN 78.A ND2 ILE 77.A O no hydrogen 2.918 N/A TYR 79.A N LEU 49.A O no hydrogen 2.687 N/A THR 80.A N LYS 84.A O no hydrogen 2.975 N/A THR 80.A OG1 GLU 35.A OE2 no hydrogen 2.933 N/A THR 80.A OG1 SER 82.A OG no hydrogen 3.256 N/A LYS 81.A N THR 34.A O no hydrogen 2.858 N/A LYS 81.A NZ GLU 40.A OE2 no hydrogen 2.957 N/A SER 82.A N GLU 35.A OE1 no hydrogen 3.087 N/A SER 82.A N THR 80.A OG1 no hydrogen 3.303 N/A SER 82.A OG GLU 35.A OE1 no hydrogen 2.790 N/A SER 82.A OG GLU 35.A OE2 no hydrogen 3.287 N/A SER 82.A OG THR 80.A OG1 no hydrogen 3.256 N/A GLY 83.A N THR 80.A O no hydrogen 3.018 N/A LYS 84.A N THR 80.A OG1 no hydrogen 3.180 N/A LYS 85.A NZ GLU 53.A OE2 no hydrogen 2.896 N/A PHE 86.A N ASN 78.A O no hydrogen 2.924 N/A TRP 87.A N GLY 112.A O no hydrogen 2.845 N/A ASN 88.A N LEU 76.A O no hydrogen 2.840 N/A ASN 88.A ND2 ASN 78.A OD1 no hydrogen 2.775 N/A LEU 89.A N LEU 110.A O no hydrogen 2.877 N/A PHE 90.A N VAL 74.A O no hydrogen 2.713 N/A HIS 91.A N VAL 108.A O no hydrogen 2.967 N/A HIS 91.A ND1 THR 73.A OG1 no hydrogen 2.700 N/A HIS 91.A NE2 GLN 93.A OE1 no hydrogen 2.804 N/A LEU 92.A N VAL 72.A O no hydrogen 2.836 N/A GLN 93.A N ILE 106.A O no hydrogen 2.942 N/A GLN 93.A NE2 GLU 133.A OE2 no hydrogen 3.025 N/A MET 95.A N TYR 104.A O no hydrogen 2.821 N/A ARG 96.A NH1 GLY 100.A O no hydrogen 2.784 N/A ASP 97.A N ASP 101.A O no hydrogen 2.691 N/A GLY 100.A N ASP 97.A O no hydrogen 2.807 N/A GLN 103.A N MET 95.A O no hydrogen 2.777 N/A TYR 104.A N MET 95.A O no hydrogen 3.258 N/A PHE 105.A N THR 14.A O no hydrogen 3.167 N/A ILE 106.A N GLN 93.A O no hydrogen 2.821 N/A GLY 107.A N VAL 12.A O no hydrogen 3.035 N/A VAL 108.A N HIS 91.A O no hydrogen 2.851 N/A GLN 109.A N ASN 10.A O no hydrogen 3.113 N/A LEU 110.A N LEU 89.A O no hydrogen 2.984 N/A GLY 112.A N TRP 87.A O no hydrogen 2.892 N/A HIS 115.A ND1 VAL 116.A O no hydrogen 3.162 N/A GLU 121.A N ARG 117.A O no hydrogen 3.103 N/A ARG 122.A N ASP 118.A O no hydrogen 2.939 N/A GLU 123.A N ALA 119.A O no hydrogen 2.994 N/A GLY 124.A N ALA 120.A O no hydrogen 2.932 N/A VAL 125.A N GLU 121.A O no hydrogen 2.983 N/A MET 126.A N ARG 122.A O no hydrogen 3.210 N/A LEU 127.A N GLU 123.A O no hydrogen 3.143 N/A ILE 128.A N GLY 124.A O no hydrogen 3.162 N/A LYS 129.A N VAL 125.A O no hydrogen 3.161 N/A LYS 130.A N MET 126.A O no hydrogen 3.133 N/A THR 131.A N LEU 127.A O no hydrogen 3.092 N/A THR 131.A OG1 LEU 127.A O no hydrogen 3.297 N/A ALA 132.A N ILE 128.A O no hydrogen 2.830 N/A GLU 133.A N LYS 129.A O no hydrogen 3.117 N/A ASN 134.A N LYS 130.A O no hydrogen 3.079 N/A ILE 135.A N THR 131.A O no hydrogen 2.966 N/A ASP 136.A N ALA 132.A O no hydrogen 2.941 N/A GLU 137.A N GLU 133.A O no hydrogen 3.101 N/A ALA 138.A N ASN 134.A O no hydrogen 2.966 N/A ALA 139.A N ILE 135.A O no hydrogen 2.606 N/A LYS 140.A N ASP 136.A O no hydrogen 3.180 N/A LYS 140.A NZ ASP 136.A OD1 no hydrogen 2.808 N/A GLU 141.A N ALA 138.A O no hydrogen 3.114 N/A LEU 142.A N ALA 139.A O no hydrogen 2.973 N/A ILE 143.A N ASN 191.A O no hydrogen 2.867 N/A LYS 144.A N ASP 215.A OD2 no hydrogen 2.836 N/A LYS 144.A NZ SER 210.A O no hydrogen 2.895 N/A LYS 144.A NZ PRO 212.A O no hydrogen 2.942 N/A CYS 145.A N GLY 193.A O no hydrogen 2.909 N/A CYS 145.A SG VAL 216.A O no hydrogen 3.698 N/A VAL 146.A N VAL 216.A O no hydrogen 3.121 N/A VAL 147.A N TRP 195.A O no hydrogen 2.958 N/A VAL 148.A N LEU 218.A O no hydrogen 2.916 N/A VAL 153.A N ASP 150.A O no hydrogen 3.401 N/A LYS 155.A NZ GLY 149.A O no hydrogen 2.747 N/A LYS 155.A NZ ASP 150.A O no hydrogen 2.855 N/A THR 156.A OG1 THR 174.A OG1 no hydrogen 2.783 N/A THR 156.A OG1 ASP 196.A OD2 no hydrogen 2.495 N/A LEU 158.A N GLY 154.A O no hydrogen 3.096 N/A LEU 159.A N LYS 155.A O no hydrogen 3.203 N/A ILE 160.A N THR 156.A O no hydrogen 2.835 N/A SER 161.A N CYS 157.A O no hydrogen 2.743 N/A SER 161.A OG ALA 298.A O no hydrogen 2.643 N/A TYR 162.A N LEU 158.A O no hydrogen 3.134 N/A THR 163.A N LEU 159.A O no hydrogen 3.098 N/A THR 163.A OG1 LEU 159.A O no hydrogen 2.825 N/A THR 164.A N ILE 160.A O no hydrogen 2.850 N/A THR 164.A OG1 ILE 160.A O no hydrogen 2.717 N/A ASN 165.A N SER 161.A O no hydrogen 2.732 N/A ALA 166.A N THR 164.A OG1 no hydrogen 3.091 N/A THR 174.A OG1 THR 156.A OG1 no hydrogen 2.783 N/A ASP 177.A N ASP 196.A O no hydrogen 3.145 N/A ASN 178.A N ASP 177.A OD2 no hydrogen 2.799 N/A TYR 179.A N LEU 194.A O no hydrogen 2.924 N/A ALA 181.A N LEU 192.A O no hydrogen 2.932 N/A VAL 183.A N VAL 190.A O no hydrogen 2.869 N/A VAL 185.A N LYS 188.A O no hydrogen 2.921 N/A LYS 188.A N VAL 185.A O no hydrogen 2.909 N/A VAL 190.A N VAL 183.A O no hydrogen 2.871 N/A ASN 191.A ND2 GLU 5.A OE1 no hydrogen 2.961 N/A ASN 191.A ND2 ASN 182.A OD1 no hydrogen 2.697 N/A LEU 192.A N ALA 181.A O no hydrogen 2.810 N/A GLY 193.A N ILE 143.A O no hydrogen 2.822 N/A LEU 194.A N TYR 179.A O no hydrogen 2.748 N/A TRP 195.A N CYS 145.A O no hydrogen 2.807 N/A TRP 195.A NE1 ASP 15.A OD2 no hydrogen 2.992 N/A ASP 196.A N ASP 177.A O no hydrogen 2.796 N/A THR 197.A OG1 VAL 147.A O no hydrogen 2.690 N/A TYR 203.A N LEU 200.A O no hydrogen 3.085 N/A ASP 204.A N GLU 201.A O no hydrogen 2.939 N/A LEU 206.A N TYR 203.A O no hydrogen 2.956 N/A ARG 207.A N TYR 203.A O no hydrogen 2.906 N/A ARG 207.A NE ALA 198.A O no hydrogen 2.825 N/A ARG 207.A NH1 ASP 204.A OD1 no hydrogen 2.926 N/A ARG 207.A NH1 GLU 239.A OE2 no hydrogen 2.801 N/A ARG 207.A NH2 ALA 198.A O no hydrogen 3.068 N/A ARG 207.A NH2 ASP 204.A OD1 no hydrogen 3.128 N/A LEU 209.A N LEU 206.A O no hydrogen 2.930 N/A SER 210.A N ARG 207.A O no hydrogen 2.979 N/A SER 210.A OG ARG 207.A O no hydrogen 2.752 N/A TYR 211.A N PRO 208.A O no hydrogen 2.999 N/A TYR 211.A OH GLU 239.A OE2 no hydrogen 2.601 N/A THR 214.A N TYR 211.A O no hydrogen 3.093 N/A THR 214.A OG1 TYR 211.A O no hydrogen 2.580 N/A ASP 215.A N LYS 144.A O no hydrogen 2.871 N/A VAL 216.A N LYS 144.A O no hydrogen 3.239 N/A PHE 217.A N PRO 248.A O no hydrogen 2.997 N/A LEU 218.A N VAL 146.A O no hydrogen 2.849 N/A ILE 219.A N ILE 250.A O no hydrogen 2.947 N/A CYS 220.A N VAL 148.A O no hydrogen 2.868 N/A PHE 221.A N VAL 252.A O no hydrogen 3.002 N/A SER 222.A N SER 228.A OG no hydrogen 2.974 N/A LEU 223.A N THR 254.A O no hydrogen 2.956 N/A VAL 224.A N SER 222.A OG no hydrogen 3.119 N/A SER 225.A N SER 222.A O no hydrogen 3.028 N/A SER 228.A N SER 225.A OG no hydrogen 3.256 N/A SER 228.A OG SER 225.A O no hydrogen 2.652 N/A PHE 229.A N SER 225.A O no hydrogen 3.231 N/A HIS 230.A N PRO 226.A O no hydrogen 2.949 N/A HIS 231.A N ALA 227.A O no hydrogen 3.009 N/A HIS 231.A ND1 ASP 150.A OD2 no hydrogen 2.545 N/A VAL 232.A N PHE 229.A O no hydrogen 3.050 N/A ARG 233.A NE GLU 287.A OE2 no hydrogen 2.788 N/A ARG 233.A NH1 ARG 233.A O no hydrogen 3.187 N/A ALA 234.A N HIS 230.A O no hydrogen 3.040 N/A LYS 235.A N HIS 231.A O no hydrogen 2.732 N/A LYS 235.A NZ ASP 204.A OD1 no hydrogen 2.842 N/A LYS 235.A NZ ASP 204.A OD2 no hydrogen 3.246 N/A TRP 236.A N HIS 231.A O no hydrogen 3.067 N/A TRP 236.A NE1 ASP 150.A OD1 no hydrogen 2.754 N/A TYR 237.A N VAL 232.A O no hydrogen 2.969 N/A GLU 239.A N LYS 235.A O no hydrogen 2.978 N/A VAL 240.A N TRP 236.A O no hydrogen 2.924 N/A ARG 241.A N TYR 237.A O no hydrogen 2.994 N/A ARG 241.A NH1 CYS 244.A O no hydrogen 2.864 N/A ARG 241.A NH1 THR 247.A O no hydrogen 2.737 N/A ARG 241.A NH2 THR 247.A O no hydrogen 2.925 N/A HIS 242.A N PRO 238.A O no hydrogen 2.869 N/A HIS 243.A N VAL 240.A O no hydrogen 3.211 N/A CYS 244.A N VAL 240.A O no hydrogen 2.763 N/A CYS 244.A SG TYR 211.A O no hydrogen 3.648 N/A THR 247.A N CYS 244.A O no hydrogen 3.350 N/A THR 247.A OG1 THR 214.A O no hydrogen 3.569 N/A ILE 250.A N PHE 217.A O no hydrogen 2.841 N/A LEU 251.A N LYS 292.A O no hydrogen 2.949 N/A VAL 252.A N ILE 219.A O no hydrogen 2.807 N/A GLY 253.A N LEU 294.A O no hydrogen 2.823 N/A THR 254.A N PHE 221.A O no hydrogen 2.799 N/A THR 254.A OG1 VAL 153.A O no hydrogen 2.637 N/A THR 254.A OG1 PHE 221.A O no hydrogen 2.955 N/A LYS 255.A NZ ALA 152.A O no hydrogen 2.776 N/A LEU 256.A N CYS 296.A O no hydrogen 2.977 N/A LEU 258.A N LYS 255.A O no hydrogen 2.987 N/A ARG 259.A N LEU 256.A O no hydrogen 3.150 N/A ARG 259.A NH1 ILE 276.A O no hydrogen 2.838 N/A ARG 259.A NH1 GLU 295.A OE2 no hydrogen 2.929 N/A ARG 259.A NH2 GLU 295.A OE1 no hydrogen 2.766 N/A ASP 261.A N LEU 258.A O no hydrogen 3.010 N/A THR 264.A N ASP 261.A OD2 no hydrogen 3.152 N/A THR 264.A OG1 ASP 261.A OD2 no hydrogen 2.904 N/A ILE 265.A N ASP 261.A O no hydrogen 2.984 N/A GLU 266.A N LYS 262.A O no hydrogen 3.028 N/A LYS 267.A N ASP 263.A O no hydrogen 2.957 N/A LEU 268.A N THR 264.A O no hydrogen 2.917 N/A LYS 269.A N ILE 265.A O no hydrogen 2.827 N/A GLU 270.A N GLU 266.A O no hydrogen 2.882 N/A LYS 271.A N LYS 267.A O no hydrogen 3.231 N/A LYS 271.A N LEU 268.A O no hydrogen 2.848 N/A LYS 272.A N LYS 269.A O no hydrogen 2.778 N/A LEU 273.A N LEU 268.A O no hydrogen 2.832 N/A ILE 276.A N LEU 223.A O no hydrogen 2.771 N/A THR 277.A N GLN 280.A OE1 no hydrogen 3.056 N/A GLN 280.A N THR 277.A OG1 no hydrogen 3.212 N/A GLY 281.A N THR 277.A O no hydrogen 2.874 N/A LEU 282.A N TYR 278.A O no hydrogen 2.764 N/A ALA 283.A N PRO 279.A O no hydrogen 2.978 N/A MET 284.A N GLN 280.A O no hydrogen 3.028 N/A ALA 285.A N GLY 281.A O no hydrogen 2.845 N/A LYS 286.A N LEU 282.A O no hydrogen 2.895 N/A GLU 287.A N ALA 283.A O no hydrogen 2.934 N/A ILE 288.A N MET 284.A O no hydrogen 3.050 N/A GLY 289.A N LYS 286.A O no hydrogen 3.170 N/A ALA 290.A N ALA 285.A O no hydrogen 2.938 N/A VAL 291.A N ILE 249.A O no hydrogen 2.876 N/A TYR 293.A OH GLU 295.A OE2 no hydrogen 2.676 N/A LEU 294.A N LEU 251.A O no hydrogen 2.954 N/A CYS 296.A N GLY 253.A O no hydrogen 2.951 N/A SER 297.A N ARG 302.A O no hydrogen 2.905 N/A SER 297.A OG ASP 257.A OD1 no hydrogen 2.597 N/A SER 297.A OG THR 300.A OG1 no hydrogen 3.332 N/A THR 300.A N SER 297.A OG no hydrogen 3.064 N/A THR 300.A OG1 SER 297.A OG no hydrogen 3.332 N/A GLN 301.A N SER 297.A O no hydrogen 2.722 N/A GLN 301.A NE2 SER 161.A OG no hydrogen 3.128 N/A GLN 301.A NE2 ASN 165.A OD1 no hydrogen 2.882 N/A ARG 302.A N THR 300.A OG1 no hydrogen 3.198 N/A LEU 304.A N GLN 301.A O no hydrogen 2.969 N/A VAL 307.A N LEU 304.A O no hydrogen 3.133 N/A ASP 309.A N LYS 305.A O no hydrogen 2.990 N/A GLU 310.A N THR 306.A O no hydrogen 2.866 N/A ALA 311.A N VAL 307.A O no hydrogen 2.954 N/A ILE 312.A N PHE 308.A O no hydrogen 3.123 N/A ARG 313.A N ASP 309.A O no hydrogen 3.009 N/A ARG 313.A NE ASP 309.A OD2 no hydrogen 2.860 N/A ARG 313.A NH2 ASP 186.A OD1 no hydrogen 2.920 N/A ALA 314.A N GLU 310.A O no hydrogen 2.870 N/A ALA 314.A N ALA 311.A O no hydrogen 3.238 N/A VAL 315.A N ILE 312.A O no hydrogen 2.911 N/A LEU 316.A N ILE 312.A O no hydrogen 2.810 N/A CYS 317.A N ARG 313.A O no hydrogen 2.988 N/A