Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wnt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ASP 59.A OD2 no hydrogen 3.360 N/A VAL 4.A N VAL 21.A O no hydrogen 2.818 N/A LYS 6.A N ARG 19.A O no hydrogen 2.685 N/A ILE 9.A N CYS 17.A O no hydrogen 2.701 N/A GLY 10.A N CYS 17.A O no hydrogen 3.042 N/A SER 15.A N GLY 12.A O no hydrogen 3.119 N/A GLU 16.A N VAL 33.A O no hydrogen 2.920 N/A CYS 17.A N GLY 10.A O no hydrogen 2.857 N/A CYS 17.A SG VAL 31.A O no hydrogen 3.941 N/A LYS 18.A N VAL 31.A O no hydrogen 2.899 N/A LYS 18.A NZ THR 8.A OG1 no hydrogen 3.405 N/A ARG 19.A N GLU 7.A O no hydrogen 2.952 N/A ARG 19.A NE GLU 7.A OE1 no hydrogen 3.312 N/A ARG 19.A NE GLU 7.A OE2 no hydrogen 2.855 N/A ARG 19.A NH2 GLU 7.A OE1 no hydrogen 3.350 N/A CYS 20.A N TYR 29.A O no hydrogen 2.939 N/A VAL 21.A N VAL 4.A O no hydrogen 2.769 N/A HIS 22.A N MET 27.A O no hydrogen 2.820 N/A LYS 23.A N GLY 2.A O no hydrogen 2.785 N/A ASN 26.A N LYS 23.A O no hydrogen 3.324 N/A TYR 29.A N CYS 20.A O no hydrogen 2.796 N/A ALA 30.A N THR 71.A O no hydrogen 2.976 N/A VAL 31.A N LYS 18.A O no hydrogen 2.811 N/A LYS 32.A N LEU 69.A O no hydrogen 2.805 N/A LYS 32.A NZ GLU 41.A OE2 no hydrogen 3.257 N/A LYS 32.A NZ ASP 139.A OD1 no hydrogen 2.836 N/A VAL 33.A N GLU 16.A O no hydrogen 2.861 N/A ILE 34.A N VAL 67.A O no hydrogen 3.137 N/A LYS 36.A N LYS 65.A O no hydrogen 3.174 N/A ILE 42.A N PRO 38.A O no hydrogen 2.786 N/A GLU 43.A N SER 39.A O no hydrogen 3.091 N/A ILE 44.A N GLU 40.A O.A no hydrogen 3.255 N/A ILE 44.A N GLU 40.A O.B no hydrogen 3.130 N/A LEU 45.A N GLU 41.A O no hydrogen 3.049 N/A LEU 46.A N ILE 42.A O no hydrogen 2.976 N/A ARG 47.A N GLU 43.A O no hydrogen 2.967 N/A TYR 48.A N ILE 44.A O no hydrogen 2.854 N/A HIS 51.A N TYR 48.A O no hydrogen 3.009 N/A ASN 53.A N HIS 51.A ND1 no hydrogen 3.072 N/A ASN 53.A ND2 GLU 133.A O no hydrogen 3.365 N/A ASN 53.A ND2 LEU 135.A O no hydrogen 2.959 N/A ILE 54.A N HIS 51.A O no hydrogen 2.984 N/A ILE 55.A N ILE 137.A O no hydrogen 2.959 N/A THR 56.A N GLU 72.A OE2 no hydrogen 3.112 N/A THR 56.A OG1 GLU 72.A OE2 no hydrogen 2.891 N/A LYS 58.A N VAL 70.A O no hydrogen 2.712 N/A ASP 59.A N VAL 70.A O no hydrogen 3.196 N/A TYR 61.A N TYR 68.A O no hydrogen 2.941 N/A GLY 64.A N ASP 62.A OD1 no hydrogen 2.960 N/A HIS 66.A N ASP 63.A OD1 no hydrogen 3.238 N/A VAL 67.A N ILE 34.A O no hydrogen 3.022 N/A TYR 68.A N TYR 61.A O no hydrogen 2.711 N/A TYR 68.A OH ASP 63.A OD2 no hydrogen 2.870 N/A LEU 69.A N LYS 32.A O no hydrogen 3.115 N/A VAL 70.A N ASP 59.A O no hydrogen 2.771 N/A THR 71.A N ALA 30.A O no hydrogen 2.735 N/A THR 71.A OG1 GLU 72.A O no hydrogen 3.212 N/A ARG 75.A N VAL 126.A O no hydrogen 2.951 N/A ARG 75.A NH1 GLU 28.A OE1 no hydrogen 2.955 N/A GLY 76.A N TYR 125.A O no hydrogen 2.779 N/A LEU 79.A N ILE 123.A O no hydrogen 2.824 N/A LYS 82.A N LEU 79.A O no hydrogen 2.935 N/A LYS 82.A NZ GLU 128.A O no hydrogen 3.438 N/A ILE 83.A N LEU 79.A O no hydrogen 3.092 N/A LEU 84.A N LEU 80.A O no hydrogen 3.003 N/A ARG 85.A N LYS 82.A O no hydrogen 3.230 N/A LYS 87.A NZ GLY 130.A O no hydrogen 3.024 N/A PHE 89.A N GLN 258.A OE1 no hydrogen 2.919 N/A SER 90.A N GLU 93.A OE1 no hydrogen 2.860 N/A SER 90.A OG GLU 93.A OE1 no hydrogen 2.502 N/A SER 90.A OG PRO 255.A O no hydrogen 3.565 N/A ARG 92.A N SER 90.A OG no hydrogen 3.352 N/A ARG 92.A NE GLU 93.A OE2 no hydrogen 2.780 N/A ARG 92.A NH2 GLU 93.A OE2 no hydrogen 2.663 N/A ALA 94.A N SER 90.A O no hydrogen 3.034 N/A SER 95.A N GLU 91.A O no hydrogen 2.848 N/A SER 95.A OG TRP 247.A O no hydrogen 2.818 N/A PHE 96.A N ARG 92.A O no hydrogen 3.326 N/A VAL 97.A N GLU 93.A O no hydrogen 3.200 N/A LEU 98.A N ALA 94.A O no hydrogen 2.981 N/A HIS 99.A N SER 95.A O no hydrogen 2.935 N/A THR 100.A N PHE 96.A O no hydrogen 2.914 N/A THR 100.A OG1 PHE 96.A O no hydrogen 2.725 N/A ILE 101.A N VAL 97.A O no hydrogen 2.985 N/A GLY 102.A N LEU 98.A O no hydrogen 2.495 N/A LYS 103.A N HIS 99.A O no hydrogen 2.905 N/A THR 104.A N.A THR 100.A O no hydrogen 3.311 N/A THR 104.A N.B THR 100.A O no hydrogen 3.351 N/A THR 104.A OG1.A THR 100.A O no hydrogen 2.809 N/A VAL 105.A N ILE 101.A O no hydrogen 3.050 N/A GLU 106.A N GLY 102.A O no hydrogen 2.893 N/A TYR 107.A N LYS 103.A O no hydrogen 3.064 N/A LEU 108.A N THR 104.A O.A no hydrogen 3.217 N/A LEU 108.A N THR 104.A O.B no hydrogen 2.781 N/A HIS 109.A N VAL 105.A O no hydrogen 2.795 N/A HIS 109.A NE2 ASP 169.A OD2 no hydrogen 2.628 N/A SER 110.A N GLU 106.A O no hydrogen 3.107 N/A SER 110.A OG TYR 107.A O no hydrogen 2.589 N/A GLN 111.A N TYR 107.A O no hydrogen 3.189 N/A GLN 111.A N LEU 108.A O no hydrogen 2.885 N/A GLY 112.A N HIS 109.A O no hydrogen 2.898 N/A VAL 113.A N LEU 108.A O no hydrogen 2.987 N/A VAL 114.A N LYS 144.A O no hydrogen 2.987 N/A HIS 115.A N ASP 169.A OD2 no hydrogen 3.178 N/A ARG 116.A N ASP 169.A OD1 no hydrogen 2.955 N/A ASP 117.A N HIS 115.A ND1 no hydrogen 3.046 N/A LYS 119.A N ASP 117.A O no hydrogen 2.777 N/A ASN 122.A N LYS 119.A O no hydrogen 2.750 N/A ASN 122.A ND2 ASP 117.A O no hydrogen 2.646 N/A ASN 122.A ND2 ASP 117.A OD2 no hydrogen 3.112 N/A ILE 123.A N PRO 120.A O no hydrogen 3.004 N/A LEU 124.A N ARG 136.A O no hydrogen 2.923 N/A TYR 125.A N GLY 77.A O no hydrogen 2.908 N/A VAL 126.A N CYS 134.A O no hydrogen 2.906 N/A SER 129.A N ASP 127.A OD1 no hydrogen 2.878 N/A SER 129.A OG ASP 127.A OD1 no hydrogen 2.671 N/A ASN 131.A N SER 129.A OG no hydrogen 3.115 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.770 N/A CYS 134.A N ASN 131.A O no hydrogen 2.920 N/A CYS 134.A SG ASP 127.A OD1 no hydrogen 3.570 N/A CYS 134.A SG ASP 127.A OD2 no hydrogen 3.712 N/A CYS 134.A SG SER 129.A OG no hydrogen 3.608 N/A LEU 135.A N PRO 132.A O no hydrogen 2.947 N/A ARG 136.A N LEU 124.A O no hydrogen 2.721 N/A ARG 136.A NE GLU 72.A OE2 no hydrogen 2.970 N/A ARG 136.A NH1 GLU 133.A O no hydrogen 3.047 N/A ARG 136.A NH1 LEU 135.A O no hydrogen 3.063 N/A ILE 137.A N ASN 53.A O no hydrogen 2.886 N/A CYS 138.A N ASN 122.A O no hydrogen 2.922 N/A CYS 138.A SG ARG 136.A O no hydrogen 3.600 N/A LYS 144.A N VAL 114.A O no hydrogen 2.744 N/A GLN 145.A N GLU 40.A OE2.A no hydrogen 2.701 N/A GLN 145.A NE2 TYR 48.A OH no hydrogen 3.128 N/A LEU 146.A N GLY 112.A O no hydrogen 2.658 N/A ARG 147.A NH2 GLU 40.A OE1.B no hydrogen 3.135 N/A ARG 147.A NH2 GLU 40.A OE2.B no hydrogen 2.732 N/A ARG 147.A NH2 GLU 43.A OE1 no hydrogen 2.611 N/A ALA 148.A N LEU 152.A O no hydrogen 2.763 N/A GLY 151.A N ALA 148.A O no hydrogen 3.024 N/A LEU 152.A N ASN 150.A OD1 no hydrogen 3.139 N/A MET 154.A N LEU 146.A O no hydrogen 3.026 N/A THR 159.A N THR 155.A O no hydrogen 3.191 N/A THR 159.A OG1 THR 155.A O no hydrogen 3.379 N/A TYR 164.A N LYS 160.A O no hydrogen 3.108 N/A ASP 165.A N ARG 161.A O no hydrogen 2.718 N/A GLU 166.A N GLN 162.A O no hydrogen 2.591 N/A GLY 167.A N GLY 163.A O no hydrogen 3.306 N/A CYS 168.A N TYR 164.A O no hydrogen 3.204 N/A CYS 168.A N ASP 165.A O no hydrogen 3.103 N/A CYS 168.A SG TYR 164.A O no hydrogen 3.308 N/A ASP 169.A N ASP 165.A O no hydrogen 3.267 N/A ILE 170.A N GLU 166.A O no hydrogen 2.972 N/A TRP 171.A N GLY 167.A O no hydrogen 2.927 N/A SER 172.A N CYS 168.A O no hydrogen 3.011 N/A SER 172.A OG CYS 168.A O no hydrogen 3.368 N/A SER 172.A OG TYR 275.A OH no hydrogen 2.891 N/A LEU 173.A N ASP 169.A O no hydrogen 3.042 N/A GLY 174.A N ILE 170.A O no hydrogen 2.761 N/A ILE 175.A N TRP 171.A O no hydrogen 2.992 N/A ILE 175.A N SER 172.A O no hydrogen 3.244 N/A LEU 176.A N SER 172.A O no hydrogen 3.141 N/A LEU 177.A N LEU 173.A O no hydrogen 2.860 N/A TYR 178.A N GLY 174.A O no hydrogen 2.860 N/A TYR 178.A OH THR 208.A O no hydrogen 2.595 N/A THR 179.A N ILE 175.A O no hydrogen 2.944 N/A THR 179.A OG1 ILE 175.A O no hydrogen 2.850 N/A MET 180.A N LEU 176.A O no hydrogen 2.962 N/A LEU 181.A N LEU 177.A O no hydrogen 3.074 N/A ALA 182.A N TYR 178.A O no hydrogen 2.845 N/A GLY 183.A N THR 179.A O no hydrogen 2.716 N/A THR 185.A OG1 ALA 188.A O no hydrogen 2.881 N/A ASN 189.A N ASP 193.A OD2 no hydrogen 2.888 N/A ASP 193.A N GLY 190.A O no hydrogen 3.333 N/A THR 194.A N GLU 197.A OE1 no hydrogen 2.941 N/A THR 194.A OG1 GLU 196.A OE1 no hydrogen 3.555 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.833 N/A GLU 197.A N THR 194.A OG1 no hydrogen 3.194 N/A ILE 198.A N THR 194.A O no hydrogen 3.017 N/A LEU 199.A N PRO 195.A O no hydrogen 2.878 N/A THR 200.A N GLU 196.A O no hydrogen 3.241 N/A THR 200.A OG1 GLU 196.A O no hydrogen 2.589 N/A ARG 201.A N GLU 197.A O no hydrogen 3.278 N/A ARG 201.A NH1 PHE 187.A O no hydrogen 2.978 N/A ARG 201.A NH1 ASP 193.A OD2 no hydrogen 2.822 N/A ILE 202.A N ILE 198.A O no hydrogen 2.926 N/A GLY 203.A N LEU 199.A O no hydrogen 2.735 N/A SER 204.A N THR 200.A O no hydrogen 2.957 N/A SER 204.A OG ARG 201.A O no hydrogen 2.732 N/A GLY 205.A N ILE 202.A O no hydrogen 3.013 N/A LYS 206.A N SER 204.A OG no hydrogen 3.151 N/A SER 210.A OG.A LEU 209.A O no hydrogen 2.789 N/A GLY 211.A N ASN 215.A OD1 no hydrogen 3.106 N/A ASN 213.A ND2 ALA 182.A O no hydrogen 3.360 N/A TRP 214.A N GLY 211.A O no hydrogen 3.135 N/A TRP 214.A NE1 TYR 184.A OH no hydrogen 2.906 N/A ASN 215.A N GLY 212.A O no hydrogen 3.242 N/A THR 216.A N ASN 213.A O no hydrogen 2.825 N/A THR 216.A OG1 ASN 213.A O no hydrogen 3.124 N/A VAL 217.A N TRP 214.A O no hydrogen 3.349 N/A SER 218.A N GLU 91.A OE1 no hydrogen 2.728 N/A SER 218.A OG GLU 91.A OE1 no hydrogen 3.324 N/A SER 218.A OG GLU 91.A OE2 no hydrogen 2.510 N/A ALA 221.A N SER 218.A O no hydrogen 3.119 N/A LYS 222.A N SER 218.A O no hydrogen 3.249 N/A LYS 222.A NZ TRP 214.A O no hydrogen 2.813 N/A ASP 223.A N GLU 219.A O no hydrogen 2.848 N/A LEU 224.A N THR 220.A O no hydrogen 3.133 N/A VAL 225.A N ALA 221.A O no hydrogen 2.937 N/A SER 226.A N LYS 222.A O no hydrogen 3.022 N/A SER 226.A OG LYS 222.A O no hydrogen 3.380 N/A SER 226.A OG ASP 223.A O no hydrogen 2.986 N/A LYS 227.A N ASP 223.A O no hydrogen 3.319 N/A LYS 227.A N LEU 224.A O no hydrogen 3.107 N/A LYS 227.A NZ ASP 223.A OD1 no hydrogen 3.371 N/A LYS 227.A NZ ASP 223.A OD2 no hydrogen 3.153 N/A MET 228.A N LEU 224.A O no hydrogen 3.001 N/A LEU 229.A N VAL 225.A O no hydrogen 3.008 N/A ASP 232.A N HIS 230.A ND1 no hydrogen 3.336 N/A HIS 234.A N ASP 232.A OD1 no hydrogen 3.128 N/A GLN 235.A N ASP 232.A O no hydrogen 2.682 N/A ARG 236.A NE HIS 230.A O no hydrogen 2.861 N/A ARG 236.A NH1 GLY 167.A O no hydrogen 3.000 N/A ARG 236.A NH2 HIS 230.A O no hydrogen 3.525 N/A LEU 237.A N LYS 227.A O no hydrogen 3.401 N/A THR 238.A N GLN 241.A OE1 no hydrogen 2.963 N/A THR 238.A OG1 GLN 241.A OE1 no hydrogen 3.360 N/A GLN 241.A N THR 238.A OG1 no hydrogen 2.967 N/A VAL 242.A N THR 238.A O no hydrogen 3.049 N/A VAL 242.A N ALA 239.A O no hydrogen 2.929 N/A LEU 243.A N ALA 239.A O no hydrogen 3.028 N/A GLN 244.A N GLN 241.A O no hydrogen 3.312 N/A HIS 245.A N VAL 242.A O no hydrogen 3.023 N/A HIS 245.A NE2 ASP 223.A OD2 no hydrogen 2.733 N/A TRP 247.A N HIS 245.A ND1 no hydrogen 3.062 N/A TRP 247.A NE1 GLU 91.A OE2 no hydrogen 2.789 N/A VAL 248.A N HIS 245.A O no hydrogen 2.802 N/A THR 249.A N HIS 245.A O no hydrogen 3.008 N/A THR 249.A OG1 HIS 245.A O no hydrogen 3.359 N/A GLN 250.A N PRO 246.A O no hydrogen 3.027 N/A LYS 251.A NZ HIS 99.A ND1 no hydrogen 3.361 N/A LYS 251.A NZ VAL 248.A O no hydrogen 2.686 N/A LYS 253.A N GLN 250.A O no hydrogen 2.989 N/A LEU 254.A N.A LYS 251.A O no hydrogen 3.068 N/A LEU 254.A N.B LYS 251.A O no hydrogen 3.084 N/A GLN 258.A NE2 LEU 259.A O no hydrogen 3.184 N/A LEU 259.A N PHE 89.A O no hydrogen 2.794 N/A GLN 262.A N GLY 183.A O no hydrogen 2.958 N/A LEU 266.A N ASP 263.A OD2 no hydrogen 3.202 N/A VAL 267.A N ASP 263.A O no hydrogen 3.166 N/A LYS 268.A N LEU 264.A O no hydrogen 3.034 N/A LYS 268.A NZ GLU 78.A OE1 no hydrogen 3.421 N/A LYS 268.A NZ ASP 81.A OD1 no hydrogen 2.830 N/A LYS 268.A NZ ASP 81.A OD2 no hydrogen 3.494 N/A GLY 269.A N GLN 265.A O no hydrogen 2.941 N/A ALA 270.A N LEU 266.A O no hydrogen 2.881 N/A MET 271.A N VAL 267.A O no hydrogen 2.958 N/A ALA 272.A N LYS 268.A O no hydrogen 2.938 N/A ALA 273.A N GLY 269.A O no hydrogen 3.003 N/A THR 274.A N ALA 270.A O no hydrogen 3.056 N/A THR 274.A OG1 ALA 270.A O no hydrogen 2.587 N/A TYR 275.A N MET 271.A O no hydrogen 3.226 N/A TYR 275.A OH SER 172.A OG no hydrogen 2.891 N/A SER 276.A N ALA 272.A O no hydrogen 2.863 N/A ALA 277.A N ALA 273.A O no hydrogen 2.949 N/A LEU 278.A N THR 274.A O no hydrogen 3.172 N/A ASN 279.A N TYR 275.A O no hydrogen 2.908 N/A SER 280.A N SER 276.A O no hydrogen 3.079 N/A SER 280.A OG SER 276.A O no hydrogen 3.097 N/A SER 281.A N ALA 277.A O no hydrogen 3.328 N/A