Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wu2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 7.A N GLU 278.A OE2 no hydrogen 2.619 N/A SER 8.A N PRO 5.A O no hydrogen 2.943 N/A TYR 9.A N GLU 278.A OE2 no hydrogen 3.169 N/A ARG 11.A N SER 8.A O no hydrogen 3.073 N/A ALA 12.A N TYR 9.A O no hydrogen 2.843 N/A GLU 13.A N ALA 10.A O no hydrogen 3.200 N/A ARG 14.A NE ASP 17.A OD2 no hydrogen 3.365 N/A ARG 14.A NH1 ASP 17.A OD1 no hydrogen 3.120 N/A ARG 14.A NH1 ASP 17.A OD2 no hydrogen 3.350 N/A GLN 16.A N GLN 16.A OE1 no hydrogen 2.760 N/A ASP 17.A N ARG 14.A O no hydrogen 2.997 N/A PHE 18.A N PRO 15.A O no hydrogen 2.968 N/A PHE 21.A N TYR 116.A O no hydrogen 2.768 N/A VAL 22.A N TYR 116.A O no hydrogen 3.436 N/A ARG 24.A N SER 114.A O no hydrogen 2.775 N/A LEU 25.A N ALA 150.A O no hydrogen 2.944 N/A ASP 26.A N PRO 112.A O no hydrogen 2.916 N/A ASN 27.A ND2 ALA 74.A O no hydrogen 3.173 N/A GLY 29.A N ASN 27.A OD1 no hydrogen 2.698 N/A LYS 30.A N ASP 28.A OD1 no hydrogen 2.951 N/A ARG 35.A N SER 73.A OG no hydrogen 2.868 N/A ARG 35.A NH2 LEU 33.A O no hydrogen 3.086 N/A ASN 36.A ND2 ALA 221.A O no hydrogen 2.983 N/A ARG 38.A N GLY 71.A O no hydrogen 3.068 N/A ARG 38.A NH1 ASN 36.A O no hydrogen 2.851 N/A ARG 38.A NH1 GLY 222.A O no hydrogen 2.871 N/A ARG 38.A NH2 GLY 222.A O no hydrogen 3.288 N/A THR 39.A N ASP 42.A OD2 no hydrogen 3.271 N/A THR 39.A OG1 ASP 42.A OD1 no hydrogen 2.717 N/A SER 40.A N ILE 69.A O no hydrogen 2.886 N/A SER 40.A OG ILE 69.A O no hydrogen 3.226 N/A ALA 41.A N THR 39.A OG1 no hydrogen 3.182 N/A ASP 42.A N THR 39.A O no hydrogen 3.178 N/A ARG 45.A N GLU 252.A O no hydrogen 2.889 N/A GLU 48.A N HIS 251.A NE2 no hydrogen 2.987 N/A PHE 51.A N GLU 48.A O no hydrogen 3.195 N/A HIS 52.A N LYS 49.A O no hydrogen 2.960 N/A ASP 54.A N TYR 248.A OH no hydrogen 3.040 N/A ALA 56.A N ASP 54.A OD1 no hydrogen 2.962 N/A TYR 57.A N ASP 54.A O no hydrogen 3.010 N/A TYR 57.A OH ASP 245.A OD1 no hydrogen 2.900 N/A SER 60.A N ASP 245.A OD1 no hydrogen 2.904 N/A ARG 61.A NH1 ASP 42.A O no hydrogen 2.790 N/A ARG 61.A NH2 ASP 42.A O no hydrogen 2.865 N/A GLU 62.A N SER 60.A OG no hydrogen 2.985 N/A MET 64.A N ARG 61.A O no hydrogen 3.157 N/A ALA 66.A N GLY 63.A O no hydrogen 3.218 N/A LEU 67.A N MET 64.A O no hydrogen 3.122 N/A ILE 69.A N SER 40.A OG no hydrogen 3.126 N/A SER 70.A N LEU 215.A O no hydrogen 2.910 N/A SER 70.A OG HIS 216.A ND1 no hydrogen 2.740 N/A GLY 71.A N ARG 38.A O no hydrogen 2.919 N/A SER 72.A N PHE 217.A O no hydrogen 3.183 N/A SER 72.A OG SER 73.A O no hydrogen 2.929 N/A SER 72.A OG HIS 216.A NE2 no hydrogen 2.905 N/A SER 73.A N ARG 35.A O no hydrogen 2.994 N/A SER 73.A OG ARG 35.A O no hydrogen 3.527 N/A SER 73.A OG ALA 74.A O no hydrogen 2.856 N/A ALA 74.A N GLU 220.A O no hydrogen 2.980 N/A THR 76.A N GLN 79.A OE1 no hydrogen 2.765 N/A GLN 79.A N THR 76.A OG1 no hydrogen 3.112 N/A GLN 79.A NE2 ASN 27.A OD1 no hydrogen 3.066 N/A GLN 79.A NE2 GLU 31.A O no hydrogen 2.976 N/A LEU 80.A N THR 76.A O no hydrogen 3.044 N/A LYS 81.A N PRO 77.A O no hydrogen 3.095 N/A ASN 82.A N ALA 78.A O no hydrogen 3.129 N/A ASN 82.A ND2 ALA 32.A O no hydrogen 2.993 N/A VAL 83.A N GLN 79.A O no hydrogen 2.967 N/A ALA 84.A N LEU 80.A O no hydrogen 2.818 N/A ALA 85.A N LYS 81.A O no hydrogen 2.971 N/A LYS 86.A N ASN 82.A O no hydrogen 3.153 N/A LEU 87.A N VAL 83.A O no hydrogen 2.967 N/A ARG 88.A N ALA 84.A O no hydrogen 2.865 N/A ARG 88.A NH1 GLY 93.A O no hydrogen 3.519 N/A ARG 88.A NH2 THR 91.A O no hydrogen 2.727 N/A ARG 88.A NH2 GLY 93.A O no hydrogen 3.033 N/A GLU 89.A N LYS 86.A O no hydrogen 3.315 N/A LYS 90.A N LEU 87.A O no hydrogen 2.853 N/A THR 91.A OG1 ASP 212.A O no hydrogen 3.435 N/A GLY 93.A N THR 91.A OG1 no hydrogen 3.069 N/A TYR 96.A N TRP 214.A O no hydrogen 2.790 N/A ASP 97.A N ARG 182.A O no hydrogen 2.672 N/A VAL 98.A N HIS 216.A O no hydrogen 2.827 N/A ASP 99.A N PHE 184.A O no hydrogen 2.794 N/A LEU 100.A N HIS 218.A O no hydrogen 3.091 N/A ARG 101.A N ASP 99.A OD1 no hydrogen 3.043 N/A ARG 101.A NE GLU 103.A OE1 no hydrogen 2.869 N/A ARG 101.A NH1 ASP 26.A OD2 no hydrogen 2.921 N/A ARG 101.A NH2 ASP 26.A OD1 no hydrogen 3.341 N/A ARG 101.A NH2 ASP 26.A OD2 no hydrogen 3.124 N/A ARG 101.A NH2 GLU 103.A OE1 no hydrogen 3.465 N/A ARG 101.A NH2 SER 114.A OG no hydrogen 3.283 N/A GLN 102.A N ALA 188.A O no hydrogen 2.963 N/A GLU 103.A N GLU 103.A OE2 no hydrogen 2.749 N/A SER 104.A OG ASP 134.A OD1 no hydrogen 2.664 N/A HIS 105.A N GLU 135.A OE1 no hydrogen 2.901 N/A HIS 105.A ND1 GLU 103.A O no hydrogen 2.926 N/A HIS 105.A NE2 ASP 99.A OD2 no hydrogen 2.554 N/A GLY 106.A N VAL 113.A O no hydrogen 3.053 N/A TYR 107.A N GLN 170.A O no hydrogen 2.951 N/A TYR 107.A OH PHE 75.A O no hydrogen 3.409 N/A LEU 108.A N ILE 111.A O no hydrogen 3.097 N/A ASP 109.A N LYS 168.A O no hydrogen 2.792 N/A ILE 111.A N LEU 108.A O no hydrogen 2.876 N/A VAL 113.A N GLY 106.A O no hydrogen 3.034 N/A SER 114.A N ARG 24.A O no hydrogen 3.026 N/A SER 114.A OG ASP 26.A OD1 no hydrogen 2.546 N/A SER 114.A OG ASP 26.A OD2 no hydrogen 3.330 N/A TRP 115.A N SER 104.A O no hydrogen 2.825 N/A TYR 116.A N VAL 22.A O no hydrogen 2.842 N/A TRP 121.A N GLU 118.A O no hydrogen 3.163 N/A TRP 121.A NE1 ASP 190.A O no hydrogen 2.927 N/A ASN 123.A ND2 GLN 102.A O no hydrogen 2.896 N/A ASN 123.A ND2 SER 104.A OG no hydrogen 2.983 N/A LEU 124.A N TRP 121.A O no hydrogen 3.090 N/A LYS 126.A N ASN 123.A O no hydrogen 3.151 N/A LYS 126.A NZ ASN 123.A OD1 no hydrogen 2.971 N/A SER 127.A N GLU 130.A OE2 no hydrogen 2.723 N/A SER 127.A OG GLU 130.A OE2 no hydrogen 3.149 N/A GLN 128.A NE2 ARG 185.A O no hydrogen 2.906 N/A GLU 130.A N SER 127.A OG no hydrogen 3.058 N/A ALA 131.A N SER 127.A O no hydrogen 2.976 N/A LEU 132.A N GLN 128.A O no hydrogen 3.000 N/A ALA 133.A N HIS 129.A O no hydrogen 3.081 N/A ASP 134.A N GLU 130.A O no hydrogen 2.901 N/A GLU 135.A N ALA 131.A O no hydrogen 2.929 N/A ARG 136.A N LEU 132.A O no hydrogen 2.922 N/A HIS 137.A N.A ALA 133.A O no hydrogen 3.086 N/A HIS 137.A N.B ALA 133.A O no hydrogen 3.077 N/A ARG 138.A N ASP 134.A O no hydrogen 2.911 N/A ARG 138.A NE ASP 134.A OD1 no hydrogen 3.169 N/A ARG 138.A NE ASP 134.A OD2 no hydrogen 3.048 N/A ARG 138.A NH2 ASP 134.A OD2 no hydrogen 3.426 N/A LEU 139.A N GLU 135.A O no hydrogen 2.929 N/A HIS 140.A N ARG 136.A O no hydrogen 3.144 N/A ALA 141.A N HIS 137.A O.A no hydrogen 2.971 N/A ALA 141.A N HIS 137.A O.B no hydrogen 2.983 N/A ALA 142.A N LEU 139.A O no hydrogen 3.144 N/A LEU 143.A N HIS 140.A O no hydrogen 3.154 N/A HIS 144.A N VAL 166.A O no hydrogen 2.772 N/A LYS 145.A N ALA 142.A O no hydrogen 2.961 N/A VAL 147.A N ARG 164.A O no hydrogen 2.798 N/A TYR 148.A OH GLY 160.A O no hydrogen 2.629 N/A ILE 149.A N GLU 162.A O no hydrogen 2.930 N/A ALA 150.A N TRP 23.A O no hydrogen 3.121 N/A GLY 153.A N LEU 157.A O no hydrogen 2.893 N/A LYS 156.A N GLY 153.A O no hydrogen 3.365 N/A LEU 157.A N LYS 154.A O no hydrogen 3.413 N/A GLU 159.A N PRO 151.A O no hydrogen 3.193 N/A GLU 162.A N ILE 149.A O no hydrogen 2.832 N/A ARG 164.A N VAL 147.A O no hydrogen 3.087 N/A ARG 164.A NE ASP 109.A OD2 no hydrogen 2.579 N/A ARG 164.A NH1 GLU 162.A OE1 no hydrogen 3.360 N/A ARG 164.A NH2 ASP 109.A OD2 no hydrogen 3.158 N/A ARG 165.A NH1 THR 146.A OG1 no hydrogen 3.142 N/A VAL 166.A N LYS 145.A O no hydrogen 2.987 N/A GLN 167.A N ASP 109.A OD1 no hydrogen 2.787 N/A GLN 167.A NE2 ARG 165.A O no hydrogen 3.496 N/A LYS 168.A N ASP 109.A OD1 no hydrogen 2.994 N/A GLN 170.A N TYR 107.A O no hydrogen 3.012 N/A THR 171.A N GLU 174.A OE1 no hydrogen 3.186 N/A THR 171.A OG1 GLU 174.A OE1 no hydrogen 3.299 N/A GLN 173.A NE2 GLU 177.A OE2 no hydrogen 2.968 N/A GLU 174.A N THR 171.A OG1 no hydrogen 3.173 N/A VAL 175.A N THR 171.A O no hydrogen 3.113 N/A ALA 176.A N GLU 172.A O no hydrogen 2.743 N/A GLU 177.A N GLN 173.A O no hydrogen 2.908 N/A ALA 178.A N GLU 174.A O no hydrogen 2.932 N/A ALA 179.A N ALA 176.A O no hydrogen 2.876 N/A GLY 180.A N GLU 177.A O no hydrogen 3.289 N/A MET 181.A N ALA 176.A O no hydrogen 3.025 N/A ARG 182.A N ILE 95.A O no hydrogen 2.848 N/A ARG 182.A NH1 TYR 96.A OH no hydrogen 2.938 N/A TYR 183.A OH ASP 99.A OD2 no hydrogen 2.851 N/A PHE 184.A N ASP 97.A O no hydrogen 2.946 N/A ARG 185.A NE ARG 101.A O no hydrogen 2.898 N/A ARG 185.A NH1 GLU 135.A OE1 no hydrogen 3.507 N/A ARG 185.A NH1 GLU 135.A OE2 no hydrogen 3.004 N/A ARG 185.A NH1 TYR 183.A OH no hydrogen 3.240 N/A ARG 185.A NH2 ARG 101.A O no hydrogen 2.776 N/A ARG 185.A NH2 GLU 135.A OE1 no hydrogen 2.995 N/A ILE 186.A N ASP 99.A O no hydrogen 2.731 N/A ALA 187.A N GLN 128.A OE1 no hydrogen 2.944 N/A ALA 188.A N LEU 100.A O no hydrogen 3.087 N/A THR 189.A OG1 GLN 102.A OE1 no hydrogen 2.494 N/A THR 195.A N ASN 198.A OD1 no hydrogen 2.999 N/A THR 195.A OG1 GLU 197.A OE1 no hydrogen 3.193 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.669 N/A ASN 198.A N THR 195.A OG1 no hydrogen 3.004 N/A ASN 198.A ND2 ALA 187.A O no hydrogen 3.136 N/A ILE 199.A N THR 195.A O no hydrogen 3.033 N/A ASP 200.A N PRO 196.A O no hydrogen 2.841 N/A ARG 201.A N GLU 197.A O no hydrogen 3.099 N/A ARG 201.A NE ARG 185.A O no hydrogen 2.817 N/A ARG 201.A NH2 ARG 185.A O no hydrogen 3.365 N/A PHE 202.A N ASN 198.A O no hydrogen 3.029 N/A LEU 203.A N ILE 199.A O no hydrogen 2.830 N/A ALA 204.A N ASP 200.A O no hydrogen 3.097 N/A PHE 205.A N ARG 201.A O no hydrogen 2.985 N/A TYR 206.A N PHE 202.A O no hydrogen 2.776 N/A ARG 207.A N.A LEU 203.A O no hydrogen 3.044 N/A ARG 207.A N.B LEU 203.A O no hydrogen 3.044 N/A THR 208.A N PHE 205.A O no hydrogen 3.176 N/A THR 208.A OG1 PHE 205.A O no hydrogen 2.965 N/A LEU 209.A N TYR 206.A O no hydrogen 3.339 N/A ALA 213.A N PRO 210.A O no hydrogen 3.051 N/A TRP 214.A N PRO 94.A O no hydrogen 2.927 N/A TRP 214.A NE1 SER 70.A OG no hydrogen 2.925 N/A LEU 215.A N HIS 68.A O no hydrogen 3.173 N/A HIS 216.A N TYR 96.A O no hydrogen 2.735 N/A HIS 216.A ND1 SER 70.A OG no hydrogen 2.740 N/A HIS 216.A NE2 SER 72.A OG no hydrogen 2.905 N/A PHE 217.A N SER 70.A O no hydrogen 2.910 N/A HIS 218.A N VAL 98.A O no hydrogen 2.973 N/A HIS 218.A NE2 GLU 172.A OE2 no hydrogen 2.446 N/A SER 219.A OG THR 226.A OG1 no hydrogen 2.740 N/A ARG 225.A NH1 GLU 103.A OE1 no hydrogen 3.314 N/A ARG 225.A NH1 GLU 103.A OE2 no hydrogen 2.842 N/A ARG 225.A NH1 ALA 188.A O no hydrogen 2.923 N/A ARG 225.A NH2 GLU 103.A OE1 no hydrogen 3.176 N/A THR 226.A OG1 SER 219.A OG no hydrogen 2.740 N/A THR 227.A N VAL 223.A O no hydrogen 3.168 N/A THR 227.A OG1 VAL 223.A O no hydrogen 2.525 N/A ALA 228.A N GLY 224.A O no hydrogen 3.338 N/A PHE 229.A N ARG 225.A O no hydrogen 3.164 N/A MET 230.A N THR 226.A O no hydrogen 2.967 N/A VAL 231.A N THR 227.A O no hydrogen 2.797 N/A MET 232.A N ALA 228.A O no hydrogen 3.009 N/A THR 233.A N PHE 229.A O no hydrogen 2.979 N/A THR 233.A OG1 PHE 229.A O no hydrogen 2.771 N/A ASP 234.A N MET 230.A O no hydrogen 2.955 N/A MET 235.A N VAL 231.A O no hydrogen 3.048 N/A MET 235.A N MET 232.A O no hydrogen 3.208 N/A LEU 236.A N MET 232.A O no hydrogen 3.061 N/A LYS 237.A N THR 233.A O no hydrogen 3.095 N/A LYS 237.A NZ ALA 66.A O no hydrogen 2.560 N/A LYS 237.A NZ LEU 67.A O no hydrogen 3.144 N/A ASN 238.A N ASP 234.A O no hydrogen 2.952 N/A ASN 238.A ND2 ASP 234.A O no hydrogen 3.430 N/A ASN 238.A ND2 ASP 234.A OD1 no hydrogen 2.713 N/A VAL 241.A N ASN 238.A O no hydrogen 2.973 N/A SER 242.A OG ASP 245.A OD2 no hydrogen 2.837 N/A ASP 245.A N SER 242.A OG no hydrogen 3.008 N/A ILE 246.A N SER 242.A O no hydrogen 3.045 N/A LEU 247.A N LEU 243.A O no hydrogen 3.051 N/A TYR 248.A N LYS 244.A O no hydrogen 2.861 N/A ARG 249.A N ASP 245.A O no hydrogen 2.718 N/A ARG 249.A NE ASP 234.A OD2 no hydrogen 2.836 N/A ARG 249.A NH1 SER 60.A O no hydrogen 3.102 N/A ARG 249.A NH1 GLU 62.A O no hydrogen 3.062 N/A ARG 249.A NH2 GLU 62.A O no hydrogen 3.347 N/A ARG 249.A NH2 ASP 234.A OD1 no hydrogen 2.637 N/A ARG 249.A NH2 ASP 234.A OD2 no hydrogen 3.251 N/A GLN 250.A N ILE 246.A O no hydrogen 2.895 N/A GLN 250.A NE2 ASP 234.A OD2 no hydrogen 2.818 N/A HIS 251.A N LEU 247.A O no hydrogen 3.244 N/A HIS 251.A N TYR 248.A O no hydrogen 3.246 N/A HIS 251.A ND1 GLY 255.A O no hydrogen 2.936 N/A GLU 252.A N TYR 248.A O no hydrogen 2.923 N/A ILE 253.A N ARG 249.A O no hydrogen 3.093 N/A GLY 254.A N HIS 251.A O no hydrogen 2.976 N/A GLY 255.A N HIS 251.A O no hydrogen 3.167 N/A PHE 256.A N THR 227.A OG1 no hydrogen 2.986 N/A TYR 258.A OH GLY 224.A O no hydrogen 2.698 N/A THR 265.A OG1 LYS 266.A O no hydrogen 3.376 N/A LYS 268.A NZ ASP 269.A OD2 no hydrogen 3.417 N/A SER 270.A N ASP 267.A O no hydrogen 3.089 N/A SER 270.A OG ASP 267.A O no hydrogen 2.887 N/A LYS 272.A N ASP 269.A O no hydrogen 3.251 N/A THR 273.A N SER 270.A O no hydrogen 3.200 N/A THR 273.A OG1 SER 270.A O no hydrogen 3.391 N/A TYR 275.A N LYS 272.A O no hydrogen 2.828 N/A TYR 275.A OH GLU 13.A OE2 no hydrogen 2.677 N/A TYR 276.A N LYS 272.A O no hydrogen 3.067 N/A ARG 277.A N THR 273.A O no hydrogen 3.171 N/A GLU 278.A N LYS 274.A O no hydrogen 2.932 N/A LYS 279.A N TYR 275.A O no hydrogen 3.131 N/A LYS 279.A NZ HIS 191.A O no hydrogen 3.474 N/A LYS 279.A NZ TYR 258.A OH no hydrogen 3.314 N/A ILE 280.A N TYR 276.A O no hydrogen 3.249 N/A VAL 281.A N ARG 277.A O no hydrogen 3.230 N/A MET 282.A N GLU 278.A O no hydrogen 2.926 N/A ILE 283.A N LYS 279.A O no hydrogen 2.760 N/A GLU 284.A N ILE 280.A O no hydrogen 3.345 N/A GLN 285.A N VAL 281.A O no hydrogen 2.986 N/A GLN 285.A NE2 HIS 309.A O no hydrogen 2.650 N/A PHE 286.A N MET 282.A O no hydrogen 2.849 N/A TYR 287.A N ILE 283.A O no hydrogen 3.167 N/A TYR 287.A OH VAL 241.A O no hydrogen 2.914 N/A ARG 288.A N GLU 284.A O no hydrogen 3.113 N/A ARG 288.A NE GLU 292.A OE1 no hydrogen 3.093 N/A TYR 289.A N GLN 285.A O no hydrogen 2.939 N/A TYR 289.A OH THR 300.A O no hydrogen 2.333 N/A VAL 290.A N PHE 286.A O no hydrogen 2.831 N/A GLN 291.A N TYR 287.A O no hydrogen 2.986 N/A GLN 291.A NE2 PRO 239.A O no hydrogen 2.664 N/A GLU 292.A N ARG 288.A O no hydrogen 3.156 N/A ASN 293.A N VAL 290.A O no hydrogen 3.060 N/A ASN 293.A ND2 TYR 289.A O no hydrogen 2.586 N/A ARG 294.A N VAL 290.A O no hydrogen 2.719 N/A TYR 298.A N ASN 293.A O no hydrogen 2.901 N/A GLN 299.A N ASP 296.A OD1 no hydrogen 3.440 N/A THR 300.A OG1 ASN 293.A OD1 no hydrogen 3.424 N/A SER 303.A N ASP 200.A OD1 no hydrogen 3.096 N/A SER 303.A OG ASP 200.A OD2 no hydrogen 2.379 N/A VAL 304.A N PRO 301.A O no hydrogen 2.963 N/A TRP 305.A N PRO 301.A O no hydrogen 3.125 N/A LEU 306.A N TRP 302.A O no hydrogen 2.903 N/A LYS 307.A N SER 303.A O no hydrogen 3.290 N/A SER 308.A N VAL 304.A O no hydrogen 3.215 N/A SER 308.A OG TRP 305.A O no hydrogen 2.757 N/A SER 308.A OG HIS 309.A ND1 no hydrogen 2.531 N/A HIS 309.A N TRP 305.A O no hydrogen 2.637 N/A HIS 309.A ND1 TRP 305.A O no hydrogen 3.187 N/A HIS 309.A ND1 SER 308.A OG no hydrogen 2.531 N/A