Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wun_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N ASP 4.A OD1 no hydrogen 3.189 N/A ARG 6.A NE ASP 4.A OD1 no hydrogen 2.937 N/A ARG 6.A NE ASP 4.A OD2 no hydrogen 3.216 N/A ARG 6.A NH1 ASP 4.A OD2 no hydrogen 2.805 N/A TRP 7.A N ASP 4.A O no hydrogen 3.037 N/A GLU 8.A N ASP 4.A O no hydrogen 3.111 N/A LEU 9.A N ALA 86.A O no hydrogen 2.973 N/A ARG 11.A NE GLN 89.A O no hydrogen 3.220 N/A ARG 11.A NH1 PRO 92.A O no hydrogen 2.836 N/A ARG 11.A NH2 GLN 89.A O no hydrogen 2.820 N/A ARG 11.A NH2 PRO 92.A O no hydrogen 2.996 N/A ARG 13.A N PRO 10.A O no hydrogen 2.956 N/A ARG 13.A NE ASP 12.A OD1 no hydrogen 2.996 N/A ARG 13.A NH2 ASP 12.A O no hydrogen 3.054 N/A LEU 14.A N ARG 11.A O no hydrogen 3.167 N/A VAL 15.A N GLU 32.A O no hydrogen 2.795 N/A GLY 17.A N LEU 30.A O no hydrogen 2.635 N/A LYS 18.A NZ PRO 19.A O no hydrogen 3.201 N/A LEU 20.A N VAL 28.A O no hydrogen 2.914 N/A GLY 26.A N GLY 23.A O no hydrogen 2.947 N/A VAL 29.A N VAL 49.A O no hydrogen 2.930 N/A LEU 30.A N LYS 18.A O no hydrogen 2.769 N/A ALA 31.A N VAL 47.A O no hydrogen 2.930 N/A GLU 32.A N VAL 15.A O no hydrogen 2.939 N/A ALA 33.A N THR 45.A O no hydrogen 2.752 N/A ILE 34.A N ARG 13.A O no hydrogen 2.672 N/A GLY 35.A N ARG 43.A O no hydrogen 2.865 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.851 N/A LYS 40.A N ASP 37.A O no hydrogen 3.230 N/A ARG 43.A N LYS 40.A O no hydrogen 3.354 N/A THR 45.A N ALA 33.A O no hydrogen 2.875 N/A VAL 47.A N ALA 31.A O no hydrogen 2.900 N/A ALA 48.A N VAL 97.A O no hydrogen 2.874 N/A VAL 49.A N VAL 29.A O no hydrogen 2.773 N/A LYS 50.A N VAL 95.A O no hydrogen 2.794 N/A LYS 50.A NZ PHE 25.A O no hydrogen 2.930 N/A LYS 50.A NZ GLU 67.A OE1 no hydrogen 2.943 N/A MET 51.A N GLN 27.A O no hydrogen 3.089 N/A THR 57.A N ASP 60.A OD2 no hydrogen 3.306 N/A LEU 61.A N THR 57.A O no hydrogen 3.309 N/A SER 62.A N GLU 58.A O no hydrogen 3.324 N/A SER 62.A OG GLU 58.A O no hydrogen 3.393 N/A SER 62.A OG LYS 59.A O no hydrogen 2.710 N/A ASP 63.A N LYS 59.A O no hydrogen 2.954 N/A LEU 64.A N ASP 60.A O no hydrogen 2.974 N/A ILE 65.A N LEU 61.A O no hydrogen 2.976 N/A SER 66.A N SER 62.A O no hydrogen 2.802 N/A SER 66.A OG SER 62.A O no hydrogen 2.635 N/A GLU 67.A N ASP 63.A O no hydrogen 2.825 N/A MET 68.A N LEU 64.A O no hydrogen 2.857 N/A GLU 69.A N ILE 65.A O no hydrogen 2.759 N/A MET 70.A N.A SER 66.A O no hydrogen 2.862 N/A MET 70.A N.B SER 66.A O no hydrogen 2.852 N/A MET 71.A N GLU 67.A O no hydrogen 2.951 N/A LYS 72.A N MET 68.A O no hydrogen 2.878 N/A LYS 72.A NZ ASP 4.A OD2 no hydrogen 2.714 N/A LYS 72.A NZ GLU 69.A OE2 no hydrogen 2.843 N/A MET 73.A N GLU 69.A O no hydrogen 3.223 N/A ILE 74.A N MET 70.A O.A no hydrogen 2.919 N/A ILE 74.A N MET 70.A O.B no hydrogen 2.933 N/A LYS 76.A NZ LEU 83.A O no hydrogen 3.308 N/A HIS 77.A N ASN 82.A OD1 no hydrogen 3.066 N/A ASN 79.A N HIS 77.A ND1 no hydrogen 2.979 N/A ASN 79.A ND2 MET 172.A O no hydrogen 3.052 N/A ILE 80.A N HIS 77.A O no hydrogen 3.244 N/A ILE 81.A N ILE 174.A O no hydrogen 2.817 N/A ASN 82.A N GLU 98.A OE1 no hydrogen 2.954 N/A ASN 82.A ND2 HIS 77.A O no hydrogen 2.753 N/A ASN 82.A ND2 GLU 98.A OE1 no hydrogen 2.923 N/A ASN 82.A ND2 GLU 98.A OE2 no hydrogen 3.372 N/A LEU 84.A N ILE 96.A O no hydrogen 2.704 N/A GLY 85.A N ILE 96.A O no hydrogen 3.173 N/A ALA 86.A N TRP 7.A O no hydrogen 3.000 N/A CYS 87.A N TYR 94.A O no hydrogen 2.893 N/A CYS 87.A SG LEU 9.A O no hydrogen 3.331 N/A THR 88.A N GLU 8.A OE2 no hydrogen 3.051 N/A THR 88.A OG1 GLU 8.A OE1 no hydrogen 2.838 N/A THR 88.A OG1 GLU 8.A OE2 no hydrogen 3.510 N/A GLN 89.A N GLU 8.A OE2 no hydrogen 3.425 N/A GLN 89.A NE2 LEU 1.A O no hydrogen 2.872 N/A GLN 89.A NE2 THR 88.A OG1 no hydrogen 2.692 N/A TYR 94.A N CYS 87.A O no hydrogen 2.867 N/A VAL 95.A N LYS 50.A O no hydrogen 2.800 N/A ILE 96.A N GLY 85.A O no hydrogen 2.800 N/A VAL 97.A N ALA 48.A O no hydrogen 2.792 N/A GLU 98.A N ASN 82.A O no hydrogen 3.068 N/A SER 101.A OG GLU 168.A OE1 no hydrogen 2.625 N/A LYS 102.A N VAL 166.A O no hydrogen 2.870 N/A LYS 102.A NZ GLU 168.A O no hydrogen 3.301 N/A LYS 102.A NZ ASN 170.A OD1 no hydrogen 3.088 N/A ASN 104.A N GLU 107.A OE2 no hydrogen 2.818 N/A LEU 105.A N VAL 164.A O no hydrogen 2.736 N/A GLU 107.A N ASN 104.A OD1 no hydrogen 2.921 N/A TYR 108.A N ASN 104.A O no hydrogen 2.870 N/A TYR 108.A OH ASN 170.A OD1 no hydrogen 3.037 N/A LEU 109.A N LEU 105.A O no hydrogen 2.955 N/A GLN 110.A N ARG 106.A O no hydrogen 2.891 N/A GLN 110.A NE2 GLY 214.A O no hydrogen 2.916 N/A ALA 111.A N GLU 107.A O no hydrogen 2.994 N/A ARG 112.A N LEU 109.A O no hydrogen 2.922 N/A ARG 112.A NH1 TYR 108.A O no hydrogen 2.903 N/A ARG 113.A N GLN 110.A O no hydrogen 3.144 N/A ARG 113.A NE LEU 213.A O no hydrogen 2.858 N/A ARG 113.A NH1 TYR 120.A O no hydrogen 2.853 N/A ARG 113.A NH2 THR 212.A O no hydrogen 3.277 N/A ARG 113.A NH2 LEU 213.A O no hydrogen 3.156 N/A ASN 121.A ND2 ALA 111.A O no hydrogen 2.951 N/A ASN 121.A ND2 ARG 113.A O no hydrogen 2.900 N/A SER 123.A N ASN 121.A OD1 no hydrogen 2.921 N/A ASN 125.A N SER 123.A OG no hydrogen 2.768 N/A GLU 127.A N ALA 111.A O no hydrogen 2.874 N/A SER 131.A N ASP 134.A OD2 no hydrogen 3.055 N/A SER 132.A N GLU 282.A O no hydrogen 3.116 N/A SER 132.A OG SER 279.A O no hydrogen 3.439 N/A ASP 134.A N SER 131.A OG no hydrogen 3.147 N/A LEU 135.A N SER 131.A O no hydrogen 3.151 N/A VAL 136.A N SER 132.A O no hydrogen 3.241 N/A SER 137.A N LYS 133.A O no hydrogen 2.893 N/A SER 137.A OG LYS 133.A O no hydrogen 3.043 N/A CYS 138.A N.A ASP 134.A O no hydrogen 2.894 N/A CYS 138.A N.B ASP 134.A O no hydrogen 2.894 N/A CYS 138.A SG.B ASP 134.A O no hydrogen 3.349 N/A ALA 139.A N LEU 135.A O no hydrogen 3.200 N/A TYR 140.A N VAL 136.A O no hydrogen 2.835 N/A GLN 141.A N SER 137.A O no hydrogen 2.912 N/A GLN 141.A NE2 SER 137.A O no hydrogen 3.457 N/A VAL 142.A N CYS 138.A O.A no hydrogen 3.191 N/A VAL 142.A N CYS 138.A O.B no hydrogen 3.040 N/A ALA 143.A N ALA 139.A O no hydrogen 2.938 N/A ARG 144.A N TYR 140.A O no hydrogen 2.863 N/A GLY 145.A N GLN 141.A O no hydrogen 3.001 N/A MET 146.A N VAL 142.A O no hydrogen 2.934 N/A GLU 147.A N ALA 143.A O no hydrogen 2.697 N/A TYR 148.A N ARG 144.A O no hydrogen 3.040 N/A TYR 148.A OH ILE 74.A O no hydrogen 2.640 N/A LEU 149.A N GLY 145.A O no hydrogen 2.974 N/A ALA 150.A N MET 146.A O no hydrogen 2.863 N/A SER 151.A N GLU 147.A O no hydrogen 2.955 N/A SER 151.A OG TYR 148.A O no hydrogen 2.623 N/A LYS 152.A N.A TYR 148.A O no hydrogen 3.119 N/A LYS 152.A N.A LEU 149.A O no hydrogen 3.011 N/A LYS 152.A N.B TYR 148.A O no hydrogen 3.124 N/A LYS 152.A NZ.B ILE 74.A O no hydrogen 3.519 N/A LYS 153.A N ALA 150.A O no hydrogen 2.887 N/A CYS 154.A N LEU 149.A O no hydrogen 2.933 N/A CYS 154.A SG PHE 177.A O no hydrogen 3.413 N/A HIS 156.A N ASP 199.A OD2 no hydrogen 2.770 N/A HIS 156.A NE2 ALA 175.A O no hydrogen 2.815 N/A ARG 157.A N ASP 199.A OD1 no hydrogen 2.922 N/A ASP 158.A N HIS 156.A ND1 no hydrogen 3.070 N/A ALA 161.A N GLU 209.A OE2 no hydrogen 2.842 N/A ARG 162.A NH2 ASP 158.A OD1 no hydrogen 2.895 N/A ASN 163.A N ALA 160.A O no hydrogen 2.866 N/A ASN 163.A ND2 ASP 158.A O no hydrogen 2.815 N/A ASN 163.A ND2 ASP 158.A OD2 no hydrogen 3.190 N/A VAL 164.A N ALA 161.A O no hydrogen 3.054 N/A LEU 165.A N LYS 173.A O no hydrogen 2.794 N/A VAL 166.A N GLY 103.A O no hydrogen 2.843 N/A THR 167.A N VAL 171.A O no hydrogen 3.065 N/A ASN 170.A N THR 167.A O no hydrogen 2.849 N/A VAL 171.A N THR 167.A OG1 no hydrogen 3.031 N/A MET 172.A N GLN 141.A OE1 no hydrogen 2.817 N/A LYS 173.A N LEU 165.A O no hydrogen 2.743 N/A LYS 173.A NZ LYS 78.A O no hydrogen 2.794 N/A LYS 173.A NZ ILE 80.A O no hydrogen 3.258 N/A LYS 173.A NZ GLU 98.A OE1 no hydrogen 2.859 N/A ILE 174.A N ASN 79.A O no hydrogen 2.949 N/A ALA 175.A N ASN 163.A O no hydrogen 2.770 N/A LYS 182.A NZ PRO 217.A O no hydrogen 3.461 N/A LYS 182.A NZ TYR 218.A O no hydrogen 2.802 N/A LYS 182.A NZ VAL 221.A O no hydrogen 2.950 N/A TRP 183.A N PRO 180.A O no hydrogen 2.886 N/A TRP 183.A NE1 GLU 209.A OE2 no hydrogen 2.883 N/A MET 184.A N VAL 181.A O no hydrogen 3.089 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 2.906 N/A LEU 189.A N ALA 185.A O no hydrogen 2.868 N/A PHE 190.A N PRO 186.A O no hydrogen 2.773 N/A ASP 191.A N GLU 187.A O no hydrogen 2.966 N/A ARG 192.A N ALA 188.A O no hydrogen 2.955 N/A ILE 193.A N GLU 187.A O no hydrogen 3.279 N/A THR 195.A N SER 198.A OG no hydrogen 2.711 N/A THR 195.A OG1 GLN 197.A OE1 no hydrogen 3.345 N/A THR 195.A OG1 SER 198.A OG no hydrogen 3.408 N/A GLN 197.A N GLN 197.A OE1 no hydrogen 3.014 N/A SER 198.A N THR 195.A OG1 no hydrogen 2.950 N/A SER 198.A OG THR 195.A O no hydrogen 2.735 N/A SER 198.A OG THR 195.A OG1 no hydrogen 3.408 N/A ASP 199.A N THR 195.A O no hydrogen 3.059 N/A VAL 200.A N HIS 196.A O no hydrogen 2.972 N/A TRP 201.A N GLN 197.A O no hydrogen 3.182 N/A SER 202.A N SER 198.A O no hydrogen 3.032 N/A SER 202.A OG TRP 183.A O no hydrogen 2.656 N/A SER 202.A OG SER 198.A O no hydrogen 3.241 N/A PHE 203.A N ASP 199.A O no hydrogen 2.838 N/A GLY 204.A N VAL 200.A O no hydrogen 2.979 N/A VAL 205.A N TRP 201.A O no hydrogen 3.237 N/A LEU 206.A N SER 202.A O no hydrogen 2.838 N/A LEU 207.A N PHE 203.A O no hydrogen 2.784 N/A TRP 208.A N GLY 204.A O no hydrogen 3.064 N/A TRP 208.A NE1 ASP 237.A O no hydrogen 3.019 N/A GLU 209.A N VAL 205.A O no hydrogen 2.887 N/A ILE 210.A N LEU 206.A O no hydrogen 2.866 N/A PHE 211.A N LEU 207.A O no hydrogen 2.987 N/A THR 212.A N TRP 208.A O no hydrogen 2.982 N/A THR 212.A OG1 TRP 208.A O no hydrogen 2.750 N/A THR 212.A OG1 GLU 209.A O no hydrogen 3.096 N/A LEU 213.A N ILE 210.A O no hydrogen 2.849 N/A GLY 214.A N GLU 209.A O no hydrogen 2.717 N/A GLY 215.A N THR 212.A OG1 no hydrogen 2.888 N/A VAL 221.A N TYR 218.A O no hydrogen 3.034 N/A GLU 225.A N PRO 222.A O no hydrogen 3.109 N/A LEU 226.A N VAL 223.A O no hydrogen 2.901 N/A LEU 229.A N GLU 225.A O no hydrogen 2.983 N/A LEU 230.A N LEU 226.A O no hydrogen 2.798 N/A LYS 231.A N PHE 227.A O no hydrogen 2.778 N/A GLU 232.A N LYS 228.A O no hydrogen 3.061 N/A GLY 233.A N LEU 230.A O no hydrogen 2.878 N/A HIS 234.A N LEU 229.A O no hydrogen 2.877 N/A ARG 235.A NE TRP 254.A O no hydrogen 2.891 N/A ARG 235.A NH1 LEU 230.A O no hydrogen 3.313 N/A ARG 235.A NH1 HIS 234.A O no hydrogen 2.817 N/A ARG 235.A NH2 TRP 254.A O no hydrogen 2.994 N/A LYS 238.A NZ PRO 239.A O no hydrogen 2.866 N/A LYS 238.A NZ CYS 242.A O no hydrogen 2.805 N/A CYS 242.A SG THR 243.A O no hydrogen 3.363 N/A LEU 246.A N THR 243.A OG1 no hydrogen 3.084 N/A TYR 247.A N THR 243.A O no hydrogen 3.028 N/A TYR 247.A OH MET 236.A O no hydrogen 2.553 N/A MET 248.A N ASN 244.A O no hydrogen 2.787 N/A MET 249.A N GLU 245.A O no hydrogen 3.009 N/A MET 250.A N LEU 246.A O no hydrogen 3.021 N/A ARG 251.A N TYR 247.A O no hydrogen 2.881 N/A ARG 251.A NH1 TYR 247.A OH no hydrogen 3.161 N/A ASP 252.A N MET 248.A O no hydrogen 2.845 N/A CYS 253.A N MET 249.A O no hydrogen 2.919 N/A CYS 253.A SG MET 249.A O no hydrogen 3.375 N/A TRP 254.A N MET 250.A O no hydrogen 2.978 N/A HIS 255.A N ASP 252.A O no hydrogen 3.004 N/A VAL 257.A N HIS 255.A ND1 no hydrogen 3.375 N/A GLN 260.A N VAL 257.A O no hydrogen 2.999 N/A GLN 260.A NE2 SER 259.A OG no hydrogen 2.949 N/A ARG 261.A N PRO 258.A O no hydrogen 3.169 N/A ARG 261.A NE HIS 255.A O no hydrogen 2.869 N/A ARG 261.A NH1 GLU 187.A OE2 no hydrogen 2.796 N/A ARG 261.A NH1 GLN 197.A O no hydrogen 2.958 N/A ARG 261.A NH2 GLU 187.A OE1 no hydrogen 2.915 N/A ARG 261.A NH2 HIS 255.A O no hydrogen 3.034 N/A GLN 266.A N THR 263.A OG1 no hydrogen 3.026 N/A GLN 266.A NE2 ASP 270.A OD1 no hydrogen 3.046 N/A GLN 266.A NE2 ASP 270.A OD2 no hydrogen 3.544 N/A LEU 267.A N THR 263.A O no hydrogen 2.890 N/A VAL 268.A N PHE 264.A O no hydrogen 2.825 N/A GLU 269.A N LYS 265.A O no hydrogen 3.188 N/A ASP 270.A N GLN 266.A O no hydrogen 2.852 N/A LEU 271.A N LEU 267.A O no hydrogen 2.765 N/A ASP 272.A N VAL 268.A O no hydrogen 2.823 N/A ARG 273.A N GLU 269.A O no hydrogen 3.118 N/A ARG 273.A NH1 GLU 245.A OE2 no hydrogen 2.930 N/A ILE 274.A N ASP 270.A O no hydrogen 2.950 N/A VAL 275.A N LEU 271.A O no hydrogen 2.743 N/A ALA 276.A N ASP 272.A O no hydrogen 3.140 N/A LEU 277.A N ARG 273.A O no hydrogen 3.159 N/A LEU 277.A N ILE 274.A O no hydrogen 3.124 N/A THR 278.A N VAL 275.A O no hydrogen 3.134 N/A THR 278.A OG1 ILE 274.A O no hydrogen 2.692 N/A GLN 281.A N SER 279.A OG no hydrogen 2.995 N/A