Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6wpw_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.A N LEU 4.A O no hydrogen 2.816 N/A GLN 9.A N ASP 5.A O no hydrogen 3.345 N/A GLU 10.A N GLN 6.A O no hydrogen 2.650 N/A ALA 11.A N LEU 7.A O no hydrogen 3.230 N/A GLN 13.A N GLN 9.A O no hydrogen 2.746 N/A LEU 14.A N GLU 10.A O no hydrogen 3.102 N/A LEU 14.A N ALA 11.A O no hydrogen 3.221 N/A LYS 15.A N ALA 11.A O no hydrogen 2.842 N/A ASN 16.A ND2 GLU 12.A OE2 no hydrogen 3.521 N/A GLN 17.A N LEU 14.A O no hydrogen 3.121 N/A ILE 18.A N LEU 14.A O no hydrogen 3.295 N/A ARG 19.A N LYS 15.A O no hydrogen 2.994 N/A ALA 21.A N ASP 20.A OD1 no hydrogen 2.606 N/A ARG 22.A N ILE 18.A O no hydrogen 2.803 N/A ALA 24.A N ASP 20.A O no hydrogen 2.640 N/A CYS 25.A N ALA 21.A O no hydrogen 3.188 N/A CYS 25.A SG ALA 21.A O no hydrogen 3.381 N/A ALA 26.A N LYS 23.A O no hydrogen 3.263 N/A THR 34.A OG1 LEU 30.A O no hydrogen 2.616 N/A THR 34.A OG1 LEU 300.A O no hydrogen 3.523 N/A ASN 35.A N SER 31.A O no hydrogen 3.018 N/A ILE 37.A N THR 34.A O no hydrogen 2.875 N/A ARG 46.A N ASN 340.A OXT no hydrogen 3.422 N/A ARG 48.A N ILE 338.A O no hydrogen 2.788 N/A ARG 48.A NE ASN 340.A OD1 no hydrogen 2.693 N/A ARG 49.A NE TYR 85.A O no hydrogen 2.668 N/A ARG 49.A NH2 TYR 85.A O no hydrogen 3.321 N/A LEU 51.A N LEU 336.A O no hydrogen 2.964 N/A HIS 54.A NE2 SER 72.A OG no hydrogen 2.388 N/A LYS 57.A NZ GLN 75.A OE1 no hydrogen 3.062 N/A ILE 58.A N SER 331.A O no hydrogen 3.260 N/A TYR 59.A N ALA 73.A O no hydrogen 3.261 N/A ALA 60.A N ALA 73.A O no hydrogen 3.520 N/A HIS 62.A N VAL 71.A O no hydrogen 3.146 N/A TRP 63.A NE1 GLY 319.A O no hydrogen 3.031 N/A GLY 64.A N LEU 69.A O no hydrogen 2.959 N/A THR 65.A OG1 PRO 107.A O no hydrogen 2.927 N/A SER 67.A N GLY 64.A O no hydrogen 3.111 N/A SER 67.A OG ASP 66.A O no hydrogen 2.592 N/A SER 67.A OG ASP 323.A OD1 no hydrogen 3.300 N/A SER 67.A OG ASP 323.A OD2 no hydrogen 3.087 N/A ARG 68.A N ASP 66.A OD1 no hydrogen 3.338 N/A VAL 71.A N HIS 62.A O no hydrogen 3.114 N/A SER 72.A N ILE 80.A O no hydrogen 2.947 N/A SER 72.A OG HIS 54.A NE2 no hydrogen 2.388 N/A SER 72.A OG ILE 80.A O no hydrogen 3.498 N/A ALA 73.A N ALA 60.A O no hydrogen 3.212 N/A SER 74.A N LYS 78.A O no hydrogen 3.426 N/A SER 74.A OG HIS 54.A ND1 no hydrogen 2.737 N/A SER 74.A OG ASP 76.A OD1 no hydrogen 2.488 N/A GLN 75.A N LYS 57.A O no hydrogen 2.903 N/A GLN 75.A NE2 VAL 100.A O no hydrogen 3.154 N/A GLY 77.A N SER 74.A O no hydrogen 3.463 N/A LYS 78.A N ASP 76.A OD1 no hydrogen 3.131 N/A LEU 79.A N ILE 93.A O no hydrogen 2.888 N/A ILE 80.A N SER 72.A O no hydrogen 3.137 N/A ILE 81.A N HIS 91.A O no hydrogen 3.233 N/A TRP 82.A N LEU 70.A O no hydrogen 2.747 N/A TRP 82.A NE1 SER 72.A OG no hydrogen 2.882 N/A SER 84.A N ARG 68.A O no hydrogen 2.731 N/A SER 84.A OG ARG 68.A O no hydrogen 2.844 N/A THR 86.A N ASP 83.A OD2 no hydrogen 3.435 N/A THR 86.A OG1 ASP 83.A OD2 no hydrogen 3.274 N/A THR 86.A OG1 ASN 88.A OD1 no hydrogen 3.109 N/A ASN 88.A N THR 86.A O no hydrogen 2.576 N/A VAL 90.A N ILE 81.A O no hydrogen 3.129 N/A ILE 93.A N LEU 79.A O no hydrogen 2.677 N/A LEU 95.A N GLY 77.A O no hydrogen 2.888 N/A VAL 100.A N SER 98.A O no hydrogen 3.239 N/A MET 101.A N GLY 115.A O no hydrogen 2.709 N/A THR 102.A N GLY 115.A O no hydrogen 3.115 N/A ALA 104.A N ALA 113.A O no hydrogen 3.055 N/A ALA 106.A N TYR 111.A O no hydrogen 3.019 N/A SER 108.A OG ASP 154.A OD1 no hydrogen 2.640 N/A SER 108.A OG ASP 154.A OD2 no hydrogen 2.905 N/A ASN 110.A N SER 108.A OG no hydrogen 3.353 N/A VAL 112.A N TYR 124.A O no hydrogen 3.089 N/A ALA 113.A N ALA 104.A O no hydrogen 3.091 N/A CYS 114.A N SER 122.A O no hydrogen 3.191 N/A CYS 114.A SG SER 122.A O no hydrogen 3.855 N/A LEU 117.A N TRP 99.A O no hydrogen 3.073 N/A ASN 119.A N GLY 116.A O no hydrogen 3.332 N/A ILE 120.A N ASP 118.A OD1 no hydrogen 3.462 N/A CYS 121.A N LEU 139.A O no hydrogen 3.252 N/A CYS 121.A SG CYS 114.A O no hydrogen 3.537 N/A SER 122.A N CYS 114.A O no hydrogen 3.365 N/A ILE 123.A N ARG 137.A O no hydrogen 3.069 N/A TYR 124.A N VAL 112.A O no hydrogen 2.719 N/A ASN 125.A N ARG 134.A O no hydrogen 3.435 N/A LEU 126.A N ASN 110.A O no hydrogen 2.895 N/A LYS 127.A N ASN 125.A OD1 no hydrogen 3.407 N/A ARG 129.A N THR 128.A OG1 no hydrogen 2.724 N/A VAL 133.A N ASN 132.A OD1 no hydrogen 2.793 N/A SER 136.A N ILE 123.A O no hydrogen 2.779 N/A ARG 137.A NH1 SER 136.A O no hydrogen 2.982 N/A LEU 139.A N CYS 121.A O no hydrogen 2.644 N/A HIS 142.A NE2 THR 159.A OG1 no hydrogen 2.655 N/A THR 143.A N ASP 163.A OD2 no hydrogen 3.041 N/A THR 143.A OG1 ASP 163.A OD2 no hydrogen 3.345 N/A LEU 146.A N GLY 116.A O no hydrogen 2.997 N/A SER 147.A N SER 160.A O no hydrogen 2.921 N/A SER 147.A OG SER 160.A O no hydrogen 3.115 N/A SER 147.A OG SER 160.A OG no hydrogen 3.271 N/A SER 147.A OG VAL 187.A O no hydrogen 2.558 N/A CYS 148.A N SER 160.A O no hydrogen 3.218 N/A CYS 148.A SG LEU 190.A O no hydrogen 3.788 N/A ARG 150.A N VAL 158.A O no hydrogen 2.891 N/A ARG 150.A NH1 CYS 149.A O no hydrogen 3.037 N/A LEU 152.A N GLN 156.A O no hydrogen 3.085 N/A ASP 153.A N GLN 156.A O no hydrogen 3.522 N/A ASN 155.A N ASP 153.A OD1 no hydrogen 2.938 N/A GLN 156.A N ASP 153.A OD1 no hydrogen 2.818 N/A VAL 158.A N ARG 150.A O no hydrogen 2.949 N/A THR 159.A N ALA 167.A O no hydrogen 2.919 N/A THR 159.A OG1 HIS 142.A NE2 no hydrogen 2.655 N/A SER 160.A N CYS 148.A O no hydrogen 2.761 N/A SER 160.A OG SER 147.A OG no hydrogen 3.271 N/A SER 160.A OG CYS 148.A O no hydrogen 3.159 N/A SER 161.A N THR 165.A O no hydrogen 3.284 N/A SER 161.A OG HIS 142.A ND1 no hydrogen 2.579 N/A SER 161.A OG ASP 163.A OD1 no hydrogen 2.269 N/A SER 161.A OG THR 165.A O no hydrogen 3.447 N/A GLY 162.A N TYR 145.A O no hydrogen 2.541 N/A THR 164.A OG1 ASP 163.A O no hydrogen 2.599 N/A THR 165.A OG1 ASP 163.A OD1 no hydrogen 2.798 N/A THR 165.A OG1 ASP 163.A OD2 no hydrogen 3.262 N/A CYS 166.A N PHE 180.A O no hydrogen 3.278 N/A ALA 167.A N THR 159.A O no hydrogen 3.075 N/A LEU 168.A N THR 178.A O no hydrogen 2.642 N/A TRP 169.A N ILE 157.A O no hydrogen 2.821 N/A TRP 169.A NE1 THR 159.A OG1 no hydrogen 2.933 N/A ILE 171.A N ASN 155.A O no hydrogen 2.755 N/A THR 173.A OG1 ASP 170.A O no hydrogen 3.465 N/A GLY 174.A N ASP 170.A O no hydrogen 2.667 N/A THR 177.A N LEU 168.A O no hydrogen 2.746 N/A THR 178.A N LEU 168.A O no hydrogen 3.421 N/A THR 179.A OG1 CYS 166.A O no hydrogen 3.245 N/A PHE 180.A N CYS 166.A O no hydrogen 2.721 N/A HIS 183.A NE2 SER 201.A OG no hydrogen 2.796 N/A THR 184.A N ASP 205.A OD2 no hydrogen 3.071 N/A MET 188.A N GLY 202.A O no hydrogen 2.972 N/A SER 191.A N VAL 200.A O no hydrogen 3.169 N/A ALA 193.A N LEU 198.A O no hydrogen 2.989 N/A THR 196.A N ALA 193.A O no hydrogen 3.091 N/A THR 196.A OG1 ASP 195.A O no hydrogen 2.649 N/A PHE 199.A N TRP 211.A O no hydrogen 3.337 N/A VAL 200.A N SER 191.A O no hydrogen 3.254 N/A SER 201.A N LYS 209.A O no hydrogen 3.376 N/A SER 201.A OG HIS 183.A NE2 no hydrogen 2.796 N/A GLY 202.A N SER 189.A O no hydrogen 3.087 N/A CYS 204.A N ASP 186.A O no hydrogen 2.999 N/A CYS 204.A SG ASP 186.A O no hydrogen 3.403 N/A SER 207.A OG ASP 205.A OD1 no hydrogen 2.769 N/A SER 207.A OG ASP 205.A OD2 no hydrogen 3.146 N/A ALA 208.A N PHE 222.A O no hydrogen 3.135 N/A LYS 209.A N SER 201.A O no hydrogen 3.255 N/A LYS 209.A NZ THR 221.A OG1 no hydrogen 3.084 N/A TRP 211.A N PHE 199.A O no hydrogen 2.749 N/A TRP 211.A NE1 SER 201.A OG no hydrogen 2.710 N/A ASP 212.A N MET 217.A O no hydrogen 3.133 N/A VAL 213.A N ARG 197.A O no hydrogen 3.146 N/A GLU 215.A N ASP 212.A OD2 no hydrogen 3.199 N/A GLY 216.A N ASP 212.A O no hydrogen 2.795 N/A CYS 218.A SG LEU 210.A O no hydrogen 3.766 N/A CYS 218.A SG GLN 220.A O no hydrogen 3.953 N/A ARG 219.A N LEU 210.A O no hydrogen 2.953 N/A ARG 219.A NE ASP 212.A OD1 no hydrogen 3.249 N/A GLN 220.A NE2 LEU 255.A O no hydrogen 3.422 N/A PHE 222.A N ALA 208.A O no hydrogen 3.020 N/A GLU 226.A N ASP 247.A OD2 no hydrogen 3.320 N/A ASP 228.A N SER 227.A OG no hydrogen 2.585 N/A ILE 229.A N ALA 203.A O no hydrogen 3.152 N/A ASN 230.A N GLY 244.A O no hydrogen 3.106 N/A ASN 230.A ND2 ASP 246.A OD1 no hydrogen 2.567 N/A ASN 230.A ND2 ILE 273.A O no hydrogen 3.682 N/A ALA 231.A N GLY 244.A O no hydrogen 3.450 N/A CYS 233.A N ALA 242.A O no hydrogen 3.329 N/A CYS 233.A SG PHE 234.A O no hydrogen 3.482 N/A PHE 234.A N SER 191.A OG no hydrogen 3.357 N/A PHE 235.A N ALA 240.A O no hydrogen 2.723 N/A GLY 238.A N PHE 235.A O no hydrogen 3.044 N/A ASN 239.A N ASN 237.A OD1 no hydrogen 2.992 N/A PHE 241.A N PHE 253.A O no hydrogen 3.205 N/A ALA 242.A N CYS 233.A O no hydrogen 3.051 N/A SER 245.A OG HIS 225.A ND1 no hydrogen 2.790 N/A SER 245.A OG ASP 247.A OD1 no hydrogen 2.204 N/A SER 245.A OG THR 249.A O no hydrogen 3.256 N/A ASP 246.A N ASP 228.A O no hydrogen 3.038 N/A THR 249.A OG1 ASP 247.A O no hydrogen 3.298 N/A ARG 251.A N THR 243.A O no hydrogen 3.223 N/A ARG 251.A NE GLU 260.A OE2 no hydrogen 3.042 N/A ARG 251.A NH1 HIS 225.A ND1 no hydrogen 3.102 N/A ARG 251.A NH1 ASP 247.A OD2 no hydrogen 3.439 N/A LEU 252.A N MET 262.A O no hydrogen 3.380 N/A PHE 253.A N PHE 241.A O no hydrogen 2.790 N/A ASP 254.A N GLN 259.A O no hydrogen 3.156 N/A LEU 255.A N ASN 239.A O no hydrogen 3.098 N/A ALA 257.A N ASP 254.A OD2 no hydrogen 2.825 N/A LEU 261.A N LEU 252.A O no hydrogen 2.908 N/A THR 263.A OG1 GLU 260.A OE2 no hydrogen 2.494 N/A TYR 264.A N CYS 250.A O no hydrogen 2.863 N/A TYR 264.A OH ALA 299.A O no hydrogen 2.603 N/A ILE 269.A N HIS 266.A O no hydrogen 2.945 N/A ILE 273.A N SER 245.A O no hydrogen 2.991 N/A THR 274.A N GLY 288.A O no hydrogen 2.613 N/A THR 274.A OG1 ASP 290.A OD1 no hydrogen 3.163 N/A THR 274.A OG1 VAL 315.A O no hydrogen 3.166 N/A SER 275.A N GLY 288.A O no hydrogen 3.374 N/A SER 277.A N LEU 286.A O no hydrogen 3.031 N/A SER 277.A OG PHE 278.A O no hydrogen 3.229 N/A SER 279.A N LEU 284.A O no hydrogen 3.224 N/A LYS 280.A NZ ASP 322.A O no hydrogen 2.913 N/A GLY 282.A N SER 279.A OG no hydrogen 3.313 N/A ARG 283.A NE ASP 298.A OD2 no hydrogen 3.265 N/A ARG 283.A NH2 ASP 298.A OD2 no hydrogen 3.532 N/A LEU 285.A N TRP 297.A O no hydrogen 2.654 N/A LEU 286.A N SER 277.A O no hydrogen 2.886 N/A ALA 287.A N ASN 295.A O no hydrogen 3.167 N/A GLY 288.A N SER 275.A O no hydrogen 2.882 N/A ASP 290.A N GLY 272.A O no hydrogen 2.577 N/A ASN 293.A N ASP 291.A O no hydrogen 2.895 N/A CYS 294.A N LEU 308.A O no hydrogen 2.797 N/A ASN 295.A N ALA 287.A O no hydrogen 3.257 N/A VAL 296.A N GLY 306.A O no hydrogen 2.863 N/A TRP 297.A N LEU 285.A O no hydrogen 2.754 N/A TRP 297.A NE1 TYR 289.A OH no hydrogen 2.608 N/A ASP 298.A N ASP 303.A O no hydrogen 3.059 N/A ALA 299.A N ARG 283.A O no hydrogen 2.732 N/A LYS 301.A N ASP 298.A OD2 no hydrogen 2.981 N/A ALA 302.A N ASP 298.A O no hydrogen 2.873 N/A ALA 305.A N VAL 296.A O no hydrogen 3.065 N/A LEU 308.A N CYS 294.A O no hydrogen 2.750 N/A ASP 312.A N ASP 333.A OD2 no hydrogen 3.216 N/A ARG 314.A N ASN 313.A OD1 no hydrogen 2.639 N/A ARG 314.A NH2 THR 274.A OG1 no hydrogen 2.691 N/A SER 316.A N GLY 330.A O no hydrogen 2.905 N/A SER 316.A OG ILE 58.A O no hydrogen 1.735 N/A GLY 319.A N ALA 328.A O no hydrogen 2.914 N/A THR 321.A N ALA 326.A O no hydrogen 3.395 N/A THR 321.A OG1 ASP 323.A OD1 no hydrogen 2.622 N/A GLY 324.A N THR 321.A O no hydrogen 3.088 N/A MET 325.A N THR 321.A OG1 no hydrogen 2.825 N/A MET 325.A N ASP 323.A OD1 no hydrogen 3.346 N/A VAL 327.A N TRP 339.A O no hydrogen 2.714 N/A ALA 328.A N GLY 319.A O no hydrogen 2.804 N/A THR 329.A N LYS 337.A O no hydrogen 2.875 N/A THR 329.A OG1 LYS 337.A O no hydrogen 2.923 N/A SER 331.A OG ASN 313.A O no hydrogen 2.226 N/A SER 331.A OG ARG 314.A O no hydrogen 2.621 N/A SER 331.A OG ASP 333.A OD1 no hydrogen 3.194 N/A TRP 332.A N ARG 314.A O no hydrogen 2.790 N/A PHE 335.A N ASP 333.A O no hydrogen 2.631 N/A LEU 336.A N LEU 51.A O no hydrogen 3.348 N/A LYS 337.A N THR 329.A O no hydrogen 2.961 N/A ILE 338.A N ARG 49.A O no hydrogen 3.020 N/A TRP 339.A N VAL 327.A O no hydrogen 2.678 N/A TRP 339.A NE1 THR 329.A OG1 no hydrogen 3.003 N/A