Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wg6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ILE 11.A O no hydrogen 2.962 N/A LEU 5.A N ASN 9.A O no hydrogen 2.746 N/A SER 6.A OG GLY 200.A O no hydrogen 2.781 N/A ASN 7.A ND2 ASN 151.A OD1 no hydrogen 2.992 N/A GLY 8.A N LEU 5.A O no hydrogen 2.974 N/A ASN 9.A N ASN 7.A OD1 no hydrogen 3.058 N/A ASN 9.A ND2 ASN 151.A OD1 no hydrogen 2.953 N/A ILE 11.A N PHE 3.A O no hydrogen 2.964 N/A ALA 13.A N LYS 1.A O no hydrogen 3.006 N/A ALA 15.A N PRO 250.A O no hydrogen 3.188 N/A PHE 16.A N HIS 48.A O no hydrogen 2.755 N/A GLY 17.A N THR 252.A O no hydrogen 2.555 N/A THR 18.A N ASP 50.A O no hydrogen 2.915 N/A THR 18.A OG1 ASP 50.A O no hydrogen 2.792 N/A THR 18.A OG1 THR 57.A OG1 no hydrogen 3.200 N/A THR 20.A OG1 GLY 19.A O no hydrogen 2.820 N/A LYS 21.A NZ SER 255.A OG no hydrogen 3.327 N/A TYR 22.A N GLY 19.A O no hydrogen 2.912 N/A TYR 22.A OH THR 254.A O no hydrogen 2.764 N/A PHE 23.A N THR 20.A O no hydrogen 3.086 N/A LYS 24.A N TYR 55.A O no hydrogen 2.974 N/A LYS 24.A NZ ASP 29.A O no hydrogen 2.781 N/A LYS 24.A NZ GLY 56.A O no hydrogen 3.111 N/A LYS 24.A NZ GLU 60.A OE2 no hydrogen 2.892 N/A ASP 31.A N GLU 60.A OE2 no hydrogen 2.933 N/A LEU 34.A N ASP 31.A OD1 no hydrogen 3.133 N/A ILE 35.A N ASP 31.A O no hydrogen 3.123 N/A GLY 36.A N LYS 32.A O no hydrogen 3.156 N/A THR 37.A N GLN 33.A O no hydrogen 2.906 N/A THR 37.A OG1 GLN 33.A O no hydrogen 3.163 N/A LEU 38.A N LEU 34.A O no hydrogen 2.765 N/A GLU 39.A N ILE 35.A O no hydrogen 2.984 N/A LEU 40.A N GLY 36.A O no hydrogen 2.952 N/A ALA 41.A N THR 37.A O no hydrogen 2.768 N/A LEU 42.A N LEU 38.A O no hydrogen 2.941 N/A ARG 43.A N GLU 39.A O no hydrogen 2.857 N/A ARG 43.A NH1 GLU 39.A OE1 no hydrogen 2.807 N/A SER 44.A N LEU 40.A O no hydrogen 2.758 N/A SER 44.A OG LEU 40.A O no hydrogen 2.577 N/A GLY 45.A N ALA 41.A O no hydrogen 3.029 N/A GLY 45.A N LEU 42.A O no hydrogen 3.025 N/A PHE 46.A N ALA 41.A O no hydrogen 2.888 N/A ARG 47.A NH1 LEU 42.A O no hydrogen 2.995 N/A ARG 47.A NH1 PHE 46.A O no hydrogen 2.867 N/A HIS 48.A ND1 PRO 12.A O no hydrogen 3.011 N/A ILE 49.A N PHE 76.A O no hydrogen 3.001 N/A ASP 50.A N PHE 16.A O no hydrogen 2.812 N/A GLY 51.A N THR 78.A O no hydrogen 2.847 N/A GLU 53.A N LYS 80.A O no hydrogen 3.043 N/A TYR 55.A N ALA 52.A O no hydrogen 3.106 N/A GLY 56.A N GLU 53.A O no hydrogen 3.406 N/A THR 57.A OG1 THR 18.A O no hydrogen 2.800 N/A ASN 58.A ND2 ASP 79.A OD1 no hydrogen 3.229 N/A GLU 60.A N GLU 60.A OE1 no hydrogen 2.531 N/A ILE 61.A N THR 57.A O no hydrogen 3.083 N/A GLY 62.A N ASN 58.A O no hydrogen 3.091 N/A ILE 63.A N LYS 59.A O no hydrogen 2.977 N/A ALA 64.A N GLU 60.A O no hydrogen 3.032 N/A LEU 65.A N ILE 61.A O no hydrogen 2.931 N/A LYS 66.A N GLY 62.A O no hydrogen 2.890 N/A ASN 67.A N ILE 63.A O no hydrogen 2.795 N/A ASN 67.A ND2 GLU 39.A OE2 no hydrogen 2.708 N/A VAL 68.A N ALA 64.A O no hydrogen 3.034 N/A GLY 69.A N LEU 65.A O no hydrogen 2.917 N/A ARG 72.A NH1 ARG 72.A O no hydrogen 2.945 N/A ARG 72.A NH1 VAL 75.A O no hydrogen 3.044 N/A ARG 72.A NH1 ASP 115.A OD2 no hydrogen 3.121 N/A ARG 72.A NH2 TYR 113.A O no hydrogen 2.814 N/A ARG 72.A NH2 ASP 115.A OD2 no hydrogen 3.018 N/A ASP 74.A N ASN 71.A O no hydrogen 2.989 N/A VAL 75.A N ARG 72.A O no hydrogen 3.278 N/A PHE 76.A N ARG 47.A O no hydrogen 2.866 N/A ILE 77.A N ASP 115.A OD2 no hydrogen 2.694 N/A THR 78.A N ILE 49.A O no hydrogen 3.112 N/A ASP 79.A N LEU 116.A O no hydrogen 3.010 N/A LYS 80.A NZ ASP 50.A OD1 no hydrogen 3.283 N/A LYS 80.A NZ ASP 50.A OD2 no hydrogen 2.583 N/A LYS 80.A NZ GLY 51.A O no hydrogen 2.850 N/A LYS 80.A NZ TYR 55.A OH no hydrogen 2.991 N/A TYR 81.A N LEU 118.A O no hydrogen 2.789 N/A ASN 82.A N GLU 53.A OE1 no hydrogen 3.150 N/A SER 83.A OG PHE 121.A O no hydrogen 2.717 N/A THR 87.A N ASN 85.A OD1 no hydrogen 2.893 N/A THR 87.A OG1 ASN 85.A OD1 no hydrogen 2.460 N/A TYR 88.A N ASN 85.A O no hydrogen 3.175 N/A LYS 91.A N ASP 89.A OD1 no hydrogen 2.850 N/A LYS 91.A NZ HIS 92.A O no hydrogen 3.543 N/A SER 93.A N ASN 82.A O no hydrogen 2.802 N/A SER 93.A OG GLU 53.A OE1 no hydrogen 3.195 N/A SER 93.A OG GLU 53.A OE2 no hydrogen 2.811 N/A HIS 95.A N SER 93.A OG no hydrogen 3.265 N/A TYR 99.A OH GLU 146.A OE1 no hydrogen 2.429 N/A ALA 101.A N ASN 97.A O no hydrogen 3.041 N/A LEU 102.A N PRO 98.A O no hydrogen 2.854 N/A LYS 103.A N TYR 99.A O no hydrogen 3.136 N/A LYS 103.A NZ TYR 99.A OH no hydrogen 3.032 N/A ALA 104.A N ASN 100.A O no hydrogen 3.077 N/A ASP 105.A N ALA 101.A O no hydrogen 2.883 N/A LEU 106.A N LEU 102.A O no hydrogen 2.865 N/A GLU 107.A N LYS 103.A O no hydrogen 3.259 N/A ASP 108.A N ALA 104.A O no hydrogen 3.197 N/A LEU 109.A N ASP 105.A O no hydrogen 2.805 N/A GLY 110.A N GLU 107.A O no hydrogen 3.311 N/A LEU 111.A N LEU 106.A O no hydrogen 3.319 N/A VAL 114.A N LEU 148.A O no hydrogen 3.014 N/A ASP 115.A N ILE 77.A O no hydrogen 2.740 N/A LEU 116.A N ILE 77.A O no hydrogen 2.956 N/A TYR 117.A N ASN 151.A O no hydrogen 3.119 N/A TYR 117.A OH PRO 98.A O no hydrogen 3.110 N/A LEU 118.A N ASP 79.A O no hydrogen 2.990 N/A ILE 119.A N GLY 153.A O no hydrogen 3.007 N/A HIS 120.A N TYR 81.A O no hydrogen 3.263 N/A PHE 121.A N SER 83.A OG no hydrogen 2.918 N/A TYR 123.A OH GLU 294.A OE2 no hydrogen 2.383 N/A SER 125.A OG SER 128.A OG no hydrogen 2.713 N/A SER 128.A N SER 125.A O no hydrogen 3.228 N/A SER 128.A N SER 125.A OG no hydrogen 3.188 N/A SER 128.A OG SER 125.A O no hydrogen 3.292 N/A SER 128.A OG SER 125.A OG no hydrogen 2.713 N/A HIS 129.A N SER 125.A O no hydrogen 2.822 N/A GLY 130.A N GLU 126.A O no hydrogen 2.792 N/A ASP 132.A N GLU 135.A OE1 no hydrogen 3.273 N/A GLU 135.A N ASP 132.A OD2 no hydrogen 3.042 N/A ALA 136.A N ASP 132.A O no hydrogen 2.972 N/A TRP 137.A N LEU 133.A O no hydrogen 3.155 N/A TRP 137.A NE1 SER 172.A O no hydrogen 3.111 N/A ARG 138.A N VAL 134.A O no hydrogen 2.929 N/A ARG 138.A NH1 ASN 169.A O no hydrogen 3.094 N/A TYR 139.A N GLU 135.A O no hydrogen 3.085 N/A LEU 140.A N ALA 136.A O no hydrogen 3.161 N/A GLU 141.A N TRP 137.A O no hydrogen 2.810 N/A ARG 142.A N ARG 138.A O no hydrogen 2.970 N/A ALA 143.A N TYR 139.A O no hydrogen 2.999 N/A LYS 144.A N LEU 140.A O no hydrogen 2.993 N/A ASN 145.A N GLU 141.A O no hydrogen 3.023 N/A GLU 146.A N ARG 142.A O no hydrogen 2.962 N/A GLY 147.A N ALA 143.A O no hydrogen 3.073 N/A GLY 147.A N LYS 144.A O no hydrogen 3.138 N/A LEU 148.A N ALA 143.A O no hydrogen 2.842 N/A ALA 149.A N ALA 143.A O no hydrogen 3.439 N/A ARG 150.A N VAL 114.A O no hydrogen 3.033 N/A ASN 151.A N ASP 115.A O no hydrogen 2.964 N/A ASN 151.A ND2 ASP 115.A O no hydrogen 2.933 N/A GLY 153.A N TYR 117.A O no hydrogen 2.950 N/A VAL 154.A N VAL 176.A O no hydrogen 2.971 N/A SER 155.A OG ASN 156.A OD1 no hydrogen 3.373 N/A SER 155.A OG GLN 178.A O no hydrogen 2.555 N/A ASN 156.A N GLN 178.A O no hydrogen 2.913 N/A ASN 156.A ND2 TYR 206.A OH no hydrogen 2.551 N/A ASN 161.A N THR 158.A OG1 no hydrogen 3.014 N/A LEU 162.A N THR 158.A O no hydrogen 2.839 N/A LYS 163.A N ILE 159.A O no hydrogen 2.770 N/A LYS 163.A NZ TYR 195.A OH no hydrogen 2.969 N/A SER 164.A N GLU 160.A O no hydrogen 2.980 N/A SER 164.A OG GLU 160.A O no hydrogen 3.352 N/A ILE 165.A N LEU 162.A O no hydrogen 2.989 N/A LEU 166.A N LEU 162.A O no hydrogen 3.068 N/A ASP 167.A N LYS 163.A O no hydrogen 2.866 N/A ALA 168.A N ILE 165.A O no hydrogen 3.266 N/A THR 170.A OG1 GLU 141.A OE2 no hydrogen 2.546 N/A THR 170.A OG1 SER 172.A O no hydrogen 3.518 N/A SER 172.A N GLU 141.A OE2 no hydrogen 2.685 N/A SER 172.A OG GLU 141.A OE2 no hydrogen 3.497 N/A VAL 175.A N ILE 152.A O no hydrogen 3.026 N/A ASN 177.A N LEU 202.A O no hydrogen 3.026 N/A GLN 178.A N VAL 154.A O no hydrogen 2.947 N/A ILE 179.A N GLU 204.A O no hydrogen 2.900 N/A PHE 181.A N TYR 206.A O no hydrogen 2.910 N/A SER 182.A N LEU 185.A O no hydrogen 3.312 N/A TYR 184.A N SER 182.A OG no hydrogen 3.052 N/A LEU 185.A N SER 182.A O no hydrogen 2.782 N/A GLN 186.A NE2 THR 280.A O no hydrogen 3.597 N/A ILE 192.A N THR 189.A O no hydrogen 3.057 N/A VAL 193.A N ASP 187.A OD1 no hydrogen 3.009 N/A TYR 195.A N GLY 191.A O no hydrogen 2.836 N/A SER 196.A N ILE 192.A O no hydrogen 3.067 N/A SER 196.A OG ILE 192.A O no hydrogen 2.829 N/A GLN 197.A N VAL 193.A O no hydrogen 2.897 N/A GLN 197.A NE2 ARG 246.A O no hydrogen 3.253 N/A GLN 197.A NE2 GLY 247.A O no hydrogen 3.604 N/A GLN 198.A N GLU 194.A O no hydrogen 3.057 N/A GLN 199.A N TYR 195.A O no hydrogen 3.028 N/A GLY 200.A N GLN 197.A O no hydrogen 2.989 N/A ILE 201.A N SER 196.A O no hydrogen 2.877 N/A LEU 202.A N VAL 175.A O no hydrogen 2.900 N/A GLU 204.A N ASN 177.A O no hydrogen 3.204 N/A ALA 205.A N LEU 249.A O no hydrogen 2.738 N/A TYR 206.A N ILE 179.A O no hydrogen 2.756 N/A GLY 210.A N GLY 207.A O no hydrogen 3.123 N/A ILE 212.A N LEU 209.A O no hydrogen 2.850 N/A THR 213.A N LEU 209.A O no hydrogen 2.877 N/A THR 213.A OG1 LEU 209.A O no hydrogen 3.270 N/A THR 213.A OG1 GLY 210.A O no hydrogen 3.469 N/A GLN 214.A N GLY 210.A O no hydrogen 2.726 N/A GLY 218.A N ASP 221.A OD2 no hydrogen 2.865 N/A LEU 220.A N TYR 184.A OH no hydrogen 2.825 N/A ASP 221.A N GLY 218.A O no hydrogen 2.997 N/A LEU 224.A N LEU 220.A O no hydrogen 2.738 N/A SER 225.A N ASP 221.A O no hydrogen 2.943 N/A LYS 226.A N LYS 222.A O no hydrogen 3.302 N/A LEU 227.A N VAL 223.A O no hydrogen 3.046 N/A SER 228.A N LEU 224.A O no hydrogen 2.849 N/A SER 228.A OG ARG 233.A O no hydrogen 2.843 N/A GLU 229.A N SER 225.A O no hydrogen 3.257 N/A LYS 230.A N LYS 226.A O no hydrogen 3.186 N/A LYS 230.A NZ ASP 272.A OD2 no hydrogen 3.316 N/A TYR 231.A N LEU 227.A O no hydrogen 2.829 N/A TYR 231.A OH ASP 275.A OD2 no hydrogen 2.433 N/A LYS 232.A N SER 228.A O no hydrogen 2.966 N/A ARG 233.A N SER 228.A O no hydrogen 3.343 N/A ASN 234.A N GLN 237.A OE1 no hydrogen 2.917 N/A ASN 234.A ND2 ASP 262.A OD2 no hydrogen 3.072 N/A GLN 237.A N ASN 234.A OD1 no hydrogen 2.918 N/A GLN 237.A NE2 ASP 262.A O no hydrogen 2.969 N/A ILE 238.A N ASN 234.A O no hydrogen 3.142 N/A LEU 239.A N GLU 235.A O no hydrogen 2.985 N/A LEU 240.A N GLY 236.A O no hydrogen 3.047 N/A ARG 241.A N GLN 237.A O no hydrogen 2.983 N/A ARG 241.A NH1 ILE 266.A O no hydrogen 2.947 N/A TRP 242.A N ILE 238.A O no hydrogen 3.030 N/A TRP 242.A NE1 GLU 276.A O no hydrogen 3.124 N/A VAL 243.A N LEU 239.A O no hydrogen 2.979 N/A LEU 244.A N LEU 240.A O no hydrogen 3.180 N/A GLN 245.A N ARG 241.A O no hydrogen 2.913 N/A GLN 245.A NE2 LEU 271.A O no hydrogen 3.577 N/A ARG 246.A N TRP 242.A O no hydrogen 3.042 N/A ARG 246.A NE GLU 276.A OE1 no hydrogen 3.372 N/A GLY 247.A N LEU 244.A O no hydrogen 2.973 N/A ILE 248.A N VAL 243.A O no hydrogen 3.260 N/A LEU 249.A N ILE 203.A O no hydrogen 3.120 N/A ILE 251.A N ALA 205.A O no hydrogen 2.815 N/A THR 252.A N ALA 15.A O no hydrogen 3.102 N/A THR 253.A OG1 GLY 17.A O no hydrogen 2.697 N/A LYS 256.A N THR 254.A OG1 no hydrogen 2.966 N/A GLU 258.A N GLU 258.A OE1 no hydrogen 2.569 N/A ARG 259.A N LYS 256.A O no hydrogen 3.180 N/A ILE 260.A N LYS 256.A O no hydrogen 3.398 N/A ASP 262.A N GLU 258.A O no hydrogen 3.051 N/A VAL 263.A N ARG 259.A O no hydrogen 2.961 N/A LEU 264.A N ILE 260.A O no hydrogen 3.175 N/A GLU 265.A N ASN 261.A O no hydrogen 3.169 N/A GLU 265.A N ASP 262.A O no hydrogen 3.032 N/A ILE 266.A N VAL 263.A O no hydrogen 3.080 N/A ASP 268.A N GLU 265.A O no hydrogen 3.072 N/A ASP 272.A N TYR 231.A OH no hydrogen 2.946 N/A LYS 273.A NZ ASP 277.A OD1 no hydrogen 3.012 N/A LYS 273.A NZ ASP 277.A OD2 no hydrogen 3.048 N/A ASP 275.A N ASP 272.A O no hydrogen 2.848 N/A GLU 276.A N ASP 272.A O no hydrogen 2.932 N/A ASP 277.A N LYS 273.A O no hydrogen 2.818 N/A GLN 278.A N GLU 274.A O no hydrogen 3.140 N/A ILE 279.A N ASP 275.A O no hydrogen 3.138 N/A THR 280.A N GLU 276.A O no hydrogen 3.139 N/A THR 280.A OG1 ASP 277.A O no hydrogen 3.085 N/A LYS 281.A N ASP 277.A O no hydrogen 3.018 N/A VAL 282.A N GLN 278.A O no hydrogen 2.769 N/A GLY 283.A N ILE 279.A O no hydrogen 2.802 N/A LYS 284.A N LYS 281.A O no hydrogen 3.253 N/A GLU 285.A N VAL 282.A O no hydrogen 3.057 N/A LYS 286.A N GLY 283.A O no hydrogen 3.230 N/A LYS 286.A NZ GLY 215.A O no hydrogen 2.797 N/A LEU 288.A N TYR 184.A O no hydrogen 2.982 N/A ARG 289.A NE ASP 299.A OD1 no hydrogen 2.873 N/A ARG 289.A NE ASP 299.A OD2 no hydrogen 3.395 N/A ARG 289.A NH1 GLN 188.A O no hydrogen 2.839 N/A ARG 289.A NH2 GLN 188.A O no hydrogen 2.711 N/A ARG 289.A NH2 ASP 299.A OD2 no hydrogen 2.732 N/A GLN 290.A N GLU 180.A OE2 no hydrogen 2.648 N/A PHE 291.A N GLU 180.A OE1 no hydrogen 3.053 N/A GLU 294.A N GLU 294.A OE1 no hydrogen 2.753 N/A TYR 295.A N SER 292.A O no hydrogen 2.955 N/A TYR 295.A OH ASN 156.A O no hydrogen 2.579 N/A SER 296.A N LYS 293.A O no hydrogen 2.978 N/A SER 296.A OG LYS 293.A O no hydrogen 2.966 N/A TYR 298.A N TYR 295.A O no hydrogen 3.056 N/A ASP 299.A N SER 296.A O no hydrogen 2.698 N/A