Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wep_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N PRO 31.A O no hydrogen 2.677 N/A LYS 5.A N ASP 54.A OD2 no hydrogen 2.766 N/A VAL 6.A N VAL 33.A O no hydrogen 2.974 N/A GLY 7.A N ILE 55.A O no hydrogen 2.872 N/A SER 8.A OG LYS 9.A O no hydrogen 3.411 N/A SER 8.A OG GLY 14.A O no hydrogen 2.815 N/A LYS 9.A NZ THR 41.A OG1 no hydrogen 2.711 N/A LYS 9.A NZ GLU 58.A OE1 no hydrogen 2.767 N/A LYS 9.A NZ GLU 58.A OE2 no hydrogen 3.543 N/A ILE 10.A N GLY 39.A O no hydrogen 3.186 N/A GLY 14.A N ASP 11.A OD1 no hydrogen 2.839 N/A ALA 15.A N ASP 11.A O no hydrogen 2.907 N/A LEU 16.A N THR 12.A O no hydrogen 2.967 N/A LEU 17.A N GLU 13.A O no hydrogen 2.820 N/A GLY 18.A N GLY 14.A O no hydrogen 2.841 N/A ASN 19.A N ALA 15.A O no hydrogen 3.163 N/A ASN 19.A ND2 ALA 15.A O no hydrogen 2.801 N/A ILE 20.A N LEU 16.A O no hydrogen 2.991 N/A ILE 21.A N LEU 17.A O no hydrogen 3.020 N/A LEU 22.A N GLY 18.A O no hydrogen 2.949 N/A GLN 23.A N ASN 19.A O no hydrogen 2.920 N/A GLN 23.A NE2 LYS 268.A O no hydrogen 2.936 N/A VAL 24.A N ILE 20.A O no hydrogen 2.990 N/A LEU 25.A N ILE 21.A O no hydrogen 3.100 N/A GLU 26.A N LEU 22.A O no hydrogen 2.888 N/A SER 27.A N GLN 23.A O no hydrogen 2.965 N/A SER 27.A OG GLN 23.A O no hydrogen 3.481 N/A SER 27.A OG VAL 24.A O no hydrogen 2.659 N/A HIS 28.A N LEU 25.A O no hydrogen 3.082 N/A GLY 29.A N GLU 26.A O no hydrogen 2.952 N/A VAL 30.A N LEU 25.A O no hydrogen 3.105 N/A THR 32.A OG1 GLU 26.A OE2 no hydrogen 3.563 N/A VAL 33.A N VAL 4.A O no hydrogen 2.853 N/A LYS 35.A N VAL 6.A O no hydrogen 2.744 N/A LYS 35.A NZ GLU 52.A O no hydrogen 2.861 N/A LYS 35.A NZ GLU 52.A OE1 no hydrogen 3.342 N/A VAL 36.A N ASN 34.A OD1 no hydrogen 3.007 N/A GLN 37.A N SER 8.A OG no hydrogen 2.926 N/A GLN 37.A NE2 ILE 10.A O no hydrogen 2.806 N/A LEU 38.A N SER 8.A O no hydrogen 2.913 N/A VAL 44.A N THR 40.A O no hydrogen 3.015 N/A ARG 45.A N THR 41.A O no hydrogen 2.886 N/A ARG 45.A NH1 ASP 89.A OD1 no hydrogen 3.480 N/A ARG 45.A NH1 ASP 89.A OD2 no hydrogen 2.792 N/A ARG 45.A NH2 ASP 89.A OD1 no hydrogen 2.695 N/A ARG 45.A NH2 ASP 89.A OD2 no hydrogen 3.389 N/A GLY 46.A N PRO 42.A O no hydrogen 2.873 N/A ALA 47.A N VAL 43.A O no hydrogen 2.915 N/A ILE 48.A N VAL 44.A O no hydrogen 2.934 N/A THR 49.A N ARG 45.A O no hydrogen 3.171 N/A THR 49.A OG1 ARG 45.A O no hydrogen 2.793 N/A THR 49.A OG1 GLY 46.A O no hydrogen 3.240 N/A SER 50.A N ALA 47.A O no hydrogen 3.257 N/A SER 50.A OG.A GLY 46.A O no hydrogen 2.776 N/A SER 50.A OG.B GLY 46.A O no hydrogen 2.888 N/A SER 50.A OG.B ALA 47.A O no hydrogen 3.042 N/A LEU 53.A N ALA 47.A O no hydrogen 3.088 N/A ASP 54.A N LYS 5.A O no hydrogen 2.804 N/A ILE 55.A N LYS 5.A O no hydrogen 3.188 N/A TYR 56.A N VAL 225.A O no hydrogen 3.186 N/A TYR 56.A OH GLU 58.A OE2 no hydrogen 2.585 N/A GLU 58.A N ALA 223.A O no hydrogen 2.927 N/A TYR 59.A N GLU 58.A OE1 no hydrogen 2.795 N/A TYR 59.A OH GLU 13.A OE2 no hydrogen 2.568 N/A THR 60.A N ALA 221.A O no hydrogen 2.936 N/A THR 60.A OG1 ILE 219.A O no hydrogen 3.254 N/A ASN 62.A N TYR 59.A O no hydrogen 2.955 N/A ASN 62.A ND2 GLU 58.A OE1 no hydrogen 2.893 N/A GLY 63.A N THR 60.A O no hydrogen 2.898 N/A ALA 64.A N GLY 61.A O no hydrogen 3.078 N/A PHE 65.A N ASN 62.A O no hydrogen 2.954 N/A PHE 66.A N ASN 62.A O no hydrogen 3.045 N/A PHE 67.A N GLY 63.A O no hydrogen 3.052 N/A LYS 68.A N PHE 65.A O no hydrogen 3.369 N/A ASP 69.A N ALA 64.A O no hydrogen 2.887 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.791 N/A ASP 72.A N ASP 69.A O no hydrogen 3.250 N/A ALA 74.A N ASP 72.A OD1 no hydrogen 2.992 N/A TRP 75.A N ASP 72.A O no hydrogen 3.311 N/A TRP 75.A NE1 ASP 69.A O no hydrogen 2.973 N/A LYS 76.A N ALA 73.A O no hydrogen 3.030 N/A ASN 77.A N ALA 74.A O no hydrogen 3.135 N/A GLN 79.A NE2 GLU 83.A OE2 no hydrogen 3.440 N/A GLN 80.A N ASN 77.A OD1 no hydrogen 2.869 N/A GLY 81.A N ASN 77.A O no hydrogen 2.906 N/A TYR 82.A N ALA 78.A O no hydrogen 3.188 N/A TYR 82.A OH TRP 97.A O no hydrogen 3.057 N/A TYR 82.A OH LEU 98.A O no hydrogen 2.883 N/A GLU 83.A N GLN 79.A O no hydrogen 2.955 N/A LYS 84.A N GLN 80.A O no hydrogen 2.952 N/A LYS 84.A NZ ASP 69.A OD2 no hydrogen 3.054 N/A LYS 84.A NZ ASP 72.A OD2 no hydrogen 2.335 N/A VAL 85.A N GLY 81.A O no hydrogen 3.057 N/A LYS 86.A N TYR 82.A O no hydrogen 2.929 N/A LYS 86.A NZ TRP 97.A O no hydrogen 2.740 N/A LYS 87.A N GLU 83.A O no hydrogen 3.015 N/A LYS 87.A NZ GLU 91.A OE2.A no hydrogen 2.303 N/A LYS 87.A NZ GLU 91.A OE2.B no hydrogen 3.490 N/A LEU 88.A N LYS 84.A O no hydrogen 3.049 N/A ASP 89.A N VAL 85.A O no hydrogen 2.897 N/A SER 90.A N LYS 86.A O no hydrogen 3.188 N/A GLU 91.A N LYS 87.A O no hydrogen 3.141 N/A HIS 92.A N LEU 88.A O no hydrogen 2.966 N/A ASN 93.A N ASP 89.A O no hydrogen 2.967 N/A ASN 93.A ND2 ASP 89.A OD1 no hydrogen 2.887 N/A LYS 94.A N SER 90.A O no hydrogen 3.113 N/A LYS 94.A NZ GLU 228.A OE1 no hydrogen 3.470 N/A LEU 95.A N ASP 89.A O no hydrogen 3.087 N/A ILE 96.A N VAL 226.A O no hydrogen 2.720 N/A TRP 97.A NE1 ASP 89.A OD2 no hydrogen 2.800 N/A LEU 98.A N PRO 224.A O no hydrogen 2.867 N/A ALA 101.A N PRO 222.A O no hydrogen 2.827 N/A ASN 105.A N TYR 220.A O no hydrogen 2.823 N/A ASN 105.A ND2 GLU 13.A OE2 no hydrogen 3.011 N/A THR 106.A N ASN 104.A O no hydrogen 2.983 N/A THR 106.A OG1 PRO 218.A O no hydrogen 3.035 N/A THR 108.A N ALA 195.A O no hydrogen 2.841 N/A THR 108.A OG1 LEU 210.A O no hydrogen 2.811 N/A ILE 109.A N THR 108.A OG1 no hydrogen 2.697 N/A ALA 110.A N ALA 193.A O no hydrogen 2.822 N/A VAL 111.A N GLN 208.A O no hydrogen 2.835 N/A ARG 112.A N ASN 191.A O no hydrogen 3.030 N/A ARG 112.A NE ASP 114.A OD1 no hydrogen 3.183 N/A ARG 112.A NH1 ALA 183.A O no hydrogen 3.063 N/A ARG 112.A NH1 ALA 184.A O no hydrogen 2.943 N/A ARG 112.A NH2 ASP 114.A OD2 no hydrogen 3.063 N/A GLN 113.A N GLY 206.A O no hydrogen 3.035 N/A VAL 115.A N ASP 114.A OD1 no hydrogen 2.761 N/A ALA 116.A N ARG 112.A O no hydrogen 2.916 N/A GLU 117.A N GLN 113.A O no hydrogen 2.899 N/A LYS 118.A N ASP 114.A O no hydrogen 3.018 N/A ASN 119.A N VAL 115.A O no hydrogen 3.077 N/A ASN 119.A ND2 VAL 115.A O no hydrogen 2.966 N/A LYS 120.A N GLU 117.A O no hydrogen 3.356 N/A LEU 121.A N ALA 116.A O no hydrogen 2.801 N/A THR 122.A N ASP 126.A OD2 no hydrogen 2.888 N/A SER 123.A N ASP 126.A OD2 no hydrogen 3.004 N/A LEU 124.A N SER 211.A O no hydrogen 2.966 N/A ASP 126.A N SER 123.A OG no hydrogen 3.091 N/A LEU 127.A N SER 123.A O no hydrogen 3.078 N/A SER 128.A N LEU 124.A O no hydrogen 2.961 N/A SER 128.A OG TYR 159.A O no hydrogen 2.661 N/A SER 128.A OG GLY 160.A O no hydrogen 3.147 N/A ARG 129.A N ALA 125.A O no hydrogen 3.043 N/A TYR 130.A N ASP 126.A O no hydrogen 2.958 N/A TYR 130.A OH THR 136.A O no hydrogen 2.591 N/A LEU 131.A N LEU 127.A O no hydrogen 2.889 N/A GLN 132.A N SER 128.A O no hydrogen 3.055 N/A GLU 133.A N ARG 129.A O no hydrogen 3.040 N/A GLU 133.A N TYR 130.A O no hydrogen 3.145 N/A GLY 134.A N LEU 131.A O no hydrogen 2.936 N/A GLY 135.A N TYR 130.A O no hydrogen 2.853 N/A LYS 138.A N ASN 191.A OD1 no hydrogen 2.994 N/A LYS 138.A NZ SER 188.A O no hydrogen 2.816 N/A LEU 139.A N GLN 167.A O no hydrogen 2.836 N/A ALA 140.A N ALA 192.A O no hydrogen 2.873 N/A ALA 141.A N LEU 169.A O no hydrogen 3.011 N/A ALA 143.A N LEU 171.A O no hydrogen 3.370 N/A PHE 145.A N SER 142.A OG no hydrogen 3.102 N/A ILE 146.A N SER 142.A O no hydrogen 3.104 N/A GLU 147.A N ALA 143.A O no hydrogen 2.989 N/A GLU 147.A N GLU 144.A O no hydrogen 3.260 N/A ARG 148.A N GLU 144.A O no hydrogen 2.807 N/A ARG 148.A NE ASP 150.A OD1 no hydrogen 2.984 N/A ARG 148.A NH1 ASP 150.A OD1 no hydrogen 3.110 N/A ARG 148.A NH1 ASP 150.A OD2 no hydrogen 3.077 N/A ARG 148.A NH2 GLU 144.A OE2 no hydrogen 3.351 N/A ALA 151.A N ARG 148.A O no hydrogen 2.901 N/A LEU 152.A N PHE 145.A O no hydrogen 2.918 N/A ALA 154.A N ALA 151.A O no hydrogen 2.992 N/A PHE 155.A N ALA 151.A O no hydrogen 3.194 N/A GLU 156.A N LEU 152.A O no hydrogen 2.851 N/A LYS 157.A N PRO 153.A O no hydrogen 2.946 N/A ALA 158.A N ALA 154.A O no hydrogen 3.021 N/A TYR 159.A N PHE 155.A O no hydrogen 2.936 N/A TYR 159.A OH ASP 212.A OD1 no hydrogen 2.566 N/A GLY 160.A N GLU 156.A O no hydrogen 2.899 N/A PHE 161.A N GLU 156.A O no hydrogen 3.051 N/A LEU 163.A N GLU 156.A OE2 no hydrogen 3.021 N/A GLY 164.A N GLN 167.A OE1 no hydrogen 2.973 N/A GLN 167.A N GLY 164.A O no hydrogen 2.854 N/A LEU 168.A N GLN 165.A O no hydrogen 3.295 N/A LEU 169.A N LEU 139.A O no hydrogen 2.814 N/A LEU 171.A N ALA 141.A O no hydrogen 2.794 N/A THR 176.A OG1 ASP 199.A OD1 no hydrogen 3.506 N/A THR 176.A OG1 ASP 199.A OD2 no hydrogen 2.776 N/A ALA 177.A N ASP 175.A OD1 no hydrogen 3.044 N/A VAL 178.A N ASP 175.A O no hydrogen 3.030 N/A THR 179.A N ASP 175.A O no hydrogen 3.206 N/A THR 179.A OG1 THR 176.A O no hydrogen 3.114 N/A THR 179.A OG1 MET 194.A O no hydrogen 2.775 N/A ILE 180.A N THR 176.A O no hydrogen 2.852 N/A LYS 181.A N ALA 177.A O no hydrogen 3.036 N/A ALA 182.A N VAL 178.A O no hydrogen 3.090 N/A ALA 183.A N THR 179.A O no hydrogen 3.275 N/A ALA 184.A N ILE 180.A O no hydrogen 2.889 N/A GLN 185.A N LYS 181.A O no hydrogen 3.054 N/A GLN 186.A N ALA 183.A O no hydrogen 3.252 N/A THR 187.A N ALA 182.A O no hydrogen 2.891 N/A GLY 189.A N GLN 186.A O no hydrogen 3.009 N/A VAL 190.A N THR 187.A O no hydrogen 2.934 N/A ASN 191.A N LYS 138.A O no hydrogen 2.966 N/A ASN 191.A ND2 THR 136.A O no hydrogen 3.086 N/A ALA 192.A N LYS 138.A O no hydrogen 3.174 N/A ALA 193.A N ALA 110.A O no hydrogen 2.738 N/A MET 194.A N ALA 140.A O no hydrogen 2.866 N/A ALA 195.A N THR 108.A O no hydrogen 3.098 N/A TYR 196.A N ASP 199.A OD2 no hydrogen 2.824 N/A GLY 197.A N THR 106.A O no hydrogen 2.850 N/A THR 198.A OG1 GLU 13.A OE1 no hydrogen 2.677 N/A ASP 199.A N TYR 196.A O no hydrogen 3.062 N/A VAL 202.A N ASP 199.A O no hydrogen 3.126 N/A ALA 203.A N GLY 200.A O no hydrogen 3.014 N/A ALA 204.A N GLY 200.A O no hydrogen 3.207 N/A LEU 205.A N PRO 201.A O no hydrogen 2.901 N/A GLY 206.A N ALA 203.A O no hydrogen 3.452 N/A LEU 207.A N VAL 202.A O no hydrogen 2.898 N/A GLN 208.A N VAL 111.A O no hydrogen 2.766 N/A GLN 208.A NE2 LEU 121.A O no hydrogen 2.935 N/A GLN 208.A NE2 THR 209.A O no hydrogen 3.209 N/A LEU 210.A N ILE 109.A O no hydrogen 2.914 N/A SER 211.A N THR 122.A O no hydrogen 2.949 N/A SER 211.A OG THR 122.A O no hydrogen 3.546 N/A GLN 214.A N TYR 159.A OH no hydrogen 2.946 N/A GLY 215.A N ASP 212.A O no hydrogen 2.979 N/A VAL 216.A N ASP 212.A OD1 no hydrogen 3.090 N/A GLN 217.A N ASP 212.A OD2 no hydrogen 3.053 N/A GLN 217.A NE2 ASP 150.A O no hydrogen 2.912 N/A ILE 219.A N TRP 75.A O no hydrogen 2.920 N/A TYR 220.A N ASN 104.A OD1 no hydrogen 3.005 N/A ALA 221.A N THR 60.A OG1 no hydrogen 3.138 N/A ALA 223.A N GLU 58.A O no hydrogen 2.808 N/A VAL 225.A N TYR 56.A O no hydrogen 2.875 N/A VAL 226.A N ILE 96.A O no hydrogen 2.924 N/A ARG 227.A N ASP 54.A O no hydrogen 2.948 N/A ARG 227.A NH1 ASP 54.A OD1 no hydrogen 2.945 N/A GLU 228.A N LYS 94.A O no hydrogen 2.984 N/A VAL 230.A N ARG 227.A O no hydrogen 2.982 N/A LEU 231.A N ARG 227.A O no hydrogen 3.050 N/A ARG 232.A N GLU 228.A O no hydrogen 2.751 N/A GLU 233.A N VAL 230.A O no hydrogen 3.091 N/A TYR 234.A N VAL 230.A O no hydrogen 3.084 N/A MET 237.A N TYR 234.A O no hydrogen 3.114 N/A ALA 238.A N PRO 235.A O no hydrogen 3.457 N/A TRP 240.A N GLN 236.A O no hydrogen 3.120 N/A LEU 241.A N MET 237.A O no hydrogen 3.084 N/A PHE 245.A N LEU 241.A O no hydrogen 3.050 N/A ALA 246.A N GLN 242.A O no hydrogen 2.983 N/A SER 247.A N PRO 243.A O no hydrogen 3.248 N/A SER 247.A N VAL 244.A O no hydrogen 3.199 N/A SER 247.A OG VAL 244.A O no hydrogen 2.706 N/A SER 247.A OG TYR 274.A OH no hydrogen 2.671 N/A LEU 248.A N PHE 245.A O no hydrogen 3.101 N/A ASP 249.A N SER 247.A O no hydrogen 3.035 N/A THR 252.A N ASP 249.A OD1.A no hydrogen 3.134 N/A THR 252.A N ASP 249.A OD1.B no hydrogen 3.043 N/A THR 252.A OG1 ASP 249.A OD1.A no hydrogen 3.289 N/A THR 252.A OG1 ASP 249.A OD1.B no hydrogen 2.670 N/A THR 252.A OG1 ASP 249.A OD2.A no hydrogen 2.640 N/A LEU 253.A N ASP 249.A O no hydrogen 2.987 N/A GLN 254.A N ALA 250.A O no hydrogen 2.799 N/A GLN 254.A NE2 GLY 197.A O no hydrogen 2.857 N/A GLN 254.A NE2 THR 209.A OG1 no hydrogen 2.931 N/A GLN 255.A N LYS 251.A O no hydrogen 2.963 N/A LEU 256.A N THR 252.A O no hydrogen 2.982 N/A ASN 257.A N LEU 253.A O no hydrogen 2.811 N/A ASN 257.A ND2 GLU 13.A OE1 no hydrogen 3.027 N/A ASN 257.A ND2 THR 198.A O no hydrogen 2.913 N/A ALA 258.A N GLN 254.A O no hydrogen 2.806 N/A SER 259.A N GLN 255.A O no hydrogen 3.075 N/A SER 259.A OG GLN 255.A O no hydrogen 3.198 N/A ILE 260.A N LEU 256.A O no hydrogen 3.328 N/A ALA 261.A N ASN 257.A O no hydrogen 2.791 N/A VAL 262.A N ALA 258.A O no hydrogen 2.950 N/A GLU 263.A N ALA 258.A O no hydrogen 3.231 N/A GLY 264.A N ILE 260.A O no hydrogen 3.141 N/A LEU 265.A N SER 259.A O no hydrogen 2.919 N/A LYS 268.A N ASP 266.A OD1 no hydrogen 2.899 N/A VAL 270.A N ASP 266.A O no hydrogen 2.833 N/A ALA 271.A N ALA 267.A O no hydrogen 2.957 N/A ALA 272.A N LYS 268.A O no hydrogen 3.013 N/A ASP 273.A N LYS 269.A O no hydrogen 2.859 N/A TYR 274.A N VAL 270.A O no hydrogen 3.140 N/A TYR 274.A OH SER 247.A OG no hydrogen 2.671 N/A LEU 275.A N ALA 271.A O no hydrogen 3.032 N/A LYS 276.A N ALA 272.A O no hydrogen 3.012 N/A GLN 277.A N ASP 273.A O no hydrogen 2.978 N/A LYS 278.A N TYR 274.A O no hydrogen 3.083 N/A LYS 278.A NZ TYR 274.A OH no hydrogen 2.806 N/A GLY 279.A N LYS 276.A O no hydrogen 3.046 N/A TRP 280.A N LEU 275.A O no hydrogen 2.840 N/A