Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fcd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N SER 27.A OG no hydrogen 2.679 N/A LYS 4.A N ASP 98.A OD1 no hydrogen 3.195 N/A VAL 5.A N GLU 29.A O no hydrogen 3.290 N/A VAL 6.A N ARG 99.A O no hydrogen 3.127 N/A VAL 7.A N THR 31.A O no hydrogen 3.148 N/A VAL 8.A N VAL 101.A O no hydrogen 2.757 N/A GLY 9.A N ILE 33.A O no hydrogen 2.935 N/A THR 12.A OG1 TYR 39.A OH no hydrogen 2.963 N/A THR 12.A OG1 TYR 43.A OH no hydrogen 2.653 N/A ALA 15.A N GLY 11.A O no hydrogen 3.250 N/A THR 16.A N THR 12.A O no hydrogen 2.985 N/A THR 16.A OG1 THR 12.A O no hydrogen 2.973 N/A ALA 17.A N GLY 13.A O no hydrogen 3.172 N/A ALA 18.A N GLY 14.A O no hydrogen 2.996 N/A LYS 19.A N ALA 15.A O no hydrogen 3.112 N/A LYS 19.A NZ ASP 398.A O no hydrogen 2.796 N/A TYR 20.A N THR 16.A O no hydrogen 3.292 N/A TYR 20.A OH ASP 398.A OD1 no hydrogen 2.752 N/A ILE 21.A N ALA 18.A O no hydrogen 3.233 N/A LYS 22.A N ALA 18.A O no hydrogen 3.051 N/A LYS 22.A NZ PRO 26.A O no hydrogen 3.392 N/A LYS 22.A NZ GLY 69.A O no hydrogen 3.057 N/A LEU 23.A N LYS 19.A O no hydrogen 2.542 N/A ALA 24.A N TYR 20.A O no hydrogen 2.898 N/A ASP 25.A N LYS 22.A O no hydrogen 3.232 N/A SER 27.A N ASP 25.A O no hydrogen 2.492 N/A SER 27.A N ASP 25.A OD1 no hydrogen 3.029 N/A SER 27.A OG ALA 1.A O no hydrogen 3.268 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.620 N/A ILE 28.A N ASP 25.A O no hydrogen 3.451 N/A THR 31.A N VAL 5.A O no hydrogen 3.346 N/A LEU 32.A N GLN 71.A O no hydrogen 2.743 N/A ILE 33.A N VAL 7.A O no hydrogen 2.911 N/A GLU 34.A N VAL 73.A O no hydrogen 3.164 N/A TYR 39.A N HIS 60.A O no hydrogen 2.971 N/A TYR 39.A OH THR 12.A OG1 no hydrogen 2.963 N/A THR 41.A N ILE 58.A O no hydrogen 2.766 N/A THR 41.A OG1 TYR 392.A OH no hydrogen 3.147 N/A CYS 42.A SG SER 45.A OG no hydrogen 3.697 N/A CYS 42.A SG ALA 127.A O no hydrogen 3.825 N/A TYR 43.A N THR 41.A O no hydrogen 2.730 N/A TYR 43.A OH THR 12.A OG1 no hydrogen 2.653 N/A SER 45.A N CYS 42.A O no hydrogen 3.245 N/A SER 45.A OG CYS 42.A O no hydrogen 2.635 N/A GLU 47.A N LEU 44.A O no hydrogen 3.251 N/A VAL 48.A N SER 45.A O no hydrogen 2.691 N/A ILE 49.A N SER 45.A O no hydrogen 3.094 N/A GLY 50.A N ASN 46.A O no hydrogen 2.820 N/A GLY 51.A N GLU 47.A O no hydrogen 2.883 N/A ASP 52.A N GLU 47.A O no hydrogen 3.070 N/A ARG 53.A N GLU 47.A O no hydrogen 3.289 N/A LYS 54.A NZ GLU 56.A OE1 no hydrogen 3.017 N/A SER 57.A N LYS 54.A O no hydrogen 3.175 N/A SER 57.A OG LYS 54.A O no hydrogen 2.934 N/A ILE 58.A N LEU 55.A O no hydrogen 3.182 N/A LYS 59.A N GLU 56.A O no hydrogen 3.292 N/A LYS 59.A NZ ASP 38.A OD2 no hydrogen 3.142 N/A TYR 62.A OH GLY 10.A O no hydrogen 2.741 N/A ARG 66.A N TYR 62.A O no hydrogen 2.776 N/A ARG 66.A NH2 ASP 63.A OD1 no hydrogen 2.760 N/A ALA 67.A N ASP 63.A O no hydrogen 2.926 N/A HIS 68.A N LEU 65.A O no hydrogen 3.120 N/A HIS 68.A ND1 HIS 68.A O no hydrogen 2.607 N/A GLY 69.A N ARG 66.A O no hydrogen 2.858 N/A ILE 70.A N ARG 66.A O no hydrogen 3.220 N/A GLN 71.A N VAL 30.A O no hydrogen 2.816 N/A VAL 73.A N LEU 32.A O no hydrogen 2.934 N/A THR 78.A N LYS 88.A O no hydrogen 2.928 N/A LYS 88.A N GLY 79.A O no hydrogen 3.399 N/A THR 89.A OG1 ASP 75.A OD2 no hydrogen 2.682 N/A THR 89.A OG1 ALA 93.A O no hydrogen 3.181 N/A ALA 90.A N SER 76.A O no hydrogen 2.739 N/A GLY 92.A N THR 89.A O no hydrogen 3.173 N/A PHE 95.A N VAL 87.A O no hydrogen 2.923 N/A TYR 97.A N LYS 85.A O no hydrogen 3.334 N/A ASP 98.A N LYS 4.A O no hydrogen 2.889 N/A ARG 99.A NH1 GLU 282.A OE2 no hydrogen 3.138 N/A ARG 99.A NH2 GLU 282.A OE2 no hydrogen 3.228 N/A CYS 100.A N GLY 288.A O no hydrogen 2.917 N/A CYS 100.A SG VAL 6.A O no hydrogen 3.559 N/A VAL 101.A N VAL 6.A O no hydrogen 2.752 N/A VAL 102.A N HIS 290.A O no hydrogen 2.851 N/A ALA 103.A N VAL 8.A O no hydrogen 2.942 N/A GLU 107.A N ARG 257.A O no hydrogen 2.755 N/A ILE 109.A N PRO 255.A O no hydrogen 2.692 N/A ILE 113.A N TYR 110.A O no hydrogen 2.877 N/A TYR 116.A N ILE 113.A O no hydrogen 2.863 N/A TYR 116.A OH LEU 124.A O no hydrogen 2.681 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 2.796 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.805 N/A ALA 120.A N SER 117.A O no hydrogen 2.818 N/A ALA 121.A N SER 117.A O no hydrogen 3.063 N/A LYS 123.A N ALA 120.A O no hydrogen 2.923 N/A LEU 124.A N ALA 120.A O no hydrogen 2.941 N/A TRP 128.A NE1 ARG 160.A O no hydrogen 2.941 N/A LYS 129.A NZ ILE 106.A O no hydrogen 2.938 N/A GLY 131.A N THR 134.A OG1 no hydrogen 3.358 N/A GLN 133.A N GLU 132.A OE2 no hydrogen 3.091 N/A GLN 133.A NE2 HIS 126.A O no hydrogen 3.107 N/A THR 134.A N GLY 131.A O no hydrogen 3.168 N/A THR 134.A OG1 GLY 131.A O no hydrogen 3.518 N/A ALA 135.A N GLY 131.A O no hydrogen 3.373 N/A ILE 136.A N GLU 132.A O no hydrogen 2.975 N/A LEU 137.A N GLN 133.A O no hydrogen 3.324 N/A ARG 138.A N THR 134.A O no hydrogen 3.098 N/A LYS 139.A N ALA 135.A O no hydrogen 2.813 N/A LYS 139.A NZ ASP 143.A OD1 no hydrogen 2.707 N/A LYS 139.A NZ ASP 143.A OD2 no hydrogen 3.210 N/A GLN 140.A N ILE 136.A O no hydrogen 2.927 N/A GLN 140.A NE2 LYS 123.A O no hydrogen 2.730 N/A LEU 141.A N LEU 137.A O no hydrogen 2.988 N/A GLU 142.A N ARG 138.A O no hydrogen 2.869 N/A ASP 143.A N LYS 139.A O no hydrogen 2.704 N/A MET 144.A N GLN 140.A O no hydrogen 2.806 N/A GLY 148.A N ALA 145.A O no hydrogen 2.720 N/A VAL 150.A N LYS 184.A O no hydrogen 2.691 N/A VAL 151.A N VAL 249.A O no hydrogen 3.073 N/A ILE 152.A N ILE 186.A O no hydrogen 3.060 N/A ALA 153.A N ASN 251.A O no hydrogen 2.737 N/A ARG 160.A N GLN 256.A OE1 no hydrogen 3.075 N/A ARG 160.A NE ASP 294.A OD2 no hydrogen 3.016 N/A ARG 160.A NH2 ASP 294.A OD2 no hydrogen 2.772 N/A CYS 161.A N LYS 303.A O no hydrogen 2.731 N/A GLY 164.A N CYS 161.A O no hydrogen 2.775 N/A TYR 166.A N PRO 163.A O no hydrogen 2.984 N/A TYR 166.A OH ASP 189.A OD1 no hydrogen 3.347 N/A TYR 166.A OH ASP 189.A OD2 no hydrogen 2.899 N/A GLU 167.A N PRO 163.A O no hydrogen 2.802 N/A ARG 168.A N GLY 164.A O no hydrogen 2.875 N/A ARG 168.A NH1 ALA 127.A O no hydrogen 3.201 N/A ARG 168.A NH1 ASN 251.A OD1 no hydrogen 3.198 N/A ARG 168.A NH2 ALA 127.A O no hydrogen 2.825 N/A ALA 169.A N PRO 165.A O no hydrogen 2.900 N/A SER 170.A N TYR 166.A O no hydrogen 2.935 N/A SER 170.A OG TYR 166.A O no hydrogen 2.691 N/A GLN 171.A N GLU 167.A O no hydrogen 2.769 N/A VAL 172.A N ARG 168.A O no hydrogen 2.844 N/A ALA 173.A N ALA 169.A O no hydrogen 2.944 N/A TYR 174.A N SER 170.A O no hydrogen 2.849 N/A TYR 174.A OH ASP 52.A OD1 no hydrogen 2.996 N/A TYR 174.A OH ASP 52.A OD2 no hydrogen 3.085 N/A TYR 175.A N GLN 171.A O no hydrogen 3.104 N/A TYR 175.A N VAL 172.A O no hydrogen 3.008 N/A TYR 175.A OH LEU 141.A O no hydrogen 3.401 N/A LEU 176.A N VAL 172.A O no hydrogen 2.812 N/A ALA 178.A N TYR 175.A O no hydrogen 2.367 N/A HIS 179.A N LEU 176.A O no hydrogen 2.540 N/A LYS 180.A N LYS 177.A O no hydrogen 3.365 N/A LYS 180.A NZ LYS 177.A O no hydrogen 3.077 N/A SER 183.A OG MET 182.A O no hydrogen 2.439 N/A LYS 184.A NZ ALA 215.A O no hydrogen 3.539 N/A VAL 185.A N MET 216.A O no hydrogen 2.902 N/A ILE 186.A N VAL 150.A O no hydrogen 2.823 N/A ILE 187.A N GLU 218.A O no hydrogen 3.000 N/A LEU 188.A N ILE 152.A O no hydrogen 3.329 N/A ASP 189.A N HIS 220.A O no hydrogen 2.914 N/A SER 190.A OG PRO 154.A O no hydrogen 2.891 N/A PHE 194.A N GLN 197.A OE1 no hydrogen 3.169 N/A LYS 196.A NZ SER 339.A OG no hydrogen 2.857 N/A GLN 197.A N PHE 194.A O no hydrogen 3.263 N/A GLN 199.A N GLN 199.A OE1 no hydrogen 2.614 N/A GLN 199.A NE2 THR 372.A O no hydrogen 3.433 N/A PHE 200.A N LYS 196.A O no hydrogen 2.735 N/A SER 201.A N GLN 197.A O no hydrogen 2.735 N/A SER 201.A OG GLN 197.A O no hydrogen 2.986 N/A LYS 202.A N SER 198.A O no hydrogen 2.868 N/A GLY 203.A N GLN 199.A O no hydrogen 3.010 N/A TRP 204.A N PHE 200.A O no hydrogen 2.878 N/A TRP 204.A NE1 SER 170.A OG no hydrogen 2.897 N/A GLU 205.A N SER 201.A O no hydrogen 2.864 N/A ARG 206.A N LYS 202.A O no hydrogen 2.977 N/A LEU 207.A N GLY 203.A O no hydrogen 2.811 N/A TYR 208.A N TRP 204.A O no hydrogen 2.962 N/A TYR 208.A OH LEU 341.A O no hydrogen 2.724 N/A THR 212.A OG1 ASN 214.A O no hydrogen 3.283 N/A ASN 214.A ND2 ASN 214.A O no hydrogen 2.787 N/A MET 216.A N TYR 208.A O no hydrogen 2.898 N/A GLU 218.A N VAL 185.A O no hydrogen 2.900 N/A TRP 219.A NE1 ASP 189.A OD2 no hydrogen 2.900 N/A HIS 220.A N ILE 187.A O no hydrogen 3.038 N/A SER 225.A OG HIS 220.A O no hydrogen 3.168 N/A ALA 226.A N PRO 223.A O no hydrogen 2.790 N/A LYS 229.A NZ GLU 114.A OE2 no hydrogen 2.793 N/A GLY 232.A N MET 236.A O no hydrogen 2.937 N/A MET 235.A N GLY 232.A O no hydrogen 2.568 N/A MET 236.A N GLY 232.A O no hydrogen 3.176 N/A VAL 237.A N PHE 245.A O no hydrogen 2.876 N/A GLU 238.A N VAL 230.A O no hydrogen 2.985 N/A THR 239.A N ASP 243.A O no hydrogen 3.386 N/A THR 239.A OG1 ASP 224.A O no hydrogen 3.138 N/A PHE 241.A N THR 239.A OG1 no hydrogen 3.168 N/A GLY 242.A N THR 239.A O no hydrogen 3.024 N/A PHE 245.A N VAL 237.A O no hydrogen 3.033 N/A ALA 247.A N MET 235.A O no hydrogen 3.117 N/A ASN 251.A N VAL 151.A O no hydrogen 2.849 N/A ASN 251.A ND2 PRO 125.A O no hydrogen 2.613 N/A ASN 251.A ND2 LEU 252.A O no hydrogen 3.668 N/A ILE 253.A N ALA 153.A O no hydrogen 2.955 N/A GLN 256.A NE2 PRO 254.A O no hydrogen 3.145 N/A ARG 257.A N GLU 107.A O no hydrogen 2.928 N/A ALA 258.A N GLY 272.A O no hydrogen 2.798 N/A GLY 259.A N GLY 105.A O no hydrogen 3.000 N/A ALA 262.A N GLY 259.A O no hydrogen 2.824 N/A GLN 263.A N LYS 260.A O no hydrogen 2.878 N/A GLN 263.A NE2 GLU 107.A OE1 no hydrogen 2.908 N/A ILE 264.A N LYS 260.A O no hydrogen 2.910 N/A ALA 265.A N ILE 261.A O no hydrogen 2.955 N/A GLY 266.A N GLN 263.A O no hydrogen 3.237 N/A LEU 267.A N ALA 262.A O no hydrogen 2.749 N/A ASN 269.A N TRP 273.A O no hydrogen 2.955 N/A ALA 271.A N ASN 269.A OD1 no hydrogen 3.027 N/A GLY 272.A N ASN 269.A O no hydrogen 2.643 N/A CYS 274.A N ALA 295.A O no hydrogen 2.774 N/A CYS 274.A SG ALA 295.A O no hydrogen 2.725 N/A ASP 277.A N GLU 282.A O no hydrogen 2.893 N/A LYS 279.A N ASP 277.A OD2 no hydrogen 3.150 N/A THR 280.A OG1 HIS 290.A NE2 no hydrogen 2.833 N/A GLU 282.A N THR 280.A O no hydrogen 2.721 N/A SER 283.A N ILE 289.A O no hydrogen 2.819 N/A SER 283.A OG PRO 275.A O no hydrogen 3.216 N/A SER 284.A N PRO 275.A O no hydrogen 2.892 N/A SER 284.A OG PRO 275.A O no hydrogen 3.002 N/A ILE 285.A N SER 283.A OG no hydrogen 3.259 N/A HIS 290.A N CYS 100.A O no hydrogen 2.817 N/A VAL 291.A N PHE 281.A O no hydrogen 3.053 N/A ILE 292.A N VAL 102.A O no hydrogen 3.204 N/A ILE 297.A N CYS 274.A O no hydrogen 2.792 N/A MET 301.A N ALA 298.A O no hydrogen 3.235 N/A MET 301.A N ASN 299.A O no hydrogen 1.986 N/A LYS 303.A NZ ASP 294.A O no hydrogen 2.779 N/A SER 304.A OG PRO 302.A O no hydrogen 3.182 N/A SER 304.A OG SER 307.A OG no hydrogen 2.633 N/A SER 304.A OG ASN 335.A OD1 no hydrogen 2.826 N/A SER 307.A N SER 304.A OG no hydrogen 3.193 N/A SER 307.A OG PRO 302.A O no hydrogen 2.735 N/A SER 307.A OG SER 304.A OG no hydrogen 2.633 N/A ALA 308.A N SER 304.A O no hydrogen 3.040 N/A ASN 309.A N GLY 305.A O no hydrogen 2.973 N/A ASN 309.A ND2 ASP 398.A OD2 no hydrogen 3.224 N/A ASN 309.A ND2 THR 399.A OG1 no hydrogen 3.037 N/A SER 310.A N TYR 306.A O no hydrogen 2.989 N/A SER 310.A OG LEU 334.A O no hydrogen 3.008 N/A GLN 311.A N SER 307.A O no hydrogen 3.007 N/A GLN 311.A NE2 SER 307.A O no hydrogen 2.737 N/A GLY 312.A N ALA 308.A O no hydrogen 2.840 N/A LYS 313.A N ASN 309.A O no hydrogen 3.081 N/A LYS 313.A N SER 310.A O no hydrogen 2.724 N/A LYS 313.A NZ ASN 309.A OD1 no hydrogen 3.438 N/A LYS 313.A NZ ASP 398.A OD2 no hydrogen 2.737 N/A VAL 314.A N SER 310.A O no hydrogen 3.081 N/A ALA 315.A N GLN 311.A O no hydrogen 2.714 N/A ALA 316.A N GLY 312.A O no hydrogen 2.730 N/A ALA 317.A N LYS 313.A O no hydrogen 2.876 N/A ALA 318.A N VAL 314.A O no hydrogen 2.988 N/A VAL 319.A N ALA 315.A O no hydrogen 2.738 N/A VAL 320.A N ALA 316.A O no hydrogen 3.107 N/A VAL 321.A N ALA 317.A O no hydrogen 3.184 N/A LEU 322.A N ALA 318.A O no hydrogen 3.299 N/A LEU 323.A N VAL 319.A O no hydrogen 2.240 N/A LYS 324.A N VAL 320.A O no hydrogen 3.515 N/A GLY 325.A N VAL 321.A O no hydrogen 2.861 N/A TYR 333.A N TYR 353.A O no hydrogen 3.241 N/A TYR 333.A OH ILE 278.A O no hydrogen 2.621 N/A ASN 335.A N ALA 351.A O no hydrogen 3.125 N/A CYS 337.A N VAL 349.A O no hydrogen 3.134 N/A SER 339.A N ILE 347.A O no hydrogen 3.215 N/A ILE 340.A N GLU 167.A OE2 no hydrogen 3.096 N/A LEU 341.A N TYR 345.A O no hydrogen 3.085 N/A TYR 345.A N ALA 342.A O no hydrogen 2.715 N/A ILE 347.A N SER 339.A O no hydrogen 3.058 N/A SER 348.A N THR 372.A OG1 no hydrogen 2.831 N/A SER 348.A OG THR 372.A OG1 no hydrogen 3.208 N/A SER 348.A OG GLU 384.A OE1 no hydrogen 2.700 N/A SER 348.A OG GLU 384.A OE2 no hydrogen 2.940 N/A VAL 349.A N CYS 337.A O no hydrogen 3.305 N/A ALA 350.A N GLY 370.A O no hydrogen 2.770 N/A ALA 351.A N ASN 335.A O no hydrogen 2.949 N/A TYR 353.A N TYR 333.A O no hydrogen 2.974 N/A ARG 354.A N GLU 363.A O no hydrogen 3.057 N/A ASN 356.A N ALA 361.A O no hydrogen 2.837 N/A ILE 362.A N ASN 299.A OD1 no hydrogen 2.837 N/A GLU 363.A N ARG 354.A O no hydrogen 3.224 N/A VAL 365.A N ILE 352.A O no hydrogen 2.813 N/A SER 368.A N VAL 365.A O no hydrogen 3.442 N/A SER 368.A OG VAL 365.A O no hydrogen 2.307 N/A GLY 370.A N ALA 350.A O no hydrogen 2.829 N/A THR 372.A N SER 348.A O no hydrogen 3.145 N/A THR 372.A OG1 SER 348.A O no hydrogen 3.528 N/A THR 372.A OG1 SER 348.A OG no hydrogen 3.208 N/A THR 372.A OG1 GLU 384.A OE2 no hydrogen 2.919 N/A ALA 376.A N PRO 373.A O no hydrogen 3.114 N/A LEU 381.A N PRO 377.A O no hydrogen 3.351 N/A GLU 382.A N ASP 378.A O no hydrogen 2.969 N/A ARG 383.A N TRP 379.A O no hydrogen 2.768 N/A GLU 384.A N VAL 380.A O no hydrogen 2.867 N/A TYR 387.A N ARG 383.A O no hydrogen 2.973 N/A ALA 388.A N GLU 384.A O no hydrogen 2.772 N/A ALA 388.A N VAL 385.A O no hydrogen 3.030 N/A TYR 389.A N VAL 385.A O no hydrogen 3.033 N/A TYR 389.A OH GLU 47.A OE2 no hydrogen 2.953 N/A SER 390.A N GLN 386.A O no hydrogen 3.017 N/A SER 390.A OG GLN 386.A O no hydrogen 2.862 N/A TRP 391.A N TYR 387.A O no hydrogen 3.031 N/A TYR 392.A N ALA 388.A O no hydrogen 3.055 N/A ASN 393.A N TYR 389.A O no hydrogen 2.856 N/A ASN 394.A N SER 390.A O no hydrogen 3.018 N/A ASN 394.A ND2 SER 390.A O no hydrogen 3.072 N/A ILE 395.A N TRP 391.A O no hydrogen 2.929 N/A VAL 396.A N TYR 392.A O no hydrogen 2.984 N/A HIS 397.A N ASN 394.A O no hydrogen 3.013 N/A ASP 398.A N ASN 394.A O no hydrogen 2.743 N/A THR 399.A N ILE 395.A O no hydrogen 3.058 N/A THR 399.A OG1 THR 16.A OG1 no hydrogen 3.312 N/A THR 399.A OG1 ILE 395.A O no hydrogen 2.693 N/A