Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wze_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 8.A OH GLU 14.A OE1 no hydrogen 2.727 N/A SER 11.A OG ASP 9.A OD1 no hydrogen 2.742 N/A LYS 12.A N ASP 9.A O no hydrogen 3.097 N/A LYS 12.A N ASP 9.A OD1 no hydrogen 3.346 N/A TRP 13.A N ASP 9.A O no hydrogen 3.088 N/A GLU 14.A N ALA 10.A O no hydrogen 2.948 N/A PHE 15.A N ALA 90.A O no hydrogen 2.800 N/A ARG 17.A NE PRO 97.A O no hydrogen 3.033 N/A ARG 17.A NH1 LYS 93.A O no hydrogen 3.375 N/A ARG 17.A NH2 LYS 93.A O no hydrogen 2.785 N/A ARG 17.A NH2 PRO 97.A O no hydrogen 2.905 N/A ARG 19.A N PRO 16.A O no hydrogen 3.100 N/A LEU 20.A N ARG 17.A O no hydrogen 3.270 N/A LYS 21.A N ASP 38.A O no hydrogen 2.855 N/A LYS 21.A NZ LEU 22.A O no hydrogen 3.331 N/A GLY 23.A N GLU 36.A O no hydrogen 2.654 N/A LEU 26.A N VAL 34.A O no hydrogen 2.751 N/A GLY 27.A N VAL 34.A O no hydrogen 3.210 N/A GLY 29.A N GLY 32.A O no hydrogen 2.876 N/A GLN 33.A N MET 55.A O no hydrogen 2.854 N/A GLN 33.A NE2 LEU 56.A O no hydrogen 3.114 N/A VAL 34.A N GLY 27.A O no hydrogen 2.717 N/A ILE 35.A N VAL 53.A O no hydrogen 2.803 N/A GLU 36.A N LYS 24.A O no hydrogen 2.961 N/A ALA 37.A N VAL 51.A O no hydrogen 2.991 N/A ASP 38.A N LYS 21.A O no hydrogen 2.983 N/A ALA 39.A N ARG 49.A O no hydrogen 2.738 N/A PHE 40.A N ARG 19.A O no hydrogen 2.933 N/A GLY 41.A N THR 47.A O no hydrogen 2.838 N/A THR 47.A N LYS 44.A O no hydrogen 3.198 N/A THR 47.A OG1 THR 45.A O no hydrogen 3.025 N/A ARG 49.A N ALA 39.A O no hydrogen 2.885 N/A THR 50.A OG1 ASP 38.A OD1 no hydrogen 3.196 N/A VAL 51.A N ALA 37.A O no hydrogen 2.838 N/A ALA 52.A N VAL 102.A O no hydrogen 2.922 N/A VAL 53.A N ILE 35.A O no hydrogen 2.803 N/A LYS 54.A N VAL 100.A O no hydrogen 2.843 N/A LYS 54.A NZ GLU 71.A OE1 no hydrogen 3.021 N/A LYS 54.A NZ GLU 71.A OE2 no hydrogen 2.791 N/A LYS 54.A NZ ASP 178.A O no hydrogen 2.956 N/A LYS 54.A NZ PHE 179.A O no hydrogen 3.079 N/A MET 55.A N GLN 33.A O no hydrogen 2.931 N/A LYS 57.A N PHE 31.A O no hydrogen 2.786 N/A LYS 57.A NZ ALA 30.A O no hydrogen 3.095 N/A LYS 57.A NZ GLU 58.A O no hydrogen 3.162 N/A ALA 60.A N LYS 57.A O no hydrogen 3.010 N/A THR 61.A N GLU 64.A OE1 no hydrogen 2.826 N/A THR 61.A OG1 GLU 64.A OE1 no hydrogen 2.564 N/A SER 63.A N.A THR 61.A OG1 no hydrogen 3.224 N/A SER 63.A N.B THR 61.A OG1 no hydrogen 3.226 N/A SER 63.A OG.B THR 61.A OG1 no hydrogen 2.736 N/A SER 63.A OG.B GLU 64.A OE1 no hydrogen 3.353 N/A SER 63.A OG.B GLU 64.A OE2 no hydrogen 3.058 N/A HIS 65.A N THR 61.A O no hydrogen 3.256 N/A ARG 66.A N.A HIS 62.A O no hydrogen 2.825 N/A ARG 66.A N.B HIS 62.A O no hydrogen 2.827 N/A ARG 66.A NH2.A SER 63.A OG.A no hydrogen 3.203 N/A ALA 67.A N SER 63.A O.A no hydrogen 3.107 N/A ALA 67.A N SER 63.A O.B no hydrogen 3.095 N/A LEU 68.A N GLU 64.A O no hydrogen 2.886 N/A MET 69.A N HIS 65.A O no hydrogen 2.953 N/A SER 70.A N.A ARG 66.A O.A no hydrogen 2.956 N/A SER 70.A N.A ARG 66.A O.B no hydrogen 2.910 N/A SER 70.A N.B ARG 66.A O.A no hydrogen 2.934 N/A SER 70.A N.B ARG 66.A O.B no hydrogen 2.887 N/A SER 70.A OG.A HIS 2.A O no hydrogen 3.472 N/A SER 70.A OG.A ARG 66.A O.A no hydrogen 3.272 N/A SER 70.A OG.A ARG 66.A O.B no hydrogen 3.339 N/A SER 70.A OG.B HIS 2.A O no hydrogen 3.032 N/A GLU 71.A N ALA 67.A O no hydrogen 2.914 N/A LEU 72.A N LEU 68.A O no hydrogen 3.021 N/A LYS 73.A N MET 69.A O no hydrogen 3.054 N/A LYS 73.A NZ LEU 6.A O no hydrogen 3.519 N/A ILE 74.A N SER 70.A O.A no hydrogen 2.901 N/A ILE 74.A N SER 70.A O.B no hydrogen 2.905 N/A LEU 75.A N GLU 71.A O no hydrogen 3.012 N/A ILE 76.A N LEU 72.A O no hydrogen 3.010 N/A HIS 77.A N LYS 73.A O no hydrogen 2.819 N/A HIS 77.A NE2 ARG 154.A O no hydrogen 3.004 N/A ILE 78.A N ILE 74.A O no hydrogen 2.791 N/A GLY 79.A N LEU 75.A O no hydrogen 3.269 N/A ASN 83.A N HIS 81.A ND1 no hydrogen 3.217 N/A ASN 83.A ND2 GLN 143.A OE1 no hydrogen 3.031 N/A ASN 83.A ND2 VAL 174.A O no hydrogen 3.011 N/A VAL 84.A N HIS 81.A O no hydrogen 3.143 N/A VAL 85.A N ILE 176.A O no hydrogen 2.853 N/A ASN 86.A N GLU 103.A OE2 no hydrogen 2.924 N/A ASN 86.A ND2 HIS 81.A O no hydrogen 3.257 N/A ASN 86.A ND2 VAL 84.A O no hydrogen 2.863 N/A LEU 88.A N ILE 101.A O no hydrogen 2.826 N/A GLY 89.A N ILE 101.A O no hydrogen 3.193 N/A ALA 90.A N TRP 13.A O no hydrogen 2.914 N/A CYS 91.A N MET 99.A O no hydrogen 2.867 N/A CYS 91.A SG PHE 15.A O no hydrogen 3.305 N/A THR 92.A N GLU 14.A OE2 no hydrogen 2.770 N/A THR 92.A OG1 GLU 14.A OE1 no hydrogen 2.626 N/A THR 92.A OG1 GLU 14.A OE2 no hydrogen 3.328 N/A LYS 93.A N GLU 14.A OE2 no hydrogen 3.240 N/A MET 99.A N CYS 91.A O no hydrogen 2.919 N/A VAL 100.A N LYS 54.A O no hydrogen 2.979 N/A ILE 101.A N GLY 89.A O no hydrogen 2.898 N/A VAL 102.A N ALA 52.A O no hydrogen 2.946 N/A GLU 103.A N ASN 86.A O no hydrogen 3.013 N/A PHE 107.A N LEU 168.A O no hydrogen 2.929 N/A GLY 108.A N CYS 105.A O no hydrogen 3.188 N/A ASN 109.A ND2 THR 112.A OG1 no hydrogen 2.968 N/A LEU 110.A N ALA 163.A O no hydrogen 3.318 N/A LEU 110.A N ILE 166.A O no hydrogen 2.824 N/A THR 112.A N ASN 109.A OD1 no hydrogen 3.163 N/A TYR 113.A N ASN 109.A O no hydrogen 3.199 N/A LEU 114.A N LEU 110.A O no hydrogen 2.911 N/A ARG 115.A N SER 111.A O no hydrogen 3.060 N/A ARG 115.A NH1 ARG 115.A O no hydrogen 2.825 N/A SER 116.A N THR 112.A O no hydrogen 3.164 N/A SER 116.A N TYR 113.A O no hydrogen 2.942 N/A SER 116.A OG TYR 113.A O no hydrogen 2.544 N/A LYS 117.A N LEU 114.A O no hydrogen 2.889 N/A LYS 117.A NZ GLU 120.A OE1 no hydrogen 2.792 N/A LYS 117.A NZ ASP 130.A O no hydrogen 2.666 N/A ARG 118.A NE LEU 232.A O no hydrogen 2.941 N/A ARG 118.A NH2 LEU 232.A O no hydrogen 3.404 N/A GLU 120.A N LYS 117.A O no hydrogen 2.902 N/A VAL 122.A N LEU 132.A O no hydrogen 3.107 N/A LYS 125.A NZ LYS 129.A O no hydrogen 3.360 N/A LYS 129.A N ASP 126.A O no hydrogen 3.182 N/A PHE 131.A N TYR 128.A O no hydrogen 3.082 N/A LEU 132.A N GLU 120.A O no hydrogen 2.829 N/A THR 133.A N HIS 136.A ND1 no hydrogen 3.214 N/A THR 133.A OG1 HIS 136.A ND1 no hydrogen 2.858 N/A LEU 134.A N PRO 123.A O no hydrogen 2.960 N/A HIS 136.A N THR 133.A OG1 no hydrogen 3.336 N/A HIS 136.A ND1 THR 133.A OG1 no hydrogen 2.858 N/A LEU 137.A N THR 133.A O no hydrogen 3.261 N/A ILE 138.A N LEU 134.A O no hydrogen 3.088 N/A CYS 139.A N GLU 135.A O no hydrogen 2.844 N/A TYR 140.A N HIS 136.A O no hydrogen 2.810 N/A TYR 140.A OH ASN 172.A OD1 no hydrogen 2.653 N/A SER 141.A N LEU 137.A O no hydrogen 3.064 N/A SER 141.A OG LEU 137.A O no hydrogen 2.717 N/A PHE 142.A N ILE 138.A O no hydrogen 2.832 N/A GLN 143.A N CYS 139.A O no hydrogen 2.962 N/A GLN 143.A NE2 CYS 139.A O no hydrogen 3.555 N/A GLN 143.A NE2 ASN 172.A O no hydrogen 2.770 N/A VAL 144.A N TYR 140.A O no hydrogen 3.068 N/A ALA 145.A N SER 141.A O no hydrogen 3.025 N/A LYS 146.A N PHE 142.A O no hydrogen 2.915 N/A GLY 147.A N GLN 143.A O no hydrogen 2.984 N/A MET 148.A N VAL 144.A O no hydrogen 2.931 N/A GLU 149.A N ALA 145.A O no hydrogen 2.864 N/A PHE 150.A N LYS 146.A O no hydrogen 2.937 N/A LEU 151.A N GLY 147.A O no hydrogen 2.990 N/A ALA 152.A N MET 148.A O no hydrogen 2.808 N/A SER 153.A N GLU 149.A O no hydrogen 3.019 N/A SER 153.A OG PHE 150.A O no hydrogen 2.577 N/A ARG 154.A N PHE 150.A O no hydrogen 3.132 N/A ARG 154.A N LEU 151.A O no hydrogen 3.125 N/A ARG 154.A NE HIS 77.A O no hydrogen 3.326 N/A ARG 154.A NE ILE 78.A O no hydrogen 3.182 N/A ARG 154.A NH2 HIS 77.A O no hydrogen 2.825 N/A LYS 155.A N ALA 152.A O no hydrogen 2.956 N/A CYS 156.A N LEU 151.A O no hydrogen 3.098 N/A CYS 156.A SG ARG 154.A O no hydrogen 3.715 N/A HIS 158.A N ASP 218.A OD2 no hydrogen 2.787 N/A HIS 158.A NE2 CYS 177.A O no hydrogen 2.728 N/A ARG 159.A N.A ASP 218.A OD1 no hydrogen 3.021 N/A ARG 159.A N.B ASP 218.A OD1 no hydrogen 3.034 N/A ASP 160.A N HIS 158.A ND1 no hydrogen 3.141 N/A ALA 163.A N GLU 228.A OE2 no hydrogen 2.938 N/A ARG 164.A NE TYR 191.A OH no hydrogen 2.892 N/A ARG 164.A NH2 ASP 160.A OD1 no hydrogen 2.875 N/A ARG 164.A NH2 TYR 191.A OH no hydrogen 3.337 N/A ASN 165.A N ALA 162.A O no hydrogen 2.863 N/A ASN 165.A ND2 ASP 160.A O no hydrogen 2.900 N/A ILE 166.A N ALA 163.A O no hydrogen 3.202 N/A LEU 167.A N LYS 175.A O no hydrogen 2.786 N/A LEU 168.A N GLY 108.A O no hydrogen 3.093 N/A SER 169.A N VAL 173.A O no hydrogen 2.770 N/A GLU 170.A N SER 169.A OG no hydrogen 2.750 N/A VAL 173.A N GLU 170.A O no hydrogen 3.172 N/A VAL 174.A N GLN 143.A OE1 no hydrogen 2.969 N/A LYS 175.A N LEU 167.A O no hydrogen 2.802 N/A LYS 175.A NZ LEU 82.A O no hydrogen 2.704 N/A LYS 175.A NZ GLU 103.A OE1 no hydrogen 3.379 N/A LYS 175.A NZ GLU 103.A OE2 no hydrogen 3.000 N/A ILE 176.A N ASN 83.A O no hydrogen 2.943 N/A CYS 177.A N ASN 165.A O no hydrogen 2.928 N/A CYS 177.A SG ASN 165.A O no hydrogen 3.495 N/A PHE 179.A N ASN 165.A OD1 no hydrogen 3.245 N/A ALA 182.A N PHE 179.A O no hydrogen 2.900 N/A ARG 183.A N GLY 180.A O no hydrogen 3.154 N/A ARG 183.A NH1 ASN 165.A OD1 no hydrogen 3.398 N/A ARG 183.A NH2 ASN 165.A OD1 no hydrogen 2.807 N/A LYS 187.A N ASP 184.A O no hydrogen 3.191 N/A ASP 188.A N ASP 184.A O no hydrogen 3.110 N/A ASP 190.A N ASP 188.A OD2 no hydrogen 2.952 N/A TYR 191.A N ASP 188.A O no hydrogen 3.244 N/A TYR 191.A OH ASP 160.A OD1 no hydrogen 3.379 N/A TYR 191.A OH ASP 160.A OD2 no hydrogen 2.594 N/A VAL 192.A N LEU 198.A O no hydrogen 2.974 N/A LYS 194.A N ALA 196.A O no hydrogen 2.788 N/A LEU 198.A N VAL 192.A O no hydrogen 2.946 N/A LEU 200.A N LEU 198.A O no hydrogen 2.819 N/A LYS 201.A NZ SER 235.A OG no hydrogen 2.889 N/A LYS 201.A NZ PRO 236.A O no hydrogen 3.147 N/A TRP 202.A N PRO 199.A O no hydrogen 2.977 N/A TRP 202.A NE1 GLU 228.A OE2 no hydrogen 2.832 N/A MET 203.A N LEU 200.A O no hydrogen 3.131 N/A GLU 206.A N GLU 206.A OE1 no hydrogen 2.615 N/A THR 207.A OG1 VAL 212.A O no hydrogen 2.751 N/A ILE 208.A N ALA 204.A O no hydrogen 2.961 N/A PHE 209.A N PRO 205.A O no hydrogen 2.801 N/A ASP 210.A N GLU 206.A O no hydrogen 2.747 N/A ARG 211.A N THR 207.A O no hydrogen 3.084 N/A VAL 212.A N GLU 206.A O no hydrogen 3.417 N/A THR 214.A N SER 217.A OG no hydrogen 2.964 N/A GLN 216.A N THR 214.A OG1 no hydrogen 2.863 N/A GLN 216.A NE2 PRO 278.A O no hydrogen 3.437 N/A GLN 216.A NE2 PRO 282.A O no hydrogen 3.084 N/A SER 217.A OG THR 214.A O no hydrogen 2.639 N/A ASP 218.A N THR 214.A O no hydrogen 3.194 N/A VAL 219.A N ILE 215.A O no hydrogen 3.066 N/A TRP 220.A N GLN 216.A O no hydrogen 3.248 N/A SER 221.A N SER 217.A O no hydrogen 3.150 N/A SER 221.A OG TRP 202.A O no hydrogen 2.730 N/A SER 221.A OG SER 217.A O no hydrogen 3.416 N/A PHE 222.A N ASP 218.A O no hydrogen 2.863 N/A GLY 223.A N VAL 219.A O no hydrogen 3.004 N/A VAL 224.A N TRP 220.A O no hydrogen 3.241 N/A LEU 225.A N SER 221.A O no hydrogen 2.785 N/A LEU 226.A N PHE 222.A O no hydrogen 2.821 N/A TRP 227.A N GLY 223.A O no hydrogen 3.119 N/A TRP 227.A NE1 ARG 257.A O no hydrogen 3.027 N/A GLU 228.A N VAL 224.A O no hydrogen 2.913 N/A ILE 229.A N LEU 225.A O no hydrogen 2.904 N/A PHE 230.A N LEU 226.A O no hydrogen 2.872 N/A SER 231.A N TRP 227.A O no hydrogen 2.917 N/A SER 231.A OG TRP 227.A O no hydrogen 2.901 N/A SER 231.A OG GLU 228.A O no hydrogen 2.906 N/A LEU 232.A N ILE 229.A O no hydrogen 2.987 N/A GLY 233.A N GLU 228.A O no hydrogen 2.758 N/A ALA 234.A N SER 231.A OG no hydrogen 2.981 N/A VAL 240.A N TYR 237.A O no hydrogen 3.292 N/A LYS 241.A NZ ASP 243.A OD2 no hydrogen 3.252 N/A PHE 246.A N ASP 243.A OD1 no hydrogen 3.041 N/A CYS 247.A N ASP 243.A O no hydrogen 3.328 N/A CYS 247.A SG ASP 243.A O no hydrogen 3.704 N/A ARG 248.A N GLU 244.A O no hydrogen 3.101 N/A ARG 249.A N GLU 245.A O no hydrogen 3.001 N/A LEU 250.A N PHE 246.A O no hydrogen 3.023 N/A LYS 251.A N CYS 247.A O no hydrogen 3.228 N/A GLU 252.A N ARG 248.A O no hydrogen 2.829 N/A GLY 253.A N ARG 249.A O no hydrogen 2.917 N/A GLY 253.A N LEU 250.A O no hydrogen 3.148 N/A THR 254.A N ARG 249.A O no hydrogen 2.856 N/A THR 254.A OG1 ARG 249.A O no hydrogen 3.113 N/A ARG 255.A NE TRP 274.A O no hydrogen 2.811 N/A ARG 255.A NH1 LEU 250.A O no hydrogen 2.913 N/A ARG 255.A NH1 THR 254.A O no hydrogen 2.908 N/A ARG 255.A NH2 TRP 274.A O no hydrogen 2.748 N/A TYR 261.A N PHE 230.A O no hydrogen 2.865 N/A THR 262.A N PRO 259.A O no hydrogen 3.332 N/A THR 262.A OG1 THR 263.A O no hydrogen 2.770 N/A GLU 265.A N GLU 265.A OE1 no hydrogen 3.021 N/A MET 266.A N THR 263.A OG1 no hydrogen 2.953 N/A TYR 267.A N THR 263.A O no hydrogen 3.046 N/A TYR 267.A OH MET 256.A O no hydrogen 2.572 N/A GLN 268.A N PRO 264.A O no hydrogen 2.982 N/A GLN 268.A NE2 ASP 272.A OD1 no hydrogen 3.171 N/A THR 269.A N GLU 265.A O no hydrogen 2.930 N/A THR 269.A OG1 GLU 265.A O no hydrogen 3.160 N/A MET 270.A N MET 266.A O no hydrogen 3.024 N/A LEU 271.A N TYR 267.A O no hydrogen 2.998 N/A ASP 272.A N GLN 268.A O no hydrogen 2.859 N/A CYS 273.A N THR 269.A O no hydrogen 3.000 N/A CYS 273.A SG THR 269.A O no hydrogen 3.356 N/A TRP 274.A N MET 270.A O no hydrogen 3.016 N/A HIS 275.A N ASP 272.A O no hydrogen 3.429 N/A GLU 277.A N HIS 275.A ND1 no hydrogen 3.385 N/A SER 279.A N GLU 277.A OE2 no hydrogen 3.308 N/A SER 279.A OG GLU 277.A OE2 no hydrogen 3.014 N/A GLN 280.A N GLU 277.A O no hydrogen 3.065 N/A ARG 281.A N PRO 278.A O no hydrogen 3.337 N/A ARG 281.A NE HIS 275.A O no hydrogen 2.738 N/A ARG 281.A NH1 GLU 206.A OE2 no hydrogen 2.707 N/A ARG 281.A NH1 GLN 216.A O no hydrogen 2.920 N/A ARG 281.A NH2 GLU 206.A OE1 no hydrogen 3.079 N/A ARG 281.A NH2 GLU 206.A OE2 no hydrogen 3.451 N/A ARG 281.A NH2 HIS 275.A O no hydrogen 3.171 N/A THR 283.A N GLU 286.A OE1 no hydrogen 2.969 N/A SER 285.A OG GLU 149.A OE2 no hydrogen 2.644 N/A GLU 286.A N THR 283.A OG1 no hydrogen 3.002 N/A LEU 287.A N THR 283.A O no hydrogen 2.916 N/A VAL 288.A N PHE 284.A O no hydrogen 2.831 N/A GLU 289.A N SER 285.A O no hydrogen 3.184 N/A HIS 290.A N GLU 286.A O no hydrogen 2.946 N/A LEU 291.A N LEU 287.A O no hydrogen 2.871 N/A GLY 292.A N VAL 288.A O no hydrogen 2.866 N/A ASN 293.A N GLU 289.A O no hydrogen 3.014 N/A LEU 294.A N HIS 290.A O no hydrogen 3.067 N/A LEU 295.A N LEU 291.A O no hydrogen 2.939 N/A GLN 296.A N GLY 292.A O no hydrogen 3.179 N/A GLN 296.A NE2 GLY 292.A O no hydrogen 3.457 N/A ALA 297.A N ASN 293.A O no hydrogen 3.027 N/A ASN 298.A N LEU 294.A O no hydrogen 2.938 N/A