Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N GLN 301.A OE1 no hydrogen 3.020 N/A HIS 8.A N THR 112.A OG1 no hydrogen 2.988 N/A SER 10.A OG GLU 14.A OE2 no hydrogen 3.035 N/A GLU 14.A N SER 10.A O no hydrogen 2.830 N/A ARG 15.A N GLY 11.A O no hydrogen 3.134 N/A CYS 16.A N VAL 13.A O no hydrogen 3.022 N/A CYS 16.A SG VAL 12.A O no hydrogen 3.444 N/A CYS 16.A SG ALA 96.A O no hydrogen 3.799 N/A MET 17.A N GLU 14.A O no hydrogen 3.263 N/A VAL 18.A N GLY 29.A O no hydrogen 2.674 N/A SER 19.A N LYS 66.A O no hydrogen 2.876 N/A SER 19.A OG LYS 66.A O no hydrogen 3.484 N/A VAL 20.A N LEU 27.A O no hydrogen 2.837 N/A VAL 21.A N ILE 64.A O no hydrogen 2.913 N/A TYR 22.A N SER 25.A O no hydrogen 3.007 N/A SER 25.A N TYR 22.A O no hydrogen 3.166 N/A LEU 27.A N VAL 20.A O no hydrogen 2.907 N/A ASN 28.A N CYS 144.A O no hydrogen 2.902 N/A ASN 28.A ND2 ALA 116.A O no hydrogen 2.830 N/A ASN 28.A ND2 GLY 142.A O no hydrogen 2.876 N/A ASN 28.A ND2 CYS 144.A O no hydrogen 3.132 N/A GLY 29.A N VAL 18.A O no hydrogen 2.782 N/A ILE 30.A N TYR 37.A O no hydrogen 2.946 N/A TRP 31.A N CYS 16.A O no hydrogen 2.869 N/A LEU 32.A N VAL 35.A O no hydrogen 2.889 N/A LYS 33.A N THR 97.A OG1 no hydrogen 2.780 N/A VAL 35.A N LEU 32.A O no hydrogen 2.896 N/A VAL 36.A N LEU 88.A O no hydrogen 2.741 N/A TYR 37.A N ILE 30.A O no hydrogen 2.764 N/A CYS 38.A N LEU 86.A O no hydrogen 3.285 N/A CYS 38.A SG PRO 39.A O no hydrogen 3.420 N/A ARG 40.A N ALA 84.A O no hydrogen 3.201 N/A ARG 40.A NE ASP 186.A OD2 no hydrogen 2.746 N/A ARG 40.A NH2 ASP 186.A OD1 no hydrogen 3.040 N/A ARG 40.A NH2 ASP 186.A OD2 no hydrogen 3.491 N/A ILE 43.A N ARG 40.A O no hydrogen 3.244 N/A GLY 44.A N HIS 41.A O no hydrogen 3.323 N/A LYS 45.A NZ GLU 188.A OE2 no hydrogen 3.431 N/A ARG 47.A N GLN 50.A OE1 no hydrogen 3.004 N/A GLY 48.A N GLU 187.A OE2 no hydrogen 2.858 N/A GLN 50.A N ARG 47.A O no hydrogen 3.385 N/A MET 54.A N GLN 50.A O no hydrogen 3.101 N/A VAL 55.A N TRP 51.A O no hydrogen 2.896 N/A SER 56.A N THR 52.A O no hydrogen 3.097 N/A SER 56.A OG THR 52.A O no hydrogen 3.455 N/A SER 56.A OG HIS 53.A O no hydrogen 2.920 N/A ILE 57.A N HIS 53.A O no hydrogen 3.241 N/A ALA 58.A N VAL 55.A O no hydrogen 3.062 N/A ARG 61.A N ASP 59.A OD1 no hydrogen 3.281 N/A ASP 62.A N ASP 59.A O no hydrogen 3.212 N/A PHE 63.A N CYS 60.A O no hydrogen 3.236 N/A ILE 64.A N VAL 21.A O no hydrogen 3.002 N/A LYS 66.A N SER 19.A O no hydrogen 3.100 N/A CYS 67.A N ILE 72.A O no hydrogen 2.681 N/A CYS 67.A SG ARG 15.A O no hydrogen 3.983 N/A CYS 67.A SG MET 17.A O no hydrogen 3.694 N/A GLN 70.A NE2 ARG 15.A O no hydrogen 2.770 N/A GLN 70.A NE2 ASN 94.A OD1 no hydrogen 2.892 N/A GLY 71.A N PRO 68.A O no hydrogen 3.279 N/A ILE 72.A N CYS 67.A O no hydrogen 3.115 N/A LEU 74.A N VAL 65.A O no hydrogen 2.689 N/A GLN 77.A N THR 89.A O no hydrogen 2.912 N/A LYS 80.A N GLN 87.A O no hydrogen 3.114 N/A VAL 82.A N LEU 85.A O no hydrogen 2.993 N/A ALA 84.A N GLY 178.A O no hydrogen 2.623 N/A LEU 85.A N VAL 82.A O no hydrogen 3.123 N/A LEU 86.A N CYS 38.A O no hydrogen 2.781 N/A GLN 87.A N LYS 80.A O no hydrogen 2.526 N/A LEU 88.A N VAL 36.A O no hydrogen 2.785 N/A THR 89.A N SER 78.A O no hydrogen 3.041 N/A VAL 90.A N ASN 34.A O no hydrogen 2.766 N/A ASN 94.A N LYS 33.A O no hydrogen 2.778 N/A ASN 94.A ND2 TRP 31.A O no hydrogen 2.946 N/A ALA 96.A N ASN 94.A OD1 no hydrogen 3.006 N/A THR 97.A N ASN 94.A O no hydrogen 3.198 N/A THR 97.A OG1 ASN 94.A O no hydrogen 2.955 N/A LYS 101.A N LEU 156.A O no hydrogen 2.880 N/A GLU 103.A N LEU 158.A O no hydrogen 3.217 N/A ARG 104.A NH1 ASP 175.A OD2 no hydrogen 3.267 N/A ARG 104.A NH1 ASN 179.A O no hydrogen 3.013 N/A ARG 104.A NH1 PHE 180.A O no hydrogen 3.236 N/A ARG 104.A NH2 PHE 180.A O no hydrogen 2.702 N/A LEU 105.A N TYR 181.A OH no hydrogen 2.860 N/A GLY 108.A N LEU 129.A O no hydrogen 2.762 N/A SER 109.A N GLN 106.A O no hydrogen 3.269 N/A SER 109.A OG GLN 106.A O no hydrogen 3.433 N/A MET 111.A N VAL 127.A O no hydrogen 3.041 N/A THR 112.A N TYR 149.A O no hydrogen 2.891 N/A ILE 113.A N TYR 125.A O no hydrogen 2.768 N/A ALA 114.A N VAL 147.A O no hydrogen 3.021 N/A CYS 115.A N HIS 123.A O no hydrogen 2.796 N/A CYS 115.A SG TYR 117.A OH no hydrogen 3.760 N/A CYS 115.A SG SER 138.A O no hydrogen 3.807 N/A ALA 116.A N SER 146.A OG no hydrogen 3.006 N/A TYR 117.A N ILE 120.A O no hydrogen 2.929 N/A GLY 119.A N ASN 28.A OD1 no hydrogen 2.743 N/A ILE 120.A N TYR 117.A O no hydrogen 3.013 N/A ARG 122.A N CYS 115.A O no hydrogen 2.768 N/A HIS 123.A N CYS 115.A O no hydrogen 3.145 N/A TYR 125.A N ILE 113.A O no hydrogen 3.099 N/A TYR 125.A OH SER 138.A O no hydrogen 2.490 N/A VAL 127.A N MET 111.A O no hydrogen 3.110 N/A LEU 129.A N SER 109.A O no hydrogen 3.169 N/A GLN 130.A N LEU 134.A O no hydrogen 2.892 N/A GLN 130.A NE2 VAL 128.A O no hydrogen 2.973 N/A ASN 133.A N GLN 130.A O no hydrogen 2.837 N/A LEU 134.A N ASN 132.A OD1 no hydrogen 3.075 N/A ILE 135.A N HIS 171.A O no hydrogen 3.003 N/A ALA 137.A N HIS 171.A ND1 no hydrogen 3.115 N/A SER 138.A N TYR 125.A OH no hydrogen 2.988 N/A LEU 140.A N TYR 117.A OH no hydrogen 2.815 N/A ALA 143.A N LEU 140.A O no hydrogen 3.164 N/A CYS 144.A SG HIS 41.A NE2 no hydrogen 3.762 N/A CYS 144.A SG HIS 163.A O no hydrogen 3.366 N/A GLY 145.A N HIS 162.A O no hydrogen 3.235 N/A SER 146.A N ALA 143.A O no hydrogen 3.130 N/A SER 146.A OG ALA 143.A O no hydrogen 2.585 N/A GLY 148.A N TYR 160.A O no hydrogen 2.906 N/A TYR 149.A N THR 112.A O no hydrogen 2.848 N/A TYR 149.A OH HIS 8.A O no hydrogen 2.714 N/A THR 150.A N TYR 157.A O no hydrogen 2.809 N/A THR 150.A OG1 HIS 159.A NE2 no hydrogen 2.543 N/A LYS 152.A N THR 155.A O no hydrogen 3.194 N/A THR 155.A OG1 LYS 152.A O no hydrogen 3.524 N/A THR 155.A OG1 GLY 153.A O no hydrogen 3.285 N/A LEU 156.A N ASP 99.A O no hydrogen 2.891 N/A TYR 157.A N THR 150.A O no hydrogen 2.894 N/A LEU 158.A N LYS 101.A O no hydrogen 3.063 N/A HIS 159.A N GLY 148.A O no hydrogen 2.807 N/A HIS 159.A ND1 GLU 103.A O no hydrogen 2.779 N/A HIS 159.A NE2 THR 150.A OG1 no hydrogen 2.543 N/A TYR 160.A N GLY 148.A O no hydrogen 3.245 N/A TYR 160.A OH HIS 162.A ND1 no hydrogen 3.065 N/A MET 161.A N THR 174.A O no hydrogen 2.849 N/A HIS 162.A N SER 146.A O no hydrogen 2.929 N/A HIS 162.A ND1 TYR 160.A OH no hydrogen 3.065 N/A HIS 163.A N SER 172.A O no hydrogen 3.212 N/A HIS 163.A NE2 THR 174.A OG1 no hydrogen 3.132 N/A ILE 164.A N SER 172.A O no hydrogen 3.143 N/A PHE 166.A N THR 170.A O no hydrogen 2.795 N/A ASN 168.A ND2 GLN 193.A OE1 no hydrogen 2.780 N/A LYS 169.A N PHE 166.A O no hydrogen 2.794 N/A THR 170.A OG1 ASN 168.A OD1 no hydrogen 2.725 N/A HIS 171.A N ILE 135.A O no hydrogen 2.819 N/A HIS 171.A NE2 GLU 165.A OE1 no hydrogen 2.902 N/A SER 172.A N ILE 164.A O no hydrogen 3.015 N/A THR 174.A N MET 161.A O no hydrogen 3.215 N/A THR 174.A OG1 HIS 163.A NE2 no hydrogen 3.132 N/A THR 174.A OG1 ASP 175.A O no hydrogen 2.976 N/A ASP 175.A N ASN 179.A O no hydrogen 2.929 N/A GLU 177.A N ASP 175.A OD1 no hydrogen 3.155 N/A GLY 178.A N ASP 175.A O no hydrogen 3.192 N/A ASN 179.A N ASP 175.A OD1 no hydrogen 2.864 N/A TYR 181.A N GLY 173.A O no hydrogen 2.985 N/A TYR 181.A OH HIS 159.A O no hydrogen 2.581 N/A TYR 184.A OH ASN 132.A O no hydrogen 2.558 N/A VAL 185.A N GLN 191.A OE1 no hydrogen 3.012 N/A GLN 191.A NE2 VAL 185.A O no hydrogen 2.978 N/A GLN 191.A NE2 GLU 187.A O no hydrogen 2.955 N/A GLN 193.A NE2 THR 170.A OG1 no hydrogen 3.285 N/A THR 194.A OG1 ALA 195.A O no hydrogen 3.415 N/A TYR 198.A N SER 239.A O no hydrogen 2.831 N/A THR 200.A OG1 TYR 198.A O no hydrogen 3.535 N/A THR 200.A OG1 ALA 241.A O no hydrogen 2.718 N/A ASN 202.A N TYR 199.A O no hydrogen 2.945 N/A ASN 202.A ND2 GLY 108.A O no hydrogen 3.063 N/A ASN 202.A ND2 CYS 291.A O no hydrogen 2.777 N/A VAL 203.A N TYR 199.A O no hydrogen 3.136 N/A VAL 204.A N THR 200.A O no hydrogen 2.885 N/A ALA 205.A N ASP 201.A O no hydrogen 3.095 N/A GLN 206.A N ASN 202.A O no hydrogen 2.898 N/A GLN 206.A NE2 ILE 283.A O no hydrogen 3.131 N/A GLN 206.A NE2 ASP 288.A O no hydrogen 3.410 N/A LEU 207.A N VAL 203.A O no hydrogen 3.199 N/A TYR 208.A N VAL 204.A O no hydrogen 2.997 N/A TYR 208.A OH VAL 262.A O no hydrogen 2.664 N/A ALA 209.A N ALA 205.A O no hydrogen 2.805 N/A HIS 210.A N GLN 206.A O no hydrogen 3.071 N/A LEU 211.A N LEU 207.A O no hydrogen 3.158 N/A LEU 212.A N ALA 209.A O no hydrogen 3.382 N/A THR 213.A OG1 ALA 209.A O no hydrogen 2.966 N/A VAL 214.A N HIS 210.A O no hydrogen 2.940 N/A ASP 215.A N HIS 210.A O no hydrogen 3.132 N/A ARG 217.A N ASP 215.A OD1 no hydrogen 3.166 N/A LEU 221.A N PRO 218.A O no hydrogen 3.395 N/A ALA 222.A N THR 270.A OG1 no hydrogen 2.855 N/A ILE 226.A N GLU 265.A O no hydrogen 3.244 N/A ASP 230.A N SER 227.A OG no hydrogen 2.947 N/A PHE 231.A N SER 227.A O no hydrogen 2.904 N/A ASN 232.A N ILE 228.A O no hydrogen 2.880 N/A ASN 232.A ND2 PHE 243.A O no hydrogen 2.965 N/A SER 233.A N GLU 229.A O no hydrogen 3.230 N/A TRP 234.A N ASP 230.A O no hydrogen 3.141 N/A ALA 235.A N PHE 231.A O no hydrogen 2.644 N/A ALA 236.A N ASN 232.A O no hydrogen 3.280 N/A ASN 237.A N TRP 234.A O no hydrogen 3.105 N/A ASN 238.A N ALA 235.A O no hydrogen 3.300 N/A ASN 238.A ND2 TRP 234.A O no hydrogen 2.591 N/A PHE 240.A N ALA 235.A O no hydrogen 3.280 N/A ALA 241.A N TYR 198.A O no hydrogen 3.010 N/A PHE 243.A N ASN 232.A OD1 no hydrogen 2.532 N/A CYS 245.A N ASP 201.A OD1 no hydrogen 2.935 N/A CYS 245.A SG ASN 242.A O no hydrogen 3.745 N/A GLU 246.A N ASP 201.A OD2 no hydrogen 2.897 N/A THR 248.A OG1 GLU 246.A OE1 no hydrogen 3.562 N/A ASN 249.A N GLU 246.A O no hydrogen 2.985 N/A ASN 249.A ND2 ASP 201.A OD2 no hydrogen 3.050 N/A MET 250.A N GLN 247.A O no hydrogen 3.149 N/A SER 251.A OG THR 248.A O no hydrogen 3.376 N/A ILE 253.A N ASN 249.A O no hydrogen 2.960 N/A MET 254.A N MET 250.A O no hydrogen 2.741 N/A GLY 255.A N SER 251.A O no hydrogen 3.080 N/A LEU 256.A N TYR 252.A O no hydrogen 2.903 N/A SER 257.A N ILE 253.A O no hydrogen 2.830 N/A SER 257.A OG MET 254.A O no hydrogen 2.915 N/A GLN 258.A N MET 254.A O no hydrogen 3.057 N/A THR 259.A N GLY 255.A O no hydrogen 3.041 N/A THR 259.A OG1 GLY 255.A O no hydrogen 2.941 N/A THR 259.A OG1 PRO 303.A O no hydrogen 3.220 N/A ALA 260.A N LEU 256.A O no hydrogen 2.978 N/A VAL 262.A N SER 257.A O no hydrogen 3.109 N/A GLU 265.A N GLU 265.A OE1 no hydrogen 2.712 N/A ARG 266.A N PRO 263.A O no hydrogen 3.002 N/A ARG 266.A NE ALA 222.A O no hydrogen 2.590 N/A ARG 266.A NH2 ALA 222.A O no hydrogen 3.298 N/A ILE 267.A N PRO 263.A O no hydrogen 3.469 N/A LEU 268.A N VAL 264.A O no hydrogen 2.895 N/A ASN 269.A N GLU 265.A O no hydrogen 3.231 N/A THR 270.A N ARG 266.A O no hydrogen 2.951 N/A THR 270.A OG1 ARG 266.A O no hydrogen 2.821 N/A ILE 271.A N ILE 267.A O no hydrogen 2.908 N/A ILE 272.A N LEU 268.A O no hydrogen 3.160 N/A GLN 273.A N ASN 269.A O no hydrogen 2.918 N/A LEU 274.A N THR 270.A O no hydrogen 2.727 N/A THR 275.A N ILE 271.A O no hydrogen 3.190 N/A THR 275.A N ILE 272.A O no hydrogen 3.187 N/A THR 275.A OG1 ILE 271.A O no hydrogen 3.311 N/A THR 276.A N GLN 273.A O no hydrogen 2.995 N/A THR 276.A OG1 GLN 273.A O no hydrogen 3.352 N/A THR 276.A OG1 ASN 277.A OD1.A no hydrogen 2.723 N/A ASN 277.A N GLN 273.A O no hydrogen 2.772 N/A ASN 277.A ND2.B GLN 273.A O no hydrogen 2.846 N/A ARG 278.A NE ALA 281.A O no hydrogen 2.926 N/A ARG 278.A NH2 ALA 281.A O no hydrogen 3.327 N/A ARG 278.A NH2 SER 286.A O no hydrogen 3.239 N/A ALA 281.A N ARG 278.A O no hydrogen 3.085 N/A CYS 282.A SG SER 286.A O no hydrogen 3.645 N/A ILE 283.A N SER 286.A O no hydrogen 2.680 N/A MET 284.A N HIS 210.A ND1 no hydrogen 2.906 N/A SER 286.A N ILE 283.A O no hydrogen 3.025 N/A SER 286.A OG ASP 288.A OD1 no hydrogen 3.067 N/A SER 286.A OG GLU 290.A OE2 no hydrogen 2.506 N/A GLU 290.A N GLN 206.A OE1 no hydrogen 2.974 N/A CYS 291.A SG GLN 130.A OE1 no hydrogen 3.633 N/A MET 297.A N THR 294.A OG1 no hydrogen 3.181 N/A VAL 298.A N THR 294.A O no hydrogen 3.055 N/A TYR 299.A N PRO 295.A O no hydrogen 2.889 N/A ASN 300.A N GLU 296.A O no hydrogen 2.909 N/A GLN 301.A N VAL 298.A O no hydrogen 3.266 N/A GLN 301.A NE2 LYS 4.A O no hydrogen 2.881 N/A GLN 301.A NE2 MET 297.A O no hydrogen 2.946 N/A ALA 302.A N TYR 299.A O no hydrogen 3.149 N/A