Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wgb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N GLY 295.A O no hydrogen 2.700 N/A LEU 4.A N LEU 297.A O no hydrogen 2.773 N/A ARG 5.A N ASP 3.A OD1 no hydrogen 3.364 N/A ARG 5.A NE ASP 3.A OD1 no hydrogen 2.783 N/A ARG 5.A NE ASP 3.A OD2 no hydrogen 3.402 N/A ARG 5.A NH2 ASP 3.A OD2 no hydrogen 2.729 N/A SER 6.A OG THR 8.A OG1 no hydrogen 2.988 N/A THR 8.A N SER 6.A OG no hydrogen 3.099 N/A THR 8.A OG1 SER 6.A OG no hydrogen 2.988 N/A THR 10.A OG1 ASP 7.A O no hydrogen 3.369 N/A THR 10.A OG1 LYS 195.A O no hydrogen 2.757 N/A MET 16.A N THR 13.A OG1 no hydrogen 3.284 N/A ARG 17.A N THR 13.A O no hydrogen 2.764 N/A GLN 18.A N ASP 14.A O no hydrogen 2.991 N/A GLN 18.A NE2 HIS 22.A NE2 no hydrogen 3.104 N/A CYS 19.A N ALA 15.A O no hydrogen 3.190 N/A CYS 19.A SG.A GLN 234.A O no hydrogen 3.718 N/A MET 20.A N MET 16.A O no hydrogen 3.018 N/A LEU 21.A N ARG 17.A O no hydrogen 2.862 N/A LEU 21.A N GLN 18.A O no hydrogen 3.182 N/A HIS 22.A N GLN 18.A O no hydrogen 3.310 N/A GLY 26.A N ASP 33.A OD2 no hydrogen 3.205 N/A ASP 28.A N ARG 227.A O no hydrogen 2.827 N/A VAL 29.A N ASP 27.A OD1 no hydrogen 3.185 N/A TYR 30.A N ASP 27.A O no hydrogen 3.108 N/A GLY 31.A N ASP 28.A O no hydrogen 2.934 N/A GLU 32.A N ASP 27.A O no hydrogen 2.996 N/A VAL 36.A N ASP 33.A OD1 no hydrogen 2.874 N/A ASN 37.A N ASP 33.A O no hydrogen 2.924 N/A ASN 37.A ND2 GLY 31.A O no hydrogen 2.810 N/A ALA 38.A N PRO 34.A O no hydrogen 3.036 N/A LEU 39.A N GLY 35.A O no hydrogen 3.335 N/A GLU 40.A N VAL 36.A O no hydrogen 3.110 N/A ALA 41.A N ASN 37.A O no hydrogen 3.094 N/A TYR 42.A N ALA 38.A O no hydrogen 2.852 N/A GLY 43.A N LEU 39.A O no hydrogen 2.776 N/A ALA 44.A N GLU 40.A O no hydrogen 3.024 N/A ASP 45.A N ALA 41.A O no hydrogen 3.108 N/A LEU 46.A N TYR 42.A O no hydrogen 2.902 N/A LEU 47.A N GLY 43.A O no hydrogen 3.288 N/A GLY 48.A N ASP 45.A O no hydrogen 3.226 N/A LYS 49.A N ALA 44.A O no hydrogen 2.760 N/A LYS 49.A NZ VAL 183.A O no hydrogen 2.758 N/A LYS 49.A NZ PHE 186.A O no hydrogen 2.701 N/A ALA 51.A N GLY 207.A O no hydrogen 2.763 N/A LEU 53.A N LEU 205.A O no hydrogen 2.745 N/A PHE 54.A N GLU 40.A OE2 no hydrogen 2.807 N/A VAL 55.A N SER 203.A O no hydrogen 2.937 N/A SER 61.A N SER 57.A O no hydrogen 3.289 N/A SER 61.A OG SER 190.A OG no hydrogen 2.799 N/A ASN 62.A N GLY 58.A O no hydrogen 3.031 N/A ASN 62.A ND2 GLU 88.A OE2 no hydrogen 3.284 N/A LEU 63.A N THR 59.A O no hydrogen 2.681 N/A LEU 64.A N MET 60.A O no hydrogen 2.746 N/A ALA 65.A N SER 61.A O no hydrogen 2.970 N/A VAL 66.A N ASN 62.A O no hydrogen 3.010 N/A MET 67.A N LEU 63.A O no hydrogen 3.361 N/A SER 68.A N LEU 64.A O no hydrogen 3.086 N/A SER 68.A OG LEU 64.A O no hydrogen 2.557 N/A HIS 69.A N ALA 65.A O no hydrogen 3.236 N/A HIS 69.A N VAL 66.A O no hydrogen 3.160 N/A CYS 70.A N VAL 66.A O no hydrogen 2.671 N/A CYS 70.A SG VAL 66.A O no hydrogen 3.396 N/A CYS 70.A SG GLY 75.A O no hydrogen 3.855 N/A GLN 71.A N GLU 74.A OE1 no hydrogen 2.775 N/A GLY 73.A N SER 97.A O no hydrogen 2.768 N/A GLU 74.A N GLN 71.A O no hydrogen 3.074 N/A GLY 75.A N PRO 127.A O no hydrogen 2.736 N/A ALA 76.A N ALA 99.A O no hydrogen 2.859 N/A VAL 77.A N LEU 130.A O no hydrogen 2.783 N/A LEU 78.A N GLN 101.A O no hydrogen 3.399 N/A SER 80.A N VAL 103.A O no hydrogen 3.085 N/A ALA 82.A N GLY 79.A O no hydrogen 3.148 N/A HIS 83.A N GLU 134.A OE1 no hydrogen 2.779 N/A TYR 85.A N ALA 82.A O no hydrogen 3.154 N/A ARG 86.A N ALA 82.A O no hydrogen 3.229 N/A TYR 87.A N HIS 83.A O no hydrogen 3.087 N/A GLY 91.A N GLU 88.A O no hydrogen 3.141 N/A ALA 93.A N GLN 90.A O no hydrogen 2.803 N/A VAL 94.A N GLN 90.A O no hydrogen 2.903 N/A LEU 95.A N GLY 91.A O no hydrogen 2.807 N/A GLY 96.A N GLY 91.A O no hydrogen 3.371 N/A SER 97.A N ALA 93.A O no hydrogen 3.050 N/A VAL 98.A N SER 92.A O no hydrogen 3.214 N/A ALA 99.A N GLU 74.A O no hydrogen 2.930 N/A GLN 101.A N ALA 76.A O no hydrogen 2.829 N/A GLN 101.A NE2 THR 128.A OG1 no hydrogen 2.748 N/A VAL 103.A N LEU 78.A O no hydrogen 2.788 N/A GLN 106.A N SER 109.A O no hydrogen 3.190 N/A SER 109.A OG GLN 106.A OE1 no hydrogen 3.095 N/A SER 109.A OG ASP 107.A OD2 no hydrogen 2.530 N/A LEU 110.A N TYR 146.A OH no hydrogen 2.703 N/A VAL 115.A N ALA 111.A O no hydrogen 3.075 N/A ARG 116.A N LEU 112.A O no hydrogen 3.195 N/A ARG 116.A NH2 GLU 156.A OE1 no hydrogen 3.144 N/A ALA 117.A N ALA 113.A O no hydrogen 3.103 N/A ALA 118.A N ASP 114.A O no hydrogen 3.283 N/A ALA 118.A N VAL 115.A O no hydrogen 3.056 N/A ALA 120.A N THR 128.A OG1 no hydrogen 3.286 N/A VAL 123.A N ASP 122.A OD1 no hydrogen 2.843 N/A PHE 125.A N ASP 122.A O no hydrogen 3.120 N/A THR 128.A N ALA 120.A O no hydrogen 3.222 N/A ARG 129.A N GLY 75.A O no hydrogen 2.726 N/A ARG 129.A NE THR 128.A O no hydrogen 3.476 N/A LEU 130.A N GLY 75.A O no hydrogen 3.217 N/A VAL 131.A N GLN 160.A O no hydrogen 2.773 N/A CYS 132.A N VAL 77.A O no hydrogen 2.673 N/A LEU 133.A N HIS 162.A O no hydrogen 2.815 N/A THR 136.A OG1 ARG 167.A O no hydrogen 3.108 N/A HIS 137.A N LYS 140.A O no hydrogen 3.080 N/A LYS 140.A N HIS 137.A O no hydrogen 2.999 N/A LYS 140.A NZ ASN 138.A O no hydrogen 3.334 N/A VAL 141.A N GLN 274.A OE1 no hydrogen 2.862 N/A LEU 142.A N ASN 135.A OD1 no hydrogen 3.181 N/A TYR 146.A OH LEU 110.A O no hydrogen 2.754 N/A LEU 147.A N PRO 143.A O no hydrogen 3.266 N/A ARG 148.A N LEU 144.A O no hydrogen 3.023 N/A GLU 149.A N PRO 145.A O no hydrogen 3.287 N/A MET 150.A N TYR 146.A O no hydrogen 3.042 N/A ARG 151.A N LEU 147.A O no hydrogen 3.188 N/A ARG 151.A NE ASP 155.A OD1 no hydrogen 3.531 N/A ARG 151.A NE ASP 155.A OD2 no hydrogen 3.229 N/A ARG 151.A NH1 ASP 155.A OD2 no hydrogen 2.792 N/A ARG 151.A NH2 PRO 185.A O no hydrogen 3.366 N/A ARG 151.A NH2 ASP 187.A OD2 no hydrogen 2.592 N/A LEU 153.A N GLU 149.A O no hydrogen 3.223 N/A VAL 154.A N MET 150.A O no hydrogen 3.091 N/A ASP 155.A N ARG 151.A O no hydrogen 2.970 N/A GLU 156.A N GLU 152.A O no hydrogen 3.162 N/A GLY 158.A N ASP 155.A O no hydrogen 3.370 N/A LEU 159.A N VAL 154.A O no hydrogen 2.625 N/A GLN 160.A N ARG 129.A O no hydrogen 3.096 N/A LEU 161.A N ASP 187.A OD2 no hydrogen 2.969 N/A HIS 162.A N VAL 131.A O no hydrogen 2.782 N/A HIS 162.A ND1 SER 188.A OG no hydrogen 2.731 N/A HIS 162.A NE2 ASN 62.A OD1 no hydrogen 2.889 N/A LEU 163.A N SER 188.A O no hydrogen 2.810 N/A ASP 164.A N LEU 133.A O no hydrogen 2.756 N/A ARG 167.A NE ASP 7.A OD1 no hydrogen 3.244 N/A ARG 167.A NE ASP 7.A OD2 no hydrogen 2.742 N/A ARG 167.A NH2 ASP 7.A OD1 no hydrogen 2.669 N/A LEU 168.A N GLY 165.A O no hydrogen 3.186 N/A ASN 170.A ND2 HIS 251.A NE2 no hydrogen 3.474 N/A ALA 171.A N ARG 167.A O no hydrogen 3.456 N/A VAL 172.A N LEU 168.A O no hydrogen 2.905 N/A VAL 173.A N PHE 169.A O no hydrogen 3.246 N/A ALA 174.A N ASN 170.A O no hydrogen 3.325 N/A SER 175.A N ALA 171.A O no hydrogen 3.042 N/A SER 175.A OG ALA 171.A O no hydrogen 2.938 N/A GLY 176.A N VAL 172.A O no hydrogen 3.165 N/A HIS 177.A N SER 175.A OG no hydrogen 3.279 N/A HIS 177.A ND1 GLU 181.A OE1 no hydrogen 3.151 N/A ARG 180.A NH2 ASP 45.A O no hydrogen 2.731 N/A GLU 181.A N THR 178.A O no hydrogen 2.891 N/A GLU 181.A N THR 178.A OG1 no hydrogen 3.298 N/A LEU 182.A N THR 178.A O no hydrogen 3.192 N/A LEU 182.A N VAL 179.A O no hydrogen 3.084 N/A VAL 183.A N VAL 179.A O no hydrogen 3.033 N/A ALA 184.A N ARG 180.A O no hydrogen 2.938 N/A PHE 186.A N VAL 183.A O no hydrogen 2.898 N/A ASP 187.A N LEU 161.A O no hydrogen 3.089 N/A SER 188.A N LEU 161.A O no hydrogen 3.412 N/A SER 188.A OG HIS 162.A ND1 no hydrogen 2.731 N/A VAL 189.A N VAL 206.A O no hydrogen 2.830 N/A SER 190.A N LEU 163.A O no hydrogen 2.792 N/A SER 190.A OG SER 61.A OG no hydrogen 2.799 N/A ILE 191.A N LEU 204.A O no hydrogen 2.849 N/A CYS 192.A SG.A SER 203.A OG no hydrogen 3.079 N/A CYS 192.A SG.B SER 194.A OG no hydrogen 3.103 N/A LEU 193.A N GLY 202.A O no hydrogen 3.087 N/A SER 194.A OG GLY 202.A O no hydrogen 3.521 N/A ALA 199.A N LEU 193.A O no hydrogen 3.050 N/A SER 203.A N VAL 55.A O no hydrogen 2.782 N/A LEU 204.A N ILE 191.A O no hydrogen 2.788 N/A LEU 205.A N LEU 53.A O no hydrogen 2.965 N/A VAL 206.A N VAL 189.A O no hydrogen 2.700 N/A GLY 207.A N ALA 51.A O no hydrogen 2.832 N/A HIS 209.A N GLU 50.A OE1 no hydrogen 2.907 N/A PHE 211.A N SER 208.A OG no hydrogen 3.230 N/A ILE 212.A N SER 208.A O no hydrogen 2.887 N/A ALA 213.A N HIS 209.A O no hydrogen 2.854 N/A ARG 214.A N ALA 210.A O no hydrogen 2.998 N/A ARG 214.A NE SER 68.A O no hydrogen 2.681 N/A ARG 214.A NH2 SER 68.A O no hydrogen 2.755 N/A ALA 215.A N PHE 211.A O no hydrogen 2.998 N/A ARG 216.A N ILE 212.A O no hydrogen 2.729 N/A ARG 216.A NH2 GLU 40.A OE1 no hydrogen 3.197 N/A ARG 217.A N ALA 213.A O no hydrogen 3.364 N/A LEU 218.A N ARG 214.A O no hydrogen 3.132 N/A ARG 219.A N ALA 215.A O no hydrogen 2.802 N/A ARG 219.A NH1 PHE 54.A O no hydrogen 2.859 N/A ARG 219.A NH2 ASP 28.A OD2 no hydrogen 2.990 N/A VAL 222.A N LEU 218.A O no hydrogen 3.104 N/A GLY 223.A N ARG 219.A O no hydrogen 3.119 N/A GLY 224.A N ARG 219.A O no hydrogen 2.684 N/A ARG 227.A NH1 ASP 27.A OD1 no hydrogen 3.090 N/A ARG 227.A NH1 ASP 27.A OD2 no hydrogen 3.057 N/A GLY 230.A N ASP 33.A OD2 no hydrogen 2.823 N/A ALA 233.A N ALA 229.A O no hydrogen 2.869 N/A GLN 234.A N GLY 230.A O no hydrogen 2.840 N/A GLY 236.A N LEU 232.A O no hydrogen 3.055 N/A LEU 237.A N ALA 233.A O no hydrogen 2.922 N/A PHE 238.A N GLN 234.A O no hydrogen 2.778 N/A ALA 239.A N ALA 235.A O no hydrogen 2.968 N/A LEU 240.A N GLY 236.A O no hydrogen 3.012 N/A GLN 241.A N LEU 237.A O no hydrogen 3.069 N/A GLN 242.A N PHE 238.A O no hydrogen 2.976 N/A GLN 242.A N ALA 239.A O no hydrogen 3.314 N/A HIS 243.A N ALA 239.A O no hydrogen 2.734 N/A HIS 243.A ND1 LEU 197.A O no hydrogen 2.727 N/A ARG 246.A NH1 ASP 250.A OD1 no hydrogen 3.412 N/A ARG 246.A NH1 ASP 250.A OD2 no hydrogen 3.041 N/A ARG 246.A NH2 ASP 250.A OD1 no hydrogen 2.719 N/A LEU 247.A N VAL 244.A O no hydrogen 3.119 N/A ALA 248.A N VAL 245.A O no hydrogen 3.264 N/A ASP 249.A N ARG 246.A O no hydrogen 2.883 N/A HIS 251.A N LEU 247.A O no hydrogen 3.202 N/A ARG 252.A N ALA 248.A O no hydrogen 3.319 N/A ARG 253.A N ASP 249.A O no hydrogen 2.897 N/A ARG 253.A NE ILE 308.A O no hydrogen 3.170 N/A ARG 253.A NH1 ILE 308.A O no hydrogen 3.523 N/A ALA 254.A N ASP 250.A O no hydrogen 3.044 N/A ARG 255.A N HIS 251.A O no hydrogen 2.729 N/A ARG 255.A NH1 LEU 270.A O no hydrogen 3.351 N/A ARG 255.A NH2 LEU 270.A O no hydrogen 3.142 N/A GLN 256.A N ARG 252.A O no hydrogen 2.815 N/A LEU 257.A N ARG 253.A O no hydrogen 2.919 N/A ALA 258.A N ALA 254.A O no hydrogen 2.778 N/A GLU 259.A N ARG 255.A O no hydrogen 3.107 N/A GLY 260.A N GLN 256.A O no hydrogen 3.112 N/A LEU 261.A N LEU 257.A O no hydrogen 3.062 N/A LEU 261.A N ALA 258.A O no hydrogen 2.934 N/A ALA 262.A N ALA 258.A O no hydrogen 2.752 N/A LEU 264.A N LEU 261.A O no hydrogen 3.423 N/A ILE 266.A N LEU 264.A O no hydrogen 3.224 N/A ARG 267.A N GLN 281.A O no hydrogen 2.750 N/A THR 275.A OG1 GLY 139.A O no hydrogen 2.733 N/A ASN 276.A ND2 ASP 7.A OD2 no hydrogen 3.262 N/A ASN 276.A ND2 THR 304.A O no hydrogen 2.965 N/A VAL 278.A N LEU 302.A O no hydrogen 2.725 N/A LEU 280.A N LEU 300.A O no hydrogen 2.964 N/A GLN 281.A N ARG 267.A O no hydrogen 2.684 N/A THR 283.A N GLY 265.A O no hydrogen 3.386 N/A LEU 288.A N SER 284.A O no hydrogen 3.452 N/A ALA 289.A N ALA 285.A O no hydrogen 3.307 N/A PHE 290.A N PRO 286.A O no hydrogen 3.090 N/A MET 291.A N LEU 287.A O no hydrogen 3.070 N/A LYS 292.A N LEU 288.A O no hydrogen 2.630 N/A ALA 293.A N ALA 289.A O no hydrogen 3.360 N/A ARG 294.A N PHE 290.A O no hydrogen 3.267 N/A GLY 295.A N LYS 292.A O no hydrogen 3.224 N/A ILE 296.A N MET 291.A O no hydrogen 2.770 N/A LEU 297.A N ILE 2.A O no hydrogen 2.794 N/A ARG 301.A NH2 ARG 5.A O no hydrogen 2.905 N/A LEU 302.A N VAL 278.A O no hydrogen 2.914 N/A VAL 303.A N LEU 4.A O no hydrogen 2.795 N/A THR 304.A N ASN 276.A O no hydrogen 2.949 N/A THR 304.A OG1 ASP 250.A O no hydrogen 2.601 N/A THR 304.A OG1 ASN 276.A O no hydrogen 3.445 N/A HIS 305.A NE2 ASP 3.A O no hydrogen 2.718 N/A GLN 307.A N HIS 305.A ND1 no hydrogen 3.308 N/A ILE 308.A N HIS 305.A O no hydrogen 2.862 N/A HIS 309.A N ASP 312.A OD2 no hydrogen 2.807 N/A ASP 312.A N HIS 309.A O no hydrogen 3.056 N/A ILE 313.A N HIS 309.A O no hydrogen 3.038 N/A GLU 314.A N ASP 310.A O no hydrogen 3.083 N/A GLU 315.A N ASP 311.A O no hydrogen 3.172 N/A VAL 316.A N ASP 312.A O no hydrogen 3.189 N/A ILE 317.A N ILE 313.A O no hydrogen 3.187 N/A ASP 318.A N GLU 314.A O no hydrogen 3.010 N/A ALA 319.A N GLU 315.A O no hydrogen 2.960 N/A PHE 320.A N VAL 316.A O no hydrogen 3.223 N/A THR 321.A N ILE 317.A O no hydrogen 3.127 N/A THR 321.A OG1 ILE 317.A O no hydrogen 2.957 N/A GLU 322.A N ASP 318.A O no hydrogen 2.961 N/A TYR 323.A N ALA 319.A O no hydrogen 3.049 N/A TYR 323.A N PHE 320.A O no hydrogen 2.959 N/A LEU 324.A N PHE 320.A O no hydrogen 3.076 N/A