Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fgu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N HIS 113.A O no hydrogen 2.964 N/A TRP 3.A NE1 ASP 112.A OD2 no hydrogen 3.213 N/A VAL 4.A N GLN 38.A O no hydrogen 3.088 N/A VAL 5.A N PHE 115.A O no hydrogen 3.119 N/A ILE 6.A N VAL 40.A O no hydrogen 3.083 N/A VAL 7.A N TYR 117.A O no hydrogen 2.942 N/A ALA 8.A N MET 42.A O no hydrogen 2.956 N/A GLY 9.A N THR 119.A O no hydrogen 3.194 N/A SER 10.A OG ASN 15.A O no hydrogen 3.234 N/A GLY 12.A N ASP 46.A OD2 no hydrogen 2.642 N/A TRP 13.A NE1 ARG 198.A O no hydrogen 3.081 N/A ASN 15.A ND2 ASN 11.A O no hydrogen 2.833 N/A TYR 16.A N TRP 13.A O no hydrogen 3.038 N/A ARG 17.A NH1 TYR 14.A O no hydrogen 3.202 N/A ARG 17.A NH2 SER 280.A OG no hydrogen 2.815 N/A GLN 19.A NE2 SER 10.A O no hydrogen 3.120 N/A GLN 19.A NE2 ASP 46.A OD1 no hydrogen 2.716 N/A ALA 20.A N TYR 16.A O no hydrogen 3.000 N/A ASP 21.A N ARG 17.A O no hydrogen 2.996 N/A ALA 22.A N HIS 18.A O no hydrogen 3.409 N/A CYS 23.A N GLN 19.A O no hydrogen 3.240 N/A CYS 23.A SG GLN 19.A O no hydrogen 3.245 N/A HIS 24.A N ALA 20.A O no hydrogen 3.231 N/A HIS 24.A NE2 ASP 215.A OD2 no hydrogen 2.859 N/A ALA 25.A N ASP 21.A O no hydrogen 3.110 N/A ALA 25.A N ALA 22.A O no hydrogen 3.150 N/A TYR 26.A OH ASP 36.A OD1 no hydrogen 2.893 N/A TYR 26.A OH ASP 36.A OD2 no hydrogen 3.170 N/A ILE 28.A N HIS 24.A O no hydrogen 3.214 N/A ILE 29.A N TYR 26.A O no hydrogen 2.945 N/A HIS 30.A N TYR 26.A O no hydrogen 2.677 N/A HIS 30.A ND1 ILE 34.A O no hydrogen 2.889 N/A ARG 31.A NH2 ASP 215.A OD1 no hydrogen 2.885 N/A ASN 32.A N ILE 29.A O no hydrogen 2.868 N/A GLY 33.A N ILE 29.A O no hydrogen 3.155 N/A GLY 33.A N HIS 30.A O no hydrogen 3.257 N/A GLN 38.A N PRO 35.A O no hydrogen 2.779 N/A ILE 39.A N ASP 36.A O no hydrogen 3.356 N/A VAL 40.A N VAL 4.A O no hydrogen 3.139 N/A MET 42.A N ILE 6.A O no hydrogen 2.802 N/A ASP 45.A N GLN 19.A OE1 no hydrogen 3.056 N/A ASP 52.A N SER 50.A OG no hydrogen 3.288 N/A ASN 53.A N SER 50.A O no hydrogen 3.012 N/A ASN 53.A ND2 ALA 48.A O no hydrogen 2.585 N/A THR 55.A N ASN 53.A OD1 no hydrogen 3.464 N/A THR 55.A OG1 ILE 58.A O no hydrogen 3.095 N/A ILE 58.A N THR 55.A O no hydrogen 3.078 N/A VAL 59.A N ASP 67.A OD1 no hydrogen 2.807 N/A ILE 60.A N TYR 16.A OH no hydrogen 3.282 N/A ASN 61.A ND2 ASP 21.A OD1 no hydrogen 3.156 N/A ASN 61.A ND2 HIS 24.A ND1 no hydrogen 3.211 N/A GLY 65.A N ARG 62.A O no hydrogen 3.051 N/A VAL 68.A N VAL 59.A O no hydrogen 2.887 N/A TYR 69.A N ASP 67.A OD1 no hydrogen 3.022 N/A TYR 69.A OH ASP 45.A OD1 no hydrogen 2.866 N/A VAL 72.A N TYR 69.A O no hydrogen 3.274 N/A LYS 74.A N VAL 72.A O no hydrogen 3.102 N/A TYR 76.A N VAL 41.A O no hydrogen 3.349 N/A TYR 76.A OH LYS 104.A O no hydrogen 2.774 N/A ASP 80.A N THR 77.A O no hydrogen 3.372 N/A THR 82.A OG1 ASP 80.A O no hydrogen 3.497 N/A ASN 85.A N THR 82.A O no hydrogen 3.148 N/A ASN 85.A ND2 ASP 80.A O no hydrogen 2.609 N/A PHE 86.A N THR 82.A O no hydrogen 2.845 N/A LEU 87.A N PRO 83.A O no hydrogen 2.761 N/A LEU 90.A N PHE 86.A O no hydrogen 3.493 N/A ARG 91.A N LEU 87.A O no hydrogen 3.027 N/A ARG 91.A NH2 ASP 93.A OD2 no hydrogen 3.236 N/A GLY 92.A N VAL 89.A O no hydrogen 3.035 N/A ASP 93.A N ALA 88.A O no hydrogen 2.767 N/A ALA 94.A N GLY 92.A O no hydrogen 2.851 N/A ALA 96.A N ASP 93.A O no hydrogen 3.076 N/A VAL 97.A N ALA 94.A O no hydrogen 3.348 N/A ILE 100.A N VAL 97.A O no hydrogen 2.858 N/A SER 102.A N ASP 75.A O no hydrogen 3.274 N/A SER 102.A OG ASP 75.A OD2 no hydrogen 2.802 N/A LYS 104.A N SER 102.A OG no hydrogen 2.574 N/A LEU 106.A N VAL 89.A O no hydrogen 3.045 N/A SER 108.A OG MET 151.A O no hydrogen 2.574 N/A GLY 109.A N ASP 112.A OD2 no hydrogen 3.185 N/A ASP 112.A N GLY 109.A O no hydrogen 3.255 N/A HIS 113.A N LYS 1.A O no hydrogen 2.793 N/A VAL 114.A N LYS 154.A O no hydrogen 3.392 N/A PHE 115.A N TRP 3.A O no hydrogen 3.014 N/A ILE 116.A N VAL 156.A O no hydrogen 3.338 N/A TYR 117.A N VAL 5.A O no hydrogen 2.855 N/A PHE 118.A N TYR 158.A O no hydrogen 3.351 N/A THR 119.A N VAL 7.A O no hydrogen 2.979 N/A THR 119.A OG1 HIS 18.A O no hydrogen 3.116 N/A ASP 120.A N GLU 160.A O no hydrogen 3.380 N/A SER 123.A N ILE 126.A O no hydrogen 2.896 N/A SER 123.A OG LEU 375.A O no hydrogen 2.981 N/A THR 124.A OG1 GLU 163.A OE1 no hydrogen 2.540 N/A GLY 125.A N SER 166.A OG no hydrogen 3.391 N/A ILE 126.A N SER 123.A O no hydrogen 3.011 N/A LEU 127.A N LEU 134.A O no hydrogen 2.886 N/A VAL 128.A N HIS 121.A O no hydrogen 3.165 N/A PHE 129.A N GLU 132.A O no hydrogen 2.991 N/A LEU 134.A N LEU 127.A O no hydrogen 3.015 N/A VAL 136.A N GLY 125.A O no hydrogen 3.211 N/A LYS 137.A NZ HIS 349.A O no hydrogen 2.479 N/A LEU 139.A N HIS 135.A O no hydrogen 3.000 N/A ASN 140.A N VAL 136.A O no hydrogen 2.663 N/A THR 142.A OG1 ASP 138.A O no hydrogen 2.914 N/A THR 142.A OG1 LEU 139.A O no hydrogen 2.754 N/A ILE 143.A N LEU 139.A O no hydrogen 2.891 N/A TYR 145.A N GLU 141.A O no hydrogen 2.793 N/A MET 146.A N THR 142.A O no hydrogen 3.170 N/A TYR 147.A N HIS 144.A O no hydrogen 3.151 N/A LYS 148.A N HIS 144.A O no hydrogen 3.077 N/A HIS 149.A N TYR 145.A O no hydrogen 3.277 N/A LYS 150.A N TYR 147.A O no hydrogen 3.192 N/A MET 151.A N MET 146.A O no hydrogen 2.695 N/A TYR 152.A OH ILE 175.A O no hydrogen 2.783 N/A ARG 153.A N ASP 112.A O no hydrogen 2.917 N/A LYS 154.A NZ ASN 176.A OD1 no hydrogen 2.804 N/A MET 155.A N ASN 176.A O no hydrogen 3.125 N/A VAL 156.A N VAL 114.A O no hydrogen 3.336 N/A PHE 157.A N TYR 178.A O no hydrogen 2.734 N/A TYR 158.A N ILE 116.A O no hydrogen 3.174 N/A ILE 159.A N THR 180.A O no hydrogen 3.008 N/A GLU 160.A N PHE 118.A O no hydrogen 2.772 N/A GLU 163.A N GLU 187.A O no hydrogen 3.278 N/A SER 164.A OG ALA 161.A O no hydrogen 3.061 N/A SER 164.A OG ALA 183.A O no hydrogen 3.383 N/A GLY 165.A N ALA 183.A O no hydrogen 2.806 N/A SER 166.A N GLU 163.A O no hydrogen 3.418 N/A SER 166.A OG SER 123.A O no hydrogen 3.272 N/A SER 166.A OG GLU 163.A O no hydrogen 2.545 N/A MET 167.A N SER 164.A O no hydrogen 2.906 N/A ASN 169.A N GLY 165.A O no hydrogen 2.950 N/A TYR 178.A N MET 155.A O no hydrogen 2.773 N/A TYR 178.A OH GLN 242.A OE1 no hydrogen 2.760 N/A ALA 179.A N TYR 243.A O no hydrogen 2.829 N/A THR 180.A N PHE 157.A O no hydrogen 2.684 N/A THR 181.A N MET 241.A O no hydrogen 2.953 N/A ALA 182.A N SER 164.A OG no hydrogen 3.142 N/A ALA 183.A N SER 164.A OG no hydrogen 3.238 N/A ARG 186.A N ASN 184.A O no hydrogen 2.549 N/A GLU 187.A N ASN 184.A O no hydrogen 3.225 N/A SER 189.A OG GLU 160.A OE2 no hydrogen 2.535 N/A ALA 191.A N THR 278.A O no hydrogen 2.709 N/A CYS 192.A N GLY 203.A O no hydrogen 2.878 N/A TYR 193.A N LEU 275.A O no hydrogen 3.049 N/A ASP 195.A N THR 200.A O no hydrogen 3.232 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.776 N/A ARG 198.A NH1 ASP 195.A OD1 no hydrogen 2.807 N/A SER 199.A OG GLU 196.A O no hydrogen 2.993 N/A THR 200.A N ASP 195.A O no hydrogen 3.370 N/A THR 200.A OG1 ARG 198.A O no hydrogen 3.204 N/A LEU 202.A N TYR 193.A O no hydrogen 2.914 N/A GLY 203.A N CYS 192.A O no hydrogen 3.402 N/A ASP 204.A N ASP 21.A OD1 no hydrogen 3.228 N/A TRP 205.A N TYR 190.A O no hydrogen 2.960 N/A SER 207.A OG TYR 117.A OH no hydrogen 2.409 N/A VAL 208.A N ASP 204.A O no hydrogen 2.749 N/A TRP 210.A N TYR 206.A O no hydrogen 3.054 N/A GLU 212.A N VAL 208.A O no hydrogen 2.783 N/A SER 214.A N TRP 210.A O no hydrogen 2.797 N/A SER 214.A OG TRP 210.A O no hydrogen 2.939 N/A GLU 217.A N ASP 213.A O no hydrogen 2.960 N/A THR 220.A OG1 ASP 218.A OD1 no hydrogen 2.786 N/A HIS 225.A N SER 249.A O no hydrogen 2.942 N/A HIS 225.A ND1 SER 249.A OG no hydrogen 2.472 N/A LYS 226.A N THR 223.A OG1 no hydrogen 3.339 N/A GLN 227.A N THR 223.A O no hydrogen 3.227 N/A GLN 227.A N LEU 224.A O no hydrogen 3.276 N/A GLN 227.A NE2 ASP 213.A OD2 no hydrogen 3.261 N/A GLN 227.A NE2 SER 214.A OG no hydrogen 2.698 N/A TYR 228.A N LEU 224.A O no hydrogen 2.746 N/A HIS 229.A N HIS 225.A O no hydrogen 2.905 N/A VAL 231.A N GLN 227.A O no hydrogen 2.913 N/A LYS 232.A N TYR 228.A O no hydrogen 2.758 N/A SER 233.A N HIS 229.A O no hydrogen 3.246 N/A HIS 234.A N LEU 230.A O no hydrogen 2.783 N/A THR 235.A OG1 THR 237.A OG1 no hydrogen 3.358 N/A THR 235.A OG1 SER 238.A O no hydrogen 3.547 N/A THR 237.A OG1 THR 235.A OG1 no hydrogen 3.358 N/A SER 238.A OG ALA 182.A O no hydrogen 3.489 N/A HIS 239.A N GLU 187.A OE2 no hydrogen 2.459 N/A HIS 239.A ND1 GLU 187.A OE2 no hydrogen 3.196 N/A MET 241.A N THR 181.A O no hydrogen 3.273 N/A TYR 243.A N ALA 179.A O no hydrogen 2.731 N/A GLN 245.A N VAL 177.A O no hydrogen 2.866 N/A ILE 248.A N GLN 245.A O no hydrogen 3.314 N/A SER 249.A N LYS 246.A O no hydrogen 2.997 N/A SER 249.A OG HIS 225.A ND1 no hydrogen 2.472 N/A SER 249.A OG LYS 246.A O no hydrogen 2.457 N/A THR 250.A N THR 247.A O no hydrogen 3.386 N/A THR 250.A OG1 THR 247.A O no hydrogen 2.992 N/A MET 251.A N ILE 248.A O no hydrogen 2.792 N/A LYS 252.A NZ THR 220.A O no hydrogen 3.447 N/A VAL 253.A N GLU 222.A O no hydrogen 3.382 N/A GLN 255.A N LYS 252.A O no hydrogen 3.487 N/A PHE 256.A N VAL 253.A O no hydrogen 3.049 N/A GLN 257.A N VAL 253.A O no hydrogen 2.915 N/A SER 264.A OG ARG 31.A O no hydrogen 3.085 N/A SER 265.A OG GLU 217.A O no hydrogen 3.322 N/A THR 278.A N ALA 191.A O no hydrogen 3.199 N/A SER 280.A N SER 189.A O no hydrogen 2.730 N/A ASP 282.A N PRO 279.A O no hydrogen 3.119 N/A LEU 285.A N ASP 282.A O no hydrogen 3.181 N/A THR 286.A N ASP 282.A O no hydrogen 2.864 N/A THR 286.A OG1 ASP 282.A O no hydrogen 2.831 N/A THR 286.A OG1 VAL 283.A O no hydrogen 2.921 N/A ILE 287.A N VAL 283.A O no hydrogen 3.146 N/A LYS 289.A N LEU 285.A O no hydrogen 2.829 N/A ARG 290.A N THR 286.A O no hydrogen 3.126 N/A ARG 290.A NE ASN 294.A OD1 no hydrogen 2.951 N/A ARG 290.A NH2 GLU 196.A OE2 no hydrogen 3.128 N/A LYS 291.A N ILE 287.A O no hydrogen 2.873 N/A LEU 292.A N MET 288.A O no hydrogen 3.087 N/A MET 293.A N ARG 290.A O no hydrogen 3.042 N/A ASN 294.A N ARG 290.A O no hydrogen 3.064 N/A THR 295.A OG1 LYS 291.A O no hydrogen 2.891 N/A GLU 300.A N ASP 297.A OD2 no hydrogen 2.796 N/A SER 301.A N ASP 297.A O no hydrogen 3.178 N/A SER 301.A OG ASP 297.A O no hydrogen 2.641 N/A ARG 302.A N LEU 298.A O no hydrogen 2.897 N/A GLN 303.A N GLU 299.A O no hydrogen 3.251 N/A LEU 304.A N SER 301.A O no hydrogen 3.317 N/A THR 305.A N SER 301.A O no hydrogen 2.790 N/A THR 305.A OG1 SER 301.A O no hydrogen 3.039 N/A GLU 306.A N ARG 302.A O no hydrogen 2.685 N/A GLU 307.A N LEU 304.A O no hydrogen 2.950 N/A ILE 308.A N LEU 304.A O no hydrogen 2.832 N/A GLN 309.A N THR 305.A O no hydrogen 3.139 N/A ARG 310.A N GLU 307.A O no hydrogen 3.129 N/A ARG 310.A NH1 THR 370.A OG1 no hydrogen 3.195 N/A LEU 312.A N ILE 308.A O no hydrogen 2.960 N/A ASP 313.A N GLN 309.A O no hydrogen 2.903 N/A ALA 314.A N ARG 310.A O no hydrogen 3.040 N/A ARG 315.A N HIS 311.A O no hydrogen 3.113 N/A ARG 315.A NH1 ASP 282.A OD1 no hydrogen 3.371 N/A ARG 315.A NH2 ASP 282.A OD1 no hydrogen 2.702 N/A HIS 316.A N LEU 312.A O no hydrogen 2.957 N/A LEU 317.A N ALA 314.A O no hydrogen 3.316 N/A ILE 318.A N ALA 314.A O no hydrogen 3.085 N/A GLU 319.A N ARG 315.A O no hydrogen 3.250 N/A SER 321.A N LEU 317.A O no hydrogen 2.687 N/A SER 321.A OG LEU 317.A O no hydrogen 2.947 N/A ARG 323.A N GLU 319.A O no hydrogen 3.159 N/A ARG 323.A NH1 GLU 337.A OE2 no hydrogen 2.776 N/A ARG 323.A NH2 GLU 337.A OE1 no hydrogen 3.364 N/A ARG 323.A NH2 GLU 337.A OE2 no hydrogen 2.690 N/A LYS 324.A N LYS 320.A O no hydrogen 3.392 N/A ILE 325.A N SER 321.A O no hydrogen 3.043 N/A ILE 325.A N VAL 322.A O no hydrogen 3.016 N/A VAL 326.A N VAL 322.A O no hydrogen 3.101 N/A SER 327.A N ARG 323.A O no hydrogen 2.884 N/A LEU 329.A N ILE 325.A O no hydrogen 3.074 N/A LEU 329.A N VAL 326.A O no hydrogen 2.742 N/A ALA 330.A N VAL 326.A O no hydrogen 2.927 N/A LEU 339.A N GLU 335.A O no hydrogen 3.161 N/A SER 341.A N GLN 338.A O no hydrogen 2.832 N/A SER 341.A OG GLU 337.A O no hydrogen 2.738 N/A GLU 342.A N GLN 338.A O no hydrogen 2.587 N/A ARG 343.A NH1 GLU 163.A OE1 no hydrogen 2.992 N/A THR 347.A N GLU 386.A OE1 no hydrogen 2.857 N/A THR 347.A OG1 GLU 386.A OE1 no hydrogen 2.630 N/A CYS 351.A SG CYS 385.A O no hydrogen 3.895 N/A TYR 352.A OH THR 124.A O no hydrogen 2.344 N/A LEU 357.A N TYR 352.A O no hydrogen 3.009 N/A HIS 358.A N GLU 354.A O no hydrogen 3.170 N/A PHE 359.A N ALA 355.A O no hydrogen 3.249 N/A ARG 360.A N LEU 357.A O no hydrogen 3.164 N/A THR 361.A N HIS 358.A O no hydrogen 3.377 N/A THR 361.A OG1 HIS 358.A O no hydrogen 2.824 N/A THR 361.A OG1 HIS 362.A ND1 no hydrogen 3.133 N/A CYS 363.A N ARG 360.A O no hydrogen 2.975 N/A PHE 364.A N ARG 360.A O no hydrogen 3.325 N/A HIS 367.A ND1 ASN 365.A OD1 no hydrogen 3.062 N/A SER 368.A N ASN 365.A O no hydrogen 3.317 N/A TYR 371.A N SER 368.A O no hydrogen 2.832 N/A ALA 374.A N TYR 371.A O no hydrogen 3.406 N/A ARG 376.A N TYR 373.A O no hydrogen 3.135 N/A HIS 377.A N ALA 374.A O no hydrogen 3.065 N/A LEU 378.A N LEU 375.A O no hydrogen 3.374 N/A TYR 379.A OH LEU 340.A O no hydrogen 2.658 N/A VAL 380.A N HIS 377.A O no hydrogen 3.271 N/A ASN 383.A N TYR 379.A O no hydrogen 3.479 N/A LEU 384.A N VAL 380.A O no hydrogen 2.619 N/A CYS 385.A N VAL 382.A O no hydrogen 2.792 N/A GLU 386.A N VAL 382.A O no hydrogen 2.521 N/A LYS 387.A N ASN 383.A O no hydrogen 3.412 N/A ARG 393.A N PRO 390.A O no hydrogen 3.181 N/A ILE 394.A N PRO 390.A O no hydrogen 3.282 N/A LEU 396.A N HIS 392.A O no hydrogen 3.162 N/A SER 397.A N ARG 393.A O no hydrogen 2.829 N/A SER 397.A OG ILE 325.A O no hydrogen 3.367 N/A MET 398.A N ILE 394.A O no hydrogen 3.322 N/A ASP 399.A N LYS 395.A O no hydrogen 3.122 N/A HIS 400.A N LEU 396.A O no hydrogen 3.099 N/A VAL 401.A N MET 398.A O no hydrogen 2.892 N/A CYS 402.A N MET 398.A O no hydrogen 2.729 N/A CYS 402.A SG MET 398.A O no hydrogen 3.650 N/A HIS 405.A N ASP 399.A O no hydrogen 2.650 N/A